0 B10R0.71 C#CCCCCCCOCC 34a_100011217361_100000210202 [0,0,0,0,0,0|2,0,2]=4 1 B10R0.71 C#CCCCCCCOCC 34a_100121572206_100012276617 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.71 C#CCCCCCCOCC 7a_100011217361_100000210202 [0,0,0,0,0,0|2,0,2]=4 3 B10R0.71 C#CCCCNCCOCC 2230a_102516460346_100000731252 [0,0,0,0,0,0|2,0,2]=4 4 B10R0.71 C#CCCCNCCOCC 34a_100000718082_100000210147 [0,0,0,0,0,0|2,0,2]=4 5 B10R0.71 C#CCCCNCCOCC 34a_102516460346_100000695029 [0,0,0,0,0,0|2,0,2]=4 6 B10R0.71 C#CCCCOCCCCC 34a_100000210253_100000695029 [0,0,0,0,0,0|2,0,2]=4 7 B10R0.71 C#CCCCOCCCCC 34a_100000215630_100000718602 [0,0,0,0,0,0|2,0,2]=4 8 B10R0.71 C#CCCCOCCCCC 7a_100000210253_100011215417 [0,0,0,0,0,0|2,0,2]=4 9 B10R0.71 C#CCCCOCCCCC 7a_100000215630_100000210326 [0,0,0,0,0,0|2,0,2]=4 10 B10R0.71 C#CCCCOCCOCC 34a_100000210136_100000695029 [0,0,0,0,0,0|1,0,2]=3 11 B10R0.71 C#CCCCOCCOCC 34a_100000215630_100000210147 [0,0,0,0,0,0|1,0,2]=3 12 B10R0.71 C#CCCCOCCOCC 7a_100000210136_100011215417 [0,0,0,0,0,0|1,0,2]=3 13 B10R0.71 C#CCCCOCCOCC 7a_100000215630_100011215890 [0,0,0,0,0,0|1,0,2]=3 14 B10R0.71 C#CCCCOCCSCC 34a_100000212035_100000695029 [0,0,0,0,0,0|1,1,2]=4 15 B10R0.71 C#CCCCOCCSCC 34a_100000215630_100000757381 [0,0,0,0,0,0|1,1,2]=4 16 B10R0.71 C#CCCCOCCSCC 7a_100000212035_100011215417 [0,0,0,0,0,0|1,1,2]=4 17 B10R0.71 C#CCCCOCCSCC 7a_100000215630_100000757381 [0,0,0,0,0,0|1,1,2]=4 18 B10R0.71 C#CCCCSCCOCC 62a_100000210147_100011215417 [0,0,0,0,0,0|1,1,2]=4 19 B10R0.71 C#CCCCSCCOCC 62a_100011215417_100011215890 [0,0,0,0,0,0|1,1,2]=4 20 B10R0.71 C/C=C/CCOC/C=C\CC 34a_100016278192_100103147603 [0,0,0,0,0,0|2,0,2]=4 21 B10R0.71 C/C=C/CCOCC#CCC 34a_100016278192_100009813939 [0,0,0,0,0,0|2,0,2]=4 22 B10R0.71 C/C=C/CCOCCCCC 34a_100016278192_100000718602 [0,0,0,0,0,0|2,0,1]=3 23 B10R0.71 C/C=C/CCOCCCCF 34a_100016278192_100000729493 [0,0,0,0,0,0|3,0,1]=4 24 B10R0.71 C/C=C/CCOCCCCO 34a_100016278192_100011216708 [0,0,0,0,0,0|3,0,1]=4 25 B10R0.71 C/C=C/CCOCCCOC 34a_100016278192_100000740836 [0,0,0,0,0,0|3,0,1]=4 26 B10R0.71 C/C=C/CCOCCOCC 34a_100016278192_100000210147 [0,0,0,0,0,0|1,0,1]=2 27 B10R0.71 C/C=C/CCOCCSCC 34a_100016278192_100000757381 [0,0,0,0,0,0|1,1,1]=3 28 B10R0.71 C/C=C/CNCCCOCC 34a_100000210961_100102629194 [0,0,0,0,0,0|3,0,1]=4 29 B10R0.71 C/C=C/COCCCOCC 34a_100000757476_100102629194 [0,0,0,0,0,0|3,0,1]=4 30 B10R0.71 C/C=C/COCCCOCC 34a_100016270725_100012232248 [0,0,0,0,0,0|3,0,1]=4 31 B10R0.71 C/C=C/COCCCOCC 7a_100000757476_100102629194 [0,0,0,0,0,0|3,0,1]=4 32 B10R0.71 C/C=C/CSCCCOCC 62a_100012232248_100102629194 [0,0,0,0,0,0|3,0,1]=4 33 B10R0.71 C/C=C/CSCCCOCC 62a_100102629194_100012232248 [0,0,0,0,0,0|3,0,1]=4 34 B10R0.71 C=CCCCCCCOCC 34a_100121572206_100011215473 [0,0,0,0,0,0|2,0,2]=4 35 B10R0.71 C=CCCCCCCOCC 34a_200011216477_100000210202 [0,0,0,0,0,0|2,0,2]=4 36 B10R0.71 C=CCCCCCCOCC 7a_200011216477_100000210202 [0,0,0,0,0,0|2,0,2]=4 37 B10R0.71 C=CCCCNCCOCC 2230a_100000700776_100011215890 [0,0,0,0,0,0|2,0,2]=4 38 B10R0.71 C=CCCCNCCOCC 2230a_102516460346_100011713584 [0,0,0,0,0,0|2,0,2]=4 39 B10R0.71 C=CCCCNCCOCC 34a_100000700776_100000210147 [0,0,0,0,0,0|2,0,2]=4 40 B10R0.71 C=CCCCNCCOCC 34a_102516460346_100000757094 [0,0,0,0,0,0|2,0,2]=4 41 B10R0.71 C=CCCCOCCCCC 34a_100000210253_100000757094 [0,0,0,0,0,0|2,0,2]=4 42 B10R0.71 C=CCCCOCCCCC 34a_100000758997_100000718602 [0,0,0,0,0,0|2,0,2]=4 43 B10R0.71 C=CCCCOCCCCC 7a_100000210253_100000757094 [0,0,0,0,0,0|2,0,2]=4 44 B10R0.71 C=CCCCOCCCCC 7a_100000758997_100000210326 [0,0,0,0,0,0|2,0,2]=4 45 B10R0.71 C=CCCCOCCOCC 34a_100000210136_100000757094 [0,0,0,0,0,0|1,0,2]=3 46 B10R0.71 C=CCCCOCCOCC 34a_100000758997_100000210147 [0,0,0,0,0,0|1,0,2]=3 47 B10R0.71 C=CCCCOCCOCC 7a_100000210136_100000757094 [0,0,0,0,0,0|1,0,2]=3 48 B10R0.71 C=CCCCOCCOCC 7a_100000758997_100011215890 [0,0,0,0,0,0|1,0,2]=3 49 B10R0.71 C=CCCCOCCSCC 34a_100000212035_100000757094 [0,0,0,0,0,0|1,1,2]=4 50 B10R0.71 C=CCCCOCCSCC 34a_100000758997_100000757381 [0,0,0,0,0,0|1,1,2]=4 51 B10R0.71 C=CCCCOCCSCC 7a_100000212035_100000757094 [0,0,0,0,0,0|1,1,2]=4 52 B10R0.71 C=CCCCOCCSCC 7a_100000758997_100000757381 [0,0,0,0,0,0|1,1,2]=4 53 B10R0.71 C=CCCCSCCOCC 62a_100000210147_100000757094 [0,0,0,0,0,0|1,1,2]=4 54 B10R0.71 C=CCCCSCCOCC 62a_100011713584_100011215890 [0,0,0,0,0,0|1,1,2]=4 55 B10R0.71 C=COCCNCCCCC 2230a_100000209983_100000039644 [0,0,0,0,0,0|2,0,2]=4 56 B10R0.71 C=COCCNCCOCC 2230a_102516460346_100000039644 [0,0,0,0,0,0|1,0,2]=3 57 B10R0.71 C=COCCNCCOCC 34a_102516460346_100000039644 [0,0,0,0,0,0|1,0,2]=3 58 B10R0.71 C=COCCNCCSCC 2230a_100000106463_100000039644 [0,0,0,0,0,0|1,1,2]=4 59 B10R0.71 C=COCCOC/C=C\CC 34a_100000033082_100103147603 [0,0,0,0,0,0|1,0,3]=4 60 B10R0.71 C=COCCOC/C=C\CC 34a_100016268518_100000039644 [0,0,0,0,0,0|1,0,3]=4 61 B10R0.71 C=COCCOCC#CCC 34a_100000032950_100000039644 [0,0,0,0,0,0|1,0,3]=4 62 B10R0.71 C=COCCOCC#CCC 34a_100000033082_100009813939 [0,0,0,0,0,0|1,0,3]=4 63 B10R0.71 C=COCCOCC/C=C/C 34a_100016278192_100000039644 [0,0,0,0,0,0|1,0,3]=4 64 B10R0.71 C=COCCOCCC#CC 34a_100000750427_100000039644 [0,0,0,0,0,0|1,0,3]=4 65 B10R0.71 C=COCCOCCCCBr 34a_100011216708_100000039644 [0,0,0,0,0,0|2,0,2]=4 66 B10R0.71 C=COCCOCCCCC 34a_100000033082_100000718602 [0,0,0,0,0,0|1,0,2]=3 67 B10R0.71 C=COCCOCCCCC 34a_100000210253_100000039644 [0,0,0,0,0,0|1,0,2]=3 68 B10R0.71 C=COCCOCCCCC 7a_100000210253_100000039644 [0,0,0,0,0,0|1,0,2]=3 69 B10R0.71 C=COCCOCCCCCl 34a_100000210776_100000039644 [0,0,0,0,0,0|2,0,2]=4 70 B10R0.71 C=COCCOCCCCCl 7a_100000210776_100000039644 [0,0,0,0,0,0|2,0,2]=4 71 B10R0.71 C=COCCOCCCCF 34a_100000033082_100000729493 [0,0,0,0,0,0|2,0,2]=4 72 B10R0.71 C=COCCOCCCCF 34a_100011995726_100000039644 [0,0,0,0,0,0|2,0,2]=4 73 B10R0.71 C=COCCOCCCCF 7a_100011995726_100000039644 [0,0,0,0,0,0|2,0,2]=4 74 B10R0.71 C=COCCOCCCCI 34a_200012148704_100000039644 [0,0,0,0,0,0|2,0,2]=4 75 B10R0.71 C=COCCOCCCCN 34a_100000750430_100000039644 [0,0,0,0,0,0|2,0,2]=4 76 B10R0.71 C=COCCOCCCCO 34a_100000033082_100011216708 [0,0,0,0,0,0|2,0,2]=4 77 B10R0.71 C=COCCOCCCNC 34a_100000213112_100000039644 [0,0,0,0,0,0|2,0,2]=4 78 B10R0.71 C=COCCOCCCOC 34a_100000033082_100000740836 [0,0,0,0,0,0|2,0,2]=4 79 B10R0.71 C=COCCOCCCOC 34a_100000740835_100000039644 [0,0,0,0,0,0|2,0,2]=4 80 B10R0.71 C=COCCOCCCSC 34a_100000690336_100000039644 [0,0,0,0,0,0|2,0,2]=4 81 B10R0.71 C=COCCOCCCSC 7a_100000690336_100000039644 [0,0,0,0,0,0|2,0,2]=4 82 B10R0.71 C=COCCOCCOC=C 34a_100000033082_100000039644 [0,0,0,0,0,0|0,0,4]=4 83 B10R0.71 C=COCCOCCOCC 34a_100000033082_100000210147 [0,0,0,0,0,0|0,0,2]=2 84 B10R0.71 C=COCCOCCOCC 34a_100000039918_100000210202 [0,0,0,0,0,0|0,0,2]=2 85 B10R0.71 C=COCCOCCOCC 34a_100000210136_100000039644 [0,0,0,0,0,0|0,0,2]=2 86 B10R0.71 C=COCCOCCOCC 7a_100000039918_100000210202 [0,0,0,0,0,0|0,0,2]=2 87 B10R0.71 C=COCCOCCOCC 7a_100000210136_100000039644 [0,0,0,0,0,0|0,0,2]=2 88 B10R0.71 C=COCCOCCOCF 34a_100000039918_100015361967 [0,0,0,0,0,0|1,0,2]=3 89 B10R0.71 C=COCCOCCOCF 7a_100000039918_100015361967 [0,0,0,0,0,0|1,0,2]=3 90 B10R0.71 C=COCCOCCSCC 34a_100000033082_100000757381 [0,0,0,0,0,0|0,1,2]=3 91 B10R0.71 C=COCCOCCSCC 34a_100000212035_100000039644 [0,0,0,0,0,0|0,1,2]=3 92 B10R0.71 C=COCCOCCSCC 7a_100000212035_100000039644 [0,0,0,0,0,0|0,1,2]=3 93 B10R0.71 C=COCCSCCCCC 62a_100000039644_100000210326 [0,0,0,0,0,0|1,1,2]=4 94 B10R0.71 C=COCCSCCCCC 62a_100000210326_100000039644 [0,0,0,0,0,0|1,1,2]=4 95 B10R0.71 C=COCCSCCOCC 62a_100000039644_100011215890 [0,0,0,0,0,0|0,1,2]=3 96 B10R0.71 C=COCCSCCOCC 62a_100000210147_100000039644 [0,0,0,0,0,0|0,1,2]=3 97 B10R0.71 C=COCCSCCSCC 62a_100000039644_100000757381 [0,0,0,0,0,0|0,2,2]=4 98 B10R0.71 C=COCCSCCSCC 62a_100000757381_100000039644 [0,0,0,0,0,0|0,2,2]=4 99 B10R0.71 CC#CCCOC/C=C\CC 34a_100000750427_100103147603 [0,0,0,0,0,0|2,0,2]=4 100 B10R0.71 CC#CCCOCC#CCC 34a_100000750427_100009813939 [0,0,0,0,0,0|2,0,2]=4 101 B10R0.71 CC#CCCOCCCCC 34a_100000750427_100000718602 [0,0,0,0,0,0|2,0,1]=3 102 B10R0.71 CC#CCCOCCCCF 34a_100000750427_100000729493 [0,0,0,0,0,0|3,0,1]=4 103 B10R0.71 CC#CCCOCCCCO 34a_100000750427_100011216708 [0,0,0,0,0,0|3,0,1]=4 104 B10R0.71 CC#CCCOCCCOC 34a_100000750427_100000740836 [0,0,0,0,0,0|3,0,1]=4 105 B10R0.71 CC#CCCOCCOCC 34a_100000750427_100000210147 [0,0,0,0,0,0|1,0,1]=2 106 B10R0.71 CC#CCCOCCSCC 34a_100000750427_100000757381 [0,0,0,0,0,0|1,1,1]=3 107 B10R0.71 CC#CCNCCCOCC 2230a_100000210961_100000748600 [0,0,0,0,0,0|3,0,1]=4 108 B10R0.71 CC#CCNCCCOCC 2230a_100000685387_100012232248 [0,0,0,0,0,0|3,0,1]=4 109 B10R0.71 CC#CCNCCCOCC 34a_100000210961_100000748600 [0,0,0,0,0,0|3,0,1]=4 110 B10R0.71 CC#CCNCCCOCC 34a_100000685387_100012232248 [0,0,0,0,0,0|3,0,1]=4 111 B10R0.71 CC#CCOCCCOCC 34a_100000757476_100000748600 [0,0,0,0,0,0|3,0,1]=4 112 B10R0.71 CC#CCOCCCOCC 34a_100000761923_100012232248 [0,0,0,0,0,0|3,0,1]=4 113 B10R0.71 CC#CCOCCCOCC 7a_100000757476_100000748600 [0,0,0,0,0,0|3,0,1]=4 114 B10R0.71 CC#CCSCCCOCC 62a_100000748600_100012232248 [0,0,0,0,0,0|3,0,1]=4 115 B10R0.71 CC#CCSCCCOCC 62a_100012232248_100000748600 [0,0,0,0,0,0|3,0,1]=4 116 B10R0.71 CC/C=C\CCCCOCC 34a_100016287862_100000210202 [0,0,0,0,0,0|2,0,1]=3 117 B10R0.71 CC/C=C\CCCCOCC 7a_100016287862_100000210202 [0,0,0,0,0,0|2,0,1]=3 118 B10R0.71 CC/C=C\CCCCOCF 34a_100016287862_100015361967 [0,0,0,0,0,0|3,0,1]=4 119 B10R0.71 CC/C=C\CCCCOCF 7a_100016287862_100015361967 [0,0,0,0,0,0|3,0,1]=4 120 B10R0.71 CC/C=C\CCSCOCC 62a_100000739092_100015370543 [0,0,0,0,0,0|3,0,1]=4 121 B10R0.71 CC/C=C\CCSCOCC 62a_100015370543_100000739092 [0,0,0,0,0,0|3,0,1]=4 122 B10R0.71 CC/C=C\CNCCCCC 2230a_100000209983_100103147603 [0,0,0,0,0,0|3,0,1]=4 123 B10R0.71 CC/C=C\CNCCOCC 2230a_102516460346_100103147603 [0,0,0,0,0,0|2,0,1]=3 124 B10R0.71 CC/C=C\CNCCOCC 34a_102516460346_100103147603 [0,0,0,0,0,0|2,0,1]=3 125 B10R0.71 CC/C=C\CNCCSCC 2230a_100000106463_100103147603 [0,0,0,0,0,0|2,1,1]=4 126 B10R0.71 CC/C=C\COC/C=C\CC 34a_100016268518_100103147603 [0,0,0,0,0,0|2,0,2]=4 127 B10R0.71 CC/C=C\COCCCCBr 34a_100011216708_100103147603 [0,0,0,0,0,0|3,0,1]=4 128 B10R0.71 CC/C=C\COCCCCC 34a_100000210253_100103147603 [0,0,0,0,0,0|2,0,1]=3 129 B10R0.71 CC/C=C\COCCCCC 34a_100016268518_100000718602 [0,0,0,0,0,0|2,0,1]=3 130 B10R0.71 CC/C=C\COCCCCC 7a_100000210253_100103147603 [0,0,0,0,0,0|2,0,1]=3 131 B10R0.71 CC/C=C\COCCCCCl 34a_100000210776_100103147603 [0,0,0,0,0,0|3,0,1]=4 132 B10R0.71 CC/C=C\COCCCCCl 7a_100000210776_100103147603 [0,0,0,0,0,0|3,0,1]=4 133 B10R0.71 CC/C=C\COCCCCF 34a_100011995726_100103147603 [0,0,0,0,0,0|3,0,1]=4 134 B10R0.71 CC/C=C\COCCCCF 34a_100016268518_100000729493 [0,0,0,0,0,0|3,0,1]=4 135 B10R0.71 CC/C=C\COCCCCF 7a_100011995726_100103147603 [0,0,0,0,0,0|3,0,1]=4 136 B10R0.71 CC/C=C\COCCCCI 34a_200012148704_100103147603 [0,0,0,0,0,0|3,0,1]=4 137 B10R0.71 CC/C=C\COCCCCN 34a_100000750430_100103147603 [0,0,0,0,0,0|3,0,1]=4 138 B10R0.71 CC/C=C\COCCCCO 34a_100016268518_100011216708 [0,0,0,0,0,0|3,0,1]=4 139 B10R0.71 CC/C=C\COCCCNC 34a_100000213112_100103147603 [0,0,0,0,0,0|3,0,1]=4 140 B10R0.71 CC/C=C\COCCCOC 34a_100000740835_100103147603 [0,0,0,0,0,0|3,0,1]=4 141 B10R0.71 CC/C=C\COCCCOC 34a_100016268518_100000740836 [0,0,0,0,0,0|3,0,1]=4 142 B10R0.71 CC/C=C\COCCCSC 34a_100000690336_100103147603 [0,0,0,0,0,0|3,0,1]=4 143 B10R0.71 CC/C=C\COCCCSC 7a_100000690336_100103147603 [0,0,0,0,0,0|3,0,1]=4 144 B10R0.71 CC/C=C\COCCOCC 34a_100000210136_100103147603 [0,0,0,0,0,0|1,0,1]=2 145 B10R0.71 CC/C=C\COCCOCC 34a_100016268518_100000210147 [0,0,0,0,0,0|1,0,1]=2 146 B10R0.71 CC/C=C\COCCOCC 7a_100000210136_100103147603 [0,0,0,0,0,0|1,0,1]=2 147 B10R0.71 CC/C=C\COCCSCC 34a_100000212035_100103147603 [0,0,0,0,0,0|1,1,1]=3 148 B10R0.71 CC/C=C\COCCSCC 34a_100016268518_100000757381 [0,0,0,0,0,0|1,1,1]=3 149 B10R0.71 CC/C=C\COCCSCC 7a_100000212035_100103147603 [0,0,0,0,0,0|1,1,1]=3 150 B10R0.71 CC/C=C\CSCCCCC 62a_100000210326_100103147603 [0,0,0,0,0,0|2,1,1]=4 151 B10R0.71 CC/C=C\CSCCCCC 62a_100103147603_100000210326 [0,0,0,0,0,0|2,1,1]=4 152 B10R0.71 CC/C=C\CSCCOCC 62a_100000210147_100103147603 [0,0,0,0,0,0|1,1,1]=3 153 B10R0.71 CC/C=C\CSCCOCC 62a_100103147603_100011215890 [0,0,0,0,0,0|1,1,1]=3 154 B10R0.71 CC/C=C\CSCCSCC 62a_100000757381_100103147603 [0,0,0,0,0,0|1,2,1]=4 155 B10R0.71 CC/C=C\CSCCSCC 62a_100103147603_100000757381 [0,0,0,0,0,0|1,2,1]=4 156 B10R0.71 CC=CCNCCCOCC 2230a_100000210961_100000070051 [0,0,0,0,0,0|3,0,1]=4 157 B10R0.71 CC=CCNCCCOCC 34a_100000210961_100000070051 [0,0,0,0,0,0|3,0,1]=4 158 B10R0.71 CC=CCOCCCOCC 34a_100000757476_100000070051 [0,0,0,0,0,0|3,0,1]=4 159 B10R0.71 CC=CCOCCCOCC 7a_100000757476_100000070051 [0,0,0,0,0,0|3,0,1]=4 160 B10R0.71 CC=CCSCCCOCC 62a_100000070051_100012232248 [0,0,0,0,0,0|3,0,1]=4 161 B10R0.71 CC=CCSCCCOCC 62a_100012232248_100000070051 [0,0,0,0,0,0|3,0,1]=4 162 B10R0.71 CCC#CCNCCCCC 2230a_100000209983_100009813939 [0,0,0,0,0,0|3,0,1]=4 163 B10R0.71 CCC#CCNCCOCC 2230a_102516460346_100009813939 [0,0,0,0,0,0|2,0,1]=3 164 B10R0.71 CCC#CCNCCOCC 34a_102516460346_100009813939 [0,0,0,0,0,0|2,0,1]=3 165 B10R0.71 CCC#CCNCCSCC 2230a_100000106463_100009813939 [0,0,0,0,0,0|2,1,1]=4 166 B10R0.71 CCC#CCOC/C=C\CC 34a_100000032950_100103147603 [0,0,0,0,0,0|2,0,2]=4 167 B10R0.71 CCC#CCOC/C=C\CC 34a_100016268518_100009813939 [0,0,0,0,0,0|2,0,2]=4 168 B10R0.71 CCC#CCOCC#CCC 34a_100000032950_100009813939 [0,0,0,0,0,0|2,0,2]=4 169 B10R0.71 CCC#CCOCCCCBr 34a_100011216708_100009813939 [0,0,0,0,0,0|3,0,1]=4 170 B10R0.71 CCC#CCOCCCCC 34a_100000032950_100000718602 [0,0,0,0,0,0|2,0,1]=3 171 B10R0.71 CCC#CCOCCCCC 34a_100000210253_100009813939 [0,0,0,0,0,0|2,0,1]=3 172 B10R0.71 CCC#CCOCCCCC 7a_100000210253_100009813939 [0,0,0,0,0,0|2,0,1]=3 173 B10R0.71 CCC#CCOCCCCCl 34a_100000210776_100009813939 [0,0,0,0,0,0|3,0,1]=4 174 B10R0.71 CCC#CCOCCCCCl 7a_100000210776_100009813939 [0,0,0,0,0,0|3,0,1]=4 175 B10R0.71 CCC#CCOCCCCF 34a_100000032950_100000729493 [0,0,0,0,0,0|3,0,1]=4 176 B10R0.71 CCC#CCOCCCCF 34a_100011995726_100009813939 [0,0,0,0,0,0|3,0,1]=4 177 B10R0.71 CCC#CCOCCCCF 7a_100011995726_100009813939 [0,0,0,0,0,0|3,0,1]=4 178 B10R0.71 CCC#CCOCCCCI 34a_200012148704_100009813939 [0,0,0,0,0,0|3,0,1]=4 179 B10R0.71 CCC#CCOCCCCN 34a_100000750430_100009813939 [0,0,0,0,0,0|3,0,1]=4 180 B10R0.71 CCC#CCOCCCCO 34a_100000032950_100011216708 [0,0,0,0,0,0|3,0,1]=4 181 B10R0.71 CCC#CCOCCCNC 34a_100000213112_100009813939 [0,0,0,0,0,0|3,0,1]=4 182 B10R0.71 CCC#CCOCCCOC 34a_100000032950_100000740836 [0,0,0,0,0,0|3,0,1]=4 183 B10R0.71 CCC#CCOCCCOC 34a_100000740835_100009813939 [0,0,0,0,0,0|3,0,1]=4 184 B10R0.71 CCC#CCOCCCSC 34a_100000690336_100009813939 [0,0,0,0,0,0|3,0,1]=4 185 B10R0.71 CCC#CCOCCCSC 7a_100000690336_100009813939 [0,0,0,0,0,0|3,0,1]=4 186 B10R0.71 CCC#CCOCCOCC 34a_100000032950_100000210147 [0,0,0,0,0,0|1,0,1]=2 187 B10R0.71 CCC#CCOCCOCC 34a_100000210136_100009813939 [0,0,0,0,0,0|1,0,1]=2 188 B10R0.71 CCC#CCOCCOCC 7a_100000210136_100009813939 [0,0,0,0,0,0|1,0,1]=2 189 B10R0.71 CCC#CCOCCSCC 34a_100000032950_100000757381 [0,0,0,0,0,0|1,1,1]=3 190 B10R0.71 CCC#CCOCCSCC 34a_100000212035_100009813939 [0,0,0,0,0,0|1,1,1]=3 191 B10R0.71 CCC#CCOCCSCC 7a_100000212035_100009813939 [0,0,0,0,0,0|1,1,1]=3 192 B10R0.71 CCC#CCSCCCCC 62a_100000210326_100009813939 [0,0,0,0,0,0|2,1,1]=4 193 B10R0.71 CCC#CCSCCCCC 62a_100009813939_100000210326 [0,0,0,0,0,0|2,1,1]=4 194 B10R0.71 CCC#CCSCCOCC 62a_100000210147_100009813939 [0,0,0,0,0,0|1,1,1]=3 195 B10R0.71 CCC#CCSCCOCC 62a_100009813939_100011215890 [0,0,0,0,0,0|1,1,1]=3 196 B10R0.71 CCC#CCSCCSCC 62a_100000757381_100009813939 [0,0,0,0,0,0|1,2,1]=4 197 B10R0.71 CCC#CCSCCSCC 62a_100009813939_100000757381 [0,0,0,0,0,0|1,2,1]=4 198 B10R0.71 CCCC/C=C\CCOCC 34a_200016286491_100000210202 [0,0,0,0,0,0|2,0,1]=3 199 B10R0.71 CCCC/C=C\CCOCC 7a_200016286491_100000210202 [0,0,0,0,0,0|2,0,1]=3 200 B10R0.71 CCCC/C=C\CCOCF 34a_200016286491_100015361967 [0,0,0,0,0,0|3,0,1]=4 201 B10R0.71 CCCC/C=C\CCOCF 7a_200016286491_100015361967 [0,0,0,0,0,0|3,0,1]=4 202 B10R0.71 CCCC=NNCCOCC 4a_100000732670_100000185831 [0,0,0,0,0,0|3,0,1]=4 203 B10R0.71 CCCCC#CCCOCC 34a_100000037610_100000210202 [0,0,0,0,0,0|2,0,1]=3 204 B10R0.71 CCCCC#CCCOCC 7a_100000037610_100000210202 [0,0,0,0,0,0|2,0,1]=3 205 B10R0.71 CCCCC#CCCOCF 34a_100000037610_100015361967 [0,0,0,0,0,0|3,0,1]=4 206 B10R0.71 CCCCC#CCCOCF 7a_100000037610_100015361967 [0,0,0,0,0,0|3,0,1]=4 207 B10R0.71 CCCCC/C=C/COCC 34a_100016258190_100000210202 [0,0,0,0,0,0|2,0,1]=3 208 B10R0.71 CCCCC/C=C/COCC 7a_100016258190_100000210202 [0,0,0,0,0,0|2,0,1]=3 209 B10R0.71 CCCCC/C=C/COCF 34a_100016258190_100015361967 [0,0,0,0,0,0|3,0,1]=4 210 B10R0.71 CCCCC/C=C/COCF 7a_100016258190_100015361967 [0,0,0,0,0,0|3,0,1]=4 211 B10R0.71 CCCCCC#CCNCC 2230a_100015525214_100009816472 [0,0,0,0,0,0|3,0,1]=4 212 B10R0.71 CCCCCC#CCOCC 34a_100121572206_100009816472 [0,0,0,0,0,0|2,0,1]=3 213 B10R0.71 CCCCCC#CCOCC 34a_200000033628_100000210202 [0,0,0,0,0,0|2,0,1]=3 214 B10R0.71 CCCCCC#CCOCC 7a_200000033628_100000210202 [0,0,0,0,0,0|2,0,1]=3 215 B10R0.71 CCCCCC#CCOCF 34a_200000033628_100015361967 [0,0,0,0,0,0|3,0,1]=4 216 B10R0.71 CCCCCC#CCOCF 7a_200000033628_100015361967 [0,0,0,0,0,0|3,0,1]=4 217 B10R0.71 CCCCCC#CCSCC 62a_100000210202_100009816472 [0,0,0,0,0,0|2,1,1]=4 218 B10R0.71 CCCCCC#CCSCC 62a_100009816472_100000210202 [0,0,0,0,0,0|2,1,1]=4 219 B10R0.71 CCCCCCCCCNC 2230a_100000212291_200000210301 [0,0,0,0,0,0|4,0,0]=4 220 B10R0.71 CCCCCCCCCNC 2230a_106832991635_100011214924 [0,0,0,0,0,0|4,0,0]=4 221 B10R0.71 CCCCCCCCCNC 34a_100000212291_200000210301 [0,0,0,0,0,0|4,0,0]=4 222 B10R0.71 CCCCCCCCCNC 34a_100102657272_100011214924 [0,0,0,0,0,0|4,0,0]=4 223 B10R0.71 CCCCCCCCCNC 7a_106832991635_100000210328 [0,0,0,0,0,0|4,0,0]=4 224 B10R0.71 CCCCCCCCCN[13CH3] 2230a_100000212291_200025704644 [0,0,0,0,0,0|4,0,0]=4 225 B10R0.71 CCCCCCCCCN[13CH3] 34a_100000212291_200025704644 [0,0,0,0,0,0|4,0,0]=4 226 B10R0.71 CCCCCCCCCOC 34a_100000210712_200000210301 [0,0,0,0,0,0|4,0,0]=4 227 B10R0.71 CCCCCCCCCOC 34a_100138415774_100011214924 [0,0,0,0,0,0|4,0,0]=4 228 B10R0.71 CCCCCCCCCOC 7a_100000210712_200000210301 [0,0,0,0,0,0|4,0,0]=4 229 B10R0.71 CCCCCCCCCO[13CH3] 34a_100000210712_200025704644 [0,0,0,0,0,0|4,0,0]=4 230 B10R0.71 CCCCCCCCCO[13CH3] 7a_100000210712_200025704644 [0,0,0,0,0,0|4,0,0]=4 231 B10R0.71 CCCCCCCCCSC 62a_200000210301_100000210670 [0,0,0,0,0,0|4,0,0]=4 232 B10R0.71 CCCCCCCCCS[13CH3] 62a_200025704644_100000210670 [0,0,0,0,0,0|4,0,0]=4 233 B10R0.71 CCCCCCCCNCC 2230a_100000229939_100000210202 [0,0,0,0,0,0|3,0,0]=3 234 B10R0.71 CCCCCCCCNCC 2230a_100015525214_100000210759 [0,0,0,0,0,0|3,0,0]=3 235 B10R0.71 CCCCCCCCNCC 34a_100000229939_100000210202 [0,0,0,0,0,0|3,0,0]=3 236 B10R0.71 CCCCCCCCNCF 34a_100000229939_100015361967 [0,0,0,0,0,0|4,0,0]=4 237 B10R0.71 CCCCCCCCOCC 34a_100000210232_100000210202 [0,0,0,0,0,0|2,0,0]=2 238 B10R0.71 CCCCCCCCOCC 34a_100121572206_100000210759 [0,0,0,0,0,0|2,0,0]=2 239 B10R0.71 CCCCCCCCOCC 7a_100000210232_100000210202 [0,0,0,0,0,0|2,0,0]=2 240 B10R0.71 CCCCCCCCOCF 34a_100000210232_100015361967 [0,0,0,0,0,0|3,0,0]=3 241 B10R0.71 CCCCCCCCOCF 7a_100000210232_100015361967 [0,0,0,0,0,0|3,0,0]=3 242 B10R0.71 CCCCCCCCSCC 62a_100000210202_100000210317 [0,0,0,0,0,0|2,1,0]=3 243 B10R0.71 CCCCCCCCSCC 62a_100000210759_100000210202 [0,0,0,0,0,0|2,1,0]=3 244 B10R0.71 CCCCCCCCSCF 62a_100000210759_100015361967 [0,0,0,0,0,0|3,1,0]=4 245 B10R0.71 CCCCCCCCSCF 62a_100015361967_100000210317 [0,0,0,0,0,0|3,1,0]=4 246 B10R0.71 CCCCCCCNCCC 2230a_100000229938_100000210303 [0,0,0,0,0,0|4,0,0]=4 247 B10R0.71 CCCCCCCOCCC 34a_100000210258_100000210614 [0,0,0,0,0,0|4,0,0]=4 248 B10R0.71 CCCCCCCOCCC 34a_100000210272_100000210303 [0,0,0,0,0,0|4,0,0]=4 249 B10R0.71 CCCCCCCOCCC 7a_100000210272_100000210303 [0,0,0,0,0,0|4,0,0]=4 250 B10R0.71 CCCCCCCSCCC 62a_100000210303_100000210316 [0,0,0,0,0,0|4,0,0]=4 251 B10R0.71 CCCCCCCSCCC 62a_100000210614_100000210303 [0,0,0,0,0,0|4,0,0]=4 252 B10R0.71 CCCCCCNCCCC 2230a_100000102301_100000210314 [0,0,0,0,0,0|4,0,0]=4 253 B10R0.71 CCCCCCNCCCC 2230a_100000210581_100000210211 [0,0,0,0,0,0|4,0,0]=4 254 B10R0.71 CCCCCCNCCCC 7a_106832991798_100000210314 [0,0,0,0,0,0|4,0,0]=4 255 B10R0.71 CCCCCCOCCCC 34a_100000210227_100000210314 [0,0,0,0,0,0|4,0,0]=4 256 B10R0.71 CCCCCCOCCCC 34a_100000210259_100000210210 [0,0,0,0,0,0|4,0,0]=4 257 B10R0.71 CCCCCCOCCCC 7a_100000210227_100000210314 [0,0,0,0,0,0|4,0,0]=4 258 B10R0.71 CCCCCCOCCCC 7a_100000210259_100000210211 [0,0,0,0,0,0|4,0,0]=4 259 B10R0.71 CCCCCCSCCCC 62a_100000210211_100000210757 [0,0,0,0,0,0|4,0,0]=4 260 B10R0.71 CCCCCCSCCCC 62a_100000210314_100000210210 [0,0,0,0,0,0|4,0,0]=4 261 B10R0.71 CCCCCCSCOCC 62a_100000210314_100000739092 [0,0,0,0,0,0|3,0,0]=3 262 B10R0.71 CCCCCCSCOCC 62a_100000739092_100000210757 [0,0,0,0,0,0|3,0,0]=3 263 B10R0.71 CCCCCNCCCCC 2230a_100000209983_100000210326 [0,0,0,0,0,0|3,0,0]=3 264 B10R0.71 CCCCCNCCCCF 2230a_100000209983_100000729493 [0,0,0,0,0,0|4,0,0]=4 265 B10R0.71 CCCCCNCCCCO 2230a_100000209983_100000210776 [0,0,0,0,0,0|4,0,0]=4 266 B10R0.71 CCCCCNCCCCO 2230a_100000750430_100000210326 [0,0,0,0,0,0|4,0,0]=4 267 B10R0.71 CCCCCNCCCCO 34a_100000750430_100000718602 [0,0,0,0,0,0|4,0,0]=4 268 B10R0.71 CCCCCNCCCOC 2230a_100000209983_100000740836 [0,0,0,0,0,0|4,0,0]=4 269 B10R0.71 CCCCCNCCCOC 34a_100150723488_100000718602 [0,0,0,0,0,0|4,0,0]=4 270 B10R0.71 CCCCCNCCCSC 2230a_100000749238_100000210326 [0,0,0,0,0,0|4,0,0]=4 271 B10R0.71 CCCCCNCCOCC 2230a_100000209983_100011215890 [0,0,0,0,0,0|2,0,0]=2 272 B10R0.71 CCCCCNCCOCC 2230a_102516460346_100000210326 [0,0,0,0,0,0|2,0,0]=2 273 B10R0.71 CCCCCNCCOCC 34a_100000224656_100000210202 [0,0,0,0,0,0|2,0,0]=2 274 B10R0.71 CCCCCNCCOCC 34a_102516460346_100000718602 [0,0,0,0,0,0|2,0,0]=2 275 B10R0.71 CCCCCNCCOCF 34a_100000224656_100015361967 [0,0,0,0,0,0|3,0,0]=3 276 B10R0.71 CCCCCNCCSCC 2230a_100000106463_100000210326 [0,0,0,0,0,0|2,1,0]=3 277 B10R0.71 CCCCCNCCSCC 2230a_100000209983_100000757381 [0,0,0,0,0,0|2,1,0]=3 278 B10R0.71 CCCCCOCC#CCCl 34a_200000047223_100000718602 [0,0,0,0,0,0|3,0,1]=4 279 B10R0.71 CCCCCOCC#CCO 34a_100000210253_200000047223 [0,0,0,0,0,0|3,0,1]=4 280 B10R0.71 CCCCCOCC#CCO 7a_100000210253_200000047223 [0,0,0,0,0,0|3,0,1]=4 281 B10R0.71 CCCCCOCCCC#N 7a_100000210253_100000687738 [0,0,0,0,0,0|3,0,1]=4 282 B10R0.71 CCCCCOCCCC=O 7a_100000210253_200011292268 [0,0,0,0,0,0|3,0,1]=4 283 B10R0.71 CCCCCOCCCCBr 34a_100011216708_100000718602 [0,0,0,0,0,0|3,0,0]=3 284 B10R0.71 CCCCCOCCCCC 34a_100000210253_100000718602 [0,0,0,0,0,0|2,0,0]=2 285 B10R0.71 CCCCCOCCCCC 7a_100000210253_100000210326 [0,0,0,0,0,0|2,0,0]=2 286 B10R0.71 CCCCCOCCCCCl 34a_100000210776_100000718602 [0,0,0,0,0,0|3,0,0]=3 287 B10R0.71 CCCCCOCCCCCl 7a_100000210776_100000210326 [0,0,0,0,0,0|3,0,0]=3 288 B10R0.71 CCCCCOCCCCF 34a_100000210253_100000729493 [0,0,0,0,0,0|3,0,0]=3 289 B10R0.71 CCCCCOCCCCF 34a_100011995726_100000718602 [0,0,0,0,0,0|3,0,0]=3 290 B10R0.71 CCCCCOCCCCF 7a_100000210253_100000729493 [0,0,0,0,0,0|3,0,0]=3 291 B10R0.71 CCCCCOCCCCF 7a_100011995726_100000210326 [0,0,0,0,0,0|3,0,0]=3 292 B10R0.71 CCCCCOCCCCI 34a_200012148704_100000718602 [0,0,0,0,0,0|3,0,0]=3 293 B10R0.71 CCCCCOCCCCN 34a_100000750430_100000718602 [0,0,0,0,0,0|3,0,0]=3 294 B10R0.71 CCCCCOCCCCO 34a_100000210253_100011216708 [0,0,0,0,0,0|3,0,0]=3 295 B10R0.71 CCCCCOCCCCO 7a_100000210253_100000210776 [0,0,0,0,0,0|3,0,0]=3 296 B10R0.71 CCCCCOCCCNC 34a_100000213112_100000718602 [0,0,0,0,0,0|3,0,0]=3 297 B10R0.71 CCCCCOCCCOC 34a_100000210253_100000740836 [0,0,0,0,0,0|3,0,0]=3 298 B10R0.71 CCCCCOCCCOC 34a_100000740835_100000718602 [0,0,0,0,0,0|3,0,0]=3 299 B10R0.71 CCCCCOCCCOC 7a_100000210253_100000740836 [0,0,0,0,0,0|3,0,0]=3 300 B10R0.71 CCCCCOCCCSC 34a_100000690336_100000718602 [0,0,0,0,0,0|3,0,0]=3 301 B10R0.71 CCCCCOCCCSC 7a_100000690336_100000210326 [0,0,0,0,0,0|3,0,0]=3 302 B10R0.71 CCCCCOCCOCC 34a_100000210136_100000718602 [0,0,0,0,0,0|1,0,0]=1 303 B10R0.71 CCCCCOCCOCC 34a_100000210253_100000210147 [0,0,0,0,0,0|1,0,0]=1 304 B10R0.71 CCCCCOCCOCC 34a_100011215259_100000210202 [0,0,0,0,0,0|1,0,0]=1 305 B10R0.71 CCCCCOCCOCC 7a_100000210136_100000210326 [0,0,0,0,0,0|1,0,0]=1 306 B10R0.71 CCCCCOCCOCC 7a_100000210253_100011215890 [0,0,0,0,0,0|1,0,0]=1 307 B10R0.71 CCCCCOCCOCC 7a_100011215259_100000210202 [0,0,0,0,0,0|1,0,0]=1 308 B10R0.71 CCCCCOCCOCF 34a_100011215259_100015361967 [0,0,0,0,0,0|2,0,0]=2 309 B10R0.71 CCCCCOCCOCF 7a_100011215259_100015361967 [0,0,0,0,0,0|2,0,0]=2 310 B10R0.71 CCCCCOCCSCC 34a_100000210253_100000757381 [0,0,0,0,0,0|1,1,0]=2 311 B10R0.71 CCCCCOCCSCC 34a_100000212035_100000718602 [0,0,0,0,0,0|1,1,0]=2 312 B10R0.71 CCCCCOCCSCC 7a_100000210253_100000757381 [0,0,0,0,0,0|1,1,0]=2 313 B10R0.71 CCCCCOCCSCC 7a_100000212035_100000210326 [0,0,0,0,0,0|1,1,0]=2 314 B10R0.71 CCCCCSCCCCC 62a_100000210326_100000210326 [0,0,0,0,0,0|2,1,0]=3 315 B10R0.71 CCCCCSCCCCF 62a_100000210326_100000729493 [0,0,0,0,0,0|3,1,0]=4 316 B10R0.71 CCCCCSCCCCF 62a_100000729493_100000210326 [0,0,0,0,0,0|3,1,0]=4 317 B10R0.71 CCCCCSCCCCO 62a_100000210326_100000210776 [0,0,0,0,0,0|3,1,0]=4 318 B10R0.71 CCCCCSCCCCO 62a_100000210776_100000210326 [0,0,0,0,0,0|3,1,0]=4 319 B10R0.71 CCCCCSCCCOC 62a_100000210326_100000709357 [0,0,0,0,0,0|3,1,0]=4 320 B10R0.71 CCCCCSCCCOC 62a_100000709357_100000210326 [0,0,0,0,0,0|3,1,0]=4 321 B10R0.71 CCCCCSCCOCC 62a_100000210147_100000210326 [0,0,0,0,0,0|1,1,0]=2 322 B10R0.71 CCCCCSCCOCC 62a_100000210326_100011215890 [0,0,0,0,0,0|1,1,0]=2 323 B10R0.71 CCCCCSCCSCC 62a_100000210326_100000757381 [0,0,0,0,0,0|1,2,0]=3 324 B10R0.71 CCCCCSCCSCC 62a_100000757381_100000210326 [0,0,0,0,0,0|1,2,0]=3 325 B10R0.71 CCCCNCCCOCC 2230a_100000102301_100012232248 [0,0,0,0,0,0|3,0,0]=3 326 B10R0.71 CCCCNCCCOCC 2230a_100000210961_100000210211 [0,0,0,0,0,0|3,0,0]=3 327 B10R0.71 CCCCNCCCOCC 34a_100000210961_100000210210 [0,0,0,0,0,0|3,0,0]=3 328 B10R0.71 CCCCNCCCOCC 7a_106832991798_100012232248 [0,0,0,0,0,0|3,0,0]=3 329 B10R0.71 CCCCOCCCNCC 2230a_200000211371_100000210202 [0,0,0,0,0,0|4,0,0]=4 330 B10R0.71 CCCCOCCCNCC 34a_200000211371_100000210202 [0,0,0,0,0,0|4,0,0]=4 331 B10R0.71 CCCCOCCCOCC 34a_100000210227_100012232248 [0,0,0,0,0,0|3,0,0]=3 332 B10R0.71 CCCCOCCCOCC 34a_100000757476_100000210210 [0,0,0,0,0,0|3,0,0]=3 333 B10R0.71 CCCCOCCCOCC 34a_200011215613_100000210202 [0,0,0,0,0,0|3,0,0]=3 334 B10R0.71 CCCCOCCCOCC 7a_100000210227_100012232248 [0,0,0,0,0,0|3,0,0]=3 335 B10R0.71 CCCCOCCCOCC 7a_100000757476_100000210211 [0,0,0,0,0,0|3,0,0]=3 336 B10R0.71 CCCCOCCCOCC 7a_200011215613_100000210202 [0,0,0,0,0,0|3,0,0]=3 337 B10R0.71 CCCCOCCCOCF 34a_200011215613_100015361967 [0,0,0,0,0,0|4,0,0]=4 338 B10R0.71 CCCCOCCCOCF 7a_200011215613_100015361967 [0,0,0,0,0,0|4,0,0]=4 339 B10R0.71 CCCCOCCCSCC 34a_100011216438_100000210210 [0,0,0,0,0,0|3,1,0]=4 340 B10R0.71 CCCCOCCCSCC 7a_100011216438_100000210211 [0,0,0,0,0,0|3,1,0]=4 341 B10R0.71 CCCCOCSCOCC 62a_100000739092_100011995733 [0,0,0,0,0,0|4,0,0]=4 342 B10R0.71 CCCCOCSCOCC 62a_100011995733_100000739092 [0,0,0,0,0,0|4,0,0]=4 343 B10R0.71 CCCCSCCCOCC 62a_100000210211_100012232248 [0,0,0,0,0,0|3,0,0]=3 344 B10R0.71 CCCCSCCCOCC 62a_100012232248_100000210210 [0,0,0,0,0,0|3,0,0]=3 345 B10R0.71 CCCOCCSCOCC 62a_100000739092_100011215938 [0,0,0,0,0,0|4,0,0]=4 346 B10R0.71 CCCOCCSCOCC 62a_100011215938_100000739092 [0,0,0,0,0,0|4,0,0]=4 347 B10R0.71 CCNCCCCCCCO 2230a_100011996573_100000210202 [0,0,0,0,0,0|4,0,0]=4 348 B10R0.71 CCNCCCCCCCO 2230a_100015525214_100000760002 [0,0,0,0,0,0|4,0,0]=4 349 B10R0.71 CCNCCCCCCCO 34a_100011996573_100000210202 [0,0,0,0,0,0|4,0,0]=4 350 B10R0.71 CCNCCCCCCOC 2230a_100015525214_100011998445 [0,0,0,0,0,0|4,0,0]=4 351 B10R0.71 CCNCCOCCN=[N+]=[N-] 2230a_100102953956_100000210202 [0,0,0,0,0,0|4,0,0]=4 352 B10R0.71 CCNCCOCCOCC 2230a_100015525214_100011211534 [0,0,0,0,0,0|1,0,0]=1 353 B10R0.71 CCNCCOCCOCC 2230a_100102712874_100000210202 [0,0,0,0,0,0|1,0,0]=1 354 B10R0.71 CCNCCOCCOCC 34a_100102712874_100000210202 [0,0,0,0,0,0|1,0,0]=1 355 B10R0.71 CCOCCCCCCCBr 34a_100000760002_100000210202 [0,0,0,0,0,0|3,0,0]=3 356 B10R0.71 CCOCCCCCCCBr 7a_100000760002_100000210202 [0,0,0,0,0,0|3,0,0]=3 357 B10R0.71 CCOCCCCCCCN 34a_100011996573_100000210202 [0,0,0,0,0,0|3,0,0]=3 358 B10R0.71 CCOCCCCCCCO 34a_100121572206_100000760002 [0,0,0,0,0,0|3,0,0]=3 359 B10R0.71 CCOCCCCCCOC 34a_100121572206_100011998445 [0,0,0,0,0,0|3,0,0]=3 360 B10R0.71 CCOCCCCCCOC 34a_200012092642_100000210202 [0,0,0,0,0,0|3,0,0]=3 361 B10R0.71 CCOCCCCCCOC 7a_200012092642_100000210202 [0,0,0,0,0,0|3,0,0]=3 362 B10R0.71 CCOCCCNCCCF 2230a_100000210961_100011934791 [0,0,0,0,0,0|4,0,0]=4 363 B10R0.71 CCOCCCNCCCF 2230a_100015189416_100012232248 [0,0,0,0,0,0|4,0,0]=4 364 B10R0.71 CCOCCCNCCCF 34a_100000210961_100011934791 [0,0,0,0,0,0|4,0,0]=4 365 B10R0.71 CCOCCCNCCCF 34a_100015189416_100012232248 [0,0,0,0,0,0|4,0,0]=4 366 B10R0.71 CCOCCCNCCCO 2230a_100000210961_100000230001 [0,0,0,0,0,0|4,0,0]=4 367 B10R0.71 CCOCCCNCCCO 34a_100000210961_100000230001 [0,0,0,0,0,0|4,0,0]=4 368 B10R0.71 CCOCCCNCCOC 2230a_100000209980_100012232248 [0,0,0,0,0,0|4,0,0]=4 369 B10R0.71 CCOCCCNCCOC 2230a_100000210961_100011201679 [0,0,0,0,0,0|4,0,0]=4 370 B10R0.71 CCOCCCNCCOC 34a_100000210961_100011201679 [0,0,0,0,0,0|4,0,0]=4 371 B10R0.71 CCOCCCNCCSC 2230a_100000210961_100000751147 [0,0,0,0,0,0|4,0,0]=4 372 B10R0.71 CCOCCCNCCSC 2230a_100020590264_100012232248 [0,0,0,0,0,0|4,0,0]=4 373 B10R0.71 CCOCCCNCCSC 34a_100000210961_100000212216 [0,0,0,0,0,0|4,0,0]=4 374 B10R0.71 CCOCCCOCCCBr 34a_100011217188_100012232248 [0,0,0,0,0,0|4,0,0]=4 375 B10R0.71 CCOCCCOCCCCl 34a_100000230001_100012232248 [0,0,0,0,0,0|4,0,0]=4 376 B10R0.71 CCOCCCOCCCF 34a_100000757476_100011934791 [0,0,0,0,0,0|4,0,0]=4 377 B10R0.71 CCOCCCOCCCF 34a_100000759539_100012232248 [0,0,0,0,0,0|4,0,0]=4 378 B10R0.71 CCOCCCOCCCF 7a_100000757476_100011934791 [0,0,0,0,0,0|4,0,0]=4 379 B10R0.71 CCOCCCOCCCN 34a_100000182051_100012232248 [0,0,0,0,0,0|4,0,0]=4 380 B10R0.71 CCOCCCOCCCN 34a_100011310245_100000210202 [0,0,0,0,0,0|4,0,0]=4 381 B10R0.71 CCOCCCOCCCO 34a_100000757476_100000230001 [0,0,0,0,0,0|4,0,0]=4 382 B10R0.71 CCOCCCOCCCO 7a_100000757476_100011215043 [0,0,0,0,0,0|4,0,0]=4 383 B10R0.71 CCOCCCOCCOC 34a_100000210237_100012232248 [0,0,0,0,0,0|4,0,0]=4 384 B10R0.71 CCOCCCOCCOC 34a_100000757476_100011201679 [0,0,0,0,0,0|4,0,0]=4 385 B10R0.71 CCOCCCOCCOC 34a_100121572206_100011216529 [0,0,0,0,0,0|4,0,0]=4 386 B10R0.71 CCOCCCOCCOC 7a_100000757476_100000233755 [0,0,0,0,0,0|4,0,0]=4 387 B10R0.71 CCOCCCOCCSC 34a_100000230434_100012232248 [0,0,0,0,0,0|4,0,0]=4 388 B10R0.71 CCOCCCOCCSC 34a_100000757476_100000212216 [0,0,0,0,0,0|4,0,0]=4 389 B10R0.71 CCOCCCOCCSC 7a_100000230434_100012232248 [0,0,0,0,0,0|4,0,0]=4 390 B10R0.71 CCOCCCOCCSC 7a_100000757476_100000212216 [0,0,0,0,0,0|4,0,0]=4 391 B10R0.71 CCOCCCSCCCF 62a_100011934791_100012232248 [0,0,0,0,0,0|4,0,0]=4 392 B10R0.71 CCOCCCSCCCF 62a_100012232248_100011934791 [0,0,0,0,0,0|4,0,0]=4 393 B10R0.71 CCOCCCSCCCO 62a_100011215043_100012232248 [0,0,0,0,0,0|4,0,0]=4 394 B10R0.71 CCOCCCSCCCO 62a_100012232248_100011215043 [0,0,0,0,0,0|4,0,0]=4 395 B10R0.71 CCOCCCSCCOC 62a_100000233755_100012232248 [0,0,0,0,0,0|4,0,0]=4 396 B10R0.71 CCOCCCSCCOC 62a_100012232248_100000233755 [0,0,0,0,0,0|4,0,0]=4 397 B10R0.71 CCOCCCSCCSC 62a_100000212216_100012232248 [0,0,0,0,0,0|4,0,0]=4 398 B10R0.71 CCOCCCSCCSC 62a_100012232248_100000751147 [0,0,0,0,0,0|4,0,0]=4 399 B10R0.71 CCOCCCSCOCC 62a_100000739092_100012232248 [0,0,0,0,0,0|2,0,0]=2 400 B10R0.71 CCOCCCSCOCC 62a_100012232248_100000739092 [0,0,0,0,0,0|2,0,0]=2 401 B10R0.71 CCOCCNCC#CCO 2230a_102516460346_200000047223 [0,0,0,0,0,0|3,0,1]=4 402 B10R0.71 CCOCCNCC#CCO 34a_102516460346_200000047223 [0,0,0,0,0,0|3,0,1]=4 403 B10R0.71 CCOCCNCCCC#N 2230a_102516460346_100000687738 [0,0,0,0,0,0|3,0,1]=4 404 B10R0.71 CCOCCNCCCC=O 2230a_102516460346_200011292268 [0,0,0,0,0,0|3,0,1]=4 405 B10R0.71 CCOCCNCCCCF 2230a_102516460346_100000729493 [0,0,0,0,0,0|3,0,0]=3 406 B10R0.71 CCOCCNCCCCF 34a_102516460346_100000729493 [0,0,0,0,0,0|3,0,0]=3 407 B10R0.71 CCOCCNCCCCO 2230a_100000750430_100011215890 [0,0,0,0,0,0|3,0,0]=3 408 B10R0.71 CCOCCNCCCCO 2230a_102516460346_100000210776 [0,0,0,0,0,0|3,0,0]=3 409 B10R0.71 CCOCCNCCCCO 34a_100000750430_100000210147 [0,0,0,0,0,0|3,0,0]=3 410 B10R0.71 CCOCCNCCCCO 34a_102516460346_100011216708 [0,0,0,0,0,0|3,0,0]=3 411 B10R0.71 CCOCCNCCCOC 2230a_102516460346_100000740836 [0,0,0,0,0,0|3,0,0]=3 412 B10R0.71 CCOCCNCCCOC 34a_100150723488_100000210147 [0,0,0,0,0,0|3,0,0]=3 413 B10R0.71 CCOCCNCCCOC 34a_102516460346_100000740836 [0,0,0,0,0,0|3,0,0]=3 414 B10R0.71 CCOCCNCCCSC 2230a_100000749238_100011215890 [0,0,0,0,0,0|3,0,0]=3 415 B10R0.71 CCOCCNCCOCC 2230a_102516460346_100011215890 [0,0,0,0,0,0|1,0,0]=1 416 B10R0.71 CCOCCNCCOCC 34a_102516460346_100000210147 [0,0,0,0,0,0|1,0,0]=1 417 B10R0.71 CCOCCNCCSCC 2230a_100000106463_100011215890 [0,0,0,0,0,0|1,1,0]=2 418 B10R0.71 CCOCCNCCSCC 2230a_102516460346_100000757381 [0,0,0,0,0,0|1,1,0]=2 419 B10R0.71 CCOCCNCCSCC 34a_102516460346_100000757381 [0,0,0,0,0,0|1,1,0]=2 420 B10R0.71 CCOCCOCC#CCCl 34a_200000047223_100000210147 [0,0,0,0,0,0|2,0,1]=3 421 B10R0.71 CCOCCOCC#CCO 34a_100000210136_200000047223 [0,0,0,0,0,0|2,0,1]=3 422 B10R0.71 CCOCCOCC#CCO 7a_100000210136_200000047223 [0,0,0,0,0,0|2,0,1]=3 423 B10R0.71 CCOCCOCCCC#N 7a_100000210136_100000687738 [0,0,0,0,0,0|2,0,1]=3 424 B10R0.71 CCOCCOCCCC=O 7a_100000210136_200011292268 [0,0,0,0,0,0|2,0,1]=3 425 B10R0.71 CCOCCOCCCCBr 34a_100011216708_100000210147 [0,0,0,0,0,0|2,0,0]=2 426 B10R0.71 CCOCCOCCCCCl 34a_100000210776_100000210147 [0,0,0,0,0,0|2,0,0]=2 427 B10R0.71 CCOCCOCCCCCl 7a_100000210776_100011215890 [0,0,0,0,0,0|2,0,0]=2 428 B10R0.71 CCOCCOCCCCF 34a_100000210136_100000729493 [0,0,0,0,0,0|2,0,0]=2 429 B10R0.71 CCOCCOCCCCF 34a_100011995726_100000210147 [0,0,0,0,0,0|2,0,0]=2 430 B10R0.71 CCOCCOCCCCF 7a_100000210136_100000729493 [0,0,0,0,0,0|2,0,0]=2 431 B10R0.71 CCOCCOCCCCF 7a_100011995726_100011215890 [0,0,0,0,0,0|2,0,0]=2 432 B10R0.71 CCOCCOCCCCI 34a_200012148704_100000210147 [0,0,0,0,0,0|2,0,0]=2 433 B10R0.71 CCOCCOCCCCN 34a_100000750430_100000210147 [0,0,0,0,0,0|2,0,0]=2 434 B10R0.71 CCOCCOCCCCO 34a_100000210136_100011216708 [0,0,0,0,0,0|2,0,0]=2 435 B10R0.71 CCOCCOCCCCO 7a_100000210136_100000210776 [0,0,0,0,0,0|2,0,0]=2 436 B10R0.71 CCOCCOCCCNC 34a_100000213112_100000210147 [0,0,0,0,0,0|2,0,0]=2 437 B10R0.71 CCOCCOCCCOC 34a_100000210136_100000740836 [0,0,0,0,0,0|2,0,0]=2 438 B10R0.71 CCOCCOCCCOC 34a_100000740835_100000210147 [0,0,0,0,0,0|2,0,0]=2 439 B10R0.71 CCOCCOCCCOC 7a_100000210136_100000740836 [0,0,0,0,0,0|2,0,0]=2 440 B10R0.71 CCOCCOCCCSC 34a_100000690336_100000210147 [0,0,0,0,0,0|2,0,0]=2 441 B10R0.71 CCOCCOCCCSC 7a_100000690336_100011215890 [0,0,0,0,0,0|2,0,0]=2 442 B10R0.71 CCOCCOCCNCF 34a_100102712874_100015361967 [0,0,0,0,0,0|2,0,0]=2 443 B10R0.71 CCOCCOCCOCC 34a_100000210136_100000210147 [0,0,0,0,0,0|0,0,0]=0 444 B10R0.71 CCOCCOCCOCC 34a_100000210240_100000210202 [0,0,0,0,0,0|0,0,0]=0 445 B10R0.71 CCOCCOCCOCC 34a_100121572206_100011211534 [0,0,0,0,0,0|0,0,0]=0 446 B10R0.71 CCOCCOCCOCC 7a_100000210136_100011215890 [0,0,0,0,0,0|0,0,0]=0 447 B10R0.71 CCOCCOCCOCC 7a_100000210240_100000210202 [0,0,0,0,0,0|0,0,0]=0 448 B10R0.71 CCOCCOCCOCF 34a_100000210240_100015361967 [0,0,0,0,0,0|1,0,0]=1 449 B10R0.71 CCOCCOCCOCF 7a_100000210240_100015361967 [0,0,0,0,0,0|1,0,0]=1 450 B10R0.71 CCOCCOCCSCC 34a_100000210136_100000757381 [0,0,0,0,0,0|0,1,0]=1 451 B10R0.71 CCOCCOCCSCC 34a_100000212035_100000210147 [0,0,0,0,0,0|0,1,0]=1 452 B10R0.71 CCOCCOCCSCC 62a_100000210202_100011211534 [0,0,0,0,0,0|0,1,0]=1 453 B10R0.71 CCOCCOCCSCC 62a_100011211534_100000210202 [0,0,0,0,0,0|0,1,0]=1 454 B10R0.71 CCOCCOCCSCC 7a_100000210136_100000757381 [0,0,0,0,0,0|0,1,0]=1 455 B10R0.71 CCOCCOCCSCC 7a_100000212035_100011215890 [0,0,0,0,0,0|0,1,0]=1 456 B10R0.71 CCOCCOCCSCF 62a_100011211534_100015361967 [0,0,0,0,0,0|1,1,0]=2 457 B10R0.71 CCOCCOCCSCF 62a_100015361967_100011211534 [0,0,0,0,0,0|1,1,0]=2 458 B10R0.71 CCOCCSCC#CCO 62a_100000210147_200000047223 [0,0,0,0,0,0|2,1,1]=4 459 B10R0.71 CCOCCSCC#CCO 62a_200000047223_100011215890 [0,0,0,0,0,0|2,1,1]=4 460 B10R0.71 CCOCCSCCCC#N 62a_100000210147_100000687738 [0,0,0,0,0,0|2,1,1]=4 461 B10R0.71 CCOCCSCCCC#N 62a_100000687738_100011215890 [0,0,0,0,0,0|2,1,1]=4 462 B10R0.71 CCOCCSCCCC=O 62a_100000210147_200011292268 [0,0,0,0,0,0|2,1,1]=4 463 B10R0.71 CCOCCSCCCC=O 62a_200011292268_100011215890 [0,0,0,0,0,0|2,1,1]=4 464 B10R0.71 CCOCCSCCCCF 62a_100000210147_100000729493 [0,0,0,0,0,0|2,1,0]=3 465 B10R0.71 CCOCCSCCCCF 62a_100000729493_100011215890 [0,0,0,0,0,0|2,1,0]=3 466 B10R0.71 CCOCCSCCCCO 62a_100000210147_100000210776 [0,0,0,0,0,0|2,1,0]=3 467 B10R0.71 CCOCCSCCCCO 62a_100000210776_100011215890 [0,0,0,0,0,0|2,1,0]=3 468 B10R0.71 CCOCCSCCCOC 62a_100000210147_100000709357 [0,0,0,0,0,0|2,1,0]=3 469 B10R0.71 CCOCCSCCCOC 62a_100000709357_100011215890 [0,0,0,0,0,0|2,1,0]=3 470 B10R0.71 CCOCCSCCOCC 62a_100000210147_100011215890 [0,0,0,0,0,0|0,1,0]=1 471 B10R0.71 CCOCCSCCSC#N 62a_100000034367_100011215890 [0,0,0,0,0,0|1,2,1]=4 472 B10R0.71 CCOCCSCCSC#N 62a_100000210147_100000034367 [0,0,0,0,0,0|1,2,1]=4 473 B10R0.71 CCOCCSCCSCC 62a_100000210147_100000757381 [0,0,0,0,0,0|0,2,0]=2 474 B10R0.71 CCOCCSCCSCC 62a_100000757381_100011215890 [0,0,0,0,0,0|0,2,0]=2 475 B10R0.71 CCOCSCCCCCF 62a_100000729378_100000739092 [0,0,0,0,0,0|4,0,0]=4 476 B10R0.71 CCOCSCCCCCF 62a_100000739092_100000729378 [0,0,0,0,0,0|4,0,0]=4 477 B10R0.71 CCOCSCCCCCO 62a_100000739092_100000746330 [0,0,0,0,0,0|4,0,0]=4 478 B10R0.71 CCOCSCCCCCO 62a_100000746330_100000739092 [0,0,0,0,0,0|4,0,0]=4 479 B10R0.71 CCOCSCCCCOC 62a_100000730899_100000739092 [0,0,0,0,0,0|4,0,0]=4 480 B10R0.71 CCOCSCCCCOC 62a_100000739092_100000730899 [0,0,0,0,0,0|4,0,0]=4 481 B10R0.71 CCSCCCCCCCO 62a_100000210202_100000760002 [0,0,0,0,0,0|3,1,0]=4 482 B10R0.71 CCSCCCCCCCO 62a_100000760002_100000210202 [0,0,0,0,0,0|3,1,0]=4 483 B10R0.71 CCSCCCCCCOC 62a_100000210202_100011998445 [0,0,0,0,0,0|3,1,0]=4 484 B10R0.71 CCSCCCCCCOC 62a_100011998445_100000210202 [0,0,0,0,0,0|3,1,0]=4 485 B10R0.71 CCSCCNCCCCF 2230a_100000106463_100000729493 [0,0,0,0,0,0|3,1,0]=4 486 B10R0.71 CCSCCNCCCCO 2230a_100000106463_100000210776 [0,0,0,0,0,0|3,1,0]=4 487 B10R0.71 CCSCCNCCCCO 2230a_100000750430_100000757381 [0,0,0,0,0,0|3,1,0]=4 488 B10R0.71 CCSCCNCCCCO 34a_100000750430_100000757381 [0,0,0,0,0,0|3,1,0]=4 489 B10R0.71 CCSCCNCCCOC 2230a_100000106463_100000740836 [0,0,0,0,0,0|3,1,0]=4 490 B10R0.71 CCSCCNCCCOC 34a_100150723488_100000757381 [0,0,0,0,0,0|3,1,0]=4 491 B10R0.71 CCSCCNCCCSC 2230a_100000749238_100000757381 [0,0,0,0,0,0|3,1,0]=4 492 B10R0.71 CCSCCNCCSCC 2230a_100000106463_100000757381 [0,0,0,0,0,0|1,2,0]=3 493 B10R0.71 CCSCCOCC#CCCl 34a_200000047223_100000757381 [0,0,0,0,0,0|2,1,1]=4 494 B10R0.71 CCSCCOCC#CCO 34a_100000212035_200000047223 [0,0,0,0,0,0|2,1,1]=4 495 B10R0.71 CCSCCOCC#CCO 7a_100000212035_200000047223 [0,0,0,0,0,0|2,1,1]=4 496 B10R0.71 CCSCCOCCCC#N 7a_100000212035_100000687738 [0,0,0,0,0,0|2,1,1]=4 497 B10R0.71 CCSCCOCCCC=O 7a_100000212035_200011292268 [0,0,0,0,0,0|2,1,1]=4 498 B10R0.71 CCSCCOCCCCBr 34a_100011216708_100000757381 [0,0,0,0,0,0|2,1,0]=3 499 B10R0.71 CCSCCOCCCCCl 34a_100000210776_100000757381 [0,0,0,0,0,0|2,1,0]=3 500 B10R0.71 CCSCCOCCCCCl 7a_100000210776_100000757381 [0,0,0,0,0,0|2,1,0]=3 501 B10R0.71 CCSCCOCCCCF 34a_100000212035_100000729493 [0,0,0,0,0,0|2,1,0]=3 502 B10R0.71 CCSCCOCCCCF 34a_100011995726_100000757381 [0,0,0,0,0,0|2,1,0]=3 503 B10R0.71 CCSCCOCCCCF 7a_100000212035_100000729493 [0,0,0,0,0,0|2,1,0]=3 504 B10R0.71 CCSCCOCCCCF 7a_100011995726_100000757381 [0,0,0,0,0,0|2,1,0]=3 505 B10R0.71 CCSCCOCCCCI 34a_200012148704_100000757381 [0,0,0,0,0,0|2,1,0]=3 506 B10R0.71 CCSCCOCCCCN 34a_100000750430_100000757381 [0,0,0,0,0,0|2,1,0]=3 507 B10R0.71 CCSCCOCCCCO 34a_100000212035_100011216708 [0,0,0,0,0,0|2,1,0]=3 508 B10R0.71 CCSCCOCCCCO 7a_100000212035_100000210776 [0,0,0,0,0,0|2,1,0]=3 509 B10R0.71 CCSCCOCCCNC 34a_100000213112_100000757381 [0,0,0,0,0,0|2,1,0]=3 510 B10R0.71 CCSCCOCCCOC 34a_100000212035_100000740836 [0,0,0,0,0,0|2,1,0]=3 511 B10R0.71 CCSCCOCCCOC 34a_100000740835_100000757381 [0,0,0,0,0,0|2,1,0]=3 512 B10R0.71 CCSCCOCCCOC 7a_100000212035_100000740836 [0,0,0,0,0,0|2,1,0]=3 513 B10R0.71 CCSCCOCCCSC 34a_100000690336_100000757381 [0,0,0,0,0,0|2,1,0]=3 514 B10R0.71 CCSCCOCCCSC 7a_100000690336_100000757381 [0,0,0,0,0,0|2,1,0]=3 515 B10R0.71 CCSCCOCCSCC 34a_100000212035_100000757381 [0,0,0,0,0,0|0,2,0]=2 516 B10R0.71 CCSCCOCCSCC 7a_100000212035_100000757381 [0,0,0,0,0,0|0,2,0]=2 517 B10R0.71 CCSCCSCCCCF 62a_100000729493_100000757381 [0,0,0,0,0,0|2,2,0]=4 518 B10R0.71 CCSCCSCCCCF 62a_100000757381_100000729493 [0,0,0,0,0,0|2,2,0]=4 519 B10R0.71 CCSCCSCCCCO 62a_100000210776_100000757381 [0,0,0,0,0,0|2,2,0]=4 520 B10R0.71 CCSCCSCCCCO 62a_100000757381_100000210776 [0,0,0,0,0,0|2,2,0]=4 521 B10R0.71 CCSCCSCCCOC 62a_100000709357_100000757381 [0,0,0,0,0,0|2,2,0]=4 522 B10R0.71 CCSCCSCCCOC 62a_100000757381_100000709357 [0,0,0,0,0,0|2,2,0]=4 523 B10R0.71 CCSCCSCCSCC 62a_100000757381_100000757381 [0,0,0,0,0,0|0,3,0]=3 524 B10R0.71 CNCCCOCCCCF 34a_100000213112_100000729493 [0,0,0,0,0,0|4,0,0]=4 525 B10R0.71 CNCCCOCCCCO 34a_100000213112_100011216708 [0,0,0,0,0,0|4,0,0]=4 526 B10R0.71 CNCCCOCCCOC 34a_100000213112_100000740836 [0,0,0,0,0,0|4,0,0]=4 527 B10R0.71 COCCCCCCOCF 34a_200012092642_100015361967 [0,0,0,0,0,0|4,0,0]=4 528 B10R0.71 COCCCCCCOCF 7a_200012092642_100015361967 [0,0,0,0,0,0|4,0,0]=4 529 B10R0.71 COCCCOCCCCBr 34a_100011216708_100000740836 [0,0,0,0,0,0|4,0,0]=4 530 B10R0.71 COCCCOCCCCCl 34a_100000210776_100000740836 [0,0,0,0,0,0|4,0,0]=4 531 B10R0.71 COCCCOCCCCCl 7a_100000210776_100000740836 [0,0,0,0,0,0|4,0,0]=4 532 B10R0.71 COCCCOCCCCF 34a_100000740835_100000729493 [0,0,0,0,0,0|4,0,0]=4 533 B10R0.71 COCCCOCCCCF 34a_100011995726_100000740836 [0,0,0,0,0,0|4,0,0]=4 534 B10R0.71 COCCCOCCCCF 7a_100011995726_100000740836 [0,0,0,0,0,0|4,0,0]=4 535 B10R0.71 COCCCOCCCCI 34a_200012148704_100000740836 [0,0,0,0,0,0|4,0,0]=4 536 B10R0.71 COCCCOCCCCN 34a_100000750430_100000740836 [0,0,0,0,0,0|4,0,0]=4 537 B10R0.71 COCCCOCCCCO 34a_100000740835_100011216708 [0,0,0,0,0,0|4,0,0]=4 538 B10R0.71 COCCCOCCCOC 34a_100000740835_100000740836 [0,0,0,0,0,0|4,0,0]=4 539 B10R0.71 COCCCOCCCOC 34a_200011215475_200000210301 [0,0,0,0,0,0|4,0,0]=4 540 B10R0.71 COCCCOCCCOC 7a_200011215475_200000210301 [0,0,0,0,0,0|4,0,0]=4 541 B10R0.71 COCCCOCCCO[13CH3] 34a_200011215475_200025704644 [0,0,0,0,0,0|4,0,0]=4 542 B10R0.71 COCCCOCCCO[13CH3] 7a_200011215475_200025704644 [0,0,0,0,0,0|4,0,0]=4 543 B10R0.71 COCCCOCCCSC 34a_100000690336_100000740836 [0,0,0,0,0,0|4,0,0]=4 544 B10R0.71 COCCCOCCCSC 7a_100000690336_100000740836 [0,0,0,0,0,0|4,0,0]=4 545 B10R0.71 CSCCCOCCCCF 34a_100000690336_100000729493 [0,0,0,0,0,0|4,0,0]=4 546 B10R0.71 CSCCCOCCCCF 7a_100000690336_100000729493 [0,0,0,0,0,0|4,0,0]=4 547 B10R0.71 CSCCCOCCCCO 34a_100000690336_100011216708 [0,0,0,0,0,0|4,0,0]=4 548 B10R0.71 CSCCCOCCCCO 7a_100000690336_100000210776 [0,0,0,0,0,0|4,0,0]=4 549 B10R0.71 FCCCCOCCCCBr 34a_100011216708_100000729493 [0,0,0,0,0,0|4,0,0]=4 550 B10R0.71 FCCCCOCCCCCl 34a_100000210776_100000729493 [0,0,0,0,0,0|4,0,0]=4 551 B10R0.71 FCCCCOCCCCCl 7a_100000210776_100000729493 [0,0,0,0,0,0|4,0,0]=4 552 B10R0.71 FCCCCOCCCCF 34a_100011995726_100000729493 [0,0,0,0,0,0|4,0,0]=4 553 B10R0.71 FCCCCOCCCCF 7a_100011995726_100000729493 [0,0,0,0,0,0|4,0,0]=4 554 B10R0.71 FCCCCOCCCCI 34a_200012148704_100000729493 [0,0,0,0,0,0|4,0,0]=4 555 B10R0.71 FCOCCCCCCCBr 34a_100000760002_100015361967 [0,0,0,0,0,0|4,0,0]=4 556 B10R0.71 FCOCCCCCCCBr 7a_100000760002_100015361967 [0,0,0,0,0,0|4,0,0]=4 557 B10R0.71 NCCCCCCCOCF 34a_100011996573_100015361967 [0,0,0,0,0,0|4,0,0]=4 558 B10R0.71 NCCCCOCCCCF 34a_100000750430_100000729493 [0,0,0,0,0,0|4,0,0]=4 559 B10R0.71 NCCCCOCCCCO 34a_100000750430_100011216708 [0,0,0,0,0,0|4,0,0]=4 560 B10R0.71 OCCCCOCCCCBr 34a_100011216708_100011216708 [0,0,0,0,0,0|4,0,0]=4 561 B10R0.71 OCCCCOCCCCCl 34a_100000210776_100011216708 [0,0,0,0,0,0|4,0,0]=4 562 B10R0.71 OCCCCOCCCCCl 7a_100000210776_100000210776 [0,0,0,0,0,0|4,0,0]=4 563 B10R0.71 OCCCCOCCCCF 34a_100011995726_100011216708 [0,0,0,0,0,0|4,0,0]=4 564 B10R0.71 OCCCCOCCCCF 7a_100011995726_100000210776 [0,0,0,0,0,0|4,0,0]=4 565 B10R0.71 OCCCCOCCCCI 34a_200012148704_100011216708 [0,0,0,0,0,0|4,0,0]=4 566 B9R0.45 C#CCCCCCOCC 34a_100000766912_100000210202 [1,0,0,0,0,0|1,0,2]=4 567 B9R0.45 C#CCCCCCOCC 34a_100121572206_100012094781 [1,0,0,0,0,0|1,0,2]=4 568 B9R0.45 C#CCCCCCOCC 7a_100000766912_100000210202 [1,0,0,0,0,0|1,0,2]=4 569 B9R0.45 C#CCCCOCCCC 34a_100000210227_100000695029 [1,0,0,0,0,0|1,0,2]=4 570 B9R0.45 C#CCCCOCCCC 34a_100000215630_100000210210 [1,0,0,0,0,0|1,0,2]=4 571 B9R0.45 C#CCCCOCCCC 7a_100000210227_100011215417 [1,0,0,0,0,0|1,0,2]=4 572 B9R0.45 C#CCCCOCCCC 7a_100000215630_100000210211 [1,0,0,0,0,0|1,0,2]=4 573 B9R0.45 C#CCCCOCCOC 34a_100000210237_100000695029 [1,0,0,0,0,0|1,0,2]=4 574 B9R0.45 C#CCCCOCCOC 34a_100000215630_100011201679 [1,0,0,0,0,0|1,0,2]=4 575 B9R0.45 C#CCCCOCCOC 7a_100000215630_100000233755 [1,0,0,0,0,0|1,0,2]=4 576 B9R0.45 C#CCCNCCOCC 2230a_102516460346_100000688953 [1,0,0,0,0,0|1,0,2]=4 577 B9R0.45 C#CCCNCCOCC 34a_100000755551_100000210147 [1,0,0,0,0,0|1,0,2]=4 578 B9R0.45 C#CCCNCCOCC 34a_102516460346_100000688953 [1,0,0,0,0,0|1,0,2]=4 579 B9R0.45 C#CCCOCCCCC 34a_100000210253_100000688953 [1,0,0,0,0,0|1,0,2]=4 580 B9R0.45 C#CCCOCCCCC 34a_100011215631_100000718602 [1,0,0,0,0,0|1,0,2]=4 581 B9R0.45 C#CCCOCCCCC 7a_100000210253_100000688953 [1,0,0,0,0,0|1,0,2]=4 582 B9R0.45 C#CCCOCCOCC 34a_100000210136_100000688953 [1,0,0,0,0,0|0,0,2]=3 583 B9R0.45 C#CCCOCCOCC 34a_100011215631_100000210147 [1,0,0,0,0,0|0,0,2]=3 584 B9R0.45 C#CCCOCCOCC 7a_100000210136_100000688953 [1,0,0,0,0,0|0,0,2]=3 585 B9R0.45 C#CCCOCCSCC 34a_100000212035_100000688953 [1,0,0,0,0,0|0,1,2]=4 586 B9R0.45 C#CCCOCCSCC 34a_100011215631_100000757381 [1,0,0,0,0,0|0,1,2]=4 587 B9R0.45 C#CCCOCCSCC 7a_100000212035_100000688953 [1,0,0,0,0,0|0,1,2]=4 588 B9R0.45 C#CCCSCCOCC 62a_100000210147_100000688953 [1,0,0,0,0,0|0,1,2]=4 589 B9R0.45 C#CCCSCCOCC 62a_100000688953_100011215890 [1,0,0,0,0,0|0,1,2]=4 590 B9R0.45 C/C=C/CCOCCCC 34a_100016278192_100000210210 [1,0,0,0,0,0|1,0,1]=3 591 B9R0.45 C/C=C/CCOCCCF 34a_100016278192_100011934791 [1,0,0,0,0,0|2,0,1]=4 592 B9R0.45 C/C=C/CCOCCCO 34a_100016278192_100000230001 [1,0,0,0,0,0|2,0,1]=4 593 B9R0.45 C/C=C/CCOCCOC 34a_100016278192_100011201679 [1,0,0,0,0,0|1,0,1]=3 594 B9R0.45 C/C=C/CCOCCSC 34a_100016278192_100000212216 [1,0,0,0,0,0|1,1,1]=4 595 B9R0.45 C/C=C/CNCCOCC 34a_102516460346_100102629194 [1,0,0,0,0,0|1,0,2]=4 596 B9R0.45 C/C=C/COCCCCC 34a_100000210253_100102629194 [1,0,0,0,0,0|1,0,2]=4 597 B9R0.45 C/C=C/COCCCCC 34a_100016270725_100000718602 [1,0,0,0,0,0|1,0,2]=4 598 B9R0.45 C/C=C/COCCCCC 7a_100000210253_100102629194 [1,0,0,0,0,0|1,0,2]=4 599 B9R0.45 C/C=C/COCCOCC 34a_100000210136_100102629194 [1,0,0,0,0,0|0,0,2]=3 600 B9R0.45 C/C=C/COCCOCC 34a_100016270725_100000210147 [1,0,0,0,0,0|0,0,2]=3 601 B9R0.45 C/C=C/COCCOCC 7a_100000210136_100102629194 [1,0,0,0,0,0|0,0,2]=3 602 B9R0.45 C/C=C/COCCSCC 34a_100000212035_100102629194 [1,0,0,0,0,0|0,1,2]=4 603 B9R0.45 C/C=C/COCCSCC 34a_100016270725_100000757381 [1,0,0,0,0,0|0,1,2]=4 604 B9R0.45 C/C=C/COCCSCC 7a_100000212035_100102629194 [1,0,0,0,0,0|0,1,2]=4 605 B9R0.45 C/C=C/CSCCOCC 62a_100000210147_100102629194 [1,0,0,0,0,0|0,1,2]=4 606 B9R0.45 C/C=C/CSCCOCC 62a_100102629194_100011215890 [1,0,0,0,0,0|0,1,2]=4 607 B9R0.45 C=CCCCCCOCC 34a_100011216702_100000210202 [1,0,0,0,0,0|1,0,2]=4 608 B9R0.45 C=CCCCCCOCC 34a_100121572206_100000700193 [1,0,0,0,0,0|1,0,2]=4 609 B9R0.45 C=CCCCCCOCC 7a_100011216702_100000210202 [1,0,0,0,0,0|1,0,2]=4 610 B9R0.45 C=CCCCOCCCC 34a_100000210227_100000757094 [1,0,0,0,0,0|1,0,2]=4 611 B9R0.45 C=CCCCOCCCC 34a_100000758997_100000210210 [1,0,0,0,0,0|1,0,2]=4 612 B9R0.45 C=CCCCOCCCC 7a_100000210227_100000757094 [1,0,0,0,0,0|1,0,2]=4 613 B9R0.45 C=CCCCOCCCC 7a_100000758997_100000210211 [1,0,0,0,0,0|1,0,2]=4 614 B9R0.45 C=CCCCOCCOC 34a_100000210237_100000757094 [1,0,0,0,0,0|1,0,2]=4 615 B9R0.45 C=CCCCOCCOC 34a_100000758997_100011201679 [1,0,0,0,0,0|1,0,2]=4 616 B9R0.45 C=CCCCOCCOC 7a_100000758997_100000233755 [1,0,0,0,0,0|1,0,2]=4 617 B9R0.45 C=CCCNCCOCC 2230a_100015191253_100011215890 [1,0,0,0,0,0|1,0,2]=4 618 B9R0.45 C=CCCNCCOCC 2230a_102516460346_100000754431 [1,0,0,0,0,0|1,0,2]=4 619 B9R0.45 C=CCCNCCOCC 34a_102516460346_100000754431 [1,0,0,0,0,0|1,0,2]=4 620 B9R0.45 C=CCCOCCCCC 34a_100000210253_100000754431 [1,0,0,0,0,0|1,0,2]=4 621 B9R0.45 C=CCCOCCCCC 34a_100011205117_100000718602 [1,0,0,0,0,0|1,0,2]=4 622 B9R0.45 C=CCCOCCCCC 7a_100000210253_100000754431 [1,0,0,0,0,0|1,0,2]=4 623 B9R0.45 C=CCCOCCOCC 34a_100000210136_100000754431 [1,0,0,0,0,0|0,0,2]=3 624 B9R0.45 C=CCCOCCOCC 34a_100011205117_100000210147 [1,0,0,0,0,0|0,0,2]=3 625 B9R0.45 C=CCCOCCOCC 7a_100000210136_100000754431 [1,0,0,0,0,0|0,0,2]=3 626 B9R0.45 C=CCCOCCSCC 34a_100000212035_100000754431 [1,0,0,0,0,0|0,1,2]=4 627 B9R0.45 C=CCCOCCSCC 34a_100011205117_100000757381 [1,0,0,0,0,0|0,1,2]=4 628 B9R0.45 C=CCCOCCSCC 7a_100000212035_100000754431 [1,0,0,0,0,0|0,1,2]=4 629 B9R0.45 C=CCCSCCOCC 62a_100000210147_100000754431 [1,0,0,0,0,0|0,1,2]=4 630 B9R0.45 C=CCCSCCOCC 62a_100000754431_100011215890 [1,0,0,0,0,0|0,1,2]=4 631 B9R0.45 C=COCCCCOCC 34a_100000031558_100000210202 [1,0,0,0,0,0|0,0,2]=3 632 B9R0.45 C=COCCCCOCC 7a_100000031558_100000210202 [1,0,0,0,0,0|0,0,2]=3 633 B9R0.45 C=COCCCCOCF 34a_100000031558_100015361967 [1,0,0,0,0,0|1,0,2]=4 634 B9R0.45 C=COCCCCOCF 7a_100000031558_100015361967 [1,0,0,0,0,0|1,0,2]=4 635 B9R0.45 C=COCCNCCCC 2230a_100000102301_100000039644 [1,0,0,0,0,0|1,0,2]=4 636 B9R0.45 C=COCCNCCCC 7a_106832991798_100000039644 [1,0,0,0,0,0|1,0,2]=4 637 B9R0.45 C=COCCNCCOC 2230a_100000209980_100000039644 [1,0,0,0,0,0|1,0,2]=4 638 B9R0.45 C=COCCOCCCBr 34a_100011217188_100000039644 [1,0,0,0,0,0|1,0,2]=4 639 B9R0.45 C=COCCOCCCC 34a_100000033082_100000210210 [1,0,0,0,0,0|0,0,2]=3 640 B9R0.45 C=COCCOCCCC 34a_100000210227_100000039644 [1,0,0,0,0,0|0,0,2]=3 641 B9R0.45 C=COCCOCCCC 7a_100000210227_100000039644 [1,0,0,0,0,0|0,0,2]=3 642 B9R0.45 C=COCCOCCCCl 34a_100000230001_100000039644 [1,0,0,0,0,0|1,0,2]=4 643 B9R0.45 C=COCCOCCCF 34a_100000033082_100011934791 [1,0,0,0,0,0|1,0,2]=4 644 B9R0.45 C=COCCOCCCF 34a_100000759539_100000039644 [1,0,0,0,0,0|1,0,2]=4 645 B9R0.45 C=COCCOCCCN 34a_100000182051_100000039644 [1,0,0,0,0,0|1,0,2]=4 646 B9R0.45 C=COCCOCCCO 34a_100000033082_100000230001 [1,0,0,0,0,0|1,0,2]=4 647 B9R0.45 C=COCCOCCOC 34a_100000033082_100011201679 [1,0,0,0,0,0|0,0,2]=3 648 B9R0.45 C=COCCOCCOC 34a_100000039918_200000210301 [1,0,0,0,0,0|0,0,2]=3 649 B9R0.45 C=COCCOCCOC 34a_100000210237_100000039644 [1,0,0,0,0,0|0,0,2]=3 650 B9R0.45 C=COCCOCCOC 7a_100000039918_200000210301 [1,0,0,0,0,0|0,0,2]=3 651 B9R0.45 C=COCCOCCON 34a_100000700252_100000039644 [1,0,0,0,0,0|1,0,2]=4 652 B9R0.45 C=COCCOCCO[13CH3] 34a_100000039918_200025704644 [1,0,0,0,0,0|0,0,2]=3 653 B9R0.45 C=COCCOCCO[13CH3] 7a_100000039918_200025704644 [1,0,0,0,0,0|0,0,2]=3 654 B9R0.45 C=COCCOCCSC 34a_100000033082_100000212216 [1,0,0,0,0,0|0,1,2]=4 655 B9R0.45 C=COCCOCCSC 34a_100000230434_100000039644 [1,0,0,0,0,0|0,1,2]=4 656 B9R0.45 C=COCCOCCSC 7a_100000230434_100000039644 [1,0,0,0,0,0|0,1,2]=4 657 B9R0.45 C=COCCSCCCC 62a_100000039644_100000210210 [1,0,0,0,0,0|0,1,2]=4 658 B9R0.45 C=COCCSCCCC 62a_100000210211_100000039644 [1,0,0,0,0,0|0,1,2]=4 659 B9R0.45 C=COCCSCCOC 62a_100000039644_100000233755 [1,0,0,0,0,0|0,1,2]=4 660 B9R0.45 C=COCCSCCOC 62a_100000233755_100000039644 [1,0,0,0,0,0|0,1,2]=4 661 B9R0.45 C=COCCSCOCC 62a_100000039644_100000739092 [1,0,0,0,0,0|0,1,2]=4 662 B9R0.45 C=COCCSCOCC 62a_100000739092_100000039644 [1,0,0,0,0,0|0,1,2]=4 663 B9R0.45 CC#CCCOCCCC 34a_100000750427_100000210210 [1,0,0,0,0,0|1,0,1]=3 664 B9R0.45 CC#CCCOCCCF 34a_100000750427_100011934791 [1,0,0,0,0,0|2,0,1]=4 665 B9R0.45 CC#CCCOCCCO 34a_100000750427_100000230001 [1,0,0,0,0,0|2,0,1]=4 666 B9R0.45 CC#CCCOCCOC 34a_100000750427_100011201679 [1,0,0,0,0,0|1,0,1]=3 667 B9R0.45 CC#CCCOCCSC 34a_100000750427_100000212216 [1,0,0,0,0,0|1,1,1]=4 668 B9R0.45 CC#CCNCCOCC 2230a_100000685387_100011215890 [1,0,0,0,0,0|1,0,2]=4 669 B9R0.45 CC#CCNCCOCC 2230a_102516460346_100000748600 [1,0,0,0,0,0|1,0,2]=4 670 B9R0.45 CC#CCNCCOCC 34a_100000685387_100000210147 [1,0,0,0,0,0|1,0,2]=4 671 B9R0.45 CC#CCNCCOCC 34a_102516460346_100000748600 [1,0,0,0,0,0|1,0,2]=4 672 B9R0.45 CC#CCOCCCCC 34a_100000210253_100000748600 [1,0,0,0,0,0|1,0,2]=4 673 B9R0.45 CC#CCOCCCCC 34a_100000761923_100000718602 [1,0,0,0,0,0|1,0,2]=4 674 B9R0.45 CC#CCOCCCCC 7a_100000210253_100000748600 [1,0,0,0,0,0|1,0,2]=4 675 B9R0.45 CC#CCOCCOCC 34a_100000210136_100000748600 [1,0,0,0,0,0|0,0,2]=3 676 B9R0.45 CC#CCOCCOCC 34a_100000761923_100000210147 [1,0,0,0,0,0|0,0,2]=3 677 B9R0.45 CC#CCOCCOCC 7a_100000210136_100000748600 [1,0,0,0,0,0|0,0,2]=3 678 B9R0.45 CC#CCOCCSCC 34a_100000212035_100000748600 [1,0,0,0,0,0|0,1,2]=4 679 B9R0.45 CC#CCOCCSCC 34a_100000761923_100000757381 [1,0,0,0,0,0|0,1,2]=4 680 B9R0.45 CC#CCOCCSCC 7a_100000212035_100000748600 [1,0,0,0,0,0|0,1,2]=4 681 B9R0.45 CC#CCSCCOCC 62a_100000210147_100000748600 [1,0,0,0,0,0|0,1,2]=4 682 B9R0.45 CC#CCSCCOCC 62a_100000748600_100011215890 [1,0,0,0,0,0|0,1,2]=4 683 B9R0.45 CC/C=C/CCCOCC 34a_100016287902_100000210202 [1,0,0,0,0,0|1,0,1]=3 684 B9R0.45 CC/C=C/CCCOCC 7a_100016287902_100000210202 [1,0,0,0,0,0|1,0,1]=3 685 B9R0.45 CC/C=C/CCCOCF 34a_100016287902_100015361967 [1,0,0,0,0,0|2,0,1]=4 686 B9R0.45 CC/C=C/CCCOCF 7a_100016287902_100015361967 [1,0,0,0,0,0|2,0,1]=4 687 B9R0.45 CC/C=C\CCCCOC 34a_100016287862_200000210301 [1,0,0,0,0,0|2,0,1]=4 688 B9R0.45 CC/C=C\CCCCOC 7a_100016287862_200000210301 [1,0,0,0,0,0|2,0,1]=4 689 B9R0.45 CC/C=C\CCCCO[13CH3] 34a_100016287862_200025704644 [1,0,0,0,0,0|2,0,1]=4 690 B9R0.45 CC/C=C\CCCCO[13CH3] 7a_100016287862_200025704644 [1,0,0,0,0,0|2,0,1]=4 691 B9R0.45 CC/C=C\CNCCCC 2230a_100000102301_100103147603 [1,0,0,0,0,0|2,0,1]=4 692 B9R0.45 CC/C=C\CNCCCC 7a_106832991798_100103147603 [1,0,0,0,0,0|2,0,1]=4 693 B9R0.45 CC/C=C\CNCCOC 2230a_100000209980_100103147603 [1,0,0,0,0,0|2,0,1]=4 694 B9R0.45 CC/C=C\COCCCBr 34a_100011217188_100103147603 [1,0,0,0,0,0|2,0,1]=4 695 B9R0.45 CC/C=C\COCCCC 34a_100000210227_100103147603 [1,0,0,0,0,0|1,0,1]=3 696 B9R0.45 CC/C=C\COCCCC 34a_100016268518_100000210210 [1,0,0,0,0,0|1,0,1]=3 697 B9R0.45 CC/C=C\COCCCC 7a_100000210227_100103147603 [1,0,0,0,0,0|1,0,1]=3 698 B9R0.45 CC/C=C\COCCCCl 34a_100000230001_100103147603 [1,0,0,0,0,0|2,0,1]=4 699 B9R0.45 CC/C=C\COCCCF 34a_100000759539_100103147603 [1,0,0,0,0,0|2,0,1]=4 700 B9R0.45 CC/C=C\COCCCF 34a_100016268518_100011934791 [1,0,0,0,0,0|2,0,1]=4 701 B9R0.45 CC/C=C\COCCCN 34a_100000182051_100103147603 [1,0,0,0,0,0|2,0,1]=4 702 B9R0.45 CC/C=C\COCCCO 34a_100016268518_100000230001 [1,0,0,0,0,0|2,0,1]=4 703 B9R0.45 CC/C=C\COCCOC 34a_100000210237_100103147603 [1,0,0,0,0,0|1,0,1]=3 704 B9R0.45 CC/C=C\COCCOC 34a_100016268518_100011201679 [1,0,0,0,0,0|1,0,1]=3 705 B9R0.45 CC/C=C\COCCON 34a_100000700252_100103147603 [1,0,0,0,0,0|2,0,1]=4 706 B9R0.45 CC/C=C\COCCSC 34a_100000230434_100103147603 [1,0,0,0,0,0|1,1,1]=4 707 B9R0.45 CC/C=C\COCCSC 34a_100016268518_100000212216 [1,0,0,0,0,0|1,1,1]=4 708 B9R0.45 CC/C=C\COCCSC 7a_100000230434_100103147603 [1,0,0,0,0,0|1,1,1]=4 709 B9R0.45 CC/C=C\CSCCCC 62a_100000210211_100103147603 [1,0,0,0,0,0|1,1,1]=4 710 B9R0.45 CC/C=C\CSCCCC 62a_100103147603_100000210210 [1,0,0,0,0,0|1,1,1]=4 711 B9R0.45 CC/C=C\CSCCOC 62a_100000233755_100103147603 [1,0,0,0,0,0|1,1,1]=4 712 B9R0.45 CC/C=C\CSCCOC 62a_100103147603_100000233755 [1,0,0,0,0,0|1,1,1]=4 713 B9R0.45 CC/C=C\CSCOCC 62a_100000739092_100103147603 [1,0,0,0,0,0|1,1,1]=4 714 B9R0.45 CC/C=C\CSCOCC 62a_100103147603_100000739092 [1,0,0,0,0,0|1,1,1]=4 715 B9R0.45 CC=CCNCCOCC 2230a_102516460346_100000070051 [1,0,0,0,0,0|1,0,2]=4 716 B9R0.45 CC=CCNCCOCC 34a_102516460346_100000070051 [1,0,0,0,0,0|1,0,2]=4 717 B9R0.45 CC=CCOCCCCC 34a_100000210253_100000070051 [1,0,0,0,0,0|1,0,2]=4 718 B9R0.45 CC=CCOCCCCC 7a_100000210253_100000070051 [1,0,0,0,0,0|1,0,2]=4 719 B9R0.45 CC=CCOCCOCC 34a_100000210136_100000070051 [1,0,0,0,0,0|0,0,2]=3 720 B9R0.45 CC=CCOCCOCC 7a_100000210136_100000070051 [1,0,0,0,0,0|0,0,2]=3 721 B9R0.45 CC=CCOCCSCC 34a_100000212035_100000070051 [1,0,0,0,0,0|0,1,2]=4 722 B9R0.45 CC=CCOCCSCC 7a_100000212035_100000070051 [1,0,0,0,0,0|0,1,2]=4 723 B9R0.45 CC=CCSCCOCC 62a_100000070051_100011215890 [1,0,0,0,0,0|0,1,2]=4 724 B9R0.45 CC=CCSCCOCC 62a_100000210147_100000070051 [1,0,0,0,0,0|0,1,2]=4 725 B9R0.45 CCC#CCNCCCC 2230a_100000102301_100009813939 [1,0,0,0,0,0|2,0,1]=4 726 B9R0.45 CCC#CCNCCCC 7a_106832991798_100009813939 [1,0,0,0,0,0|2,0,1]=4 727 B9R0.45 CCC#CCNCCOC 2230a_100000209980_100009813939 [1,0,0,0,0,0|2,0,1]=4 728 B9R0.45 CCC#CCOCCCBr 34a_100011217188_100009813939 [1,0,0,0,0,0|2,0,1]=4 729 B9R0.45 CCC#CCOCCCC 34a_100000032950_100000210210 [1,0,0,0,0,0|1,0,1]=3 730 B9R0.45 CCC#CCOCCCC 34a_100000210227_100009813939 [1,0,0,0,0,0|1,0,1]=3 731 B9R0.45 CCC#CCOCCCC 7a_100000210227_100009813939 [1,0,0,0,0,0|1,0,1]=3 732 B9R0.45 CCC#CCOCCCCl 34a_100000230001_100009813939 [1,0,0,0,0,0|2,0,1]=4 733 B9R0.45 CCC#CCOCCCF 34a_100000032950_100011934791 [1,0,0,0,0,0|2,0,1]=4 734 B9R0.45 CCC#CCOCCCF 34a_100000759539_100009813939 [1,0,0,0,0,0|2,0,1]=4 735 B9R0.45 CCC#CCOCCCN 34a_100000182051_100009813939 [1,0,0,0,0,0|2,0,1]=4 736 B9R0.45 CCC#CCOCCCO 34a_100000032950_100000230001 [1,0,0,0,0,0|2,0,1]=4 737 B9R0.45 CCC#CCOCCOC 34a_100000032950_100011201679 [1,0,0,0,0,0|1,0,1]=3 738 B9R0.45 CCC#CCOCCOC 34a_100000210237_100009813939 [1,0,0,0,0,0|1,0,1]=3 739 B9R0.45 CCC#CCOCCON 34a_100000700252_100009813939 [1,0,0,0,0,0|2,0,1]=4 740 B9R0.45 CCC#CCOCCSC 34a_100000032950_100000212216 [1,0,0,0,0,0|1,1,1]=4 741 B9R0.45 CCC#CCOCCSC 34a_100000230434_100009813939 [1,0,0,0,0,0|1,1,1]=4 742 B9R0.45 CCC#CCOCCSC 7a_100000230434_100009813939 [1,0,0,0,0,0|1,1,1]=4 743 B9R0.45 CCC#CCSCCCC 62a_100000210211_100009813939 [1,0,0,0,0,0|1,1,1]=4 744 B9R0.45 CCC#CCSCCCC 62a_100009813939_100000210210 [1,0,0,0,0,0|1,1,1]=4 745 B9R0.45 CCC#CCSCCOC 62a_100000233755_100009813939 [1,0,0,0,0,0|1,1,1]=4 746 B9R0.45 CCC#CCSCCOC 62a_100009813939_100000233755 [1,0,0,0,0,0|1,1,1]=4 747 B9R0.45 CCC#CCSCOCC 62a_100000739092_100009813939 [1,0,0,0,0,0|1,1,1]=4 748 B9R0.45 CCC#CCSCOCC 62a_100009813939_100000739092 [1,0,0,0,0,0|1,1,1]=4 749 B9R0.45 CCC=NNCCOCC 4a_100000732670_100000210100 [1,0,0,0,0,0|2,0,1]=4 750 B9R0.45 CCCC#CCCOCC 34a_100000042726_100000210202 [1,0,0,0,0,0|1,0,1]=3 751 B9R0.45 CCCC#CCCOCC 7a_100000042726_100000210202 [1,0,0,0,0,0|1,0,1]=3 752 B9R0.45 CCCC#CCCOCF 34a_100000042726_100015361967 [1,0,0,0,0,0|2,0,1]=4 753 B9R0.45 CCCC#CCCOCF 7a_100000042726_100015361967 [1,0,0,0,0,0|2,0,1]=4 754 B9R0.45 CCCC/C=C/COCC 34a_200016272032_100000210202 [1,0,0,0,0,0|1,0,1]=3 755 B9R0.45 CCCC/C=C/COCC 7a_200016272032_100000210202 [1,0,0,0,0,0|1,0,1]=3 756 B9R0.45 CCCC/C=C/COCF 34a_200016272032_100015361967 [1,0,0,0,0,0|2,0,1]=4 757 B9R0.45 CCCC/C=C/COCF 7a_200016272032_100015361967 [1,0,0,0,0,0|2,0,1]=4 758 B9R0.45 CCCC/C=C\CCOC 34a_200016286491_200000210301 [1,0,0,0,0,0|2,0,1]=4 759 B9R0.45 CCCC/C=C\CCOC 7a_200016286491_200000210301 [1,0,0,0,0,0|2,0,1]=4 760 B9R0.45 CCCC/C=C\CCO[13CH3] 34a_200016286491_200025704644 [1,0,0,0,0,0|2,0,1]=4 761 B9R0.45 CCCC/C=C\CCO[13CH3] 7a_200016286491_200025704644 [1,0,0,0,0,0|2,0,1]=4 762 B9R0.45 CCCCC#CCCOC 34a_100000037610_200000210301 [1,0,0,0,0,0|2,0,1]=4 763 B9R0.45 CCCCC#CCCOC 7a_100000037610_200000210301 [1,0,0,0,0,0|2,0,1]=4 764 B9R0.45 CCCCC#CCCO[13CH3] 34a_100000037610_200025704644 [1,0,0,0,0,0|2,0,1]=4 765 B9R0.45 CCCCC#CCCO[13CH3] 7a_100000037610_200025704644 [1,0,0,0,0,0|2,0,1]=4 766 B9R0.45 CCCCC#CCOCC 34a_200000034558_100000210202 [1,0,0,0,0,0|1,0,1]=3 767 B9R0.45 CCCCC#CCOCC 7a_200000034558_100000210202 [1,0,0,0,0,0|1,0,1]=3 768 B9R0.45 CCCCC#CCOCF 34a_200000034558_100015361967 [1,0,0,0,0,0|2,0,1]=4 769 B9R0.45 CCCCC#CCOCF 7a_200000034558_100015361967 [1,0,0,0,0,0|2,0,1]=4 770 B9R0.45 CCCCC/C=C/COC 34a_100016258190_200000210301 [1,0,0,0,0,0|2,0,1]=4 771 B9R0.45 CCCCC/C=C/COC 7a_100016258190_200000210301 [1,0,0,0,0,0|2,0,1]=4 772 B9R0.45 CCCCC/C=C/CO[13CH3] 34a_100016258190_200025704644 [1,0,0,0,0,0|2,0,1]=4 773 B9R0.45 CCCCC/C=C/CO[13CH3] 7a_100016258190_200025704644 [1,0,0,0,0,0|2,0,1]=4 774 B9R0.45 CCCCCC#CCOC 34a_100138415774_100009816472 [1,0,0,0,0,0|2,0,1]=4 775 B9R0.45 CCCCCC#CCOC 34a_200000033628_200000210301 [1,0,0,0,0,0|2,0,1]=4 776 B9R0.45 CCCCCC#CCOC 7a_200000033628_200000210301 [1,0,0,0,0,0|2,0,1]=4 777 B9R0.45 CCCCCC#CCO[13CH3] 34a_200000033628_200025704644 [1,0,0,0,0,0|2,0,1]=4 778 B9R0.45 CCCCCC#CCO[13CH3] 7a_200000033628_200025704644 [1,0,0,0,0,0|2,0,1]=4 779 B9R0.45 CCCCCCCCNC 2230a_100000229939_200000210301 [1,0,0,0,0,0|3,0,0]=4 780 B9R0.45 CCCCCCCCNC 2230a_106832991635_100000210759 [1,0,0,0,0,0|3,0,0]=4 781 B9R0.45 CCCCCCCCNC 34a_100000229939_200000210301 [1,0,0,0,0,0|3,0,0]=4 782 B9R0.45 CCCCCCCCNC 34a_100102657272_100000210759 [1,0,0,0,0,0|3,0,0]=4 783 B9R0.45 CCCCCCCCNC 7a_106832991635_100000210759 [1,0,0,0,0,0|3,0,0]=4 784 B9R0.45 CCCCCCCCN[13CH3] 2230a_100000229939_200025704644 [1,0,0,0,0,0|3,0,0]=4 785 B9R0.45 CCCCCCCCN[13CH3] 34a_100000229939_200025704644 [1,0,0,0,0,0|3,0,0]=4 786 B9R0.45 CCCCCCCCOC 34a_100000210232_200000210301 [1,0,0,0,0,0|2,0,0]=3 787 B9R0.45 CCCCCCCCOC 34a_100138415774_100000210759 [1,0,0,0,0,0|2,0,0]=3 788 B9R0.45 CCCCCCCCOC 7a_100000210232_200000210301 [1,0,0,0,0,0|2,0,0]=3 789 B9R0.45 CCCCCCCCO[13CH3] 34a_100000210232_200025704644 [1,0,0,0,0,0|2,0,0]=3 790 B9R0.45 CCCCCCCCO[13CH3] 7a_100000210232_200025704644 [1,0,0,0,0,0|2,0,0]=3 791 B9R0.45 CCCCCCCCSC 62a_100000210759_200000210301 [1,0,0,0,0,0|2,1,0]=4 792 B9R0.45 CCCCCCCCSC 62a_200000210301_100000210317 [1,0,0,0,0,0|2,1,0]=4 793 B9R0.45 CCCCCCCCS[13CH3] 62a_100000210759_200025704644 [1,0,0,0,0,0|2,1,0]=4 794 B9R0.45 CCCCCCCCS[13CH3] 62a_200025704644_100000210317 [1,0,0,0,0,0|2,1,0]=4 795 B9R0.45 CCCCCCCNCC 2230a_100000229938_100000210202 [1,0,0,0,0,0|2,0,0]=3 796 B9R0.45 CCCCCCCNCC 2230a_100015525214_100000210681 [1,0,0,0,0,0|2,0,0]=3 797 B9R0.45 CCCCCCCOCC 34a_100000210272_100000210202 [1,0,0,0,0,0|1,0,0]=2 798 B9R0.45 CCCCCCCOCC 34a_100121572206_100000210614 [1,0,0,0,0,0|1,0,0]=2 799 B9R0.45 CCCCCCCOCC 7a_100000210272_100000210202 [1,0,0,0,0,0|1,0,0]=2 800 B9R0.45 CCCCCCCOCF 34a_100000210272_100015361967 [1,0,0,0,0,0|2,0,0]=3 801 B9R0.45 CCCCCCCOCF 7a_100000210272_100015361967 [1,0,0,0,0,0|2,0,0]=3 802 B9R0.45 CCCCCCCSCC 62a_100000210202_100000210316 [1,0,0,0,0,0|1,1,0]=3 803 B9R0.45 CCCCCCCSCC 62a_100000210614_100000210202 [1,0,0,0,0,0|1,1,0]=3 804 B9R0.45 CCCCCCCSCF 62a_100000210614_100015361967 [1,0,0,0,0,0|2,1,0]=4 805 B9R0.45 CCCCCCCSCF 62a_100015361967_100000210316 [1,0,0,0,0,0|2,1,0]=4 806 B9R0.45 CCCCCCNCCC 2230a_100000210581_100000210303 [1,0,0,0,0,0|3,0,0]=4 807 B9R0.45 CCCCCCNCOC 2230a_100000210581_100000766300 [1,0,0,0,0,0|3,0,0]=4 808 B9R0.45 CCCCCCOCCC 34a_100000210258_100000210314 [1,0,0,0,0,0|3,0,0]=4 809 B9R0.45 CCCCCCOCCC 34a_100000210259_100000210303 [1,0,0,0,0,0|3,0,0]=4 810 B9R0.45 CCCCCCOCCC 7a_100000210259_100000210303 [1,0,0,0,0,0|3,0,0]=4 811 B9R0.45 CCCCCCSCCC 62a_100000210303_100000210757 [1,0,0,0,0,0|3,0,0]=4 812 B9R0.45 CCCCCCSCCC 62a_100000210314_100000210303 [1,0,0,0,0,0|3,0,0]=4 813 B9R0.45 CCCCCCSCOC 62a_100000210314_100000766300 [1,0,0,0,0,0|3,0,0]=4 814 B9R0.45 CCCCCCSCOC 62a_100000766300_100000210757 [1,0,0,0,0,0|3,0,0]=4 815 B9R0.45 CCCCCNCCCC 2230a_100000102301_100000210326 [1,0,0,0,0,0|2,0,0]=3 816 B9R0.45 CCCCCNCCCC 2230a_100000209983_100000210211 [1,0,0,0,0,0|2,0,0]=3 817 B9R0.45 CCCCCNCCCC 7a_106832991798_100000210326 [1,0,0,0,0,0|2,0,0]=3 818 B9R0.45 CCCCCNCCCF 2230a_100000209983_100011934791 [1,0,0,0,0,0|3,0,0]=4 819 B9R0.45 CCCCCNCCCF 2230a_100015189416_100000210326 [1,0,0,0,0,0|3,0,0]=4 820 B9R0.45 CCCCCNCCCF 34a_100015189416_100000718602 [1,0,0,0,0,0|3,0,0]=4 821 B9R0.45 CCCCCNCCCO 2230a_100000209983_100000230001 [1,0,0,0,0,0|3,0,0]=4 822 B9R0.45 CCCCCNCCOC 2230a_100000209980_100000210326 [1,0,0,0,0,0|2,0,0]=3 823 B9R0.45 CCCCCNCCOC 2230a_100000209983_100011201679 [1,0,0,0,0,0|2,0,0]=3 824 B9R0.45 CCCCCNCCOC 34a_100000224656_200000210301 [1,0,0,0,0,0|2,0,0]=3 825 B9R0.45 CCCCCNCCO[13CH3] 34a_100000224656_200025704644 [1,0,0,0,0,0|2,0,0]=3 826 B9R0.45 CCCCCNCCSC 2230a_100000209983_100000751147 [1,0,0,0,0,0|2,1,0]=4 827 B9R0.45 CCCCCNCCSC 2230a_100020590264_100000210326 [1,0,0,0,0,0|2,1,0]=4 828 B9R0.45 CCCCCOCCC#N 7a_100000210253_100000184422 [1,0,0,0,0,0|2,0,1]=4 829 B9R0.45 CCCCCOCCCBr 34a_100011217188_100000718602 [1,0,0,0,0,0|2,0,0]=3 830 B9R0.45 CCCCCOCCCC 34a_100000210227_100000718602 [1,0,0,0,0,0|1,0,0]=2 831 B9R0.45 CCCCCOCCCC 34a_100000210253_100000210210 [1,0,0,0,0,0|1,0,0]=2 832 B9R0.45 CCCCCOCCCC 7a_100000210227_100000210326 [1,0,0,0,0,0|1,0,0]=2 833 B9R0.45 CCCCCOCCCC 7a_100000210253_100000210211 [1,0,0,0,0,0|1,0,0]=2 834 B9R0.45 CCCCCOCCCCl 34a_100000230001_100000718602 [1,0,0,0,0,0|2,0,0]=3 835 B9R0.45 CCCCCOCCCF 34a_100000210253_100011934791 [1,0,0,0,0,0|2,0,0]=3 836 B9R0.45 CCCCCOCCCF 34a_100000759539_100000718602 [1,0,0,0,0,0|2,0,0]=3 837 B9R0.45 CCCCCOCCCF 7a_100000210253_100011934791 [1,0,0,0,0,0|2,0,0]=3 838 B9R0.45 CCCCCOCCCN 34a_100000182051_100000718602 [1,0,0,0,0,0|2,0,0]=3 839 B9R0.45 CCCCCOCCCO 34a_100000210253_100000230001 [1,0,0,0,0,0|2,0,0]=3 840 B9R0.45 CCCCCOCCCO 7a_100000210253_100011215043 [1,0,0,0,0,0|2,0,0]=3 841 B9R0.45 CCCCCOCCOC 34a_100000210237_100000718602 [1,0,0,0,0,0|1,0,0]=2 842 B9R0.45 CCCCCOCCOC 34a_100000210253_100011201679 [1,0,0,0,0,0|1,0,0]=2 843 B9R0.45 CCCCCOCCOC 34a_100011215259_200000210301 [1,0,0,0,0,0|1,0,0]=2 844 B9R0.45 CCCCCOCCOC 7a_100000210253_100000233755 [1,0,0,0,0,0|1,0,0]=2 845 B9R0.45 CCCCCOCCOC 7a_100011215259_200000210301 [1,0,0,0,0,0|1,0,0]=2 846 B9R0.45 CCCCCOCCON 34a_100000700252_100000718602 [1,0,0,0,0,0|2,0,0]=3 847 B9R0.45 CCCCCOCCO[13CH3] 34a_100011215259_200025704644 [1,0,0,0,0,0|1,0,0]=2 848 B9R0.45 CCCCCOCCO[13CH3] 7a_100011215259_200025704644 [1,0,0,0,0,0|1,0,0]=2 849 B9R0.45 CCCCCOCCSC 34a_100000210253_100000212216 [1,0,0,0,0,0|1,1,0]=3 850 B9R0.45 CCCCCOCCSC 34a_100000230434_100000718602 [1,0,0,0,0,0|1,1,0]=3 851 B9R0.45 CCCCCOCCSC 7a_100000210253_100000212216 [1,0,0,0,0,0|1,1,0]=3 852 B9R0.45 CCCCCOCCSC 7a_100000230434_100000210326 [1,0,0,0,0,0|1,1,0]=3 853 B9R0.45 CCCCCSCCCC 62a_100000210211_100000210326 [1,0,0,0,0,0|1,1,0]=3 854 B9R0.45 CCCCCSCCCC 62a_100000210326_100000210210 [1,0,0,0,0,0|1,1,0]=3 855 B9R0.45 CCCCCSCCCF 62a_100000210326_100011934791 [1,0,0,0,0,0|2,1,0]=4 856 B9R0.45 CCCCCSCCCF 62a_100011934791_100000210326 [1,0,0,0,0,0|2,1,0]=4 857 B9R0.45 CCCCCSCCCO 62a_100000210326_100011215043 [1,0,0,0,0,0|2,1,0]=4 858 B9R0.45 CCCCCSCCCO 62a_100011215043_100000210326 [1,0,0,0,0,0|2,1,0]=4 859 B9R0.45 CCCCCSCCOC 62a_100000210326_100000233755 [1,0,0,0,0,0|1,1,0]=3 860 B9R0.45 CCCCCSCCOC 62a_100000233755_100000210326 [1,0,0,0,0,0|1,1,0]=3 861 B9R0.45 CCCCCSCCSC 62a_100000210326_100000751147 [1,0,0,0,0,0|1,2,0]=4 862 B9R0.45 CCCCCSCCSC 62a_100000212216_100000210326 [1,0,0,0,0,0|1,2,0]=4 863 B9R0.45 CCCCCSCOCC 62a_100000210326_100000739092 [1,0,0,0,0,0|1,1,0]=3 864 B9R0.45 CCCCCSCOCC 62a_100000739092_100000210326 [1,0,0,0,0,0|1,1,0]=3 865 B9R0.45 CCCCNCCCCF 2230a_100000102301_100000729493 [1,0,0,0,0,0|3,0,0]=4 866 B9R0.45 CCCCNCCCCF 7a_106832991798_100000729493 [1,0,0,0,0,0|3,0,0]=4 867 B9R0.45 CCCCNCCCCO 2230a_100000102301_100000210776 [1,0,0,0,0,0|3,0,0]=4 868 B9R0.45 CCCCNCCCCO 2230a_100000750430_100000210211 [1,0,0,0,0,0|3,0,0]=4 869 B9R0.45 CCCCNCCCCO 34a_100000750430_100000210210 [1,0,0,0,0,0|3,0,0]=4 870 B9R0.45 CCCCNCCCCO 7a_106832991798_100000210776 [1,0,0,0,0,0|3,0,0]=4 871 B9R0.45 CCCCNCCCOC 2230a_100000102301_100000740836 [1,0,0,0,0,0|3,0,0]=4 872 B9R0.45 CCCCNCCCOC 34a_100150723488_100000210210 [1,0,0,0,0,0|3,0,0]=4 873 B9R0.45 CCCCNCCCOC 7a_106832991798_100000740836 [1,0,0,0,0,0|3,0,0]=4 874 B9R0.45 CCCCNCCCSC 2230a_100000749238_100000210211 [1,0,0,0,0,0|3,0,0]=4 875 B9R0.45 CCCCNCCOCC 2230a_100000102301_100011215890 [1,0,0,0,0,0|1,0,0]=2 876 B9R0.45 CCCCNCCOCC 2230a_102516460346_100000210211 [1,0,0,0,0,0|1,0,0]=2 877 B9R0.45 CCCCNCCOCC 34a_102516460346_100000210210 [1,0,0,0,0,0|1,0,0]=2 878 B9R0.45 CCCCNCCOCC 7a_106832991798_100011215890 [1,0,0,0,0,0|1,0,0]=2 879 B9R0.45 CCCCNCCSCC 2230a_100000102301_100000757381 [1,0,0,0,0,0|1,1,0]=3 880 B9R0.45 CCCCNCCSCC 2230a_100000106463_100000210211 [1,0,0,0,0,0|1,1,0]=3 881 B9R0.45 CCCCNCCSCC 7a_106832991798_100000757381 [1,0,0,0,0,0|1,1,0]=3 882 B9R0.45 CCCCOCC#CCCl 34a_200000047223_100000210210 [1,0,0,0,0,0|2,0,1]=4 883 B9R0.45 CCCCOCC#CCO 34a_100000210227_200000047223 [1,0,0,0,0,0|2,0,1]=4 884 B9R0.45 CCCCOCC#CCO 7a_100000210227_200000047223 [1,0,0,0,0,0|2,0,1]=4 885 B9R0.45 CCCCOCCCC#N 7a_100000210227_100000687738 [1,0,0,0,0,0|2,0,1]=4 886 B9R0.45 CCCCOCCCC=O 7a_100000210227_200011292268 [1,0,0,0,0,0|2,0,1]=4 887 B9R0.45 CCCCOCCCCBr 34a_100011216708_100000210210 [1,0,0,0,0,0|2,0,0]=3 888 B9R0.45 CCCCOCCCCCl 34a_100000210776_100000210210 [1,0,0,0,0,0|2,0,0]=3 889 B9R0.45 CCCCOCCCCCl 7a_100000210776_100000210211 [1,0,0,0,0,0|2,0,0]=3 890 B9R0.45 CCCCOCCCCF 34a_100000210227_100000729493 [1,0,0,0,0,0|2,0,0]=3 891 B9R0.45 CCCCOCCCCF 34a_100011995726_100000210210 [1,0,0,0,0,0|2,0,0]=3 892 B9R0.45 CCCCOCCCCF 7a_100000210227_100000729493 [1,0,0,0,0,0|2,0,0]=3 893 B9R0.45 CCCCOCCCCF 7a_100011995726_100000210211 [1,0,0,0,0,0|2,0,0]=3 894 B9R0.45 CCCCOCCCCI 34a_200012148704_100000210210 [1,0,0,0,0,0|2,0,0]=3 895 B9R0.45 CCCCOCCCCN 34a_100000750430_100000210210 [1,0,0,0,0,0|2,0,0]=3 896 B9R0.45 CCCCOCCCCO 34a_100000210227_100011216708 [1,0,0,0,0,0|2,0,0]=3 897 B9R0.45 CCCCOCCCCO 7a_100000210227_100000210776 [1,0,0,0,0,0|2,0,0]=3 898 B9R0.45 CCCCOCCCNC 2230a_200000211371_200000210301 [1,0,0,0,0,0|2,0,0]=3 899 B9R0.45 CCCCOCCCNC 34a_100000213112_100000210210 [1,0,0,0,0,0|2,0,0]=3 900 B9R0.45 CCCCOCCCNC 34a_200000211371_200000210301 [1,0,0,0,0,0|2,0,0]=3 901 B9R0.45 CCCCOCCCN[13CH3] 2230a_200000211371_200025704644 [1,0,0,0,0,0|2,0,0]=3 902 B9R0.45 CCCCOCCCN[13CH3] 34a_200000211371_200025704644 [1,0,0,0,0,0|2,0,0]=3 903 B9R0.45 CCCCOCCCOC 34a_100000210227_100000740836 [1,0,0,0,0,0|2,0,0]=3 904 B9R0.45 CCCCOCCCOC 34a_100000740835_100000210210 [1,0,0,0,0,0|2,0,0]=3 905 B9R0.45 CCCCOCCCOC 34a_200011215613_200000210301 [1,0,0,0,0,0|2,0,0]=3 906 B9R0.45 CCCCOCCCOC 7a_100000210227_100000740836 [1,0,0,0,0,0|2,0,0]=3 907 B9R0.45 CCCCOCCCOC 7a_200011215613_200000210301 [1,0,0,0,0,0|2,0,0]=3 908 B9R0.45 CCCCOCCCO[13CH3] 34a_200011215613_200025704644 [1,0,0,0,0,0|2,0,0]=3 909 B9R0.45 CCCCOCCCO[13CH3] 7a_200011215613_200025704644 [1,0,0,0,0,0|2,0,0]=3 910 B9R0.45 CCCCOCCCSC 34a_100000690336_100000210210 [1,0,0,0,0,0|2,0,0]=3 911 B9R0.45 CCCCOCCCSC 7a_100000690336_100000210211 [1,0,0,0,0,0|2,0,0]=3 912 B9R0.45 CCCCOCCNCC 2230a_100015525214_100000743108 [1,0,0,0,0,0|1,0,0]=2 913 B9R0.45 CCCCOCCOCC 34a_100000210136_100000210210 [1,0,0,0,0,0|0,0,0]=1 914 B9R0.45 CCCCOCCOCC 34a_100000210227_100000210147 [1,0,0,0,0,0|0,0,0]=1 915 B9R0.45 CCCCOCCOCC 34a_100000210238_100000210202 [1,0,0,0,0,0|0,0,0]=1 916 B9R0.45 CCCCOCCOCC 34a_100121572206_100000743108 [1,0,0,0,0,0|0,0,0]=1 917 B9R0.45 CCCCOCCOCC 7a_100000210136_100000210211 [1,0,0,0,0,0|0,0,0]=1 918 B9R0.45 CCCCOCCOCC 7a_100000210227_100011215890 [1,0,0,0,0,0|0,0,0]=1 919 B9R0.45 CCCCOCCOCC 7a_100000210238_100000210202 [1,0,0,0,0,0|0,0,0]=1 920 B9R0.45 CCCCOCCOCF 34a_100000210238_100015361967 [1,0,0,0,0,0|1,0,0]=2 921 B9R0.45 CCCCOCCOCF 7a_100000210238_100015361967 [1,0,0,0,0,0|1,0,0]=2 922 B9R0.45 CCCCOCCSCC 34a_100000210227_100000757381 [1,0,0,0,0,0|0,1,0]=2 923 B9R0.45 CCCCOCCSCC 34a_100000212035_100000210210 [1,0,0,0,0,0|0,1,0]=2 924 B9R0.45 CCCCOCCSCC 62a_100000210202_100000743108 [1,0,0,0,0,0|0,1,0]=2 925 B9R0.45 CCCCOCCSCC 62a_100000743108_100000210202 [1,0,0,0,0,0|0,1,0]=2 926 B9R0.45 CCCCOCCSCC 7a_100000210227_100000757381 [1,0,0,0,0,0|0,1,0]=2 927 B9R0.45 CCCCOCCSCC 7a_100000212035_100000210211 [1,0,0,0,0,0|0,1,0]=2 928 B9R0.45 CCCCOCCSCF 62a_100000743108_100015361967 [1,0,0,0,0,0|1,1,0]=3 929 B9R0.45 CCCCOCCSCF 62a_100015361967_100000743108 [1,0,0,0,0,0|1,1,0]=3 930 B9R0.45 CCCCOCNCCF 34a_100000724931_100011995733 [1,0,0,0,0,0|3,0,0]=4 931 B9R0.45 CCCCOCNCCO 2230a_100016997473_100011995733 [1,0,0,0,0,0|3,0,0]=4 932 B9R0.45 CCCCOCNCCO 34a_100016990907_100011995733 [1,0,0,0,0,0|3,0,0]=4 933 B9R0.45 CCCCOCOCCBr 34a_100000211926_100011995733 [1,0,0,0,0,0|3,0,0]=4 934 B9R0.45 CCCCOCOCCC 34a_100000210258_100011995733 [1,0,0,0,0,0|2,0,0]=3 935 B9R0.45 CCCCOCOCCN 34a_100000210304_100011995733 [1,0,0,0,0,0|3,0,0]=4 936 B9R0.45 CCCCOCSCCC 62a_100000210303_100011995733 [1,0,0,0,0,0|2,0,0]=3 937 B9R0.45 CCCCOCSCCC 62a_100011995733_100000210303 [1,0,0,0,0,0|2,0,0]=3 938 B9R0.45 CCCCOCSCCF 62a_100011217306_100011995733 [1,0,0,0,0,0|3,0,0]=4 939 B9R0.45 CCCCOCSCCF 62a_100011995733_100011217306 [1,0,0,0,0,0|3,0,0]=4 940 B9R0.45 CCCCOCSCCO 62a_100000211926_100011995733 [1,0,0,0,0,0|3,0,0]=4 941 B9R0.45 CCCCOCSCCO 62a_100011995733_100000211926 [1,0,0,0,0,0|3,0,0]=4 942 B9R0.45 CCCCOCSCOC 62a_100000766300_100011995733 [1,0,0,0,0,0|3,0,0]=4 943 B9R0.45 CCCCOCSCOC 62a_100011995733_100000766300 [1,0,0,0,0,0|3,0,0]=4 944 B9R0.45 CCCCOCSCSC 62a_100011218213_100011995733 [1,0,0,0,0,0|3,0,0]=4 945 B9R0.45 CCCCOCSCSC 62a_100011995733_100011218213 [1,0,0,0,0,0|3,0,0]=4 946 B9R0.45 CCCCSCCCCF 62a_100000210211_100000729493 [1,0,0,0,0,0|2,1,0]=4 947 B9R0.45 CCCCSCCCCF 62a_100000729493_100000210210 [1,0,0,0,0,0|2,1,0]=4 948 B9R0.45 CCCCSCCCCO 62a_100000210211_100000210776 [1,0,0,0,0,0|2,1,0]=4 949 B9R0.45 CCCCSCCCCO 62a_100000210776_100000210210 [1,0,0,0,0,0|2,1,0]=4 950 B9R0.45 CCCCSCCCOC 62a_100000210211_100000709357 [1,0,0,0,0,0|2,1,0]=4 951 B9R0.45 CCCCSCCCOC 62a_100000709357_100000210210 [1,0,0,0,0,0|2,1,0]=4 952 B9R0.45 CCCCSCCNCC 2230a_100025743550_100000210202 [1,0,0,0,0,0|1,1,0]=3 953 B9R0.45 CCCCSCCOCC 34a_200000230436_100000210202 [1,0,0,0,0,0|0,1,0]=2 954 B9R0.45 CCCCSCCOCC 62a_100000210147_100000210210 [1,0,0,0,0,0|0,1,0]=2 955 B9R0.45 CCCCSCCOCC 62a_100000210211_100011215890 [1,0,0,0,0,0|0,1,0]=2 956 B9R0.45 CCCCSCCOCC 7a_200000230436_100000210202 [1,0,0,0,0,0|0,1,0]=2 957 B9R0.45 CCCCSCCOCF 34a_200000230436_100015361967 [1,0,0,0,0,0|1,1,0]=3 958 B9R0.45 CCCCSCCOCF 7a_200000230436_100015361967 [1,0,0,0,0,0|1,1,0]=3 959 B9R0.45 CCCCSCCSCC 62a_100000210211_100000757381 [1,0,0,0,0,0|0,2,0]=3 960 B9R0.45 CCCCSCCSCC 62a_100000757381_100000210210 [1,0,0,0,0,0|0,2,0]=3 961 B9R0.45 CCCNCCCOCC 2230a_100000210961_100000210303 [1,0,0,0,0,0|2,0,0]=3 962 B9R0.45 CCCNCCCOCC 34a_100000210961_100000210303 [1,0,0,0,0,0|2,0,0]=3 963 B9R0.45 CCCOCCCCOC 34a_100000210258_100000755781 [1,0,0,0,0,0|3,0,0]=4 964 B9R0.45 CCCOCCCCOC 34a_100000740925_100000210303 [1,0,0,0,0,0|3,0,0]=4 965 B9R0.45 CCCOCCCNCC 2230a_100011217757_100000210202 [1,0,0,0,0,0|3,0,0]=4 966 B9R0.45 CCCOCCCNCC 34a_100011217757_100000210202 [1,0,0,0,0,0|3,0,0]=4 967 B9R0.45 CCCOCCCOCC 34a_100000210258_100012232248 [1,0,0,0,0,0|2,0,0]=3 968 B9R0.45 CCCOCCCOCC 34a_100000757476_100000210303 [1,0,0,0,0,0|2,0,0]=3 969 B9R0.45 CCCOCCCOCC 7a_100000757476_100000210303 [1,0,0,0,0,0|2,0,0]=3 970 B9R0.45 CCCOCCCSCC 34a_100011216438_100000210303 [1,0,0,0,0,0|2,1,0]=4 971 B9R0.45 CCCOCCCSCC 7a_100011216438_100000210303 [1,0,0,0,0,0|2,1,0]=4 972 B9R0.45 CCCSCCCCOC 62a_100000210303_100000730899 [1,0,0,0,0,0|3,0,0]=4 973 B9R0.45 CCCSCCCCOC 62a_100000730899_100000210303 [1,0,0,0,0,0|3,0,0]=4 974 B9R0.45 CCCSCCCOCC 62a_100000210303_100012232248 [1,0,0,0,0,0|2,0,0]=3 975 B9R0.45 CCCSCCCOCC 62a_100012232248_100000210303 [1,0,0,0,0,0|2,0,0]=3 976 B9R0.45 CCCSCOCCOC 62a_100000210303_100000231047 [1,0,0,0,0,0|2,0,0]=3 977 B9R0.45 CCCSCOCCOC 62a_100000231047_100000210303 [1,0,0,0,0,0|2,0,0]=3 978 B9R0.45 CCNCCCCCCF 2230a_100015525214_100015922095 [1,0,0,0,0,0|3,0,0]=4 979 B9R0.45 CCNCCCCCCO 2230a_100000686447_100000210202 [1,0,0,0,0,0|3,0,0]=4 980 B9R0.45 CCNCCCCCCO 2230a_100015525214_100000766143 [1,0,0,0,0,0|3,0,0]=4 981 B9R0.45 CCNCCCCCCO 34a_100000686447_100000210202 [1,0,0,0,0,0|3,0,0]=4 982 B9R0.45 CCNCCCCCOC 2230a_100000747528_100000210202 [1,0,0,0,0,0|2,0,0]=3 983 B9R0.45 CCNCCCCCOC 34a_100000747528_100000210202 [1,0,0,0,0,0|2,0,0]=3 984 B9R0.45 CCNCCOCCOC 2230a_100000745349_100000210202 [1,0,0,0,0,0|1,0,0]=2 985 B9R0.45 CCNCCOCCOC 2230a_100015525214_100000695917 [1,0,0,0,0,0|1,0,0]=2 986 B9R0.45 CCNCCOCCOC 34a_100000745349_100000210202 [1,0,0,0,0,0|1,0,0]=2 987 B9R0.45 CCOCCCCCCBr 34a_100011215345_100000210202 [1,0,0,0,0,0|2,0,0]=3 988 B9R0.45 CCOCCCCCCBr 7a_100011215345_100000210202 [1,0,0,0,0,0|2,0,0]=3 989 B9R0.45 CCOCCCCCCCl 34a_100000766143_100000210202 [1,0,0,0,0,0|2,0,0]=3 990 B9R0.45 CCOCCCCCCCl 7a_100000766143_100000210202 [1,0,0,0,0,0|2,0,0]=3 991 B9R0.45 CCOCCCCCCF 34a_100000732779_100000210202 [1,0,0,0,0,0|2,0,0]=3 992 B9R0.45 CCOCCCCCCF 34a_100121572206_100015922095 [1,0,0,0,0,0|2,0,0]=3 993 B9R0.45 CCOCCCCCCF 7a_100000732779_100000210202 [1,0,0,0,0,0|2,0,0]=3 994 B9R0.45 CCOCCCCCCN 34a_100000686447_100000210202 [1,0,0,0,0,0|2,0,0]=3 995 B9R0.45 CCOCCCCCCO 34a_100121572206_100000766143 [1,0,0,0,0,0|2,0,0]=3 996 B9R0.45 CCOCCCCCNC 34a_100000722520_100000210202 [1,0,0,0,0,0|2,0,0]=3 997 B9R0.45 CCOCCCNCCF 2230a_100000210961_100011217306 [1,0,0,0,0,0|3,0,0]=4 998 B9R0.45 CCOCCCNCCF 34a_100000210961_100011217306 [1,0,0,0,0,0|3,0,0]=4 999 B9R0.45 CCOCCCNCCF 34a_100000724931_100012232248 [1,0,0,0,0,0|3,0,0]=4 1000 B9R0.45 CCOCCCNCCO 2230a_100000210961_100000211926 [1,0,0,0,0,0|3,0,0]=4 1001 B9R0.45 CCOCCCNCCO 2230a_100016997473_100012232248 [1,0,0,0,0,0|3,0,0]=4 1002 B9R0.45 CCOCCCNCCO 34a_100000210961_100000211926 [1,0,0,0,0,0|3,0,0]=4 1003 B9R0.45 CCOCCCNCCO 34a_100016990907_100012232248 [1,0,0,0,0,0|3,0,0]=4 1004 B9R0.45 CCOCCCNCOC 2230a_100000210961_100000766300 [1,0,0,0,0,0|2,0,0]=3 1005 B9R0.45 CCOCCCNCSC 2230a_100000210961_100011218213 [1,0,0,0,0,0|2,1,0]=4 1006 B9R0.45 CCOCCCNCSC 34a_100000210961_100011218213 [1,0,0,0,0,0|2,1,0]=4 1007 B9R0.45 CCOCCCOCCBr 34a_100000211926_100012232248 [1,0,0,0,0,0|3,0,0]=4 1008 B9R0.45 CCOCCCOCCF 34a_100000757476_100011217306 [1,0,0,0,0,0|3,0,0]=4 1009 B9R0.45 CCOCCCOCCF 7a_100000757476_100011217306 [1,0,0,0,0,0|3,0,0]=4 1010 B9R0.45 CCOCCCOCCN 34a_100000210304_100012232248 [1,0,0,0,0,0|3,0,0]=4 1011 B9R0.45 CCOCCCOCCO 34a_100000757476_100000211926 [1,0,0,0,0,0|3,0,0]=4 1012 B9R0.45 CCOCCCOCCO 7a_100000757476_100000211926 [1,0,0,0,0,0|3,0,0]=4 1013 B9R0.45 CCOCCCOCSC 34a_100000757476_100011218213 [1,0,0,0,0,0|2,1,0]=4 1014 B9R0.45 CCOCCCSCCF 62a_100011217306_100012232248 [1,0,0,0,0,0|3,0,0]=4 1015 B9R0.45 CCOCCCSCCF 62a_100012232248_100011217306 [1,0,0,0,0,0|3,0,0]=4 1016 B9R0.45 CCOCCCSCCO 62a_100000211926_100012232248 [1,0,0,0,0,0|3,0,0]=4 1017 B9R0.45 CCOCCCSCCO 62a_100012232248_100000211926 [1,0,0,0,0,0|3,0,0]=4 1018 B9R0.45 CCOCCCSCOC 62a_100000766300_100012232248 [1,0,0,0,0,0|2,0,0]=3 1019 B9R0.45 CCOCCCSCOC 62a_100012232248_100000766300 [1,0,0,0,0,0|2,0,0]=3 1020 B9R0.45 CCOCCCSCSC 62a_100011218213_100012232248 [1,0,0,0,0,0|2,1,0]=4 1021 B9R0.45 CCOCCCSCSC 62a_100012232248_100011218213 [1,0,0,0,0,0|2,1,0]=4 1022 B9R0.45 CCOCCNCCC#N 2230a_102516460346_100011215226 [1,0,0,0,0,0|2,0,1]=4 1023 B9R0.45 CCOCCNCCCF 2230a_100015189416_100011215890 [1,0,0,0,0,0|2,0,0]=3 1024 B9R0.45 CCOCCNCCCF 2230a_102516460346_100011934791 [1,0,0,0,0,0|2,0,0]=3 1025 B9R0.45 CCOCCNCCCF 34a_100015189416_100000210147 [1,0,0,0,0,0|2,0,0]=3 1026 B9R0.45 CCOCCNCCCF 34a_102516460346_100011934791 [1,0,0,0,0,0|2,0,0]=3 1027 B9R0.45 CCOCCNCCCO 2230a_102516460346_100000230001 [1,0,0,0,0,0|2,0,0]=3 1028 B9R0.45 CCOCCNCCCO 34a_102516460346_100000230001 [1,0,0,0,0,0|2,0,0]=3 1029 B9R0.45 CCOCCNCCOC 2230a_100000209980_100011215890 [1,0,0,0,0,0|1,0,0]=2 1030 B9R0.45 CCOCCNCCOC 2230a_102516460346_100011201679 [1,0,0,0,0,0|1,0,0]=2 1031 B9R0.45 CCOCCNCCOC 34a_102516460346_100011201679 [1,0,0,0,0,0|1,0,0]=2 1032 B9R0.45 CCOCCNCCSC 2230a_100020590264_100011215890 [1,0,0,0,0,0|1,1,0]=3 1033 B9R0.45 CCOCCNCCSC 2230a_102516460346_100000751147 [1,0,0,0,0,0|1,1,0]=3 1034 B9R0.45 CCOCCNCCSC 34a_102516460346_100000212216 [1,0,0,0,0,0|1,1,0]=3 1035 B9R0.45 CCOCCOCCC#N 7a_100000210136_100000184422 [1,0,0,0,0,0|1,0,1]=3 1036 B9R0.45 CCOCCOCCCBr 34a_100011217188_100000210147 [1,0,0,0,0,0|1,0,0]=2 1037 B9R0.45 CCOCCOCCCCl 34a_100000230001_100000210147 [1,0,0,0,0,0|1,0,0]=2 1038 B9R0.45 CCOCCOCCCF 34a_100000210136_100011934791 [1,0,0,0,0,0|1,0,0]=2 1039 B9R0.45 CCOCCOCCCF 34a_100000759539_100000210147 [1,0,0,0,0,0|1,0,0]=2 1040 B9R0.45 CCOCCOCCCF 7a_100000210136_100011934791 [1,0,0,0,0,0|1,0,0]=2 1041 B9R0.45 CCOCCOCCCN 34a_100000182051_100000210147 [1,0,0,0,0,0|1,0,0]=2 1042 B9R0.45 CCOCCOCCCO 34a_100000210136_100000230001 [1,0,0,0,0,0|1,0,0]=2 1043 B9R0.45 CCOCCOCCCO 7a_100000210136_100011215043 [1,0,0,0,0,0|1,0,0]=2 1044 B9R0.45 CCOCCOCCNC 2230a_100102712874_200000210301 [1,0,0,0,0,0|1,0,0]=2 1045 B9R0.45 CCOCCOCCNC 2230a_106832991635_100011211534 [1,0,0,0,0,0|1,0,0]=2 1046 B9R0.45 CCOCCOCCNC 34a_100000228057_100000210202 [1,0,0,0,0,0|1,0,0]=2 1047 B9R0.45 CCOCCOCCNC 34a_100102657272_100011211534 [1,0,0,0,0,0|1,0,0]=2 1048 B9R0.45 CCOCCOCCNC 34a_100102712874_200000210301 [1,0,0,0,0,0|1,0,0]=2 1049 B9R0.45 CCOCCOCCNC 7a_106832991635_100011211534 [1,0,0,0,0,0|1,0,0]=2 1050 B9R0.45 CCOCCOCCN[13CH3] 2230a_100102712874_200025704644 [1,0,0,0,0,0|1,0,0]=2 1051 B9R0.45 CCOCCOCCN[13CH3] 34a_100102712874_200025704644 [1,0,0,0,0,0|1,0,0]=2 1052 B9R0.45 CCOCCOCCOC 34a_100000210136_100011201679 [1,0,0,0,0,0|0,0,0]=1 1053 B9R0.45 CCOCCOCCOC 34a_100000210237_100000210147 [1,0,0,0,0,0|0,0,0]=1 1054 B9R0.45 CCOCCOCCOC 34a_100000210240_200000210301 [1,0,0,0,0,0|0,0,0]=1 1055 B9R0.45 CCOCCOCCOC 34a_100011215163_100000210202 [1,0,0,0,0,0|0,0,0]=1 1056 B9R0.45 CCOCCOCCOC 34a_100121572206_100000695917 [1,0,0,0,0,0|0,0,0]=1 1057 B9R0.45 CCOCCOCCOC 34a_100138415774_100011211534 [1,0,0,0,0,0|0,0,0]=1 1058 B9R0.45 CCOCCOCCOC 7a_100000210136_100000233755 [1,0,0,0,0,0|0,0,0]=1 1059 B9R0.45 CCOCCOCCOC 7a_100000210240_200000210301 [1,0,0,0,0,0|0,0,0]=1 1060 B9R0.45 CCOCCOCCOC 7a_100011215163_100000210202 [1,0,0,0,0,0|0,0,0]=1 1061 B9R0.45 CCOCCOCCON 34a_100000700252_100000210147 [1,0,0,0,0,0|1,0,0]=2 1062 B9R0.45 CCOCCOCCO[13CH3] 34a_100000210240_200025704644 [1,0,0,0,0,0|0,0,0]=1 1063 B9R0.45 CCOCCOCCO[13CH3] 7a_100000210240_200025704644 [1,0,0,0,0,0|0,0,0]=1 1064 B9R0.45 CCOCCOCCSC 34a_100000210136_100000212216 [1,0,0,0,0,0|0,1,0]=2 1065 B9R0.45 CCOCCOCCSC 34a_100000230434_100000210147 [1,0,0,0,0,0|0,1,0]=2 1066 B9R0.45 CCOCCOCCSC 62a_100011211534_200000210301 [1,0,0,0,0,0|0,1,0]=2 1067 B9R0.45 CCOCCOCCSC 62a_200000210301_100011211534 [1,0,0,0,0,0|0,1,0]=2 1068 B9R0.45 CCOCCOCCSC 7a_100000210136_100000212216 [1,0,0,0,0,0|0,1,0]=2 1069 B9R0.45 CCOCCOCCSC 7a_100000230434_100011215890 [1,0,0,0,0,0|0,1,0]=2 1070 B9R0.45 CCOCCOCCS[13CH3] 62a_100011211534_200025704644 [1,0,0,0,0,0|0,1,0]=2 1071 B9R0.45 CCOCCOCCS[13CH3] 62a_200025704644_100011211534 [1,0,0,0,0,0|0,1,0]=2 1072 B9R0.45 CCOCCSCCC#N 62a_100000210147_100011215226 [1,0,0,0,0,0|1,1,1]=4 1073 B9R0.45 CCOCCSCCC#N 62a_100011215226_100011215890 [1,0,0,0,0,0|1,1,1]=4 1074 B9R0.45 CCOCCSCCCF 62a_100000210147_100011934791 [1,0,0,0,0,0|1,1,0]=3 1075 B9R0.45 CCOCCSCCCF 62a_100011934791_100011215890 [1,0,0,0,0,0|1,1,0]=3 1076 B9R0.45 CCOCCSCCCO 62a_100000210147_100011215043 [1,0,0,0,0,0|1,1,0]=3 1077 B9R0.45 CCOCCSCCCO 62a_100011215043_100011215890 [1,0,0,0,0,0|1,1,0]=3 1078 B9R0.45 CCOCCSCCOC 62a_100000210147_100000233755 [1,0,0,0,0,0|0,1,0]=2 1079 B9R0.45 CCOCCSCCOC 62a_100000233755_100011215890 [1,0,0,0,0,0|0,1,0]=2 1080 B9R0.45 CCOCCSCCSC 62a_100000210147_100000751147 [1,0,0,0,0,0|0,2,0]=3 1081 B9R0.45 CCOCCSCCSC 62a_100000212216_100011215890 [1,0,0,0,0,0|0,2,0]=3 1082 B9R0.45 CCOCCSCOCC 62a_100000210147_100000739092 [1,0,0,0,0,0|0,1,0]=2 1083 B9R0.45 CCOCCSCOCC 62a_100000739092_100011215890 [1,0,0,0,0,0|0,1,0]=2 1084 B9R0.45 CCOCSCCCCF 62a_100000729493_100000739092 [1,0,0,0,0,0|2,1,0]=4 1085 B9R0.45 CCOCSCCCCF 62a_100000739092_100000729493 [1,0,0,0,0,0|2,1,0]=4 1086 B9R0.45 CCOCSCCCCO 62a_100000210776_100000739092 [1,0,0,0,0,0|2,1,0]=4 1087 B9R0.45 CCOCSCCCCO 62a_100000739092_100000210776 [1,0,0,0,0,0|2,1,0]=4 1088 B9R0.45 CCOCSCCCOC 62a_100000709357_100000739092 [1,0,0,0,0,0|2,0,0]=3 1089 B9R0.45 CCOCSCCCOC 62a_100000739092_100000709357 [1,0,0,0,0,0|2,0,0]=3 1090 B9R0.45 CCOCSCCSCC 62a_100000739092_100000757381 [1,0,0,0,0,0|0,2,0]=3 1091 B9R0.45 CCOCSCCSCC 62a_100000757381_100000739092 [1,0,0,0,0,0|0,2,0]=3 1092 B9R0.45 CCSCCCCCCF 62a_100000210202_100015922095 [1,0,0,0,0,0|2,1,0]=4 1093 B9R0.45 CCSCCCCCCF 62a_100015922095_100000210202 [1,0,0,0,0,0|2,1,0]=4 1094 B9R0.45 CCSCCCCCCO 62a_100000210202_100000766143 [1,0,0,0,0,0|2,1,0]=4 1095 B9R0.45 CCSCCCCCCO 62a_100000766143_100000210202 [1,0,0,0,0,0|2,1,0]=4 1096 B9R0.45 CCSCCNCCCF 2230a_100000106463_100011934791 [1,0,0,0,0,0|2,1,0]=4 1097 B9R0.45 CCSCCNCCCF 2230a_100015189416_100000757381 [1,0,0,0,0,0|2,1,0]=4 1098 B9R0.45 CCSCCNCCCF 34a_100015189416_100000757381 [1,0,0,0,0,0|2,1,0]=4 1099 B9R0.45 CCSCCNCCCO 2230a_100000106463_100000230001 [1,0,0,0,0,0|2,1,0]=4 1100 B9R0.45 CCSCCNCCOC 2230a_100000106463_100011201679 [1,0,0,0,0,0|1,1,0]=3 1101 B9R0.45 CCSCCNCCOC 2230a_100000209980_100000757381 [1,0,0,0,0,0|1,1,0]=3 1102 B9R0.45 CCSCCNCCSC 2230a_100000106463_100000751147 [1,0,0,0,0,0|1,2,0]=4 1103 B9R0.45 CCSCCNCCSC 2230a_100020590264_100000757381 [1,0,0,0,0,0|1,2,0]=4 1104 B9R0.45 CCSCCOCCC#N 7a_100000212035_100000184422 [1,0,0,0,0,0|1,1,1]=4 1105 B9R0.45 CCSCCOCCCBr 34a_100011217188_100000757381 [1,0,0,0,0,0|1,1,0]=3 1106 B9R0.45 CCSCCOCCCCl 34a_100000230001_100000757381 [1,0,0,0,0,0|1,1,0]=3 1107 B9R0.45 CCSCCOCCCF 34a_100000212035_100011934791 [1,0,0,0,0,0|1,1,0]=3 1108 B9R0.45 CCSCCOCCCF 34a_100000759539_100000757381 [1,0,0,0,0,0|1,1,0]=3 1109 B9R0.45 CCSCCOCCCF 7a_100000212035_100011934791 [1,0,0,0,0,0|1,1,0]=3 1110 B9R0.45 CCSCCOCCCN 34a_100000182051_100000757381 [1,0,0,0,0,0|1,1,0]=3 1111 B9R0.45 CCSCCOCCCO 34a_100000212035_100000230001 [1,0,0,0,0,0|1,1,0]=3 1112 B9R0.45 CCSCCOCCCO 7a_100000212035_100011215043 [1,0,0,0,0,0|1,1,0]=3 1113 B9R0.45 CCSCCOCCOC 34a_100000210237_100000757381 [1,0,0,0,0,0|0,1,0]=2 1114 B9R0.45 CCSCCOCCOC 34a_100000212035_100011201679 [1,0,0,0,0,0|0,1,0]=2 1115 B9R0.45 CCSCCOCCOC 62a_100000210202_100000695917 [1,0,0,0,0,0|0,1,0]=2 1116 B9R0.45 CCSCCOCCOC 62a_100000695917_100000210202 [1,0,0,0,0,0|0,1,0]=2 1117 B9R0.45 CCSCCOCCOC 7a_100000212035_100000233755 [1,0,0,0,0,0|0,1,0]=2 1118 B9R0.45 CCSCCOCCON 34a_100000700252_100000757381 [1,0,0,0,0,0|1,1,0]=3 1119 B9R0.45 CCSCCOCCSC 34a_100000212035_100000212216 [1,0,0,0,0,0|0,2,0]=3 1120 B9R0.45 CCSCCOCCSC 34a_100000230434_100000757381 [1,0,0,0,0,0|0,2,0]=3 1121 B9R0.45 CCSCCOCCSC 7a_100000212035_100000212216 [1,0,0,0,0,0|0,2,0]=3 1122 B9R0.45 CCSCCOCCSC 7a_100000230434_100000757381 [1,0,0,0,0,0|0,2,0]=3 1123 B9R0.45 CCSCCSCCCF 62a_100000757381_100011934791 [1,0,0,0,0,0|1,2,0]=4 1124 B9R0.45 CCSCCSCCCF 62a_100011934791_100000757381 [1,0,0,0,0,0|1,2,0]=4 1125 B9R0.45 CCSCCSCCCO 62a_100000757381_100011215043 [1,0,0,0,0,0|1,2,0]=4 1126 B9R0.45 CCSCCSCCCO 62a_100011215043_100000757381 [1,0,0,0,0,0|1,2,0]=4 1127 B9R0.45 CCSCCSCCOC 62a_100000233755_100000757381 [1,0,0,0,0,0|0,2,0]=3 1128 B9R0.45 CCSCCSCCOC 62a_100000757381_100000233755 [1,0,0,0,0,0|0,2,0]=3 1129 B9R0.45 CCSCCSCCSC 62a_100000212216_100000757381 [1,0,0,0,0,0|0,3,0]=4 1130 B9R0.45 CCSCCSCCSC 62a_100000757381_100000751147 [1,0,0,0,0,0|0,3,0]=4 1131 B9R0.45 CNCCCCCCOC 2230a_106832991635_100011998445 [1,0,0,0,0,0|3,0,0]=4 1132 B9R0.45 CNCCCCCCOC 34a_100102657272_100011998445 [1,0,0,0,0,0|3,0,0]=4 1133 B9R0.45 CNCCCCCCOC 7a_106832991635_100011998445 [1,0,0,0,0,0|3,0,0]=4 1134 B9R0.45 CNCCCCCOCF 34a_100000722520_100015361967 [1,0,0,0,0,0|3,0,0]=4 1135 B9R0.45 CNCCCOCCCF 34a_100000213112_100011934791 [1,0,0,0,0,0|3,0,0]=4 1136 B9R0.45 CNCCCOCCCO 2230a_100011310245_200000210301 [1,0,0,0,0,0|3,0,0]=4 1137 B9R0.45 CNCCCOCCCO 34a_100000213112_100000230001 [1,0,0,0,0,0|3,0,0]=4 1138 B9R0.45 CNCCCOCCCO 34a_100011310245_200000210301 [1,0,0,0,0,0|3,0,0]=4 1139 B9R0.45 CNCCCOCCOC 2230a_100000206027_200000210301 [1,0,0,0,0,0|2,0,0]=3 1140 B9R0.45 CNCCCOCCOC 2230a_106832991635_100011216529 [1,0,0,0,0,0|2,0,0]=3 1141 B9R0.45 CNCCCOCCOC 34a_100000206027_200000210301 [1,0,0,0,0,0|2,0,0]=3 1142 B9R0.45 CNCCCOCCOC 34a_100000213112_100011201679 [1,0,0,0,0,0|2,0,0]=3 1143 B9R0.45 CNCCCOCCOC 34a_100102657272_100011216529 [1,0,0,0,0,0|2,0,0]=3 1144 B9R0.45 CNCCCOCCOC 7a_106832991635_100011216529 [1,0,0,0,0,0|2,0,0]=3 1145 B9R0.45 CNCCCOCCSC 34a_100000213112_100000212216 [1,0,0,0,0,0|2,1,0]=4 1146 B9R0.45 CNCCOCCOCF 34a_100000228057_100015361967 [1,0,0,0,0,0|2,0,0]=3 1147 B9R0.45 COCCCCCCCBr 34a_100000760002_200000210301 [1,0,0,0,0,0|3,0,0]=4 1148 B9R0.45 COCCCCCCCBr 7a_100000760002_200000210301 [1,0,0,0,0,0|3,0,0]=4 1149 B9R0.45 COCCCCCCCN 34a_100011996573_200000210301 [1,0,0,0,0,0|3,0,0]=4 1150 B9R0.45 COCCCCCCCO 34a_100138415774_100000760002 [1,0,0,0,0,0|3,0,0]=4 1151 B9R0.45 COCCCCCCOC 34a_100138415774_100011998445 [1,0,0,0,0,0|3,0,0]=4 1152 B9R0.45 COCCCCCCOC 34a_200012092642_200000210301 [1,0,0,0,0,0|3,0,0]=4 1153 B9R0.45 COCCCCCCOC 7a_200012092642_200000210301 [1,0,0,0,0,0|3,0,0]=4 1154 B9R0.45 COCCCCCCO[13CH3] 34a_200012092642_200025704644 [1,0,0,0,0,0|3,0,0]=4 1155 B9R0.45 COCCCCCCO[13CH3] 7a_200012092642_200025704644 [1,0,0,0,0,0|3,0,0]=4 1156 B9R0.45 COCCCCCCSC 62a_100011998445_200000210301 [1,0,0,0,0,0|3,0,0]=4 1157 B9R0.45 COCCCCCCSC 62a_200000210301_100011998445 [1,0,0,0,0,0|3,0,0]=4 1158 B9R0.45 COCCCCCCS[13CH3] 62a_100011998445_200025704644 [1,0,0,0,0,0|3,0,0]=4 1159 B9R0.45 COCCCCCCS[13CH3] 62a_200025704644_100011998445 [1,0,0,0,0,0|3,0,0]=4 1160 B9R0.45 COCCCCCNCF 34a_100000747528_100015361967 [1,0,0,0,0,0|3,0,0]=4 1161 B9R0.45 COCCCNCCOC 2230a_100000209980_100000740836 [1,0,0,0,0,0|3,0,0]=4 1162 B9R0.45 COCCCNCCOC 34a_100150723488_100011201679 [1,0,0,0,0,0|3,0,0]=4 1163 B9R0.45 COCCCOCCCBr 34a_100011217188_100000740836 [1,0,0,0,0,0|3,0,0]=4 1164 B9R0.45 COCCCOCCCCl 34a_100000230001_100000740836 [1,0,0,0,0,0|3,0,0]=4 1165 B9R0.45 COCCCOCCCF 34a_100000740835_100011934791 [1,0,0,0,0,0|3,0,0]=4 1166 B9R0.45 COCCCOCCCF 34a_100000759539_100000740836 [1,0,0,0,0,0|3,0,0]=4 1167 B9R0.45 COCCCOCCCN 34a_100000182051_100000740836 [1,0,0,0,0,0|3,0,0]=4 1168 B9R0.45 COCCCOCCCN 34a_100011310245_200000210301 [1,0,0,0,0,0|3,0,0]=4 1169 B9R0.45 COCCCOCCCO 34a_100000740835_100000230001 [1,0,0,0,0,0|3,0,0]=4 1170 B9R0.45 COCCCOCCOC 34a_100000210237_100000740836 [1,0,0,0,0,0|2,0,0]=3 1171 B9R0.45 COCCCOCCOC 34a_100000740835_100011201679 [1,0,0,0,0,0|2,0,0]=3 1172 B9R0.45 COCCCOCCOC 34a_100138415774_100011216529 [1,0,0,0,0,0|2,0,0]=3 1173 B9R0.45 COCCCOCCON 34a_100000700252_100000740836 [1,0,0,0,0,0|3,0,0]=4 1174 B9R0.45 COCCCOCCSC 34a_100000230434_100000740836 [1,0,0,0,0,0|2,1,0]=4 1175 B9R0.45 COCCCOCCSC 34a_100000740835_100000212216 [1,0,0,0,0,0|2,1,0]=4 1176 B9R0.45 COCCCOCCSC 7a_100000230434_100000740836 [1,0,0,0,0,0|2,1,0]=4 1177 B9R0.45 COCCCSCCOC 62a_100000233755_100000709357 [1,0,0,0,0,0|2,1,0]=4 1178 B9R0.45 COCCCSCCOC 62a_100000709357_100000233755 [1,0,0,0,0,0|2,1,0]=4 1179 B9R0.45 COCCNCCCCF 2230a_100000209980_100000729493 [1,0,0,0,0,0|3,0,0]=4 1180 B9R0.45 COCCNCCCCO 2230a_100000209980_100000210776 [1,0,0,0,0,0|3,0,0]=4 1181 B9R0.45 COCCNCCCCO 2230a_100000750430_100011201679 [1,0,0,0,0,0|3,0,0]=4 1182 B9R0.45 COCCNCCCCO 34a_100000750430_100011201679 [1,0,0,0,0,0|3,0,0]=4 1183 B9R0.45 COCCNCCCSC 2230a_100000749238_100011201679 [1,0,0,0,0,0|3,0,0]=4 1184 B9R0.45 COCCOCC#CCCl 34a_200000047223_100011201679 [1,0,0,0,0,0|2,0,1]=4 1185 B9R0.45 COCCOCC#CCO 34a_100000210237_200000047223 [1,0,0,0,0,0|2,0,1]=4 1186 B9R0.45 COCCOCCCCBr 34a_100011216708_100011201679 [1,0,0,0,0,0|2,0,0]=3 1187 B9R0.45 COCCOCCCCCl 34a_100000210776_100011201679 [1,0,0,0,0,0|2,0,0]=3 1188 B9R0.45 COCCOCCCCCl 7a_100000210776_100000233755 [1,0,0,0,0,0|2,0,0]=3 1189 B9R0.45 COCCOCCCCF 34a_100000210237_100000729493 [1,0,0,0,0,0|2,0,0]=3 1190 B9R0.45 COCCOCCCCF 34a_100011995726_100011201679 [1,0,0,0,0,0|2,0,0]=3 1191 B9R0.45 COCCOCCCCF 7a_100011995726_100000233755 [1,0,0,0,0,0|2,0,0]=3 1192 B9R0.45 COCCOCCCCI 34a_200012148704_100011201679 [1,0,0,0,0,0|2,0,0]=3 1193 B9R0.45 COCCOCCCCN 34a_100000750430_100011201679 [1,0,0,0,0,0|2,0,0]=3 1194 B9R0.45 COCCOCCCCO 34a_100000210237_100011216708 [1,0,0,0,0,0|2,0,0]=3 1195 B9R0.45 COCCOCCCN[13CH3] 2230a_100000206027_200025704644 [1,0,0,0,0,0|2,0,0]=3 1196 B9R0.45 COCCOCCCN[13CH3] 34a_100000206027_200025704644 [1,0,0,0,0,0|2,0,0]=3 1197 B9R0.45 COCCOCCCSC 34a_100000690336_100011201679 [1,0,0,0,0,0|2,0,0]=3 1198 B9R0.45 COCCOCCCSC 62a_100011216529_200000210301 [1,0,0,0,0,0|2,0,0]=3 1199 B9R0.45 COCCOCCCSC 62a_200000210301_100011216529 [1,0,0,0,0,0|2,0,0]=3 1200 B9R0.45 COCCOCCCSC 7a_100000690336_100000233755 [1,0,0,0,0,0|2,0,0]=3 1201 B9R0.45 COCCOCCCS[13CH3] 62a_100011216529_200025704644 [1,0,0,0,0,0|2,0,0]=3 1202 B9R0.45 COCCOCCCS[13CH3] 62a_200025704644_100011216529 [1,0,0,0,0,0|2,0,0]=3 1203 B9R0.45 COCCOCCNCF 34a_100000745349_100015361967 [1,0,0,0,0,0|2,0,0]=3 1204 B9R0.45 COCCOCCOCF 34a_100011215163_100015361967 [1,0,0,0,0,0|1,0,0]=2 1205 B9R0.45 COCCOCCOCF 7a_100011215163_100015361967 [1,0,0,0,0,0|1,0,0]=2 1206 B9R0.45 COCCOCCSCF 62a_100000695917_100015361967 [1,0,0,0,0,0|1,1,0]=3 1207 B9R0.45 COCCOCCSCF 62a_100015361967_100000695917 [1,0,0,0,0,0|1,1,0]=3 1208 B9R0.45 COCCOCNCCO 2230a_100016997473_100000231047 [1,0,0,0,0,0|3,0,0]=4 1209 B9R0.45 COCCOCSCCF 62a_100000231047_100011217306 [1,0,0,0,0,0|3,0,0]=4 1210 B9R0.45 COCCOCSCCF 62a_100011217306_100000231047 [1,0,0,0,0,0|3,0,0]=4 1211 B9R0.45 COCCOCSCCO 62a_100000211926_100000231047 [1,0,0,0,0,0|3,0,0]=4 1212 B9R0.45 COCCOCSCCO 62a_100000231047_100000211926 [1,0,0,0,0,0|3,0,0]=4 1213 B9R0.45 COCCOCSCOC 62a_100000231047_100000766300 [1,0,0,0,0,0|3,0,0]=4 1214 B9R0.45 COCCOCSCOC 62a_100000766300_100000231047 [1,0,0,0,0,0|3,0,0]=4 1215 B9R0.45 COCCOCSCSC 62a_100000231047_100011218213 [1,0,0,0,0,0|3,0,0]=4 1216 B9R0.45 COCCOCSCSC 62a_100011218213_100000231047 [1,0,0,0,0,0|3,0,0]=4 1217 B9R0.45 COCCSCCCCF 62a_100000233755_100000729493 [1,0,0,0,0,0|2,1,0]=4 1218 B9R0.45 COCCSCCCCF 62a_100000729493_100000233755 [1,0,0,0,0,0|2,1,0]=4 1219 B9R0.45 COCCSCCCCO 62a_100000210776_100000233755 [1,0,0,0,0,0|2,1,0]=4 1220 B9R0.45 COCCSCCCCO 62a_100000233755_100000210776 [1,0,0,0,0,0|2,1,0]=4 1221 B9R0.45 CSCCCOCCCF 34a_100000690336_100011934791 [1,0,0,0,0,0|3,0,0]=4 1222 B9R0.45 CSCCCOCCCF 7a_100000690336_100011934791 [1,0,0,0,0,0|3,0,0]=4 1223 B9R0.45 CSCCCOCCCO 34a_100000690336_100000230001 [1,0,0,0,0,0|3,0,0]=4 1224 B9R0.45 CSCCCOCCCO 7a_100000690336_100011215043 [1,0,0,0,0,0|3,0,0]=4 1225 B9R0.45 CSCCCOCCSC 34a_100000690336_100000212216 [1,0,0,0,0,0|2,1,0]=4 1226 B9R0.45 CSCCCOCCSC 7a_100000690336_100000212216 [1,0,0,0,0,0|2,1,0]=4 1227 B9R0.45 CSCCOCCCCBr 34a_100011216708_100000212216 [1,0,0,0,0,0|2,1,0]=4 1228 B9R0.45 CSCCOCCCCCl 34a_100000210776_100000212216 [1,0,0,0,0,0|2,1,0]=4 1229 B9R0.45 CSCCOCCCCCl 7a_100000210776_100000212216 [1,0,0,0,0,0|2,1,0]=4 1230 B9R0.45 CSCCOCCCCF 34a_100000230434_100000729493 [1,0,0,0,0,0|2,1,0]=4 1231 B9R0.45 CSCCOCCCCF 34a_100011995726_100000212216 [1,0,0,0,0,0|2,1,0]=4 1232 B9R0.45 CSCCOCCCCF 7a_100000230434_100000729493 [1,0,0,0,0,0|2,1,0]=4 1233 B9R0.45 CSCCOCCCCF 7a_100011995726_100000212216 [1,0,0,0,0,0|2,1,0]=4 1234 B9R0.45 CSCCOCCCCI 34a_200012148704_100000212216 [1,0,0,0,0,0|2,1,0]=4 1235 B9R0.45 CSCCOCCCCN 34a_100000750430_100000212216 [1,0,0,0,0,0|2,1,0]=4 1236 B9R0.45 CSCCOCCCCO 34a_100000230434_100011216708 [1,0,0,0,0,0|2,1,0]=4 1237 B9R0.45 CSCCOCCCCO 7a_100000230434_100000210776 [1,0,0,0,0,0|2,1,0]=4 1238 B9R0.45 FCCCCCCOCF 34a_100000732779_100015361967 [1,0,0,0,0,0|3,0,0]=4 1239 B9R0.45 FCCCCCCOCF 7a_100000732779_100015361967 [1,0,0,0,0,0|3,0,0]=4 1240 B9R0.45 FCCCCOCCCBr 34a_100011217188_100000729493 [1,0,0,0,0,0|3,0,0]=4 1241 B9R0.45 FCCCCOCCCCl 34a_100000230001_100000729493 [1,0,0,0,0,0|3,0,0]=4 1242 B9R0.45 FCCCCOCCCF 34a_100000759539_100000729493 [1,0,0,0,0,0|3,0,0]=4 1243 B9R0.45 FCCCCOCCCF 34a_100011995726_100011934791 [1,0,0,0,0,0|3,0,0]=4 1244 B9R0.45 FCCCCOCCCF 7a_100011995726_100011934791 [1,0,0,0,0,0|3,0,0]=4 1245 B9R0.45 FCCCOCCCCBr 34a_100011216708_100011934791 [1,0,0,0,0,0|3,0,0]=4 1246 B9R0.45 FCCCOCCCCCl 34a_100000210776_100011934791 [1,0,0,0,0,0|3,0,0]=4 1247 B9R0.45 FCCCOCCCCCl 7a_100000210776_100011934791 [1,0,0,0,0,0|3,0,0]=4 1248 B9R0.45 FCCCOCCCCI 34a_200012148704_100011934791 [1,0,0,0,0,0|3,0,0]=4 1249 B9R0.45 FCOCCCCCCBr 34a_100011215345_100015361967 [1,0,0,0,0,0|3,0,0]=4 1250 B9R0.45 FCOCCCCCCBr 7a_100011215345_100015361967 [1,0,0,0,0,0|3,0,0]=4 1251 B9R0.45 FCOCCCCCCCl 34a_100000766143_100015361967 [1,0,0,0,0,0|3,0,0]=4 1252 B9R0.45 FCOCCCCCCCl 7a_100000766143_100015361967 [1,0,0,0,0,0|3,0,0]=4 1253 B9R0.45 NCCCCCCOCF 34a_100000686447_100015361967 [1,0,0,0,0,0|3,0,0]=4 1254 B9R0.45 NCCCCOCCCF 34a_100000750430_100011934791 [1,0,0,0,0,0|3,0,0]=4 1255 B9R0.45 NCCCCOCCCO 34a_100000750430_100000230001 [1,0,0,0,0,0|3,0,0]=4 1256 B9R0.45 NCCCOCCCCF 34a_100000182051_100000729493 [1,0,0,0,0,0|3,0,0]=4 1257 B9R0.45 NCCCOCCCCO 34a_100000182051_100011216708 [1,0,0,0,0,0|3,0,0]=4 1258 B9R0.45 NOCCOCCCCF 34a_100000700252_100000729493 [1,0,0,0,0,0|3,0,0]=4 1259 B9R0.45 NOCCOCCCCO 34a_100000700252_100011216708 [1,0,0,0,0,0|3,0,0]=4 1260 B9R0.45 OCCCCOCCCBr 34a_100011217188_100011216708 [1,0,0,0,0,0|3,0,0]=4 1261 B9R0.45 OCCCCOCCCCl 34a_100000230001_100011216708 [1,0,0,0,0,0|3,0,0]=4 1262 B9R0.45 OCCCCOCCCF 34a_100000759539_100011216708 [1,0,0,0,0,0|3,0,0]=4 1263 B9R0.45 OCCCOCCCCBr 34a_100011216708_100000230001 [1,0,0,0,0,0|3,0,0]=4 1264 B9R0.45 OCCCOCCCCCl 34a_100000210776_100000230001 [1,0,0,0,0,0|3,0,0]=4 1265 B9R0.45 OCCCOCCCCCl 7a_100000210776_100011215043 [1,0,0,0,0,0|3,0,0]=4 1266 B9R0.45 OCCCOCCCCF 34a_100011995726_100000230001 [1,0,0,0,0,0|3,0,0]=4 1267 B9R0.45 OCCCOCCCCF 7a_100011995726_100011215043 [1,0,0,0,0,0|3,0,0]=4 1268 B9R0.45 OCCCOCCCCI 34a_200012148704_100000230001 [1,0,0,0,0,0|3,0,0]=4 1269 B9R0.45 [13CH3]NCCCOCCCO 2230a_100011310245_200025704644 [1,0,0,0,0,0|3,0,0]=4 1270 B9R0.45 [13CH3]NCCCOCCCO 34a_100011310245_200025704644 [1,0,0,0,0,0|3,0,0]=4 1271 B9R0.45 [13CH3]OCCCCCCCBr 34a_100000760002_200025704644 [1,0,0,0,0,0|3,0,0]=4 1272 B9R0.45 [13CH3]OCCCCCCCBr 7a_100000760002_200025704644 [1,0,0,0,0,0|3,0,0]=4 1273 B9R0.45 [13CH3]OCCCCCCCN 34a_100011996573_200025704644 [1,0,0,0,0,0|3,0,0]=4 1274 B9R0.45 [13CH3]OCCCOCCCN 34a_100011310245_200025704644 [1,0,0,0,0,0|3,0,0]=4 1275 B11R0.3 C#CCCCCCCCOCC 34a_100000054614_100000210202 [0,1,0,0,0,0|2,0,1]=4 1276 B11R0.3 C#CCCCCCCCOCC 34a_100121572206_100153394163 [0,1,0,0,0,0|2,0,1]=4 1277 B11R0.3 C#CCCCCCCCOCC 7a_100000054614_100000210202 [0,1,0,0,0,0|2,0,1]=4 1278 B11R0.3 C#CCCCCNCCOCC 2230a_100000706060_100011215890 [0,1,0,0,0,0|2,0,1]=4 1279 B11R0.3 C#CCCCCNCCOCC 2230a_102516460346_100010269958 [0,1,0,0,0,0|2,0,1]=4 1280 B11R0.3 C#CCCCCNCCOCC 34a_100000706060_100000210147 [0,1,0,0,0,0|2,0,1]=4 1281 B11R0.3 C#CCCCCNCCOCC 34a_102516460346_100010269958 [0,1,0,0,0,0|2,0,1]=4 1282 B11R0.3 C#CCCCCOCCCCC 34a_100000210253_100010269958 [0,1,0,0,0,0|2,0,1]=4 1283 B11R0.3 C#CCCCCOCCCCC 34a_100000766709_100000718602 [0,1,0,0,0,0|2,0,1]=4 1284 B11R0.3 C#CCCCCOCCCCC 7a_100000210253_100010269958 [0,1,0,0,0,0|2,0,1]=4 1285 B11R0.3 C#CCCCCOCCCCC 7a_100000766709_100000210326 [0,1,0,0,0,0|2,0,1]=4 1286 B11R0.3 C#CCCCCOCCOCC 34a_100000210136_100010269958 [0,1,0,0,0,0|1,0,1]=3 1287 B11R0.3 C#CCCCCOCCOCC 34a_100000766709_100000210147 [0,1,0,0,0,0|1,0,1]=3 1288 B11R0.3 C#CCCCCOCCOCC 7a_100000210136_100010269958 [0,1,0,0,0,0|1,0,1]=3 1289 B11R0.3 C#CCCCCOCCOCC 7a_100000766709_100011215890 [0,1,0,0,0,0|1,0,1]=3 1290 B11R0.3 C#CCCCCOCCSCC 34a_100000212035_100010269958 [0,1,0,0,0,0|1,1,1]=4 1291 B11R0.3 C#CCCCCOCCSCC 34a_100000766709_100000757381 [0,1,0,0,0,0|1,1,1]=4 1292 B11R0.3 C#CCCCCOCCSCC 7a_100000212035_100010269958 [0,1,0,0,0,0|1,1,1]=4 1293 B11R0.3 C#CCCCCOCCSCC 7a_100000766709_100000757381 [0,1,0,0,0,0|1,1,1]=4 1294 B11R0.3 C#CCCCCSCCOCC 62a_100000210147_100010269958 [0,1,0,0,0,0|1,1,1]=4 1295 B11R0.3 C#CCCCCSCCOCC 62a_100010269958_100011215890 [0,1,0,0,0,0|1,1,1]=4 1296 B11R0.3 C#CCCCOCCCOCC 34a_100000215630_100012232248 [0,1,0,0,0,0|1,0,2]=4 1297 B11R0.3 C#CCCCOCCCOCC 34a_100000757476_100000695029 [0,1,0,0,0,0|1,0,2]=4 1298 B11R0.3 C#CCCCOCCCOCC 7a_100000215630_100012232248 [0,1,0,0,0,0|1,0,2]=4 1299 B11R0.3 C#CCCCOCCCOCC 7a_100000757476_100011215417 [0,1,0,0,0,0|1,0,2]=4 1300 B11R0.3 C#CCCCOCCOCCBr 34a_100000692535_100000695029 [0,1,0,0,0,0|1,0,2]=4 1301 B11R0.3 C#CCCCOCCOCCBr 7a_100000692535_100011215417 [0,1,0,0,0,0|1,0,2]=4 1302 B11R0.3 C#CCCCOCCOCCC 34a_100000215630_100011215938 [0,1,0,0,0,0|1,0,2]=4 1303 B11R0.3 C#CCCCOCCOCCC 34a_100000752267_100000695029 [0,1,0,0,0,0|1,0,2]=4 1304 B11R0.3 C#CCCCOCCOCCC 7a_100000215630_100011215938 [0,1,0,0,0,0|1,0,2]=4 1305 B11R0.3 C#CCCCOCCOCCC 7a_100000752267_100011215417 [0,1,0,0,0,0|1,0,2]=4 1306 B11R0.3 C#CCCCOCCOCCCl 34a_100011215305_100000695029 [0,1,0,0,0,0|1,0,2]=4 1307 B11R0.3 C#CCCCOCCOCCCl 7a_100011215305_100011215417 [0,1,0,0,0,0|1,0,2]=4 1308 B11R0.3 C#CCCCOCCOCCF 34a_200015357709_100000695029 [0,1,0,0,0,0|1,0,2]=4 1309 B11R0.3 C#CCCCOCCOCCF 7a_200015357709_100011215417 [0,1,0,0,0,0|1,0,2]=4 1310 B11R0.3 C#CCCCOCCOCCI 34a_100012149058_100000695029 [0,1,0,0,0,0|1,0,2]=4 1311 B11R0.3 C#CCCCOCCOCCI 7a_100012149058_100011215417 [0,1,0,0,0,0|1,0,2]=4 1312 B11R0.3 C#CCCCOCCOCCN 34a_100000211614_100000695029 [0,1,0,0,0,0|1,0,2]=4 1313 B11R0.3 C#CCCCOCCOCCO 34a_100000215630_100000692535 [0,1,0,0,0,0|1,0,2]=4 1314 B11R0.3 C#CCCCOCCOCCO 7a_100000215630_100011215305 [0,1,0,0,0,0|1,0,2]=4 1315 B11R0.3 C#CCNCCOCCOCC 2230a_100102712874_100000038162 [0,1,0,0,0,0|1,0,1]=3 1316 B11R0.3 C#CCNCCOCCOCC 34a_100000212058_100011211534 [0,1,0,0,0,0|1,0,1]=3 1317 B11R0.3 C#CCNCCOCCOCC 34a_100102712874_100000184674 [0,1,0,0,0,0|1,0,1]=3 1318 B11R0.3 C#CCOCCCCCCCC 34a_100000210232_100000184674 [0,1,0,0,0,0|2,0,1]=4 1319 B11R0.3 C#CCOCCCCCCCC 34a_100000210247_100000210759 [0,1,0,0,0,0|2,0,1]=4 1320 B11R0.3 C#CCOCCCCCCCC 7a_100000210232_100000038162 [0,1,0,0,0,0|2,0,1]=4 1321 B11R0.3 C#CCOCCNCCCCC 2230a_100000209983_100010402529 [0,1,0,0,0,0|2,0,1]=4 1322 B11R0.3 C#CCOCCNCCCCC 2230a_100000700922_100000210326 [0,1,0,0,0,0|2,0,1]=4 1323 B11R0.3 C#CCOCCNCCCCC 34a_100000224656_100000184674 [0,1,0,0,0,0|2,0,1]=4 1324 B11R0.3 C#CCOCCNCCCCC 34a_100000700922_100000718602 [0,1,0,0,0,0|2,0,1]=4 1325 B11R0.3 C#CCOCCNCCOCC 2230a_100000700922_100011215890 [0,1,0,0,0,0|1,0,1]=3 1326 B11R0.3 C#CCOCCNCCOCC 2230a_102516460346_100010402529 [0,1,0,0,0,0|1,0,1]=3 1327 B11R0.3 C#CCOCCNCCOCC 34a_100000700922_100000210147 [0,1,0,0,0,0|1,0,1]=3 1328 B11R0.3 C#CCOCCNCCOCC 34a_102516460346_100010402529 [0,1,0,0,0,0|1,0,1]=3 1329 B11R0.3 C#CCOCCNCCSCC 2230a_100000106463_100010402529 [0,1,0,0,0,0|1,1,1]=4 1330 B11R0.3 C#CCOCCNCCSCC 2230a_100000700922_100000757381 [0,1,0,0,0,0|1,1,1]=4 1331 B11R0.3 C#CCOCCNCCSCC 34a_100000700922_100000757381 [0,1,0,0,0,0|1,1,1]=4 1332 B11R0.3 C#CCOCCOC/C=C\CC 34a_100000054580_100103147603 [0,1,0,0,0,0|1,0,2]=4 1333 B11R0.3 C#CCOCCOC/C=C\CC 34a_100016268518_100010402529 [0,1,0,0,0,0|1,0,2]=4 1334 B11R0.3 C#CCOCCOC/C=C\CC 7a_100000054580_100103147603 [0,1,0,0,0,0|1,0,2]=4 1335 B11R0.3 C#CCOCCOCC#CCC 34a_100000032950_100010402529 [0,1,0,0,0,0|1,0,2]=4 1336 B11R0.3 C#CCOCCOCC#CCC 34a_100000054580_100009813939 [0,1,0,0,0,0|1,0,2]=4 1337 B11R0.3 C#CCOCCOCC#CCC 7a_100000054580_100009813939 [0,1,0,0,0,0|1,0,2]=4 1338 B11R0.3 C#CCOCCOCC/C=C/C 34a_100016278192_100010402529 [0,1,0,0,0,0|1,0,2]=4 1339 B11R0.3 C#CCOCCOCCC#CC 34a_100000750427_100010402529 [0,1,0,0,0,0|1,0,2]=4 1340 B11R0.3 C#CCOCCOCCCCBr 34a_100011216708_100010402529 [0,1,0,0,0,0|2,0,1]=4 1341 B11R0.3 C#CCOCCOCCCCC 34a_100000054580_100000718602 [0,1,0,0,0,0|1,0,1]=3 1342 B11R0.3 C#CCOCCOCCCCC 34a_100000210253_100010402529 [0,1,0,0,0,0|1,0,1]=3 1343 B11R0.3 C#CCOCCOCCCCC 34a_100011215259_100000184674 [0,1,0,0,0,0|1,0,1]=3 1344 B11R0.3 C#CCOCCOCCCCC 7a_100000054580_100000210326 [0,1,0,0,0,0|1,0,1]=3 1345 B11R0.3 C#CCOCCOCCCCC 7a_100000210253_100010402529 [0,1,0,0,0,0|1,0,1]=3 1346 B11R0.3 C#CCOCCOCCCCC 7a_100011215259_100000038162 [0,1,0,0,0,0|1,0,1]=3 1347 B11R0.3 C#CCOCCOCCCCCl 34a_100000210776_100010402529 [0,1,0,0,0,0|2,0,1]=4 1348 B11R0.3 C#CCOCCOCCCCCl 7a_100000210776_100010402529 [0,1,0,0,0,0|2,0,1]=4 1349 B11R0.3 C#CCOCCOCCCCF 34a_100000054580_100000729493 [0,1,0,0,0,0|2,0,1]=4 1350 B11R0.3 C#CCOCCOCCCCF 34a_100011995726_100010402529 [0,1,0,0,0,0|2,0,1]=4 1351 B11R0.3 C#CCOCCOCCCCF 7a_100000054580_100000729493 [0,1,0,0,0,0|2,0,1]=4 1352 B11R0.3 C#CCOCCOCCCCF 7a_100011995726_100010402529 [0,1,0,0,0,0|2,0,1]=4 1353 B11R0.3 C#CCOCCOCCCCI 34a_200012148704_100010402529 [0,1,0,0,0,0|2,0,1]=4 1354 B11R0.3 C#CCOCCOCCCCN 34a_100000750430_100010402529 [0,1,0,0,0,0|2,0,1]=4 1355 B11R0.3 C#CCOCCOCCCCO 34a_100000054580_100011216708 [0,1,0,0,0,0|2,0,1]=4 1356 B11R0.3 C#CCOCCOCCCCO 7a_100000054580_100000210776 [0,1,0,0,0,0|2,0,1]=4 1357 B11R0.3 C#CCOCCOCCCNC 34a_100000213112_100010402529 [0,1,0,0,0,0|2,0,1]=4 1358 B11R0.3 C#CCOCCOCCCOC 34a_100000054580_100000740836 [0,1,0,0,0,0|2,0,1]=4 1359 B11R0.3 C#CCOCCOCCCOC 34a_100000740835_100010402529 [0,1,0,0,0,0|2,0,1]=4 1360 B11R0.3 C#CCOCCOCCCOC 7a_100000054580_100000740836 [0,1,0,0,0,0|2,0,1]=4 1361 B11R0.3 C#CCOCCOCCCSC 34a_100000690336_100010402529 [0,1,0,0,0,0|2,0,1]=4 1362 B11R0.3 C#CCOCCOCCCSC 7a_100000690336_100010402529 [0,1,0,0,0,0|2,0,1]=4 1363 B11R0.3 C#CCOCCOCCNCC 2230a_100000056377_100000210202 [0,1,0,0,0,0|1,0,1]=3 1364 B11R0.3 C#CCOCCOCCNCC 2230a_100015525214_100010408581 [0,1,0,0,0,0|1,0,1]=3 1365 B11R0.3 C#CCOCCOCCNCC 34a_100000056377_100000210202 [0,1,0,0,0,0|1,0,1]=3 1366 B11R0.3 C#CCOCCOCCNCF 34a_100000056377_100015361967 [0,1,0,0,0,0|2,0,1]=4 1367 B11R0.3 C#CCOCCOCCOC=C 34a_100000033082_100010402529 [0,1,0,0,0,0|0,0,3]=4 1368 B11R0.3 C#CCOCCOCCOC=C 34a_100000039918_100000184674 [0,1,0,0,0,0|0,0,3]=4 1369 B11R0.3 C#CCOCCOCCOC=C 34a_100000054580_100000039644 [0,1,0,0,0,0|0,0,3]=4 1370 B11R0.3 C#CCOCCOCCOC=C 7a_100000039918_100000038162 [0,1,0,0,0,0|0,0,3]=4 1371 B11R0.3 C#CCOCCOCCOC=C 7a_100000054580_100000039644 [0,1,0,0,0,0|0,0,3]=4 1372 B11R0.3 C#CCOCCOCCOCC 34a_100000041007_100000210202 [0,1,0,0,0,0|0,0,1]=2 1373 B11R0.3 C#CCOCCOCCOCC 34a_100000054580_100000210147 [0,1,0,0,0,0|0,0,1]=2 1374 B11R0.3 C#CCOCCOCCOCC 34a_100000210136_100010402529 [0,1,0,0,0,0|0,0,1]=2 1375 B11R0.3 C#CCOCCOCCOCC 34a_100000210240_100000184674 [0,1,0,0,0,0|0,0,1]=2 1376 B11R0.3 C#CCOCCOCCOCC 34a_100000210247_100011211534 [0,1,0,0,0,0|0,0,1]=2 1377 B11R0.3 C#CCOCCOCCOCC 34a_100121572206_100010408581 [0,1,0,0,0,0|0,0,1]=2 1378 B11R0.3 C#CCOCCOCCOCC 7a_100000041007_100000210202 [0,1,0,0,0,0|0,0,1]=2 1379 B11R0.3 C#CCOCCOCCOCC 7a_100000054580_100011215890 [0,1,0,0,0,0|0,0,1]=2 1380 B11R0.3 C#CCOCCOCCOCC 7a_100000210136_100010402529 [0,1,0,0,0,0|0,0,1]=2 1381 B11R0.3 C#CCOCCOCCOCC 7a_100000210240_100000038162 [0,1,0,0,0,0|0,0,1]=2 1382 B11R0.3 C#CCOCCOCCOCF 34a_100000041007_100015361967 [0,1,0,0,0,0|1,0,1]=3 1383 B11R0.3 C#CCOCCOCCOCF 7a_100000041007_100015361967 [0,1,0,0,0,0|1,0,1]=3 1384 B11R0.3 C#CCOCCOCCSCC 34a_100000054580_100000757381 [0,1,0,0,0,0|0,1,1]=3 1385 B11R0.3 C#CCOCCOCCSCC 34a_100000212035_100010402529 [0,1,0,0,0,0|0,1,1]=3 1386 B11R0.3 C#CCOCCOCCSCC 62a_100000210202_100010408581 [0,1,0,0,0,0|0,1,1]=3 1387 B11R0.3 C#CCOCCOCCSCC 62a_100010408581_100000210202 [0,1,0,0,0,0|0,1,1]=3 1388 B11R0.3 C#CCOCCOCCSCC 7a_100000054580_100000757381 [0,1,0,0,0,0|0,1,1]=3 1389 B11R0.3 C#CCOCCOCCSCC 7a_100000212035_100010402529 [0,1,0,0,0,0|0,1,1]=3 1390 B11R0.3 C#CCOCCOCCSCF 62a_100010408581_100015361967 [0,1,0,0,0,0|1,1,1]=4 1391 B11R0.3 C#CCOCCOCCSCF 62a_100015361967_100010408581 [0,1,0,0,0,0|1,1,1]=4 1392 B11R0.3 C#CCOCCSCCCCC 62a_100000210326_100010402529 [0,1,0,0,0,0|1,1,1]=4 1393 B11R0.3 C#CCOCCSCCCCC 62a_100010402529_100000210326 [0,1,0,0,0,0|1,1,1]=4 1394 B11R0.3 C#CCOCCSCCOCC 62a_100000210147_100010402529 [0,1,0,0,0,0|0,1,1]=3 1395 B11R0.3 C#CCOCCSCCOCC 62a_100010402529_100011215890 [0,1,0,0,0,0|0,1,1]=3 1396 B11R0.3 C#CCOCCSCCSCC 62a_100000757381_100010402529 [0,1,0,0,0,0|0,2,1]=4 1397 B11R0.3 C#CCOCCSCCSCC 62a_100010402529_100000757381 [0,1,0,0,0,0|0,2,1]=4 1398 B11R0.3 C#CCSCCOCCOCC 62a_100000038162_100011211534 [0,1,0,0,0,0|0,1,1]=3 1399 B11R0.3 C/C=C/C=C/COCCOCC 34a_100016283227_100000210147 [0,1,0,0,0,0|1,0,2]=4 1400 B11R0.3 C/C=C/CCOCC/C=C\CC 34a_100016278192_100015370543 [0,1,0,0,0,0|2,0,1]=4 1401 B11R0.3 C/C=C/CCOCCCCCC 34a_100016278192_100000210314 [0,1,0,0,0,0|2,0,1]=4 1402 B11R0.3 C/C=C/CCOCCCCCF 34a_100016278192_100000729378 [0,1,0,0,0,0|2,0,1]=4 1403 B11R0.3 C/C=C/CCOCCCCCO 34a_100016278192_100000746330 [0,1,0,0,0,0|2,0,1]=4 1404 B11R0.3 C/C=C/CCOCCCCOC 34a_100016278192_100000755781 [0,1,0,0,0,0|2,0,1]=4 1405 B11R0.3 C/C=C/CCOCCCOCC 34a_100016278192_100012232248 [0,1,0,0,0,0|1,0,1]=3 1406 B11R0.3 C/C=C/CCOCCOCCC 34a_100016278192_100011215938 [0,1,0,0,0,0|1,0,1]=3 1407 B11R0.3 C/C=C/CCOCCOCCO 34a_100016278192_100000692535 [0,1,0,0,0,0|1,0,1]=3 1408 B11R0.3 C/C=C/CCOCOCCCC 34a_100016278192_100011995733 [0,1,0,0,0,0|2,0,1]=4 1409 B11R0.3 C=CCCCCCCCOCC 34a_100000730831_100000210202 [0,1,0,0,0,0|2,0,1]=4 1410 B11R0.3 C=CCCCCCCCOCC 34a_100121572206_100012355270 [0,1,0,0,0,0|2,0,1]=4 1411 B11R0.3 C=CCCCCCCCOCC 7a_100000730831_100000210202 [0,1,0,0,0,0|2,0,1]=4 1412 B11R0.3 C=CCCCCNCCOCC 2230a_100000703577_100011215890 [0,1,0,0,0,0|2,0,1]=4 1413 B11R0.3 C=CCCCCNCCOCC 2230a_102516460346_100011215482 [0,1,0,0,0,0|2,0,1]=4 1414 B11R0.3 C=CCCCCNCCOCC 34a_100000703577_100000210147 [0,1,0,0,0,0|2,0,1]=4 1415 B11R0.3 C=CCCCCNCCOCC 34a_102516460346_100011215482 [0,1,0,0,0,0|2,0,1]=4 1416 B11R0.3 C=CCCCCOCCCCC 34a_100000210253_100011215482 [0,1,0,0,0,0|2,0,1]=4 1417 B11R0.3 C=CCCCCOCCCCC 34a_100000766645_100000718602 [0,1,0,0,0,0|2,0,1]=4 1418 B11R0.3 C=CCCCCOCCCCC 7a_100000210253_100011215482 [0,1,0,0,0,0|2,0,1]=4 1419 B11R0.3 C=CCCCCOCCCCC 7a_100000766645_100000210326 [0,1,0,0,0,0|2,0,1]=4 1420 B11R0.3 C=CCCCCOCCOCC 34a_100000210136_100011215482 [0,1,0,0,0,0|1,0,1]=3 1421 B11R0.3 C=CCCCCOCCOCC 34a_100000766645_100000210147 [0,1,0,0,0,0|1,0,1]=3 1422 B11R0.3 C=CCCCCOCCOCC 7a_100000210136_100011215482 [0,1,0,0,0,0|1,0,1]=3 1423 B11R0.3 C=CCCCCOCCOCC 7a_100000766645_100011215890 [0,1,0,0,0,0|1,0,1]=3 1424 B11R0.3 C=CCCCCOCCSCC 34a_100000212035_100011215482 [0,1,0,0,0,0|1,1,1]=4 1425 B11R0.3 C=CCCCCOCCSCC 34a_100000766645_100000757381 [0,1,0,0,0,0|1,1,1]=4 1426 B11R0.3 C=CCCCCOCCSCC 7a_100000212035_100011215482 [0,1,0,0,0,0|1,1,1]=4 1427 B11R0.3 C=CCCCCOCCSCC 7a_100000766645_100000757381 [0,1,0,0,0,0|1,1,1]=4 1428 B11R0.3 C=CCCCCSCCOCC 62a_100000210147_100011215482 [0,1,0,0,0,0|1,1,1]=4 1429 B11R0.3 C=CCCCCSCCOCC 62a_100011215482_100011215890 [0,1,0,0,0,0|1,1,1]=4 1430 B11R0.3 C=CCCCOCCCOCC 34a_100000757476_100000757094 [0,1,0,0,0,0|1,0,2]=4 1431 B11R0.3 C=CCCCOCCCOCC 34a_100000758997_100012232248 [0,1,0,0,0,0|1,0,2]=4 1432 B11R0.3 C=CCCCOCCCOCC 7a_100000757476_100000757094 [0,1,0,0,0,0|1,0,2]=4 1433 B11R0.3 C=CCCCOCCCOCC 7a_100000758997_100012232248 [0,1,0,0,0,0|1,0,2]=4 1434 B11R0.3 C=CCCCOCCOCCBr 34a_100000692535_100000757094 [0,1,0,0,0,0|1,0,2]=4 1435 B11R0.3 C=CCCCOCCOCCBr 7a_100000692535_100000757094 [0,1,0,0,0,0|1,0,2]=4 1436 B11R0.3 C=CCCCOCCOCCC 34a_100000752267_100000757094 [0,1,0,0,0,0|1,0,2]=4 1437 B11R0.3 C=CCCCOCCOCCC 34a_100000758997_100011215938 [0,1,0,0,0,0|1,0,2]=4 1438 B11R0.3 C=CCCCOCCOCCC 7a_100000752267_100000757094 [0,1,0,0,0,0|1,0,2]=4 1439 B11R0.3 C=CCCCOCCOCCC 7a_100000758997_100011215938 [0,1,0,0,0,0|1,0,2]=4 1440 B11R0.3 C=CCCCOCCOCCCl 34a_100011215305_100000757094 [0,1,0,0,0,0|1,0,2]=4 1441 B11R0.3 C=CCCCOCCOCCCl 7a_100011215305_100000757094 [0,1,0,0,0,0|1,0,2]=4 1442 B11R0.3 C=CCCCOCCOCCF 34a_200015357709_100000757094 [0,1,0,0,0,0|1,0,2]=4 1443 B11R0.3 C=CCCCOCCOCCF 7a_200015357709_100000757094 [0,1,0,0,0,0|1,0,2]=4 1444 B11R0.3 C=CCCCOCCOCCI 34a_100012149058_100000757094 [0,1,0,0,0,0|1,0,2]=4 1445 B11R0.3 C=CCCCOCCOCCI 7a_100012149058_100000757094 [0,1,0,0,0,0|1,0,2]=4 1446 B11R0.3 C=CCCCOCCOCCN 34a_100000211614_100000757094 [0,1,0,0,0,0|1,0,2]=4 1447 B11R0.3 C=CCCCOCCOCCO 34a_100000758997_100000692535 [0,1,0,0,0,0|1,0,2]=4 1448 B11R0.3 C=CCCCOCCOCCO 7a_100000758997_100011215305 [0,1,0,0,0,0|1,0,2]=4 1449 B11R0.3 C=CCNCCOCCOCC 2230a_100020586998_100011211534 [0,1,0,0,0,0|1,0,1]=3 1450 B11R0.3 C=CCNCCOCCOCC 2230a_100102712874_100000210623 [0,1,0,0,0,0|1,0,1]=3 1451 B11R0.3 C=CCNCCOCCOCC 34a_100102712874_100015514636 [0,1,0,0,0,0|1,0,1]=3 1452 B11R0.3 C=CCOCCCCCCCC 34a_100000210232_100015514636 [0,1,0,0,0,0|2,0,1]=4 1453 B11R0.3 C=CCOCCCCCCCC 34a_200000210373_100000210759 [0,1,0,0,0,0|2,0,1]=4 1454 B11R0.3 C=CCOCCCCCCCC 7a_100000210232_100015514636 [0,1,0,0,0,0|2,0,1]=4 1455 B11R0.3 C=CCOCCNCCCCC 34a_100000224656_100015514636 [0,1,0,0,0,0|2,0,1]=4 1456 B11R0.3 C=CCOCCOC/C=C\CC 34a_100000037705_100103147603 [0,1,0,0,0,0|1,0,2]=4 1457 B11R0.3 C=CCOCCOC/C=C\CC 7a_100000037705_100103147603 [0,1,0,0,0,0|1,0,2]=4 1458 B11R0.3 C=CCOCCOCC#CCC 34a_100000037705_100009813939 [0,1,0,0,0,0|1,0,2]=4 1459 B11R0.3 C=CCOCCOCC#CCC 7a_100000037705_100009813939 [0,1,0,0,0,0|1,0,2]=4 1460 B11R0.3 C=CCOCCOCCCCC 34a_100000037705_100000718602 [0,1,0,0,0,0|1,0,1]=3 1461 B11R0.3 C=CCOCCOCCCCC 34a_100011215259_100015514636 [0,1,0,0,0,0|1,0,1]=3 1462 B11R0.3 C=CCOCCOCCCCC 7a_100000037705_100000210326 [0,1,0,0,0,0|1,0,1]=3 1463 B11R0.3 C=CCOCCOCCCCC 7a_100011215259_100015514636 [0,1,0,0,0,0|1,0,1]=3 1464 B11R0.3 C=CCOCCOCCCCF 34a_100000037705_100000729493 [0,1,0,0,0,0|2,0,1]=4 1465 B11R0.3 C=CCOCCOCCCCF 7a_100000037705_100000729493 [0,1,0,0,0,0|2,0,1]=4 1466 B11R0.3 C=CCOCCOCCCCO 34a_100000037705_100011216708 [0,1,0,0,0,0|2,0,1]=4 1467 B11R0.3 C=CCOCCOCCCCO 7a_100000037705_100000210776 [0,1,0,0,0,0|2,0,1]=4 1468 B11R0.3 C=CCOCCOCCCOC 34a_100000037705_100000740836 [0,1,0,0,0,0|2,0,1]=4 1469 B11R0.3 C=CCOCCOCCCOC 7a_100000037705_100000740836 [0,1,0,0,0,0|2,0,1]=4 1470 B11R0.3 C=CCOCCOCCOC=C 34a_100000037705_100000039644 [0,1,0,0,0,0|0,0,3]=4 1471 B11R0.3 C=CCOCCOCCOC=C 34a_100000039918_100015514636 [0,1,0,0,0,0|0,0,3]=4 1472 B11R0.3 C=CCOCCOCCOC=C 7a_100000037705_100000039644 [0,1,0,0,0,0|0,0,3]=4 1473 B11R0.3 C=CCOCCOCCOC=C 7a_100000039918_100015514636 [0,1,0,0,0,0|0,0,3]=4 1474 B11R0.3 C=CCOCCOCCOCC 34a_100000037705_100000210147 [0,1,0,0,0,0|0,0,1]=2 1475 B11R0.3 C=CCOCCOCCOCC 34a_100000065479_100000210202 [0,1,0,0,0,0|0,0,1]=2 1476 B11R0.3 C=CCOCCOCCOCC 34a_100000210240_100015514636 [0,1,0,0,0,0|0,0,1]=2 1477 B11R0.3 C=CCOCCOCCOCC 34a_200000210373_100011211534 [0,1,0,0,0,0|0,0,1]=2 1478 B11R0.3 C=CCOCCOCCOCC 7a_100000037705_100011215890 [0,1,0,0,0,0|0,0,1]=2 1479 B11R0.3 C=CCOCCOCCOCC 7a_100000065479_100000210202 [0,1,0,0,0,0|0,0,1]=2 1480 B11R0.3 C=CCOCCOCCOCC 7a_100000210240_100015514636 [0,1,0,0,0,0|0,0,1]=2 1481 B11R0.3 C=CCOCCOCCOCF 34a_100000065479_100015361967 [0,1,0,0,0,0|1,0,1]=3 1482 B11R0.3 C=CCOCCOCCOCF 7a_100000065479_100015361967 [0,1,0,0,0,0|1,0,1]=3 1483 B11R0.3 C=CCOCCOCCSCC 34a_100000037705_100000757381 [0,1,0,0,0,0|0,1,1]=3 1484 B11R0.3 C=CCOCCOCCSCC 7a_100000037705_100000757381 [0,1,0,0,0,0|0,1,1]=3 1485 B11R0.3 C=CCSCCOCCOCC 62a_100000210623_100011211534 [0,1,0,0,0,0|0,1,1]=3 1486 B11R0.3 C=CCSCCOCCOCC 62a_100011211534_100000210623 [0,1,0,0,0,0|0,1,1]=3 1487 B11R0.3 C=COCCCNCCOCC 2230a_100000210767_100011215890 [0,1,0,0,0,0|1,0,2]=4 1488 B11R0.3 C=COCCCNCCOCC 34a_100000210767_100000210147 [0,1,0,0,0,0|1,0,2]=4 1489 B11R0.3 C=COCCNCCCOCC 2230a_100000210961_100000039644 [0,1,0,0,0,0|1,0,2]=4 1490 B11R0.3 C=COCCNCCCOCC 34a_100000210961_100000039644 [0,1,0,0,0,0|1,0,2]=4 1491 B11R0.3 C=COCCNCCOCCC 2230a_100161115042_100000039644 [0,1,0,0,0,0|1,0,2]=4 1492 B11R0.3 C=COCCNCCOCCC 34a_100161115042_100000039644 [0,1,0,0,0,0|1,0,2]=4 1493 B11R0.3 C=COCCNCCOCCO 2230a_100000211614_100000039644 [0,1,0,0,0,0|1,0,2]=4 1494 B11R0.3 C=COCCNCCOCCO 34a_100000211614_100000039644 [0,1,0,0,0,0|1,0,2]=4 1495 B11R0.3 C=COCCOCC/C=C\CC 34a_100000033082_100015370543 [0,1,0,0,0,0|1,0,2]=4 1496 B11R0.3 C=COCCOCC/C=C\CC 34a_100016288707_100000039644 [0,1,0,0,0,0|1,0,2]=4 1497 B11R0.3 C=COCCOCC/C=C\CC 7a_100016288707_100000039644 [0,1,0,0,0,0|1,0,2]=4 1498 B11R0.3 C=COCCOCCC#CCC 34a_100000036655_100000039644 [0,1,0,0,0,0|1,0,2]=4 1499 B11R0.3 C=COCCOCCC#CCC 7a_100000036655_100000039644 [0,1,0,0,0,0|1,0,2]=4 1500 B11R0.3 C=COCCOCCCCCBr 34a_100000746331_100000039644 [0,1,0,0,0,0|1,0,2]=4 1501 B11R0.3 C=COCCOCCCCCBr 7a_100000746331_100000039644 [0,1,0,0,0,0|1,0,2]=4 1502 B11R0.3 C=COCCOCCCCCC 34a_100000033082_100000210314 [0,1,0,0,0,0|1,0,2]=4 1503 B11R0.3 C=COCCOCCCCCC 34a_100000210259_100000039644 [0,1,0,0,0,0|1,0,2]=4 1504 B11R0.3 C=COCCOCCCCCC 7a_100000210259_100000039644 [0,1,0,0,0,0|1,0,2]=4 1505 B11R0.3 C=COCCOCCCCCCl 34a_100000746330_100000039644 [0,1,0,0,0,0|1,0,2]=4 1506 B11R0.3 C=COCCOCCCCCCl 7a_100000746330_100000039644 [0,1,0,0,0,0|1,0,2]=4 1507 B11R0.3 C=COCCOCCCCCF 34a_100000033082_100000729378 [0,1,0,0,0,0|1,0,2]=4 1508 B11R0.3 C=COCCOCCCCCI 34a_200012148887_100000039644 [0,1,0,0,0,0|1,0,2]=4 1509 B11R0.3 C=COCCOCCCCCI 7a_200012148887_100000039644 [0,1,0,0,0,0|1,0,2]=4 1510 B11R0.3 C=COCCOCCCCCN 34a_100000762737_100000039644 [0,1,0,0,0,0|1,0,2]=4 1511 B11R0.3 C=COCCOCCCCCO 34a_100000033082_100000746330 [0,1,0,0,0,0|1,0,2]=4 1512 B11R0.3 C=COCCOCCCCOC 34a_100000033082_100000755781 [0,1,0,0,0,0|1,0,2]=4 1513 B11R0.3 C=COCCOCCCCOC 34a_100000740925_100000039644 [0,1,0,0,0,0|1,0,2]=4 1514 B11R0.3 C=COCCOCCCCSC 34a_100011217163_100000039644 [0,1,0,0,0,0|1,0,2]=4 1515 B11R0.3 C=COCCOCCCCSC 7a_100011217163_100000039644 [0,1,0,0,0,0|1,0,2]=4 1516 B11R0.3 C=COCCOCCCOCC 34a_100000033082_100012232248 [0,1,0,0,0,0|0,0,2]=3 1517 B11R0.3 C=COCCOCCCOCC 34a_100000757476_100000039644 [0,1,0,0,0,0|0,0,2]=3 1518 B11R0.3 C=COCCOCCCOCC 7a_100000757476_100000039644 [0,1,0,0,0,0|0,0,2]=3 1519 B11R0.3 C=COCCOCCCSCC 34a_100011216438_100000039644 [0,1,0,0,0,0|0,1,2]=4 1520 B11R0.3 C=COCCOCCCSCC 7a_100011216438_100000039644 [0,1,0,0,0,0|0,1,2]=4 1521 B11R0.3 C=COCCOCCOCC#N 7a_100000039918_100011215382 [0,1,0,0,0,0|0,0,3]=4 1522 B11R0.3 C=COCCOCCOCC=O 34a_100000039918_200009817547 [0,1,0,0,0,0|0,0,3]=4 1523 B11R0.3 C=COCCOCCOCC=O 7a_100000039918_200015260668 [0,1,0,0,0,0|0,0,3]=4 1524 B11R0.3 C=COCCOCCOCCBr 34a_100000692535_100000039644 [0,1,0,0,0,0|0,0,2]=3 1525 B11R0.3 C=COCCOCCOCCBr 7a_100000692535_100000039644 [0,1,0,0,0,0|0,0,2]=3 1526 B11R0.3 C=COCCOCCOCCC 34a_100000033082_100011215938 [0,1,0,0,0,0|0,0,2]=3 1527 B11R0.3 C=COCCOCCOCCC 34a_100000039918_100000210303 [0,1,0,0,0,0|0,0,2]=3 1528 B11R0.3 C=COCCOCCOCCC 34a_100000752267_100000039644 [0,1,0,0,0,0|0,0,2]=3 1529 B11R0.3 C=COCCOCCOCCC 7a_100000039918_100000210303 [0,1,0,0,0,0|0,0,2]=3 1530 B11R0.3 C=COCCOCCOCCC 7a_100000752267_100000039644 [0,1,0,0,0,0|0,0,2]=3 1531 B11R0.3 C=COCCOCCOCCCl 34a_100011215305_100000039644 [0,1,0,0,0,0|0,0,2]=3 1532 B11R0.3 C=COCCOCCOCCCl 7a_100011215305_100000039644 [0,1,0,0,0,0|0,0,2]=3 1533 B11R0.3 C=COCCOCCOCCF 34a_100000039918_100011217306 [0,1,0,0,0,0|0,0,2]=3 1534 B11R0.3 C=COCCOCCOCCF 34a_200015357709_100000039644 [0,1,0,0,0,0|0,0,2]=3 1535 B11R0.3 C=COCCOCCOCCF 7a_100000039918_100011217306 [0,1,0,0,0,0|0,0,2]=3 1536 B11R0.3 C=COCCOCCOCCF 7a_200015357709_100000039644 [0,1,0,0,0,0|0,0,2]=3 1537 B11R0.3 C=COCCOCCOCCI 34a_100012149058_100000039644 [0,1,0,0,0,0|0,0,2]=3 1538 B11R0.3 C=COCCOCCOCCI 7a_100012149058_100000039644 [0,1,0,0,0,0|0,0,2]=3 1539 B11R0.3 C=COCCOCCOCCN 34a_100000211614_100000039644 [0,1,0,0,0,0|0,0,2]=3 1540 B11R0.3 C=COCCOCCOCCO 34a_100000033082_100000692535 [0,1,0,0,0,0|0,0,2]=3 1541 B11R0.3 C=COCCOCCOCCO 34a_100000039918_100000211926 [0,1,0,0,0,0|0,0,2]=3 1542 B11R0.3 C=COCCOCCOCCO 7a_100000039918_100000211926 [0,1,0,0,0,0|0,0,2]=3 1543 B11R0.3 C=COCCOCCOCSC 34a_100000039918_100011218213 [0,1,0,0,0,0|0,0,2]=3 1544 B11R0.3 C=COCCOCCSCCC 34a_200000230433_100000039644 [0,1,0,0,0,0|0,1,2]=4 1545 B11R0.3 C=COCCOCCSCCC 7a_200000230433_100000039644 [0,1,0,0,0,0|0,1,2]=4 1546 B11R0.3 C=COCCOCOCCCC 34a_100000033082_100011995733 [0,1,0,0,0,0|1,0,2]=4 1547 B11R0.3 C=COCCSCCCOCC 62a_100000039644_100012232248 [0,1,0,0,0,0|0,1,2]=4 1548 B11R0.3 C=COCCSCCCOCC 62a_100012232248_100000039644 [0,1,0,0,0,0|0,1,2]=4 1549 B11R0.3 C=COCCSCCOCCC 62a_100000039644_100011215938 [0,1,0,0,0,0|0,1,2]=4 1550 B11R0.3 C=COCCSCCOCCC 62a_100011215938_100000039644 [0,1,0,0,0,0|0,1,2]=4 1551 B11R0.3 C=COCCSCCOCCO 62a_100000039644_100011215305 [0,1,0,0,0,0|0,1,2]=4 1552 B11R0.3 C=COCCSCCOCCO 62a_100011215305_100000039644 [0,1,0,0,0,0|0,1,2]=4 1553 B11R0.3 CC#CCCOCC/C=C\CC 34a_100000750427_100015370543 [0,1,0,0,0,0|2,0,1]=4 1554 B11R0.3 CC#CCCOCCCCCC 34a_100000750427_100000210314 [0,1,0,0,0,0|2,0,1]=4 1555 B11R0.3 CC#CCCOCCCCCF 34a_100000750427_100000729378 [0,1,0,0,0,0|2,0,1]=4 1556 B11R0.3 CC#CCCOCCCCCO 34a_100000750427_100000746330 [0,1,0,0,0,0|2,0,1]=4 1557 B11R0.3 CC#CCCOCCCCOC 34a_100000750427_100000755781 [0,1,0,0,0,0|2,0,1]=4 1558 B11R0.3 CC#CCCOCCCOCC 34a_100000750427_100012232248 [0,1,0,0,0,0|1,0,1]=3 1559 B11R0.3 CC#CCCOCCOCCC 34a_100000750427_100011215938 [0,1,0,0,0,0|1,0,1]=3 1560 B11R0.3 CC#CCCOCCOCCO 34a_100000750427_100000692535 [0,1,0,0,0,0|1,0,1]=3 1561 B11R0.3 CC#CCCOCOCCCC 34a_100000750427_100011995733 [0,1,0,0,0,0|2,0,1]=4 1562 B11R0.3 CC/C=C/C/C=C/CCOCC 34a_200016273837_100000210202 [0,1,0,0,0,0|2,0,1]=4 1563 B11R0.3 CC/C=C/C/C=C/CCOCC 7a_200016273837_100000210202 [0,1,0,0,0,0|2,0,1]=4 1564 B11R0.3 CC/C=C/CC/C=C/COCC 34a_100016264143_100000210202 [0,1,0,0,0,0|2,0,1]=4 1565 B11R0.3 CC/C=C/CC/C=C/COCC 7a_100016264143_100000210202 [0,1,0,0,0,0|2,0,1]=4 1566 B11R0.3 CC/C=C\CCCCCNCC 269862a_100015525214_100016288537 [0,1,0,0,0,0|3,0,0]=4 1567 B11R0.3 CC/C=C\CCCCCOCC 34a_100016268722_100000210202 [0,1,0,0,0,0|2,0,0]=3 1568 B11R0.3 CC/C=C\CCCCCOCC 7a_100016268722_100000210202 [0,1,0,0,0,0|2,0,0]=3 1569 B11R0.3 CC/C=C\CCCCCOCF 34a_100016268722_100015361967 [0,1,0,0,0,0|3,0,0]=4 1570 B11R0.3 CC/C=C\CCCCCOCF 7a_100016268722_100015361967 [0,1,0,0,0,0|3,0,0]=4 1571 B11R0.3 CC/C=C\CCCCOCCC 34a_100016287862_100000210303 [0,1,0,0,0,0|2,0,1]=4 1572 B11R0.3 CC/C=C\CCCCOCCC 7a_100016287862_100000210303 [0,1,0,0,0,0|2,0,1]=4 1573 B11R0.3 CC/C=C\CCCCOCCF 34a_100016287862_100011217306 [0,1,0,0,0,0|2,0,1]=4 1574 B11R0.3 CC/C=C\CCCCOCCF 7a_100016287862_100011217306 [0,1,0,0,0,0|2,0,1]=4 1575 B11R0.3 CC/C=C\CCCCOCCO 34a_100016287862_100000211926 [0,1,0,0,0,0|2,0,1]=4 1576 B11R0.3 CC/C=C\CCCCOCCO 7a_100016287862_100000211926 [0,1,0,0,0,0|2,0,1]=4 1577 B11R0.3 CC/C=C\CCCCOCSC 34a_100016287862_100011218213 [0,1,0,0,0,0|2,0,1]=4 1578 B11R0.3 CC/C=C\CCNCCCCC 2230a_100000209983_100015370543 [0,1,0,0,0,0|3,0,0]=4 1579 B11R0.3 CC/C=C\CCNCCOCC 2230a_102516460346_100015370543 [0,1,0,0,0,0|2,0,0]=3 1580 B11R0.3 CC/C=C\CCNCCOCC 34a_102516460346_100015370543 [0,1,0,0,0,0|2,0,0]=3 1581 B11R0.3 CC/C=C\CCNCCSCC 2230a_100000106463_100015370543 [0,1,0,0,0,0|2,1,0]=4 1582 B11R0.3 CC/C=C\CCOC/C=C\CC 34a_100016268518_100015370543 [0,1,0,0,0,0|2,0,1]=4 1583 B11R0.3 CC/C=C\CCOC/C=C\CC 34a_100016288707_100103147603 [0,1,0,0,0,0|2,0,1]=4 1584 B11R0.3 CC/C=C\CCOC/C=C\CC 7a_100016288707_100103147603 [0,1,0,0,0,0|2,0,1]=4 1585 B11R0.3 CC/C=C\CCOCCCCBr 34a_100011216708_100015370543 [0,1,0,0,0,0|3,0,0]=4 1586 B11R0.3 CC/C=C\CCOCCCCC 34a_100000210253_100015370543 [0,1,0,0,0,0|2,0,0]=3 1587 B11R0.3 CC/C=C\CCOCCCCC 34a_100016288707_100000718602 [0,1,0,0,0,0|2,0,0]=3 1588 B11R0.3 CC/C=C\CCOCCCCC 7a_100000210253_100015370543 [0,1,0,0,0,0|2,0,0]=3 1589 B11R0.3 CC/C=C\CCOCCCCC 7a_100016288707_100000210326 [0,1,0,0,0,0|2,0,0]=3 1590 B11R0.3 CC/C=C\CCOCCCCCl 34a_100000210776_100015370543 [0,1,0,0,0,0|3,0,0]=4 1591 B11R0.3 CC/C=C\CCOCCCCCl 7a_100000210776_100015370543 [0,1,0,0,0,0|3,0,0]=4 1592 B11R0.3 CC/C=C\CCOCCCCF 34a_100011995726_100015370543 [0,1,0,0,0,0|3,0,0]=4 1593 B11R0.3 CC/C=C\CCOCCCCF 34a_100016288707_100000729493 [0,1,0,0,0,0|3,0,0]=4 1594 B11R0.3 CC/C=C\CCOCCCCF 7a_100011995726_100015370543 [0,1,0,0,0,0|3,0,0]=4 1595 B11R0.3 CC/C=C\CCOCCCCF 7a_100016288707_100000729493 [0,1,0,0,0,0|3,0,0]=4 1596 B11R0.3 CC/C=C\CCOCCCCI 34a_200012148704_100015370543 [0,1,0,0,0,0|3,0,0]=4 1597 B11R0.3 CC/C=C\CCOCCCCN 34a_100000750430_100015370543 [0,1,0,0,0,0|3,0,0]=4 1598 B11R0.3 CC/C=C\CCOCCCCO 34a_100016288707_100011216708 [0,1,0,0,0,0|3,0,0]=4 1599 B11R0.3 CC/C=C\CCOCCCCO 7a_100016288707_100000210776 [0,1,0,0,0,0|3,0,0]=4 1600 B11R0.3 CC/C=C\CCOCCCNC 34a_100000213112_100015370543 [0,1,0,0,0,0|3,0,0]=4 1601 B11R0.3 CC/C=C\CCOCCCOC 34a_100000740835_100015370543 [0,1,0,0,0,0|3,0,0]=4 1602 B11R0.3 CC/C=C\CCOCCCOC 34a_100016288707_100000740836 [0,1,0,0,0,0|3,0,0]=4 1603 B11R0.3 CC/C=C\CCOCCCOC 7a_100016288707_100000740836 [0,1,0,0,0,0|3,0,0]=4 1604 B11R0.3 CC/C=C\CCOCCCSC 34a_100000690336_100015370543 [0,1,0,0,0,0|3,0,0]=4 1605 B11R0.3 CC/C=C\CCOCCCSC 7a_100000690336_100015370543 [0,1,0,0,0,0|3,0,0]=4 1606 B11R0.3 CC/C=C\CCOCCOCC 34a_100000210136_100015370543 [0,1,0,0,0,0|1,0,0]=2 1607 B11R0.3 CC/C=C\CCOCCOCC 34a_100016288707_100000210147 [0,1,0,0,0,0|1,0,0]=2 1608 B11R0.3 CC/C=C\CCOCCOCC 7a_100000210136_100015370543 [0,1,0,0,0,0|1,0,0]=2 1609 B11R0.3 CC/C=C\CCOCCOCC 7a_100016288707_100011215890 [0,1,0,0,0,0|1,0,0]=2 1610 B11R0.3 CC/C=C\CCOCCSCC 34a_100000212035_100015370543 [0,1,0,0,0,0|1,1,0]=3 1611 B11R0.3 CC/C=C\CCOCCSCC 34a_100016288707_100000757381 [0,1,0,0,0,0|1,1,0]=3 1612 B11R0.3 CC/C=C\CCOCCSCC 7a_100000212035_100015370543 [0,1,0,0,0,0|1,1,0]=3 1613 B11R0.3 CC/C=C\CCOCCSCC 7a_100016288707_100000757381 [0,1,0,0,0,0|1,1,0]=3 1614 B11R0.3 CC/C=C\CCSCCCCC 62a_100000210326_100015370543 [0,1,0,0,0,0|2,1,0]=4 1615 B11R0.3 CC/C=C\CCSCCCCC 62a_100015370543_100000210326 [0,1,0,0,0,0|2,1,0]=4 1616 B11R0.3 CC/C=C\CCSCCOCC 62a_100000210147_100015370543 [0,1,0,0,0,0|1,1,0]=3 1617 B11R0.3 CC/C=C\CCSCCOCC 62a_100015370543_100011215890 [0,1,0,0,0,0|1,1,0]=3 1618 B11R0.3 CC/C=C\CCSCCSCC 62a_100000757381_100015370543 [0,1,0,0,0,0|1,2,0]=4 1619 B11R0.3 CC/C=C\CCSCCSCC 62a_100015370543_100000757381 [0,1,0,0,0,0|1,2,0]=4 1620 B11R0.3 CC/C=C\CNCCCOCC 2230a_100000210961_100103147603 [0,1,0,0,0,0|2,0,1]=4 1621 B11R0.3 CC/C=C\CNCCCOCC 34a_100000210961_100103147603 [0,1,0,0,0,0|2,0,1]=4 1622 B11R0.3 CC/C=C\CNCCOCCC 2230a_100161115042_100103147603 [0,1,0,0,0,0|2,0,1]=4 1623 B11R0.3 CC/C=C\CNCCOCCC 34a_100161115042_100103147603 [0,1,0,0,0,0|2,0,1]=4 1624 B11R0.3 CC/C=C\CNCCOCCO 2230a_100000211614_100103147603 [0,1,0,0,0,0|2,0,1]=4 1625 B11R0.3 CC/C=C\CNCCOCCO 34a_100000211614_100103147603 [0,1,0,0,0,0|2,0,1]=4 1626 B11R0.3 CC/C=C\COCCCCCBr 34a_100000746331_100103147603 [0,1,0,0,0,0|2,0,1]=4 1627 B11R0.3 CC/C=C\COCCCCCBr 7a_100000746331_100103147603 [0,1,0,0,0,0|2,0,1]=4 1628 B11R0.3 CC/C=C\COCCCCCC 34a_100000210259_100103147603 [0,1,0,0,0,0|2,0,1]=4 1629 B11R0.3 CC/C=C\COCCCCCC 34a_100016268518_100000210314 [0,1,0,0,0,0|2,0,1]=4 1630 B11R0.3 CC/C=C\COCCCCCC 7a_100000210259_100103147603 [0,1,0,0,0,0|2,0,1]=4 1631 B11R0.3 CC/C=C\COCCCCCCl 34a_100000746330_100103147603 [0,1,0,0,0,0|2,0,1]=4 1632 B11R0.3 CC/C=C\COCCCCCCl 7a_100000746330_100103147603 [0,1,0,0,0,0|2,0,1]=4 1633 B11R0.3 CC/C=C\COCCCCCF 34a_100016268518_100000729378 [0,1,0,0,0,0|2,0,1]=4 1634 B11R0.3 CC/C=C\COCCCCCI 34a_200012148887_100103147603 [0,1,0,0,0,0|2,0,1]=4 1635 B11R0.3 CC/C=C\COCCCCCI 7a_200012148887_100103147603 [0,1,0,0,0,0|2,0,1]=4 1636 B11R0.3 CC/C=C\COCCCCCN 34a_100000762737_100103147603 [0,1,0,0,0,0|2,0,1]=4 1637 B11R0.3 CC/C=C\COCCCCCO 34a_100016268518_100000746330 [0,1,0,0,0,0|2,0,1]=4 1638 B11R0.3 CC/C=C\COCCCCOC 34a_100000740925_100103147603 [0,1,0,0,0,0|2,0,1]=4 1639 B11R0.3 CC/C=C\COCCCCOC 34a_100016268518_100000755781 [0,1,0,0,0,0|2,0,1]=4 1640 B11R0.3 CC/C=C\COCCCCSC 34a_100011217163_100103147603 [0,1,0,0,0,0|2,0,1]=4 1641 B11R0.3 CC/C=C\COCCCCSC 7a_100011217163_100103147603 [0,1,0,0,0,0|2,0,1]=4 1642 B11R0.3 CC/C=C\COCCCOCC 34a_100000757476_100103147603 [0,1,0,0,0,0|1,0,1]=3 1643 B11R0.3 CC/C=C\COCCCOCC 34a_100016268518_100012232248 [0,1,0,0,0,0|1,0,1]=3 1644 B11R0.3 CC/C=C\COCCCOCC 7a_100000757476_100103147603 [0,1,0,0,0,0|1,0,1]=3 1645 B11R0.3 CC/C=C\COCCCSCC 34a_100011216438_100103147603 [0,1,0,0,0,0|1,1,1]=4 1646 B11R0.3 CC/C=C\COCCCSCC 7a_100011216438_100103147603 [0,1,0,0,0,0|1,1,1]=4 1647 B11R0.3 CC/C=C\COCCOCCBr 34a_100000692535_100103147603 [0,1,0,0,0,0|1,0,1]=3 1648 B11R0.3 CC/C=C\COCCOCCBr 7a_100000692535_100103147603 [0,1,0,0,0,0|1,0,1]=3 1649 B11R0.3 CC/C=C\COCCOCCC 34a_100000752267_100103147603 [0,1,0,0,0,0|1,0,1]=3 1650 B11R0.3 CC/C=C\COCCOCCC 34a_100016268518_100011215938 [0,1,0,0,0,0|1,0,1]=3 1651 B11R0.3 CC/C=C\COCCOCCC 7a_100000752267_100103147603 [0,1,0,0,0,0|1,0,1]=3 1652 B11R0.3 CC/C=C\COCCOCCCl 34a_100011215305_100103147603 [0,1,0,0,0,0|1,0,1]=3 1653 B11R0.3 CC/C=C\COCCOCCCl 7a_100011215305_100103147603 [0,1,0,0,0,0|1,0,1]=3 1654 B11R0.3 CC/C=C\COCCOCCF 34a_200015357709_100103147603 [0,1,0,0,0,0|1,0,1]=3 1655 B11R0.3 CC/C=C\COCCOCCF 7a_200015357709_100103147603 [0,1,0,0,0,0|1,0,1]=3 1656 B11R0.3 CC/C=C\COCCOCCI 34a_100012149058_100103147603 [0,1,0,0,0,0|1,0,1]=3 1657 B11R0.3 CC/C=C\COCCOCCI 7a_100012149058_100103147603 [0,1,0,0,0,0|1,0,1]=3 1658 B11R0.3 CC/C=C\COCCOCCN 34a_100000211614_100103147603 [0,1,0,0,0,0|1,0,1]=3 1659 B11R0.3 CC/C=C\COCCOCCO 34a_100016268518_100000692535 [0,1,0,0,0,0|1,0,1]=3 1660 B11R0.3 CC/C=C\COCCSCCC 34a_200000230433_100103147603 [0,1,0,0,0,0|1,1,1]=4 1661 B11R0.3 CC/C=C\COCCSCCC 7a_200000230433_100103147603 [0,1,0,0,0,0|1,1,1]=4 1662 B11R0.3 CC/C=C\COCOCCCC 34a_100016268518_100011995733 [0,1,0,0,0,0|2,0,1]=4 1663 B11R0.3 CC/C=C\CSCCCOCC 62a_100012232248_100103147603 [0,1,0,0,0,0|1,1,1]=4 1664 B11R0.3 CC/C=C\CSCCCOCC 62a_100103147603_100012232248 [0,1,0,0,0,0|1,1,1]=4 1665 B11R0.3 CC/C=C\CSCCOCCC 62a_100011215938_100103147603 [0,1,0,0,0,0|1,1,1]=4 1666 B11R0.3 CC/C=C\CSCCOCCC 62a_100103147603_100011215938 [0,1,0,0,0,0|1,1,1]=4 1667 B11R0.3 CC/C=C\CSCCOCCO 62a_100011215305_100103147603 [0,1,0,0,0,0|1,1,1]=4 1668 B11R0.3 CC/C=C\CSCCOCCO 62a_100103147603_100011215305 [0,1,0,0,0,0|1,1,1]=4 1669 B11R0.3 CC=C=CCCOCCCCC 34a_100011020354_100000718602 [0,1,0,0,0,0|2,0,1]=4 1670 B11R0.3 CC=C=CCCOCCOCC 34a_100011020354_100000210147 [0,1,0,0,0,0|1,0,1]=3 1671 B11R0.3 CC=C=CCCOCCSCC 34a_100011020354_100000757381 [0,1,0,0,0,0|1,1,1]=4 1672 B11R0.3 CC=CCCCOCCCCC 34a_100020645299_100000718602 [0,1,0,0,0,0|2,0,1]=4 1673 B11R0.3 CC=CCCCOCCOCC 34a_100020645299_100000210147 [0,1,0,0,0,0|1,0,1]=3 1674 B11R0.3 CC=CCCCOCCSCC 34a_100020645299_100000757381 [0,1,0,0,0,0|1,1,1]=4 1675 B11R0.3 CCC#CCCOC/C=C\CC 34a_100000036655_100103147603 [0,1,0,0,0,0|2,0,1]=4 1676 B11R0.3 CCC#CCCOC/C=C\CC 7a_100000036655_100103147603 [0,1,0,0,0,0|2,0,1]=4 1677 B11R0.3 CCC#CCCOCC#CCC 34a_100000036655_100009813939 [0,1,0,0,0,0|2,0,1]=4 1678 B11R0.3 CCC#CCCOCC#CCC 7a_100000036655_100009813939 [0,1,0,0,0,0|2,0,1]=4 1679 B11R0.3 CCC#CCCOCCCCC 34a_100000036655_100000718602 [0,1,0,0,0,0|2,0,0]=3 1680 B11R0.3 CCC#CCCOCCCCC 7a_100000036655_100000210326 [0,1,0,0,0,0|2,0,0]=3 1681 B11R0.3 CCC#CCCOCCCCF 34a_100000036655_100000729493 [0,1,0,0,0,0|3,0,0]=4 1682 B11R0.3 CCC#CCCOCCCCF 7a_100000036655_100000729493 [0,1,0,0,0,0|3,0,0]=4 1683 B11R0.3 CCC#CCCOCCCCO 34a_100000036655_100011216708 [0,1,0,0,0,0|3,0,0]=4 1684 B11R0.3 CCC#CCCOCCCCO 7a_100000036655_100000210776 [0,1,0,0,0,0|3,0,0]=4 1685 B11R0.3 CCC#CCCOCCCOC 34a_100000036655_100000740836 [0,1,0,0,0,0|3,0,0]=4 1686 B11R0.3 CCC#CCCOCCCOC 7a_100000036655_100000740836 [0,1,0,0,0,0|3,0,0]=4 1687 B11R0.3 CCC#CCCOCCOCC 34a_100000036655_100000210147 [0,1,0,0,0,0|1,0,0]=2 1688 B11R0.3 CCC#CCCOCCOCC 7a_100000036655_100011215890 [0,1,0,0,0,0|1,0,0]=2 1689 B11R0.3 CCC#CCCOCCSCC 34a_100000036655_100000757381 [0,1,0,0,0,0|1,1,0]=3 1690 B11R0.3 CCC#CCCOCCSCC 7a_100000036655_100000757381 [0,1,0,0,0,0|1,1,0]=3 1691 B11R0.3 CCC#CCNCCCOCC 2230a_100000210961_100009813939 [0,1,0,0,0,0|2,0,1]=4 1692 B11R0.3 CCC#CCNCCCOCC 34a_100000210961_100009813939 [0,1,0,0,0,0|2,0,1]=4 1693 B11R0.3 CCC#CCNCCOCCC 2230a_100161115042_100009813939 [0,1,0,0,0,0|2,0,1]=4 1694 B11R0.3 CCC#CCNCCOCCC 34a_100161115042_100009813939 [0,1,0,0,0,0|2,0,1]=4 1695 B11R0.3 CCC#CCNCCOCCO 2230a_100000211614_100009813939 [0,1,0,0,0,0|2,0,1]=4 1696 B11R0.3 CCC#CCNCCOCCO 34a_100000211614_100009813939 [0,1,0,0,0,0|2,0,1]=4 1697 B11R0.3 CCC#CCOCC/C=C\CC 34a_100000032950_100015370543 [0,1,0,0,0,0|2,0,1]=4 1698 B11R0.3 CCC#CCOCC/C=C\CC 34a_100016288707_100009813939 [0,1,0,0,0,0|2,0,1]=4 1699 B11R0.3 CCC#CCOCC/C=C\CC 7a_100016288707_100009813939 [0,1,0,0,0,0|2,0,1]=4 1700 B11R0.3 CCC#CCOCCCCCBr 34a_100000746331_100009813939 [0,1,0,0,0,0|2,0,1]=4 1701 B11R0.3 CCC#CCOCCCCCBr 7a_100000746331_100009813939 [0,1,0,0,0,0|2,0,1]=4 1702 B11R0.3 CCC#CCOCCCCCC 34a_100000032950_100000210314 [0,1,0,0,0,0|2,0,1]=4 1703 B11R0.3 CCC#CCOCCCCCC 34a_100000210259_100009813939 [0,1,0,0,0,0|2,0,1]=4 1704 B11R0.3 CCC#CCOCCCCCC 7a_100000210259_100009813939 [0,1,0,0,0,0|2,0,1]=4 1705 B11R0.3 CCC#CCOCCCCCCl 34a_100000746330_100009813939 [0,1,0,0,0,0|2,0,1]=4 1706 B11R0.3 CCC#CCOCCCCCCl 7a_100000746330_100009813939 [0,1,0,0,0,0|2,0,1]=4 1707 B11R0.3 CCC#CCOCCCCCF 34a_100000032950_100000729378 [0,1,0,0,0,0|2,0,1]=4 1708 B11R0.3 CCC#CCOCCCCCI 34a_200012148887_100009813939 [0,1,0,0,0,0|2,0,1]=4 1709 B11R0.3 CCC#CCOCCCCCI 7a_200012148887_100009813939 [0,1,0,0,0,0|2,0,1]=4 1710 B11R0.3 CCC#CCOCCCCCN 34a_100000762737_100009813939 [0,1,0,0,0,0|2,0,1]=4 1711 B11R0.3 CCC#CCOCCCCCO 34a_100000032950_100000746330 [0,1,0,0,0,0|2,0,1]=4 1712 B11R0.3 CCC#CCOCCCCOC 34a_100000032950_100000755781 [0,1,0,0,0,0|2,0,1]=4 1713 B11R0.3 CCC#CCOCCCCOC 34a_100000740925_100009813939 [0,1,0,0,0,0|2,0,1]=4 1714 B11R0.3 CCC#CCOCCCCSC 34a_100011217163_100009813939 [0,1,0,0,0,0|2,0,1]=4 1715 B11R0.3 CCC#CCOCCCCSC 7a_100011217163_100009813939 [0,1,0,0,0,0|2,0,1]=4 1716 B11R0.3 CCC#CCOCCCOCC 34a_100000032950_100012232248 [0,1,0,0,0,0|1,0,1]=3 1717 B11R0.3 CCC#CCOCCCOCC 34a_100000757476_100009813939 [0,1,0,0,0,0|1,0,1]=3 1718 B11R0.3 CCC#CCOCCCOCC 7a_100000757476_100009813939 [0,1,0,0,0,0|1,0,1]=3 1719 B11R0.3 CCC#CCOCCCSCC 34a_100011216438_100009813939 [0,1,0,0,0,0|1,1,1]=4 1720 B11R0.3 CCC#CCOCCCSCC 7a_100011216438_100009813939 [0,1,0,0,0,0|1,1,1]=4 1721 B11R0.3 CCC#CCOCCOCCBr 34a_100000692535_100009813939 [0,1,0,0,0,0|1,0,1]=3 1722 B11R0.3 CCC#CCOCCOCCBr 7a_100000692535_100009813939 [0,1,0,0,0,0|1,0,1]=3 1723 B11R0.3 CCC#CCOCCOCCC 34a_100000032950_100011215938 [0,1,0,0,0,0|1,0,1]=3 1724 B11R0.3 CCC#CCOCCOCCC 34a_100000752267_100009813939 [0,1,0,0,0,0|1,0,1]=3 1725 B11R0.3 CCC#CCOCCOCCC 7a_100000752267_100009813939 [0,1,0,0,0,0|1,0,1]=3 1726 B11R0.3 CCC#CCOCCOCCCl 34a_100011215305_100009813939 [0,1,0,0,0,0|1,0,1]=3 1727 B11R0.3 CCC#CCOCCOCCCl 7a_100011215305_100009813939 [0,1,0,0,0,0|1,0,1]=3 1728 B11R0.3 CCC#CCOCCOCCF 34a_200015357709_100009813939 [0,1,0,0,0,0|1,0,1]=3 1729 B11R0.3 CCC#CCOCCOCCF 7a_200015357709_100009813939 [0,1,0,0,0,0|1,0,1]=3 1730 B11R0.3 CCC#CCOCCOCCI 34a_100012149058_100009813939 [0,1,0,0,0,0|1,0,1]=3 1731 B11R0.3 CCC#CCOCCOCCI 7a_100012149058_100009813939 [0,1,0,0,0,0|1,0,1]=3 1732 B11R0.3 CCC#CCOCCOCCN 34a_100000211614_100009813939 [0,1,0,0,0,0|1,0,1]=3 1733 B11R0.3 CCC#CCOCCOCCO 34a_100000032950_100000692535 [0,1,0,0,0,0|1,0,1]=3 1734 B11R0.3 CCC#CCOCCSCCC 34a_200000230433_100009813939 [0,1,0,0,0,0|1,1,1]=4 1735 B11R0.3 CCC#CCOCCSCCC 7a_200000230433_100009813939 [0,1,0,0,0,0|1,1,1]=4 1736 B11R0.3 CCC#CCOCOCCCC 34a_100000032950_100011995733 [0,1,0,0,0,0|2,0,1]=4 1737 B11R0.3 CCC#CCSCCCOCC 62a_100009813939_100012232248 [0,1,0,0,0,0|1,1,1]=4 1738 B11R0.3 CCC#CCSCCCOCC 62a_100012232248_100009813939 [0,1,0,0,0,0|1,1,1]=4 1739 B11R0.3 CCC#CCSCCOCCC 62a_100009813939_100011215938 [0,1,0,0,0,0|1,1,1]=4 1740 B11R0.3 CCC#CCSCCOCCC 62a_100011215938_100009813939 [0,1,0,0,0,0|1,1,1]=4 1741 B11R0.3 CCC#CCSCCOCCO 62a_100009813939_100011215305 [0,1,0,0,0,0|1,1,1]=4 1742 B11R0.3 CCC#CCSCCOCCO 62a_100011215305_100009813939 [0,1,0,0,0,0|1,1,1]=4 1743 B11R0.3 CCC/C=C/COCCCCC 34a_100016278788_100000718602 [0,1,0,0,0,0|2,0,1]=4 1744 B11R0.3 CCC/C=C/COCCCCC 7a_100016278788_100000210326 [0,1,0,0,0,0|2,0,1]=4 1745 B11R0.3 CCC/C=C/COCCOCC 34a_100016278788_100000210147 [0,1,0,0,0,0|1,0,1]=3 1746 B11R0.3 CCC/C=C/COCCOCC 7a_100016278788_100011215890 [0,1,0,0,0,0|1,0,1]=3 1747 B11R0.3 CCC/C=C/COCCSCC 34a_100016278788_100000757381 [0,1,0,0,0,0|1,1,1]=4 1748 B11R0.3 CCC/C=C/COCCSCC 7a_100016278788_100000757381 [0,1,0,0,0,0|1,1,1]=4 1749 B11R0.3 CCCC#CCOCCCCC 34a_100000034806_100000718602 [0,1,0,0,0,0|2,0,1]=4 1750 B11R0.3 CCCC#CCOCCCCC 7a_100000034806_100000210326 [0,1,0,0,0,0|2,0,1]=4 1751 B11R0.3 CCCC#CCOCCOCC 34a_100000034806_100000210147 [0,1,0,0,0,0|1,0,1]=3 1752 B11R0.3 CCCC#CCOCCOCC 7a_100000034806_100011215890 [0,1,0,0,0,0|1,0,1]=3 1753 B11R0.3 CCCC#CCOCCSCC 34a_100000034806_100000757381 [0,1,0,0,0,0|1,1,1]=4 1754 B11R0.3 CCCC#CCOCCSCC 7a_100000034806_100000757381 [0,1,0,0,0,0|1,1,1]=4 1755 B11R0.3 CCCC/C=C\CCOCCC 34a_200016286491_100000210303 [0,1,0,0,0,0|2,0,1]=4 1756 B11R0.3 CCCC/C=C\CCOCCC 7a_200016286491_100000210303 [0,1,0,0,0,0|2,0,1]=4 1757 B11R0.3 CCCC/C=C\CCOCCF 34a_200016286491_100011217306 [0,1,0,0,0,0|2,0,1]=4 1758 B11R0.3 CCCC/C=C\CCOCCF 7a_200016286491_100011217306 [0,1,0,0,0,0|2,0,1]=4 1759 B11R0.3 CCCC/C=C\CCOCCO 34a_200016286491_100000211926 [0,1,0,0,0,0|2,0,1]=4 1760 B11R0.3 CCCC/C=C\CCOCCO 7a_200016286491_100000211926 [0,1,0,0,0,0|2,0,1]=4 1761 B11R0.3 CCCC/C=C\CCOCSC 34a_200016286491_100011218213 [0,1,0,0,0,0|2,0,1]=4 1762 B11R0.3 CCCCC#CCCCOCC 34a_100121572206_200000047210 [0,1,0,0,0,0|2,0,1]=4 1763 B11R0.3 CCCCC#CCCOCCC 34a_100000037610_100000210303 [0,1,0,0,0,0|2,0,1]=4 1764 B11R0.3 CCCCC#CCCOCCC 7a_100000037610_100000210303 [0,1,0,0,0,0|2,0,1]=4 1765 B11R0.3 CCCCC#CCCOCCF 34a_100000037610_100011217306 [0,1,0,0,0,0|2,0,1]=4 1766 B11R0.3 CCCCC#CCCOCCF 7a_100000037610_100011217306 [0,1,0,0,0,0|2,0,1]=4 1767 B11R0.3 CCCCC#CCCOCCO 34a_100000037610_100000211926 [0,1,0,0,0,0|2,0,1]=4 1768 B11R0.3 CCCCC#CCCOCCO 7a_100000037610_100000211926 [0,1,0,0,0,0|2,0,1]=4 1769 B11R0.3 CCCCC#CCCOCSC 34a_100000037610_100011218213 [0,1,0,0,0,0|2,0,1]=4 1770 B11R0.3 CCCCC/C=C/COCCC 34a_100016258190_100000210303 [0,1,0,0,0,0|2,0,1]=4 1771 B11R0.3 CCCCC/C=C/COCCC 7a_100016258190_100000210303 [0,1,0,0,0,0|2,0,1]=4 1772 B11R0.3 CCCCC/C=C/COCCF 34a_100016258190_100011217306 [0,1,0,0,0,0|2,0,1]=4 1773 B11R0.3 CCCCC/C=C/COCCF 7a_100016258190_100011217306 [0,1,0,0,0,0|2,0,1]=4 1774 B11R0.3 CCCCC/C=C/COCCO 34a_100016258190_100000211926 [0,1,0,0,0,0|2,0,1]=4 1775 B11R0.3 CCCCC/C=C/COCCO 7a_100016258190_100000211926 [0,1,0,0,0,0|2,0,1]=4 1776 B11R0.3 CCCCC/C=C/COCSC 34a_100016258190_100011218213 [0,1,0,0,0,0|2,0,1]=4 1777 B11R0.3 CCCCC/C=C\CCOCC 34a_100016277358_100000210202 [0,1,0,0,0,0|2,0,0]=3 1778 B11R0.3 CCCCC/C=C\CCOCC 7a_100016277358_100000210202 [0,1,0,0,0,0|2,0,0]=3 1779 B11R0.3 CCCCC/C=C\CCOCF 34a_100016277358_100015361967 [0,1,0,0,0,0|3,0,0]=4 1780 B11R0.3 CCCCC/C=C\CCOCF 7a_100016277358_100015361967 [0,1,0,0,0,0|3,0,0]=4 1781 B11R0.3 CCCCC=NNCCOCC 4a_100000732670_100000210104 [0,1,0,0,0,0|2,0,1]=4 1782 B11R0.3 CCCCCC#CCCOCC 34a_200000042877_100000210202 [0,1,0,0,0,0|2,0,0]=3 1783 B11R0.3 CCCCCC#CCCOCC 7a_200000042877_100000210202 [0,1,0,0,0,0|2,0,0]=3 1784 B11R0.3 CCCCCC#CCCOCF 34a_200000042877_100015361967 [0,1,0,0,0,0|3,0,0]=4 1785 B11R0.3 CCCCCC#CCCOCF 7a_200000042877_100015361967 [0,1,0,0,0,0|3,0,0]=4 1786 B11R0.3 CCCCCC#CCOCCBr 34a_100000211926_100009816472 [0,1,0,0,0,0|2,0,1]=4 1787 B11R0.3 CCCCCC#CCOCCC 34a_100000210258_100009816472 [0,1,0,0,0,0|2,0,1]=4 1788 B11R0.3 CCCCCC#CCOCCC 34a_200000033628_100000210303 [0,1,0,0,0,0|2,0,1]=4 1789 B11R0.3 CCCCCC#CCOCCC 7a_200000033628_100000210303 [0,1,0,0,0,0|2,0,1]=4 1790 B11R0.3 CCCCCC#CCOCCF 34a_200000033628_100011217306 [0,1,0,0,0,0|2,0,1]=4 1791 B11R0.3 CCCCCC#CCOCCF 7a_200000033628_100011217306 [0,1,0,0,0,0|2,0,1]=4 1792 B11R0.3 CCCCCC#CCOCCN 34a_100000210304_100009816472 [0,1,0,0,0,0|2,0,1]=4 1793 B11R0.3 CCCCCC#CCOCCO 34a_200000033628_100000211926 [0,1,0,0,0,0|2,0,1]=4 1794 B11R0.3 CCCCCC#CCOCCO 7a_200000033628_100000211926 [0,1,0,0,0,0|2,0,1]=4 1795 B11R0.3 CCCCCC#CCOCSC 34a_200000033628_100011218213 [0,1,0,0,0,0|2,0,1]=4 1796 B11R0.3 CCCCCC/C=C/COCC 34a_200016276170_100000210202 [0,1,0,0,0,0|2,0,1]=4 1797 B11R0.3 CCCCCC/C=C/COCC 7a_200016276170_100000210202 [0,1,0,0,0,0|2,0,1]=4 1798 B11R0.3 CCCCCCC#CCOCC 34a_200000037284_100000210202 [0,1,0,0,0,0|2,0,1]=4 1799 B11R0.3 CCCCCCC#CCOCC 7a_200000037284_100000210202 [0,1,0,0,0,0|2,0,1]=4 1800 B11R0.3 CCCCCCCCCCNC 2230a_100000684558_200000210301 [0,1,0,0,0,0|3,0,0]=4 1801 B11R0.3 CCCCCCCCCCNC 2230a_106832991635_100000210320 [0,1,0,0,0,0|3,0,0]=4 1802 B11R0.3 CCCCCCCCCCNC 34a_100000684558_200000210301 [0,1,0,0,0,0|3,0,0]=4 1803 B11R0.3 CCCCCCCCCCNC 34a_100102657272_100000210320 [0,1,0,0,0,0|3,0,0]=4 1804 B11R0.3 CCCCCCCCCCNC 7a_106832991635_100000210320 [0,1,0,0,0,0|3,0,0]=4 1805 B11R0.3 CCCCCCCCCCN[13CH3] 2230a_100000684558_200025704644 [0,1,0,0,0,0|3,0,0]=4 1806 B11R0.3 CCCCCCCCCCN[13CH3] 34a_100000684558_200025704644 [0,1,0,0,0,0|3,0,0]=4 1807 B11R0.3 CCCCCCCCCCOC 34a_100000210711_200000210301 [0,1,0,0,0,0|3,0,0]=4 1808 B11R0.3 CCCCCCCCCCOC 34a_100138415774_100000210320 [0,1,0,0,0,0|3,0,0]=4 1809 B11R0.3 CCCCCCCCCCOC 7a_100000210711_200000210301 [0,1,0,0,0,0|3,0,0]=4 1810 B11R0.3 CCCCCCCCCCO[13CH3] 34a_100000210711_200025704644 [0,1,0,0,0,0|3,0,0]=4 1811 B11R0.3 CCCCCCCCCCO[13CH3] 7a_100000210711_200025704644 [0,1,0,0,0,0|3,0,0]=4 1812 B11R0.3 CCCCCCCCCCSC 62a_200000210301_100000210320 [0,1,0,0,0,0|3,0,0]=4 1813 B11R0.3 CCCCCCCCCCS[13CH3] 62a_200025704644_100000210320 [0,1,0,0,0,0|3,0,0]=4 1814 B11R0.3 CCCCCCCCCNCC 2230a_100000212291_100000210202 [0,1,0,0,0,0|3,0,0]=4 1815 B11R0.3 CCCCCCCCCNCC 2230a_100015525214_100011214924 [0,1,0,0,0,0|3,0,0]=4 1816 B11R0.3 CCCCCCCCCNCC 34a_100000212291_100000210202 [0,1,0,0,0,0|3,0,0]=4 1817 B11R0.3 CCCCCCCCCOCC 34a_100000210712_100000210202 [0,1,0,0,0,0|2,0,0]=3 1818 B11R0.3 CCCCCCCCCOCC 34a_100121572206_100011214924 [0,1,0,0,0,0|2,0,0]=3 1819 B11R0.3 CCCCCCCCCOCC 7a_100000210712_100000210202 [0,1,0,0,0,0|2,0,0]=3 1820 B11R0.3 CCCCCCCCCOCF 34a_100000210712_100015361967 [0,1,0,0,0,0|3,0,0]=4 1821 B11R0.3 CCCCCCCCCOCF 7a_100000210712_100015361967 [0,1,0,0,0,0|3,0,0]=4 1822 B11R0.3 CCCCCCCCCSCC 62a_100000210202_100000210670 [0,1,0,0,0,0|2,1,0]=4 1823 B11R0.3 CCCCCCCCNCCC 2230a_100000229939_100000210303 [0,1,0,0,0,0|3,0,0]=4 1824 B11R0.3 CCCCCCCCNCCC 34a_100000229939_100000210303 [0,1,0,0,0,0|3,0,0]=4 1825 B11R0.3 CCCCCCCCNCCF 2230a_100000229939_100011217306 [0,1,0,0,0,0|3,0,0]=4 1826 B11R0.3 CCCCCCCCNCCF 34a_100000229939_100011217306 [0,1,0,0,0,0|3,0,0]=4 1827 B11R0.3 CCCCCCCCNCCF 34a_100000724931_100000210759 [0,1,0,0,0,0|3,0,0]=4 1828 B11R0.3 CCCCCCCCNCCO 2230a_100000229939_100000211926 [0,1,0,0,0,0|3,0,0]=4 1829 B11R0.3 CCCCCCCCNCCO 2230a_100016997473_100000210759 [0,1,0,0,0,0|3,0,0]=4 1830 B11R0.3 CCCCCCCCNCCO 34a_100000229939_100000211926 [0,1,0,0,0,0|3,0,0]=4 1831 B11R0.3 CCCCCCCCNCCO 34a_100016990907_100000210759 [0,1,0,0,0,0|3,0,0]=4 1832 B11R0.3 CCCCCCCCNCOC 2230a_100000229939_100000766300 [0,1,0,0,0,0|3,0,0]=4 1833 B11R0.3 CCCCCCCCNCSC 2230a_100000229939_100011218213 [0,1,0,0,0,0|3,0,0]=4 1834 B11R0.3 CCCCCCCCNCSC 34a_100000229939_100011218213 [0,1,0,0,0,0|3,0,0]=4 1835 B11R0.3 CCCCCCCCOCC#N 7a_100000210232_100011215382 [0,1,0,0,0,0|2,0,1]=4 1836 B11R0.3 CCCCCCCCOCC=O 34a_100000210232_200009817547 [0,1,0,0,0,0|2,0,1]=4 1837 B11R0.3 CCCCCCCCOCC=O 7a_100000210232_200015260668 [0,1,0,0,0,0|2,0,1]=4 1838 B11R0.3 CCCCCCCCOCCBr 34a_100000211926_100000210759 [0,1,0,0,0,0|2,0,0]=3 1839 B11R0.3 CCCCCCCCOCCC 34a_100000210232_100000210303 [0,1,0,0,0,0|2,0,0]=3 1840 B11R0.3 CCCCCCCCOCCC 34a_100000210258_100000210759 [0,1,0,0,0,0|2,0,0]=3 1841 B11R0.3 CCCCCCCCOCCC 7a_100000210232_100000210303 [0,1,0,0,0,0|2,0,0]=3 1842 B11R0.3 CCCCCCCCOCCF 34a_100000210232_100011217306 [0,1,0,0,0,0|2,0,0]=3 1843 B11R0.3 CCCCCCCCOCCF 7a_100000210232_100011217306 [0,1,0,0,0,0|2,0,0]=3 1844 B11R0.3 CCCCCCCCOCCN 34a_100000210304_100000210759 [0,1,0,0,0,0|2,0,0]=3 1845 B11R0.3 CCCCCCCCOCCO 34a_100000210232_100000211926 [0,1,0,0,0,0|2,0,0]=3 1846 B11R0.3 CCCCCCCCOCCO 7a_100000210232_100000211926 [0,1,0,0,0,0|2,0,0]=3 1847 B11R0.3 CCCCCCCCOCSC 34a_100000210232_100011218213 [0,1,0,0,0,0|2,0,0]=3 1848 B11R0.3 CCCCCCCCSCCC 62a_100000210303_100000210317 [0,1,0,0,0,0|2,1,0]=4 1849 B11R0.3 CCCCCCCCSCCC 62a_100000210759_100000210303 [0,1,0,0,0,0|2,1,0]=4 1850 B11R0.3 CCCCCCCCSCCF 62a_100000210759_100011217306 [0,1,0,0,0,0|2,1,0]=4 1851 B11R0.3 CCCCCCCCSCCF 62a_100011217306_100000210317 [0,1,0,0,0,0|2,1,0]=4 1852 B11R0.3 CCCCCCCCSCCO 62a_100000210759_100000211926 [0,1,0,0,0,0|2,1,0]=4 1853 B11R0.3 CCCCCCCCSCCO 62a_100000211926_100000210317 [0,1,0,0,0,0|2,1,0]=4 1854 B11R0.3 CCCCCCCCSCOC 62a_100000210759_100000766300 [0,1,0,0,0,0|2,1,0]=4 1855 B11R0.3 CCCCCCCCSCOC 62a_100000766300_100000210317 [0,1,0,0,0,0|2,1,0]=4 1856 B11R0.3 CCCCCCCCSCSC 62a_100000210759_100011218213 [0,1,0,0,0,0|2,1,0]=4 1857 B11R0.3 CCCCCCCCSCSC 62a_100011218213_100000210317 [0,1,0,0,0,0|2,1,0]=4 1858 B11R0.3 CCCCCCCNCCCC 2230a_100000102301_100000210681 [0,1,0,0,0,0|3,0,0]=4 1859 B11R0.3 CCCCCCCNCCCC 2230a_100000229938_100000210211 [0,1,0,0,0,0|3,0,0]=4 1860 B11R0.3 CCCCCCCNCCCC 7a_106832991798_100000210614 [0,1,0,0,0,0|3,0,0]=4 1861 B11R0.3 CCCCCCCOCCCC 34a_100000210227_100000210614 [0,1,0,0,0,0|3,0,0]=4 1862 B11R0.3 CCCCCCCOCCCC 34a_100000210272_100000210210 [0,1,0,0,0,0|3,0,0]=4 1863 B11R0.3 CCCCCCCOCCCC 7a_100000210227_100000210614 [0,1,0,0,0,0|3,0,0]=4 1864 B11R0.3 CCCCCCCOCCCC 7a_100000210272_100000210211 [0,1,0,0,0,0|3,0,0]=4 1865 B11R0.3 CCCCCCCSCCCC 62a_100000210211_100000210316 [0,1,0,0,0,0|3,0,0]=4 1866 B11R0.3 CCCCCCCSCCCC 62a_100000210614_100000210210 [0,1,0,0,0,0|3,0,0]=4 1867 B11R0.3 CCCCCCCSCOCC 62a_100000210614_100000739092 [0,1,0,0,0,0|2,0,0]=3 1868 B11R0.3 CCCCCCCSCOCC 62a_100000739092_100000210316 [0,1,0,0,0,0|2,0,0]=3 1869 B11R0.3 CCCCCCNCCCCC 2230a_100000209983_100000210314 [0,1,0,0,0,0|3,0,0]=4 1870 B11R0.3 CCCCCCNCCCCC 2230a_100000210581_100000210326 [0,1,0,0,0,0|3,0,0]=4 1871 B11R0.3 CCCCCCNCCOCC 2230a_100000210581_100011215890 [0,1,0,0,0,0|2,0,0]=3 1872 B11R0.3 CCCCCCNCCOCC 2230a_102516460346_100000210314 [0,1,0,0,0,0|2,0,0]=3 1873 B11R0.3 CCCCCCNCCOCC 34a_102516460346_100000210314 [0,1,0,0,0,0|2,0,0]=3 1874 B11R0.3 CCCCCCNCCSCC 2230a_100000106463_100000210314 [0,1,0,0,0,0|2,1,0]=4 1875 B11R0.3 CCCCCCNCCSCC 2230a_100000210581_100000757381 [0,1,0,0,0,0|2,1,0]=4 1876 B11R0.3 CCCCCCOCCCCBr 34a_100011216708_100000210314 [0,1,0,0,0,0|3,0,0]=4 1877 B11R0.3 CCCCCCOCCCCC 34a_100000210253_100000210314 [0,1,0,0,0,0|2,0,0]=3 1878 B11R0.3 CCCCCCOCCCCC 34a_100000210259_100000718602 [0,1,0,0,0,0|2,0,0]=3 1879 B11R0.3 CCCCCCOCCCCC 7a_100000210253_100000210314 [0,1,0,0,0,0|2,0,0]=3 1880 B11R0.3 CCCCCCOCCCCC 7a_100000210259_100000210326 [0,1,0,0,0,0|2,0,0]=3 1881 B11R0.3 CCCCCCOCCCCCl 34a_100000210776_100000210314 [0,1,0,0,0,0|3,0,0]=4 1882 B11R0.3 CCCCCCOCCCCCl 7a_100000210776_100000210314 [0,1,0,0,0,0|3,0,0]=4 1883 B11R0.3 CCCCCCOCCCCF 34a_100000210259_100000729493 [0,1,0,0,0,0|3,0,0]=4 1884 B11R0.3 CCCCCCOCCCCF 34a_100011995726_100000210314 [0,1,0,0,0,0|3,0,0]=4 1885 B11R0.3 CCCCCCOCCCCF 7a_100000210259_100000729493 [0,1,0,0,0,0|3,0,0]=4 1886 B11R0.3 CCCCCCOCCCCF 7a_100011995726_100000210314 [0,1,0,0,0,0|3,0,0]=4 1887 B11R0.3 CCCCCCOCCCCI 34a_200012148704_100000210314 [0,1,0,0,0,0|3,0,0]=4 1888 B11R0.3 CCCCCCOCCCCN 34a_100000750430_100000210314 [0,1,0,0,0,0|3,0,0]=4 1889 B11R0.3 CCCCCCOCCCCO 34a_100000210259_100011216708 [0,1,0,0,0,0|3,0,0]=4 1890 B11R0.3 CCCCCCOCCCCO 7a_100000210259_100000210776 [0,1,0,0,0,0|3,0,0]=4 1891 B11R0.3 CCCCCCOCCCNC 34a_100000213112_100000210314 [0,1,0,0,0,0|3,0,0]=4 1892 B11R0.3 CCCCCCOCCCOC 34a_100000210259_100000740836 [0,1,0,0,0,0|3,0,0]=4 1893 B11R0.3 CCCCCCOCCCOC 34a_100000740835_100000210314 [0,1,0,0,0,0|3,0,0]=4 1894 B11R0.3 CCCCCCOCCCOC 7a_100000210259_100000740836 [0,1,0,0,0,0|3,0,0]=4 1895 B11R0.3 CCCCCCOCCCSC 34a_100000690336_100000210314 [0,1,0,0,0,0|3,0,0]=4 1896 B11R0.3 CCCCCCOCCCSC 7a_100000690336_100000210314 [0,1,0,0,0,0|3,0,0]=4 1897 B11R0.3 CCCCCCOCCOCC 34a_100000210136_100000210314 [0,1,0,0,0,0|1,0,0]=2 1898 B11R0.3 CCCCCCOCCOCC 34a_100000210259_100000210147 [0,1,0,0,0,0|1,0,0]=2 1899 B11R0.3 CCCCCCOCCOCC 34a_100000691444_100000210202 [0,1,0,0,0,0|1,0,0]=2 1900 B11R0.3 CCCCCCOCCOCC 7a_100000210136_100000210314 [0,1,0,0,0,0|1,0,0]=2 1901 B11R0.3 CCCCCCOCCOCC 7a_100000210259_100011215890 [0,1,0,0,0,0|1,0,0]=2 1902 B11R0.3 CCCCCCOCCOCC 7a_100000691444_100000210202 [0,1,0,0,0,0|1,0,0]=2 1903 B11R0.3 CCCCCCOCCOCF 34a_100000691444_100015361967 [0,1,0,0,0,0|2,0,0]=3 1904 B11R0.3 CCCCCCOCCOCF 7a_100000691444_100015361967 [0,1,0,0,0,0|2,0,0]=3 1905 B11R0.3 CCCCCCOCCSCC 34a_100000210259_100000757381 [0,1,0,0,0,0|1,1,0]=3 1906 B11R0.3 CCCCCCOCCSCC 34a_100000212035_100000210314 [0,1,0,0,0,0|1,1,0]=3 1907 B11R0.3 CCCCCCOCCSCC 7a_100000210259_100000757381 [0,1,0,0,0,0|1,1,0]=3 1908 B11R0.3 CCCCCCOCCSCC 7a_100000212035_100000210314 [0,1,0,0,0,0|1,1,0]=3 1909 B11R0.3 CCCCCCSCCCCC 62a_100000210314_100000210326 [0,1,0,0,0,0|2,1,0]=4 1910 B11R0.3 CCCCCCSCCCCC 62a_100000210326_100000210757 [0,1,0,0,0,0|2,1,0]=4 1911 B11R0.3 CCCCCCSCCOCC 62a_100000210147_100000210757 [0,1,0,0,0,0|1,1,0]=3 1912 B11R0.3 CCCCCCSCCOCC 62a_100000210314_100011215890 [0,1,0,0,0,0|1,1,0]=3 1913 B11R0.3 CCCCCCSCCSCC 62a_100000210314_100000757381 [0,1,0,0,0,0|1,2,0]=4 1914 B11R0.3 CCCCCCSCCSCC 62a_100000757381_100000210757 [0,1,0,0,0,0|1,2,0]=4 1915 B11R0.3 CCCCCNCCCCCF 2230a_100000209983_100000729378 [0,1,0,0,0,0|3,0,0]=4 1916 B11R0.3 CCCCCNCCCCCO 2230a_100000209983_100000746330 [0,1,0,0,0,0|3,0,0]=4 1917 B11R0.3 CCCCCNCCCCCO 2230a_100000762737_100000210326 [0,1,0,0,0,0|3,0,0]=4 1918 B11R0.3 CCCCCNCCCCCO 34a_100000762737_100000718602 [0,1,0,0,0,0|3,0,0]=4 1919 B11R0.3 CCCCCNCCCCOC 2230a_100000209983_100000730899 [0,1,0,0,0,0|3,0,0]=4 1920 B11R0.3 CCCCCNCCCOCC 2230a_100000209983_100012232248 [0,1,0,0,0,0|2,0,0]=3 1921 B11R0.3 CCCCCNCCCOCC 2230a_100000210961_100000210326 [0,1,0,0,0,0|2,0,0]=3 1922 B11R0.3 CCCCCNCCCOCC 34a_100000210961_100000718602 [0,1,0,0,0,0|2,0,0]=3 1923 B11R0.3 CCCCCNCCOCC#N 2230a_100000209983_200000047693 [0,1,0,0,0,0|2,0,1]=4 1924 B11R0.3 CCCCCNCCOCC=O 34a_100000224656_200009817547 [0,1,0,0,0,0|2,0,1]=4 1925 B11R0.3 CCCCCNCCOCCC 2230a_100000209983_100011215938 [0,1,0,0,0,0|2,0,0]=3 1926 B11R0.3 CCCCCNCCOCCC 2230a_100161115042_100000210326 [0,1,0,0,0,0|2,0,0]=3 1927 B11R0.3 CCCCCNCCOCCC 34a_100000224656_100000210303 [0,1,0,0,0,0|2,0,0]=3 1928 B11R0.3 CCCCCNCCOCCC 34a_100161115042_100000718602 [0,1,0,0,0,0|2,0,0]=3 1929 B11R0.3 CCCCCNCCOCCF 34a_100000224656_100011217306 [0,1,0,0,0,0|2,0,0]=3 1930 B11R0.3 CCCCCNCCOCCO 2230a_100000209983_100011215305 [0,1,0,0,0,0|2,0,0]=3 1931 B11R0.3 CCCCCNCCOCCO 2230a_100000211614_100000210326 [0,1,0,0,0,0|2,0,0]=3 1932 B11R0.3 CCCCCNCCOCCO 34a_100000211614_100000718602 [0,1,0,0,0,0|2,0,0]=3 1933 B11R0.3 CCCCCNCCOCCO 34a_100000224656_100000211926 [0,1,0,0,0,0|2,0,0]=3 1934 B11R0.3 CCCCCNCCOCSC 34a_100000224656_100011218213 [0,1,0,0,0,0|2,0,0]=3 1935 B11R0.3 CCCCCNCCSCCC 2230a_100020603323_100000210326 [0,1,0,0,0,0|2,1,0]=4 1936 B11R0.3 CCCCCNCCSCCO 2230a_100011219999_100000210326 [0,1,0,0,0,0|2,1,0]=4 1937 B11R0.3 CCCCCNCOCCCC 2230a_100000209983_100011995733 [0,1,0,0,0,0|3,0,0]=4 1938 B11R0.3 CCCCCOCCCCC#N 7a_100000210253_100000211819 [0,1,0,0,0,0|2,0,1]=4 1939 B11R0.3 CCCCCOCCCCC=O 7a_100000210253_100000139335 [0,1,0,0,0,0|2,0,1]=4 1940 B11R0.3 CCCCCOCCCCCBr 34a_100000746331_100000718602 [0,1,0,0,0,0|2,0,0]=3 1941 B11R0.3 CCCCCOCCCCCBr 7a_100000746331_100000210326 [0,1,0,0,0,0|2,0,0]=3 1942 B11R0.3 CCCCCOCCCCCCl 34a_100000746330_100000718602 [0,1,0,0,0,0|2,0,0]=3 1943 B11R0.3 CCCCCOCCCCCCl 7a_100000746330_100000210326 [0,1,0,0,0,0|2,0,0]=3 1944 B11R0.3 CCCCCOCCCCCF 34a_100000210253_100000729378 [0,1,0,0,0,0|2,0,0]=3 1945 B11R0.3 CCCCCOCCCCCF 7a_100000210253_100000729378 [0,1,0,0,0,0|2,0,0]=3 1946 B11R0.3 CCCCCOCCCCCI 34a_200012148887_100000718602 [0,1,0,0,0,0|2,0,0]=3 1947 B11R0.3 CCCCCOCCCCCI 7a_200012148887_100000210326 [0,1,0,0,0,0|2,0,0]=3 1948 B11R0.3 CCCCCOCCCCCN 34a_100000762737_100000718602 [0,1,0,0,0,0|2,0,0]=3 1949 B11R0.3 CCCCCOCCCCCO 34a_100000210253_100000746330 [0,1,0,0,0,0|2,0,0]=3 1950 B11R0.3 CCCCCOCCCCCO 7a_100000210253_100000746330 [0,1,0,0,0,0|2,0,0]=3 1951 B11R0.3 CCCCCOCCCCOC 34a_100000210253_100000755781 [0,1,0,0,0,0|2,0,0]=3 1952 B11R0.3 CCCCCOCCCCOC 34a_100000740925_100000718602 [0,1,0,0,0,0|2,0,0]=3 1953 B11R0.3 CCCCCOCCCCOC 7a_100000210253_100000730899 [0,1,0,0,0,0|2,0,0]=3 1954 B11R0.3 CCCCCOCCCCSC 34a_100011217163_100000718602 [0,1,0,0,0,0|2,0,0]=3 1955 B11R0.3 CCCCCOCCCCSC 7a_100011217163_100000210326 [0,1,0,0,0,0|2,0,0]=3 1956 B11R0.3 CCCCCOCCCOCC 34a_100000210253_100012232248 [0,1,0,0,0,0|1,0,0]=2 1957 B11R0.3 CCCCCOCCCOCC 34a_100000757476_100000718602 [0,1,0,0,0,0|1,0,0]=2 1958 B11R0.3 CCCCCOCCCOCC 7a_100000210253_100012232248 [0,1,0,0,0,0|1,0,0]=2 1959 B11R0.3 CCCCCOCCCOCC 7a_100000757476_100000210326 [0,1,0,0,0,0|1,0,0]=2 1960 B11R0.3 CCCCCOCCCSCC 34a_100011216438_100000718602 [0,1,0,0,0,0|1,1,0]=3 1961 B11R0.3 CCCCCOCCCSCC 7a_100011216438_100000210326 [0,1,0,0,0,0|1,1,0]=3 1962 B11R0.3 CCCCCOCCOCC#N 7a_100000210253_200000047693 [0,1,0,0,0,0|1,0,1]=3 1963 B11R0.3 CCCCCOCCOCC#N 7a_100011215259_100011215382 [0,1,0,0,0,0|1,0,1]=3 1964 B11R0.3 CCCCCOCCOCC=O 34a_100011215259_200009817547 [0,1,0,0,0,0|1,0,1]=3 1965 B11R0.3 CCCCCOCCOCC=O 7a_100011215259_200015260668 [0,1,0,0,0,0|1,0,1]=3 1966 B11R0.3 CCCCCOCCOCCBr 34a_100000692535_100000718602 [0,1,0,0,0,0|1,0,0]=2 1967 B11R0.3 CCCCCOCCOCCBr 7a_100000692535_100000210326 [0,1,0,0,0,0|1,0,0]=2 1968 B11R0.3 CCCCCOCCOCCC 34a_100000210253_100011215938 [0,1,0,0,0,0|1,0,0]=2 1969 B11R0.3 CCCCCOCCOCCC 34a_100000752267_100000718602 [0,1,0,0,0,0|1,0,0]=2 1970 B11R0.3 CCCCCOCCOCCC 34a_100011215259_100000210303 [0,1,0,0,0,0|1,0,0]=2 1971 B11R0.3 CCCCCOCCOCCC 7a_100000210253_100011215938 [0,1,0,0,0,0|1,0,0]=2 1972 B11R0.3 CCCCCOCCOCCC 7a_100000752267_100000210326 [0,1,0,0,0,0|1,0,0]=2 1973 B11R0.3 CCCCCOCCOCCC 7a_100011215259_100000210303 [0,1,0,0,0,0|1,0,0]=2 1974 B11R0.3 CCCCCOCCOCCCl 34a_100011215305_100000718602 [0,1,0,0,0,0|1,0,0]=2 1975 B11R0.3 CCCCCOCCOCCCl 7a_100011215305_100000210326 [0,1,0,0,0,0|1,0,0]=2 1976 B11R0.3 CCCCCOCCOCCF 34a_100011215259_100011217306 [0,1,0,0,0,0|1,0,0]=2 1977 B11R0.3 CCCCCOCCOCCF 34a_200015357709_100000718602 [0,1,0,0,0,0|1,0,0]=2 1978 B11R0.3 CCCCCOCCOCCF 7a_100011215259_100011217306 [0,1,0,0,0,0|1,0,0]=2 1979 B11R0.3 CCCCCOCCOCCF 7a_200015357709_100000210326 [0,1,0,0,0,0|1,0,0]=2 1980 B11R0.3 CCCCCOCCOCCI 34a_100012149058_100000718602 [0,1,0,0,0,0|1,0,0]=2 1981 B11R0.3 CCCCCOCCOCCI 7a_100012149058_100000210326 [0,1,0,0,0,0|1,0,0]=2 1982 B11R0.3 CCCCCOCCOCCN 34a_100000211614_100000718602 [0,1,0,0,0,0|1,0,0]=2 1983 B11R0.3 CCCCCOCCOCCO 34a_100000210253_100000692535 [0,1,0,0,0,0|1,0,0]=2 1984 B11R0.3 CCCCCOCCOCCO 34a_100011215259_100000211926 [0,1,0,0,0,0|1,0,0]=2 1985 B11R0.3 CCCCCOCCOCCO 7a_100000210253_100011215305 [0,1,0,0,0,0|1,0,0]=2 1986 B11R0.3 CCCCCOCCOCCO 7a_100011215259_100000211926 [0,1,0,0,0,0|1,0,0]=2 1987 B11R0.3 CCCCCOCCOCSC 34a_100011215259_100011218213 [0,1,0,0,0,0|1,0,0]=2 1988 B11R0.3 CCCCCOCCSCCC 34a_200000230433_100000718602 [0,1,0,0,0,0|1,1,0]=3 1989 B11R0.3 CCCCCOCCSCCC 7a_200000230433_100000210326 [0,1,0,0,0,0|1,1,0]=3 1990 B11R0.3 CCCCCOCOCCCC 34a_100000210253_100011995733 [0,1,0,0,0,0|2,0,0]=3 1991 B11R0.3 CCCCCSCCCCCF 62a_100000210326_100000729378 [0,1,0,0,0,0|2,1,0]=4 1992 B11R0.3 CCCCCSCCCCCF 62a_100000729378_100000210326 [0,1,0,0,0,0|2,1,0]=4 1993 B11R0.3 CCCCCSCCCCCO 62a_100000210326_100000746330 [0,1,0,0,0,0|2,1,0]=4 1994 B11R0.3 CCCCCSCCCCCO 62a_100000746330_100000210326 [0,1,0,0,0,0|2,1,0]=4 1995 B11R0.3 CCCCCSCCCCOC 62a_100000210326_100000730899 [0,1,0,0,0,0|2,1,0]=4 1996 B11R0.3 CCCCCSCCCCOC 62a_100000730899_100000210326 [0,1,0,0,0,0|2,1,0]=4 1997 B11R0.3 CCCCCSCCCOCC 62a_100000210326_100012232248 [0,1,0,0,0,0|1,1,0]=3 1998 B11R0.3 CCCCCSCCCOCC 62a_100012232248_100000210326 [0,1,0,0,0,0|1,1,0]=3 1999 B11R0.3 CCCCCSCCOCC#N 62a_100000210326_200000047693 [0,1,0,0,0,0|1,1,1]=4 2000 B11R0.3 CCCCCSCCOCC#N 62a_200000047693_100000210326 [0,1,0,0,0,0|1,1,1]=4 2001 B11R0.3 CCCCCSCCOCCC 62a_100000210326_100011215938 [0,1,0,0,0,0|1,1,0]=3 2002 B11R0.3 CCCCCSCCOCCC 62a_100011215938_100000210326 [0,1,0,0,0,0|1,1,0]=3 2003 B11R0.3 CCCCCSCCOCCO 62a_100000210326_100011215305 [0,1,0,0,0,0|1,1,0]=3 2004 B11R0.3 CCCCCSCCOCCO 62a_100011215305_100000210326 [0,1,0,0,0,0|1,1,0]=3 2005 B11R0.3 CCCCCSCOCCCC 62a_100000210326_100011995733 [0,1,0,0,0,0|2,1,0]=4 2006 B11R0.3 CCCCCSCOCCCC 62a_100011995733_100000210326 [0,1,0,0,0,0|2,1,0]=4 2007 B11R0.3 CCCCNCCCCOCC 34a_200011216965_100000210202 [0,1,0,0,0,0|2,0,0]=3 2008 B11R0.3 CCCCNCCCCOCF 34a_200011216965_100015361967 [0,1,0,0,0,0|3,0,0]=4 2009 B11R0.3 CCCCNCCCOCCC 2230a_100011217757_100000210211 [0,1,0,0,0,0|3,0,0]=4 2010 B11R0.3 CCCCNCCCOCCC 34a_100011217757_100000210210 [0,1,0,0,0,0|3,0,0]=4 2011 B11R0.3 CCCCOCCCCOCC 34a_200000760531_100000210202 [0,1,0,0,0,0|2,0,0]=3 2012 B11R0.3 CCCCOCCCCOCC 7a_200000760531_100000210202 [0,1,0,0,0,0|2,0,0]=3 2013 B11R0.3 CCCCOCCCCOCF 34a_200000760531_100015361967 [0,1,0,0,0,0|3,0,0]=4 2014 B11R0.3 CCCCOCCCCOCF 7a_200000760531_100015361967 [0,1,0,0,0,0|3,0,0]=4 2015 B11R0.3 CCCCOCCCOCCC 34a_200011215613_100000210303 [0,1,0,0,0,0|3,0,0]=4 2016 B11R0.3 CCCCOCCCOCCC 7a_200011215613_100000210303 [0,1,0,0,0,0|3,0,0]=4 2017 B11R0.3 CCCCOCCCOCCF 34a_200011215613_100011217306 [0,1,0,0,0,0|3,0,0]=4 2018 B11R0.3 CCCCOCCCOCCF 7a_200011215613_100011217306 [0,1,0,0,0,0|3,0,0]=4 2019 B11R0.3 CCCCOCCCOCCO 34a_200011215613_100000211926 [0,1,0,0,0,0|3,0,0]=4 2020 B11R0.3 CCCCOCCCOCCO 7a_200011215613_100000211926 [0,1,0,0,0,0|3,0,0]=4 2021 B11R0.3 CCCCOCCCOCSC 34a_200011215613_100011218213 [0,1,0,0,0,0|3,0,0]=4 2022 B11R0.3 CCCCOCCSCOCC 62a_100000739092_100000743108 [0,1,0,0,0,0|3,0,0]=4 2023 B11R0.3 CCCCOCCSCOCC 62a_100000743108_100000739092 [0,1,0,0,0,0|3,0,0]=4 2024 B11R0.3 CCCCOCNCCOCC 2230a_102516460346_100011995733 [0,1,0,0,0,0|2,0,0]=3 2025 B11R0.3 CCCCOCNCCOCC 34a_102516460346_100011995733 [0,1,0,0,0,0|2,0,0]=3 2026 B11R0.3 CCCCOCNCCSCC 2230a_100000106463_100011995733 [0,1,0,0,0,0|2,1,0]=4 2027 B11R0.3 CCCCOCOCCCCBr 34a_100011216708_100011995733 [0,1,0,0,0,0|3,0,0]=4 2028 B11R0.3 CCCCOCOCCCCCl 34a_100000210776_100011995733 [0,1,0,0,0,0|3,0,0]=4 2029 B11R0.3 CCCCOCOCCCCF 34a_100011995726_100011995733 [0,1,0,0,0,0|3,0,0]=4 2030 B11R0.3 CCCCOCOCCCCI 34a_200012148704_100011995733 [0,1,0,0,0,0|3,0,0]=4 2031 B11R0.3 CCCCOCOCCCCN 34a_100000750430_100011995733 [0,1,0,0,0,0|3,0,0]=4 2032 B11R0.3 CCCCOCOCCCNC 34a_100000213112_100011995733 [0,1,0,0,0,0|3,0,0]=4 2033 B11R0.3 CCCCOCOCCCOC 34a_100000740835_100011995733 [0,1,0,0,0,0|3,0,0]=4 2034 B11R0.3 CCCCOCOCCCSC 34a_100000690336_100011995733 [0,1,0,0,0,0|3,0,0]=4 2035 B11R0.3 CCCCOCOCCOCC 34a_100000210136_100011995733 [0,1,0,0,0,0|1,0,0]=2 2036 B11R0.3 CCCCOCOCCSCC 34a_100000212035_100011995733 [0,1,0,0,0,0|1,1,0]=3 2037 B11R0.3 CCCCOCSCCOCC 62a_100000210147_100011995733 [0,1,0,0,0,0|1,1,0]=3 2038 B11R0.3 CCCCOCSCCOCC 62a_100011995733_100011215890 [0,1,0,0,0,0|1,1,0]=3 2039 B11R0.3 CCCCOCSCCSCC 62a_100000757381_100011995733 [0,1,0,0,0,0|1,2,0]=4 2040 B11R0.3 CCCCOCSCCSCC 62a_100011995733_100000757381 [0,1,0,0,0,0|1,2,0]=4 2041 B11R0.3 CCCNCCOCCOCC 2230a_100102712874_100000210303 [0,1,0,0,0,0|1,0,0]=2 2042 B11R0.3 CCCNCCOCCOCC 34a_100102712874_100000210303 [0,1,0,0,0,0|1,0,0]=2 2043 B11R0.3 CCCOCCCCCCCBr 34a_100000760002_100000210303 [0,1,0,0,0,0|3,0,0]=4 2044 B11R0.3 CCCOCCCCCCCBr 7a_100000760002_100000210303 [0,1,0,0,0,0|3,0,0]=4 2045 B11R0.3 CCCOCCCCCCCN 34a_100011996573_100000210303 [0,1,0,0,0,0|3,0,0]=4 2046 B11R0.3 CCCOCCCCCCCO 34a_100000210258_100000760002 [0,1,0,0,0,0|3,0,0]=4 2047 B11R0.3 CCCOCCCCCCOC 34a_100000210258_100011998445 [0,1,0,0,0,0|3,0,0]=4 2048 B11R0.3 CCCOCCCCCCOC 34a_200012092642_100000210303 [0,1,0,0,0,0|3,0,0]=4 2049 B11R0.3 CCCOCCCCCCOC 7a_200012092642_100000210303 [0,1,0,0,0,0|3,0,0]=4 2050 B11R0.3 CCCOCCNCCCCF 2230a_100161115042_100000729493 [0,1,0,0,0,0|3,0,0]=4 2051 B11R0.3 CCCOCCNCCCCF 34a_100161115042_100000729493 [0,1,0,0,0,0|3,0,0]=4 2052 B11R0.3 CCCOCCNCCCCO 2230a_100000750430_100011215938 [0,1,0,0,0,0|3,0,0]=4 2053 B11R0.3 CCCOCCNCCCCO 2230a_100161115042_100000210776 [0,1,0,0,0,0|3,0,0]=4 2054 B11R0.3 CCCOCCNCCCCO 34a_100000750430_100011215938 [0,1,0,0,0,0|3,0,0]=4 2055 B11R0.3 CCCOCCNCCCCO 34a_100161115042_100011216708 [0,1,0,0,0,0|3,0,0]=4 2056 B11R0.3 CCCOCCNCCCOC 2230a_100161115042_100000740836 [0,1,0,0,0,0|3,0,0]=4 2057 B11R0.3 CCCOCCNCCCOC 34a_100150723488_100011215938 [0,1,0,0,0,0|3,0,0]=4 2058 B11R0.3 CCCOCCNCCCOC 34a_100161115042_100000740836 [0,1,0,0,0,0|3,0,0]=4 2059 B11R0.3 CCCOCCNCCCSC 2230a_100000749238_100011215938 [0,1,0,0,0,0|3,0,0]=4 2060 B11R0.3 CCCOCCNCCOCC 2230a_100161115042_100011215890 [0,1,0,0,0,0|1,0,0]=2 2061 B11R0.3 CCCOCCNCCOCC 2230a_102516460346_100011215938 [0,1,0,0,0,0|1,0,0]=2 2062 B11R0.3 CCCOCCNCCOCC 34a_100161115042_100000210147 [0,1,0,0,0,0|1,0,0]=2 2063 B11R0.3 CCCOCCNCCOCC 34a_102516460346_100011215938 [0,1,0,0,0,0|1,0,0]=2 2064 B11R0.3 CCCOCCNCCSCC 2230a_100000106463_100011215938 [0,1,0,0,0,0|1,1,0]=3 2065 B11R0.3 CCCOCCNCCSCC 2230a_100161115042_100000757381 [0,1,0,0,0,0|1,1,0]=3 2066 B11R0.3 CCCOCCNCCSCC 34a_100161115042_100000757381 [0,1,0,0,0,0|1,1,0]=3 2067 B11R0.3 CCCOCCOCC#CCCl 34a_200000047223_100011215938 [0,1,0,0,0,0|2,0,1]=4 2068 B11R0.3 CCCOCCOCC#CCO 34a_100000752267_200000047223 [0,1,0,0,0,0|2,0,1]=4 2069 B11R0.3 CCCOCCOCC#CCO 7a_100000752267_200000047223 [0,1,0,0,0,0|2,0,1]=4 2070 B11R0.3 CCCOCCOCCCC#N 7a_100000752267_100000687738 [0,1,0,0,0,0|2,0,1]=4 2071 B11R0.3 CCCOCCOCCCC=O 7a_100000752267_200011292268 [0,1,0,0,0,0|2,0,1]=4 2072 B11R0.3 CCCOCCOCCCCBr 34a_100011216708_100011215938 [0,1,0,0,0,0|2,0,0]=3 2073 B11R0.3 CCCOCCOCCCCCl 34a_100000210776_100011215938 [0,1,0,0,0,0|2,0,0]=3 2074 B11R0.3 CCCOCCOCCCCCl 7a_100000210776_100011215938 [0,1,0,0,0,0|2,0,0]=3 2075 B11R0.3 CCCOCCOCCCCF 34a_100000752267_100000729493 [0,1,0,0,0,0|2,0,0]=3 2076 B11R0.3 CCCOCCOCCCCF 34a_100011995726_100011215938 [0,1,0,0,0,0|2,0,0]=3 2077 B11R0.3 CCCOCCOCCCCF 7a_100000752267_100000729493 [0,1,0,0,0,0|2,0,0]=3 2078 B11R0.3 CCCOCCOCCCCF 7a_100011995726_100011215938 [0,1,0,0,0,0|2,0,0]=3 2079 B11R0.3 CCCOCCOCCCCI 34a_200012148704_100011215938 [0,1,0,0,0,0|2,0,0]=3 2080 B11R0.3 CCCOCCOCCCCN 34a_100000750430_100011215938 [0,1,0,0,0,0|2,0,0]=3 2081 B11R0.3 CCCOCCOCCCCO 34a_100000752267_100011216708 [0,1,0,0,0,0|2,0,0]=3 2082 B11R0.3 CCCOCCOCCCCO 7a_100000752267_100000210776 [0,1,0,0,0,0|2,0,0]=3 2083 B11R0.3 CCCOCCOCCCNC 34a_100000213112_100011215938 [0,1,0,0,0,0|2,0,0]=3 2084 B11R0.3 CCCOCCOCCCOC 34a_100000740835_100011215938 [0,1,0,0,0,0|2,0,0]=3 2085 B11R0.3 CCCOCCOCCCOC 34a_100000752267_100000740836 [0,1,0,0,0,0|2,0,0]=3 2086 B11R0.3 CCCOCCOCCCOC 7a_100000752267_100000740836 [0,1,0,0,0,0|2,0,0]=3 2087 B11R0.3 CCCOCCOCCCSC 34a_100000690336_100011215938 [0,1,0,0,0,0|2,0,0]=3 2088 B11R0.3 CCCOCCOCCCSC 7a_100000690336_100011215938 [0,1,0,0,0,0|2,0,0]=3 2089 B11R0.3 CCCOCCOCCNCC 2230a_200011904461_100000210202 [0,1,0,0,0,0|1,0,0]=2 2090 B11R0.3 CCCOCCOCCNCC 34a_200011904461_100000210202 [0,1,0,0,0,0|1,0,0]=2 2091 B11R0.3 CCCOCCOCCNCF 34a_200011904461_100015361967 [0,1,0,0,0,0|2,0,0]=3 2092 B11R0.3 CCCOCCOCCOCC 34a_100000210136_100011215938 [0,1,0,0,0,0|0,0,0]=1 2093 B11R0.3 CCCOCCOCCOCC 34a_100000210240_100000210303 [0,1,0,0,0,0|0,0,0]=1 2094 B11R0.3 CCCOCCOCCOCC 34a_100000210258_100011211534 [0,1,0,0,0,0|0,0,0]=1 2095 B11R0.3 CCCOCCOCCOCC 34a_100000752267_100000210147 [0,1,0,0,0,0|0,0,0]=1 2096 B11R0.3 CCCOCCOCCOCC 7a_100000210136_100011215938 [0,1,0,0,0,0|0,0,0]=1 2097 B11R0.3 CCCOCCOCCOCC 7a_100000210240_100000210303 [0,1,0,0,0,0|0,0,0]=1 2098 B11R0.3 CCCOCCOCCOCC 7a_100000752267_100011215890 [0,1,0,0,0,0|0,0,0]=1 2099 B11R0.3 CCCOCCOCCSCC 34a_100000212035_100011215938 [0,1,0,0,0,0|0,1,0]=2 2100 B11R0.3 CCCOCCOCCSCC 34a_100000752267_100000757381 [0,1,0,0,0,0|0,1,0]=2 2101 B11R0.3 CCCOCCOCCSCC 7a_100000212035_100011215938 [0,1,0,0,0,0|0,1,0]=2 2102 B11R0.3 CCCOCCOCCSCC 7a_100000752267_100000757381 [0,1,0,0,0,0|0,1,0]=2 2103 B11R0.3 CCCOCCSCCCCF 62a_100000729493_100011215938 [0,1,0,0,0,0|2,1,0]=4 2104 B11R0.3 CCCOCCSCCCCF 62a_100011215938_100000729493 [0,1,0,0,0,0|2,1,0]=4 2105 B11R0.3 CCCOCCSCCCCO 62a_100000210776_100011215938 [0,1,0,0,0,0|2,1,0]=4 2106 B11R0.3 CCCOCCSCCCCO 62a_100011215938_100000210776 [0,1,0,0,0,0|2,1,0]=4 2107 B11R0.3 CCCOCCSCCCOC 62a_100000709357_100011215938 [0,1,0,0,0,0|2,1,0]=4 2108 B11R0.3 CCCOCCSCCCOC 62a_100011215938_100000709357 [0,1,0,0,0,0|2,1,0]=4 2109 B11R0.3 CCCOCCSCCOCC 62a_100000210147_100011215938 [0,1,0,0,0,0|0,1,0]=2 2110 B11R0.3 CCCOCCSCCOCC 62a_100011215938_100011215890 [0,1,0,0,0,0|0,1,0]=2 2111 B11R0.3 CCCOCCSCCSCC 62a_100000757381_100011215938 [0,1,0,0,0,0|0,2,0]=3 2112 B11R0.3 CCCOCCSCCSCC 62a_100011215938_100000757381 [0,1,0,0,0,0|0,2,0]=3 2113 B11R0.3 CCCSCCNCCOCC 2230a_100020603323_100011215890 [0,1,0,0,0,0|1,1,0]=3 2114 B11R0.3 CCCSCCNCCSCC 2230a_100020603323_100000757381 [0,1,0,0,0,0|1,2,0]=4 2115 B11R0.3 CCCSCCOCCCCF 34a_200000230433_100000729493 [0,1,0,0,0,0|2,1,0]=4 2116 B11R0.3 CCCSCCOCCCCF 7a_200000230433_100000729493 [0,1,0,0,0,0|2,1,0]=4 2117 B11R0.3 CCCSCCOCCCCO 34a_200000230433_100011216708 [0,1,0,0,0,0|2,1,0]=4 2118 B11R0.3 CCCSCCOCCCCO 7a_200000230433_100000210776 [0,1,0,0,0,0|2,1,0]=4 2119 B11R0.3 CCCSCCOCCCOC 34a_200000230433_100000740836 [0,1,0,0,0,0|2,1,0]=4 2120 B11R0.3 CCCSCCOCCCOC 7a_200000230433_100000740836 [0,1,0,0,0,0|2,1,0]=4 2121 B11R0.3 CCCSCCOCCOCC 34a_200000230433_100000210147 [0,1,0,0,0,0|0,1,0]=2 2122 B11R0.3 CCCSCCOCCOCC 62a_100000210303_100011211534 [0,1,0,0,0,0|0,1,0]=2 2123 B11R0.3 CCCSCCOCCOCC 62a_100011211534_100000210303 [0,1,0,0,0,0|0,1,0]=2 2124 B11R0.3 CCCSCCOCCOCC 7a_200000230433_100011215890 [0,1,0,0,0,0|0,1,0]=2 2125 B11R0.3 CCCSCCOCCSCC 34a_200000230433_100000757381 [0,1,0,0,0,0|0,2,0]=3 2126 B11R0.3 CCCSCCOCCSCC 7a_200000230433_100000757381 [0,1,0,0,0,0|0,2,0]=3 2127 B11R0.3 CCNCCCCCCCCO 2230a_100015525214_100000033203 [0,1,0,0,0,0|3,0,0]=4 2128 B11R0.3 CCNCCCCCCCCO 2230a_102515433106_100000210202 [0,1,0,0,0,0|3,0,0]=4 2129 B11R0.3 CCNCCCCCCCCO 34a_102515433106_100000210202 [0,1,0,0,0,0|3,0,0]=4 2130 B11R0.3 CCNCCOCCOCCO 2230a_100011998139_100000210202 [0,1,0,0,0,0|1,0,0]=2 2131 B11R0.3 CCNCCOCCOCCO 2230a_100015525214_100000032323 [0,1,0,0,0,0|1,0,0]=2 2132 B11R0.3 CCNCCOCCOCCO 34a_100011998139_100000210202 [0,1,0,0,0,0|1,0,0]=2 2133 B11R0.3 CCOCCCCCCCCBr 34a_100009813846_100000210202 [0,1,0,0,0,0|2,0,0]=3 2134 B11R0.3 CCOCCCCCCCCBr 7a_100009813846_100000210202 [0,1,0,0,0,0|2,0,0]=3 2135 B11R0.3 CCOCCCCCCCCCl 34a_100000033203_100000210202 [0,1,0,0,0,0|2,0,0]=3 2136 B11R0.3 CCOCCCCCCCCCl 7a_100000033203_100000210202 [0,1,0,0,0,0|2,0,0]=3 2137 B11R0.3 CCOCCCCCCCCN 34a_102515433106_100000210202 [0,1,0,0,0,0|2,0,0]=3 2138 B11R0.3 CCOCCCCCCCCO 34a_100121572206_100000033203 [0,1,0,0,0,0|2,0,0]=3 2139 B11R0.3 CCOCCCCCNCCN 34a_103619048469_100000210202 [0,1,0,0,0,0|2,0,0]=3 2140 B11R0.3 CCOCCCNCCCCF 2230a_100000210961_100000729493 [0,1,0,0,0,0|3,0,0]=4 2141 B11R0.3 CCOCCCNCCCCF 34a_100000210961_100000729493 [0,1,0,0,0,0|3,0,0]=4 2142 B11R0.3 CCOCCCNCCCCO 2230a_100000210961_100000210776 [0,1,0,0,0,0|3,0,0]=4 2143 B11R0.3 CCOCCCNCCCCO 2230a_100000750430_100012232248 [0,1,0,0,0,0|3,0,0]=4 2144 B11R0.3 CCOCCCNCCCCO 34a_100000210961_100011216708 [0,1,0,0,0,0|3,0,0]=4 2145 B11R0.3 CCOCCCNCCCCO 34a_100000750430_100012232248 [0,1,0,0,0,0|3,0,0]=4 2146 B11R0.3 CCOCCCNCCCOC 2230a_100000210961_100000740836 [0,1,0,0,0,0|3,0,0]=4 2147 B11R0.3 CCOCCCNCCCOC 34a_100000210961_100000740836 [0,1,0,0,0,0|3,0,0]=4 2148 B11R0.3 CCOCCCNCCCOC 34a_100150723488_100012232248 [0,1,0,0,0,0|3,0,0]=4 2149 B11R0.3 CCOCCCNCCCSC 2230a_100000749238_100012232248 [0,1,0,0,0,0|3,0,0]=4 2150 B11R0.3 CCOCCCNCCOCC 2230a_100000210961_100011215890 [0,1,0,0,0,0|1,0,0]=2 2151 B11R0.3 CCOCCCNCCOCC 2230a_102516460346_100012232248 [0,1,0,0,0,0|1,0,0]=2 2152 B11R0.3 CCOCCCNCCOCC 34a_100000210961_100000210147 [0,1,0,0,0,0|1,0,0]=2 2153 B11R0.3 CCOCCCNCCOCC 34a_102516460346_100012232248 [0,1,0,0,0,0|1,0,0]=2 2154 B11R0.3 CCOCCCNCCSCC 2230a_100000106463_100012232248 [0,1,0,0,0,0|1,1,0]=3 2155 B11R0.3 CCOCCCNCCSCC 2230a_100000210961_100000757381 [0,1,0,0,0,0|1,1,0]=3 2156 B11R0.3 CCOCCCNCCSCC 34a_100000210961_100000757381 [0,1,0,0,0,0|1,1,0]=3 2157 B11R0.3 CCOCCCOCC#CCCl 34a_200000047223_100012232248 [0,1,0,0,0,0|2,0,1]=4 2158 B11R0.3 CCOCCCOCC#CCO 34a_100000757476_200000047223 [0,1,0,0,0,0|2,0,1]=4 2159 B11R0.3 CCOCCCOCC#CCO 7a_100000757476_200000047223 [0,1,0,0,0,0|2,0,1]=4 2160 B11R0.3 CCOCCCOCCCC#N 7a_100000757476_100000687738 [0,1,0,0,0,0|2,0,1]=4 2161 B11R0.3 CCOCCCOCCCC=O 7a_100000757476_200011292268 [0,1,0,0,0,0|2,0,1]=4 2162 B11R0.3 CCOCCCOCCCCBr 34a_100011216708_100012232248 [0,1,0,0,0,0|2,0,0]=3 2163 B11R0.3 CCOCCCOCCCCCl 34a_100000210776_100012232248 [0,1,0,0,0,0|2,0,0]=3 2164 B11R0.3 CCOCCCOCCCCCl 7a_100000210776_100012232248 [0,1,0,0,0,0|2,0,0]=3 2165 B11R0.3 CCOCCCOCCCCF 34a_100000757476_100000729493 [0,1,0,0,0,0|2,0,0]=3 2166 B11R0.3 CCOCCCOCCCCF 34a_100011995726_100012232248 [0,1,0,0,0,0|2,0,0]=3 2167 B11R0.3 CCOCCCOCCCCF 7a_100000757476_100000729493 [0,1,0,0,0,0|2,0,0]=3 2168 B11R0.3 CCOCCCOCCCCF 7a_100011995726_100012232248 [0,1,0,0,0,0|2,0,0]=3 2169 B11R0.3 CCOCCCOCCCCI 34a_200012148704_100012232248 [0,1,0,0,0,0|2,0,0]=3 2170 B11R0.3 CCOCCCOCCCCN 34a_100000750430_100012232248 [0,1,0,0,0,0|2,0,0]=3 2171 B11R0.3 CCOCCCOCCCCO 34a_100000757476_100011216708 [0,1,0,0,0,0|2,0,0]=3 2172 B11R0.3 CCOCCCOCCCCO 7a_100000757476_100000210776 [0,1,0,0,0,0|2,0,0]=3 2173 B11R0.3 CCOCCCOCCCNC 34a_100000213112_100012232248 [0,1,0,0,0,0|2,0,0]=3 2174 B11R0.3 CCOCCCOCCCOC 34a_100000740835_100012232248 [0,1,0,0,0,0|2,0,0]=3 2175 B11R0.3 CCOCCCOCCCOC 34a_100000757476_100000740836 [0,1,0,0,0,0|2,0,0]=3 2176 B11R0.3 CCOCCCOCCCOC 34a_200011215475_100000210202 [0,1,0,0,0,0|2,0,0]=3 2177 B11R0.3 CCOCCCOCCCOC 7a_100000757476_100000740836 [0,1,0,0,0,0|2,0,0]=3 2178 B11R0.3 CCOCCCOCCCOC 7a_200011215475_100000210202 [0,1,0,0,0,0|2,0,0]=3 2179 B11R0.3 CCOCCCOCCCSC 34a_100000690336_100012232248 [0,1,0,0,0,0|2,0,0]=3 2180 B11R0.3 CCOCCCOCCCSC 7a_100000690336_100012232248 [0,1,0,0,0,0|2,0,0]=3 2181 B11R0.3 CCOCCCOCCOCC 34a_100000210136_100012232248 [0,1,0,0,0,0|0,0,0]=1 2182 B11R0.3 CCOCCCOCCOCC 34a_100000757476_100000210147 [0,1,0,0,0,0|0,0,0]=1 2183 B11R0.3 CCOCCCOCCOCC 7a_100000210136_100012232248 [0,1,0,0,0,0|0,0,0]=1 2184 B11R0.3 CCOCCCOCCOCC 7a_100000757476_100011215890 [0,1,0,0,0,0|0,0,0]=1 2185 B11R0.3 CCOCCCOCCSCC 34a_100000212035_100012232248 [0,1,0,0,0,0|0,1,0]=2 2186 B11R0.3 CCOCCCOCCSCC 34a_100000757476_100000757381 [0,1,0,0,0,0|0,1,0]=2 2187 B11R0.3 CCOCCCOCCSCC 7a_100000212035_100012232248 [0,1,0,0,0,0|0,1,0]=2 2188 B11R0.3 CCOCCCOCCSCC 7a_100000757476_100000757381 [0,1,0,0,0,0|0,1,0]=2 2189 B11R0.3 CCOCCCSCCCCF 62a_100000729493_100012232248 [0,1,0,0,0,0|2,1,0]=4 2190 B11R0.3 CCOCCCSCCCCF 62a_100012232248_100000729493 [0,1,0,0,0,0|2,1,0]=4 2191 B11R0.3 CCOCCCSCCCCO 62a_100000210776_100012232248 [0,1,0,0,0,0|2,1,0]=4 2192 B11R0.3 CCOCCCSCCCCO 62a_100012232248_100000210776 [0,1,0,0,0,0|2,1,0]=4 2193 B11R0.3 CCOCCCSCCCOC 62a_100000709357_100012232248 [0,1,0,0,0,0|2,1,0]=4 2194 B11R0.3 CCOCCCSCCCOC 62a_100012232248_100000709357 [0,1,0,0,0,0|2,1,0]=4 2195 B11R0.3 CCOCCCSCCOCC 62a_100000210147_100012232248 [0,1,0,0,0,0|0,1,0]=2 2196 B11R0.3 CCOCCCSCCOCC 62a_100012232248_100011215890 [0,1,0,0,0,0|0,1,0]=2 2197 B11R0.3 CCOCCCSCCSCC 62a_100000757381_100012232248 [0,1,0,0,0,0|0,2,0]=3 2198 B11R0.3 CCOCCCSCCSCC 62a_100012232248_100000757381 [0,1,0,0,0,0|0,2,0]=3 2199 B11R0.3 CCOCCNCCCCC#N 2230a_102516460346_100000211819 [0,1,0,0,0,0|2,0,1]=4 2200 B11R0.3 CCOCCNCCCCC=O 2230a_102516460346_100000139335 [0,1,0,0,0,0|2,0,1]=4 2201 B11R0.3 CCOCCNCCCCCF 2230a_102516460346_100000729378 [0,1,0,0,0,0|2,0,0]=3 2202 B11R0.3 CCOCCNCCCCCF 34a_102516460346_100000729378 [0,1,0,0,0,0|2,0,0]=3 2203 B11R0.3 CCOCCNCCCCCO 2230a_100000762737_100011215890 [0,1,0,0,0,0|2,0,0]=3 2204 B11R0.3 CCOCCNCCCCCO 2230a_102516460346_100000746330 [0,1,0,0,0,0|2,0,0]=3 2205 B11R0.3 CCOCCNCCCCCO 34a_100000762737_100000210147 [0,1,0,0,0,0|2,0,0]=3 2206 B11R0.3 CCOCCNCCCCCO 34a_102516460346_100000746330 [0,1,0,0,0,0|2,0,0]=3 2207 B11R0.3 CCOCCNCCCCOC 2230a_102516460346_100000730899 [0,1,0,0,0,0|2,0,0]=3 2208 B11R0.3 CCOCCNCCCCOC 34a_102516460346_100000755781 [0,1,0,0,0,0|2,0,0]=3 2209 B11R0.3 CCOCCNCCOCC#N 2230a_102516460346_200000047693 [0,1,0,0,0,0|1,0,1]=3 2210 B11R0.3 CCOCCNCCOCCO 2230a_100000211614_100011215890 [0,1,0,0,0,0|1,0,0]=2 2211 B11R0.3 CCOCCNCCOCCO 2230a_102516460346_100011215305 [0,1,0,0,0,0|1,0,0]=2 2212 B11R0.3 CCOCCNCCOCCO 34a_100000211614_100000210147 [0,1,0,0,0,0|1,0,0]=2 2213 B11R0.3 CCOCCNCCOCCO 34a_102516460346_100000692535 [0,1,0,0,0,0|1,0,0]=2 2214 B11R0.3 CCOCCNCCSCCO 2230a_100011219999_100011215890 [0,1,0,0,0,0|1,1,0]=3 2215 B11R0.3 CCOCCNCOCCOC 2230a_102516460346_100000231047 [0,1,0,0,0,0|3,0,0]=4 2216 B11R0.3 CCOCCOCCCCC#N 7a_100000210136_100000211819 [0,1,0,0,0,0|1,0,1]=3 2217 B11R0.3 CCOCCOCCCCC=O 7a_100000210136_100000139335 [0,1,0,0,0,0|1,0,1]=3 2218 B11R0.3 CCOCCOCCCCCBr 34a_100000746331_100000210147 [0,1,0,0,0,0|1,0,0]=2 2219 B11R0.3 CCOCCOCCCCCBr 7a_100000746331_100011215890 [0,1,0,0,0,0|1,0,0]=2 2220 B11R0.3 CCOCCOCCCCCCl 34a_100000746330_100000210147 [0,1,0,0,0,0|1,0,0]=2 2221 B11R0.3 CCOCCOCCCCCCl 7a_100000746330_100011215890 [0,1,0,0,0,0|1,0,0]=2 2222 B11R0.3 CCOCCOCCCCCF 34a_100000210136_100000729378 [0,1,0,0,0,0|1,0,0]=2 2223 B11R0.3 CCOCCOCCCCCF 7a_100000210136_100000729378 [0,1,0,0,0,0|1,0,0]=2 2224 B11R0.3 CCOCCOCCCCCI 34a_200012148887_100000210147 [0,1,0,0,0,0|1,0,0]=2 2225 B11R0.3 CCOCCOCCCCCI 7a_200012148887_100011215890 [0,1,0,0,0,0|1,0,0]=2 2226 B11R0.3 CCOCCOCCCCCN 34a_100000762737_100000210147 [0,1,0,0,0,0|1,0,0]=2 2227 B11R0.3 CCOCCOCCCCCO 34a_100000210136_100000746330 [0,1,0,0,0,0|1,0,0]=2 2228 B11R0.3 CCOCCOCCCCCO 7a_100000210136_100000746330 [0,1,0,0,0,0|1,0,0]=2 2229 B11R0.3 CCOCCOCCCCOC 34a_100000210136_100000755781 [0,1,0,0,0,0|1,0,0]=2 2230 B11R0.3 CCOCCOCCCCOC 34a_100000740925_100000210147 [0,1,0,0,0,0|1,0,0]=2 2231 B11R0.3 CCOCCOCCCCOC 7a_100000210136_100000730899 [0,1,0,0,0,0|1,0,0]=2 2232 B11R0.3 CCOCCOCCCCSC 34a_100011217163_100000210147 [0,1,0,0,0,0|1,0,0]=2 2233 B11R0.3 CCOCCOCCCCSC 7a_100011217163_100011215890 [0,1,0,0,0,0|1,0,0]=2 2234 B11R0.3 CCOCCOCCCSCC 34a_100011216438_100000210147 [0,1,0,0,0,0|0,1,0]=2 2235 B11R0.3 CCOCCOCCCSCC 7a_100011216438_100011215890 [0,1,0,0,0,0|0,1,0]=2 2236 B11R0.3 CCOCCOCCNCC#N 2230a_100102712874_100011215382 [0,1,0,0,0,0|1,0,1]=3 2237 B11R0.3 CCOCCOCCNCC=O 2230a_100102712874_200015260668 [0,1,0,0,0,0|1,0,1]=3 2238 B11R0.3 CCOCCOCCNCC=O 34a_100102712874_200009817547 [0,1,0,0,0,0|1,0,1]=3 2239 B11R0.3 CCOCCOCCNCCF 2230a_100102712874_100011217306 [0,1,0,0,0,0|1,0,0]=2 2240 B11R0.3 CCOCCOCCNCCF 34a_100000724931_100011211534 [0,1,0,0,0,0|1,0,0]=2 2241 B11R0.3 CCOCCOCCNCCF 34a_100102712874_100011217306 [0,1,0,0,0,0|1,0,0]=2 2242 B11R0.3 CCOCCOCCNCCO 2230a_100016997473_100011211534 [0,1,0,0,0,0|1,0,0]=2 2243 B11R0.3 CCOCCOCCNCCO 2230a_100102712874_100000211926 [0,1,0,0,0,0|1,0,0]=2 2244 B11R0.3 CCOCCOCCNCCO 34a_100016990907_100011211534 [0,1,0,0,0,0|1,0,0]=2 2245 B11R0.3 CCOCCOCCNCCO 34a_100102712874_100000211926 [0,1,0,0,0,0|1,0,0]=2 2246 B11R0.3 CCOCCOCCNCOC 2230a_100102712874_100000766300 [0,1,0,0,0,0|1,0,0]=2 2247 B11R0.3 CCOCCOCCNCSC 2230a_100102712874_100011218213 [0,1,0,0,0,0|1,0,0]=2 2248 B11R0.3 CCOCCOCCNCSC 34a_100102712874_100011218213 [0,1,0,0,0,0|1,0,0]=2 2249 B11R0.3 CCOCCOCCOCC#N 7a_100000210136_200000047693 [0,1,0,0,0,0|0,0,1]=2 2250 B11R0.3 CCOCCOCCOCC#N 7a_100000210240_100011215382 [0,1,0,0,0,0|0,0,1]=2 2251 B11R0.3 CCOCCOCCOCC=O 34a_100000210240_200009817547 [0,1,0,0,0,0|0,0,1]=2 2252 B11R0.3 CCOCCOCCOCC=O 7a_100000210240_200015260668 [0,1,0,0,0,0|0,0,1]=2 2253 B11R0.3 CCOCCOCCOCCBr 34a_100000211926_100011211534 [0,1,0,0,0,0|0,0,0]=1 2254 B11R0.3 CCOCCOCCOCCBr 34a_100000692535_100000210147 [0,1,0,0,0,0|0,0,0]=1 2255 B11R0.3 CCOCCOCCOCCBr 34a_100010132937_100000210202 [0,1,0,0,0,0|0,0,0]=1 2256 B11R0.3 CCOCCOCCOCCBr 7a_100000692535_100011215890 [0,1,0,0,0,0|0,0,0]=1 2257 B11R0.3 CCOCCOCCOCCBr 7a_100010132937_100000210202 [0,1,0,0,0,0|0,0,0]=1 2258 B11R0.3 CCOCCOCCOCCCl 34a_100000032323_100000210202 [0,1,0,0,0,0|0,0,0]=1 2259 B11R0.3 CCOCCOCCOCCCl 34a_100011215305_100000210147 [0,1,0,0,0,0|0,0,0]=1 2260 B11R0.3 CCOCCOCCOCCCl 7a_100000032323_100000210202 [0,1,0,0,0,0|0,0,0]=1 2261 B11R0.3 CCOCCOCCOCCCl 7a_100011215305_100011215890 [0,1,0,0,0,0|0,0,0]=1 2262 B11R0.3 CCOCCOCCOCCF 34a_100000210240_100011217306 [0,1,0,0,0,0|0,0,0]=1 2263 B11R0.3 CCOCCOCCOCCF 34a_200015357709_100000210147 [0,1,0,0,0,0|0,0,0]=1 2264 B11R0.3 CCOCCOCCOCCF 7a_100000210240_100011217306 [0,1,0,0,0,0|0,0,0]=1 2265 B11R0.3 CCOCCOCCOCCF 7a_200015357709_100011215890 [0,1,0,0,0,0|0,0,0]=1 2266 B11R0.3 CCOCCOCCOCCI 34a_100012149058_100000210147 [0,1,0,0,0,0|0,0,0]=1 2267 B11R0.3 CCOCCOCCOCCI 7a_100012149058_100011215890 [0,1,0,0,0,0|0,0,0]=1 2268 B11R0.3 CCOCCOCCOCCN 34a_100000210304_100011211534 [0,1,0,0,0,0|0,0,0]=1 2269 B11R0.3 CCOCCOCCOCCN 34a_100000211614_100000210147 [0,1,0,0,0,0|0,0,0]=1 2270 B11R0.3 CCOCCOCCOCCN 34a_100011998139_100000210202 [0,1,0,0,0,0|0,0,0]=1 2271 B11R0.3 CCOCCOCCOCCO 34a_100000210136_100000692535 [0,1,0,0,0,0|0,0,0]=1 2272 B11R0.3 CCOCCOCCOCCO 34a_100000210240_100000211926 [0,1,0,0,0,0|0,0,0]=1 2273 B11R0.3 CCOCCOCCOCCO 34a_100121572206_100000032323 [0,1,0,0,0,0|0,0,0]=1 2274 B11R0.3 CCOCCOCCOCCO 7a_100000210136_100011215305 [0,1,0,0,0,0|0,0,0]=1 2275 B11R0.3 CCOCCOCCOCCO 7a_100000210240_100000211926 [0,1,0,0,0,0|0,0,0]=1 2276 B11R0.3 CCOCCOCCOCSC 34a_100000210240_100011218213 [0,1,0,0,0,0|0,0,0]=1 2277 B11R0.3 CCOCCOCCSCC#N 62a_100011211534_100011215382 [0,1,0,0,0,0|0,1,1]=3 2278 B11R0.3 CCOCCOCCSCC#N 62a_100011215382_100011211534 [0,1,0,0,0,0|0,1,1]=3 2279 B11R0.3 CCOCCOCCSCC=O 62a_100011211534_200015260668 [0,1,0,0,0,0|0,1,1]=3 2280 B11R0.3 CCOCCOCCSCC=O 62a_200015260668_100011211534 [0,1,0,0,0,0|0,1,1]=3 2281 B11R0.3 CCOCCOCCSCCF 62a_100011211534_100011217306 [0,1,0,0,0,0|0,1,0]=2 2282 B11R0.3 CCOCCOCCSCCF 62a_100011217306_100011211534 [0,1,0,0,0,0|0,1,0]=2 2283 B11R0.3 CCOCCOCCSCCO 62a_100000211926_100011211534 [0,1,0,0,0,0|0,1,0]=2 2284 B11R0.3 CCOCCOCCSCCO 62a_100011211534_100000211926 [0,1,0,0,0,0|0,1,0]=2 2285 B11R0.3 CCOCCOCCSCOC 62a_100000766300_100011211534 [0,1,0,0,0,0|0,1,0]=2 2286 B11R0.3 CCOCCOCCSCOC 62a_100011211534_100000766300 [0,1,0,0,0,0|0,1,0]=2 2287 B11R0.3 CCOCCOCCSCSC 62a_100011211534_100011218213 [0,1,0,0,0,0|0,1,0]=2 2288 B11R0.3 CCOCCOCCSCSC 62a_100011218213_100011211534 [0,1,0,0,0,0|0,1,0]=2 2289 B11R0.3 CCOCCSCCCCC#N 62a_100000210147_100000211819 [0,1,0,0,0,0|1,1,1]=4 2290 B11R0.3 CCOCCSCCCCC#N 62a_100011219923_100011215890 [0,1,0,0,0,0|1,1,1]=4 2291 B11R0.3 CCOCCSCCCCC=O 62a_100000139335_100011215890 [0,1,0,0,0,0|1,1,1]=4 2292 B11R0.3 CCOCCSCCCCC=O 62a_100000210147_100000139335 [0,1,0,0,0,0|1,1,1]=4 2293 B11R0.3 CCOCCSCCCCCF 62a_100000210147_100000729378 [0,1,0,0,0,0|1,1,0]=3 2294 B11R0.3 CCOCCSCCCCCF 62a_100000729378_100011215890 [0,1,0,0,0,0|1,1,0]=3 2295 B11R0.3 CCOCCSCCCCCO 62a_100000210147_100000746330 [0,1,0,0,0,0|1,1,0]=3 2296 B11R0.3 CCOCCSCCCCCO 62a_100000746330_100011215890 [0,1,0,0,0,0|1,1,0]=3 2297 B11R0.3 CCOCCSCCCCOC 62a_100000210147_100000730899 [0,1,0,0,0,0|1,1,0]=3 2298 B11R0.3 CCOCCSCCCCOC 62a_100000730899_100011215890 [0,1,0,0,0,0|1,1,0]=3 2299 B11R0.3 CCOCCSCCOCC#N 62a_100000210147_200000047693 [0,1,0,0,0,0|0,1,1]=3 2300 B11R0.3 CCOCCSCCOCC#N 62a_200000047693_100011215890 [0,1,0,0,0,0|0,1,1]=3 2301 B11R0.3 CCOCCSCCOCCO 62a_100000210147_100011215305 [0,1,0,0,0,0|0,1,0]=2 2302 B11R0.3 CCOCCSCCOCCO 62a_100011215305_100011215890 [0,1,0,0,0,0|0,1,0]=2 2303 B11R0.3 CCOCCSCOCCOC 62a_100000210147_100000231047 [0,1,0,0,0,0|2,1,0]=4 2304 B11R0.3 CCOCCSCOCCOC 62a_100000231047_100011215890 [0,1,0,0,0,0|2,1,0]=4 2305 B11R0.3 CCOCSCCCCCCF 62a_100000739092_100015922095 [0,1,0,0,0,0|3,0,0]=4 2306 B11R0.3 CCOCSCCCCCCF 62a_100015922095_100000739092 [0,1,0,0,0,0|3,0,0]=4 2307 B11R0.3 CCOCSCCCCCCO 62a_100000739092_100000766143 [0,1,0,0,0,0|3,0,0]=4 2308 B11R0.3 CCOCSCCCCCCO 62a_100000766143_100000739092 [0,1,0,0,0,0|3,0,0]=4 2309 B11R0.3 CCSCCCCCCCCO 62a_100000033203_100000210202 [0,1,0,0,0,0|2,1,0]=4 2310 B11R0.3 CCSCCCCCCCCO 62a_100000210202_100000033203 [0,1,0,0,0,0|2,1,0]=4 2311 B11R0.3 CCSCCCOCCCCF 34a_100011216438_100000729493 [0,1,0,0,0,0|2,1,0]=4 2312 B11R0.3 CCSCCCOCCCCF 7a_100011216438_100000729493 [0,1,0,0,0,0|2,1,0]=4 2313 B11R0.3 CCSCCCOCCCCO 34a_100011216438_100011216708 [0,1,0,0,0,0|2,1,0]=4 2314 B11R0.3 CCSCCCOCCCCO 7a_100011216438_100000210776 [0,1,0,0,0,0|2,1,0]=4 2315 B11R0.3 CCSCCCOCCCOC 34a_100011216438_100000740836 [0,1,0,0,0,0|2,1,0]=4 2316 B11R0.3 CCSCCCOCCCOC 7a_100011216438_100000740836 [0,1,0,0,0,0|2,1,0]=4 2317 B11R0.3 CCSCCCOCCSCC 34a_100011216438_100000757381 [0,1,0,0,0,0|0,2,0]=3 2318 B11R0.3 CCSCCCOCCSCC 7a_100011216438_100000757381 [0,1,0,0,0,0|0,2,0]=3 2319 B11R0.3 CCSCCNCCCCCF 2230a_100000106463_100000729378 [0,1,0,0,0,0|2,1,0]=4 2320 B11R0.3 CCSCCNCCCCCO 2230a_100000106463_100000746330 [0,1,0,0,0,0|2,1,0]=4 2321 B11R0.3 CCSCCNCCCCCO 2230a_100000762737_100000757381 [0,1,0,0,0,0|2,1,0]=4 2322 B11R0.3 CCSCCNCCCCCO 34a_100000762737_100000757381 [0,1,0,0,0,0|2,1,0]=4 2323 B11R0.3 CCSCCNCCCCOC 2230a_100000106463_100000730899 [0,1,0,0,0,0|2,1,0]=4 2324 B11R0.3 CCSCCNCCOCC#N 2230a_100000106463_200000047693 [0,1,0,0,0,0|1,1,1]=4 2325 B11R0.3 CCSCCNCCOCCO 2230a_100000106463_100011215305 [0,1,0,0,0,0|1,1,0]=3 2326 B11R0.3 CCSCCNCCOCCO 2230a_100000211614_100000757381 [0,1,0,0,0,0|1,1,0]=3 2327 B11R0.3 CCSCCNCCOCCO 34a_100000211614_100000757381 [0,1,0,0,0,0|1,1,0]=3 2328 B11R0.3 CCSCCNCCSCCO 2230a_100011219999_100000757381 [0,1,0,0,0,0|1,2,0]=4 2329 B11R0.3 CCSCCOCCCCC#N 7a_100000212035_100000211819 [0,1,0,0,0,0|1,1,1]=4 2330 B11R0.3 CCSCCOCCCCC=O 7a_100000212035_100000139335 [0,1,0,0,0,0|1,1,1]=4 2331 B11R0.3 CCSCCOCCCCCBr 34a_100000746331_100000757381 [0,1,0,0,0,0|1,1,0]=3 2332 B11R0.3 CCSCCOCCCCCBr 7a_100000746331_100000757381 [0,1,0,0,0,0|1,1,0]=3 2333 B11R0.3 CCSCCOCCCCCCl 34a_100000746330_100000757381 [0,1,0,0,0,0|1,1,0]=3 2334 B11R0.3 CCSCCOCCCCCCl 7a_100000746330_100000757381 [0,1,0,0,0,0|1,1,0]=3 2335 B11R0.3 CCSCCOCCCCCF 34a_100000212035_100000729378 [0,1,0,0,0,0|1,1,0]=3 2336 B11R0.3 CCSCCOCCCCCF 7a_100000212035_100000729378 [0,1,0,0,0,0|1,1,0]=3 2337 B11R0.3 CCSCCOCCCCCI 34a_200012148887_100000757381 [0,1,0,0,0,0|1,1,0]=3 2338 B11R0.3 CCSCCOCCCCCI 7a_200012148887_100000757381 [0,1,0,0,0,0|1,1,0]=3 2339 B11R0.3 CCSCCOCCCCCN 34a_100000762737_100000757381 [0,1,0,0,0,0|1,1,0]=3 2340 B11R0.3 CCSCCOCCCCCO 34a_100000212035_100000746330 [0,1,0,0,0,0|1,1,0]=3 2341 B11R0.3 CCSCCOCCCCCO 7a_100000212035_100000746330 [0,1,0,0,0,0|1,1,0]=3 2342 B11R0.3 CCSCCOCCCCOC 34a_100000212035_100000755781 [0,1,0,0,0,0|1,1,0]=3 2343 B11R0.3 CCSCCOCCCCOC 34a_100000740925_100000757381 [0,1,0,0,0,0|1,1,0]=3 2344 B11R0.3 CCSCCOCCCCOC 7a_100000212035_100000730899 [0,1,0,0,0,0|1,1,0]=3 2345 B11R0.3 CCSCCOCCCCSC 34a_100011217163_100000757381 [0,1,0,0,0,0|1,1,0]=3 2346 B11R0.3 CCSCCOCCCCSC 7a_100011217163_100000757381 [0,1,0,0,0,0|1,1,0]=3 2347 B11R0.3 CCSCCOCCOCC#N 7a_100000212035_200000047693 [0,1,0,0,0,0|0,1,1]=3 2348 B11R0.3 CCSCCOCCOCCBr 34a_100000692535_100000757381 [0,1,0,0,0,0|0,1,0]=2 2349 B11R0.3 CCSCCOCCOCCBr 7a_100000692535_100000757381 [0,1,0,0,0,0|0,1,0]=2 2350 B11R0.3 CCSCCOCCOCCCl 34a_100011215305_100000757381 [0,1,0,0,0,0|0,1,0]=2 2351 B11R0.3 CCSCCOCCOCCCl 7a_100011215305_100000757381 [0,1,0,0,0,0|0,1,0]=2 2352 B11R0.3 CCSCCOCCOCCF 34a_200015357709_100000757381 [0,1,0,0,0,0|0,1,0]=2 2353 B11R0.3 CCSCCOCCOCCF 7a_200015357709_100000757381 [0,1,0,0,0,0|0,1,0]=2 2354 B11R0.3 CCSCCOCCOCCI 34a_100012149058_100000757381 [0,1,0,0,0,0|0,1,0]=2 2355 B11R0.3 CCSCCOCCOCCI 7a_100012149058_100000757381 [0,1,0,0,0,0|0,1,0]=2 2356 B11R0.3 CCSCCOCCOCCN 34a_100000211614_100000757381 [0,1,0,0,0,0|0,1,0]=2 2357 B11R0.3 CCSCCOCCOCCO 34a_100000212035_100000692535 [0,1,0,0,0,0|0,1,0]=2 2358 B11R0.3 CCSCCOCCOCCO 62a_100000032323_100000210202 [0,1,0,0,0,0|0,1,0]=2 2359 B11R0.3 CCSCCOCCOCCO 62a_100000210202_100000032323 [0,1,0,0,0,0|0,1,0]=2 2360 B11R0.3 CCSCCOCCOCCO 7a_100000212035_100011215305 [0,1,0,0,0,0|0,1,0]=2 2361 B11R0.3 CCSCCSCCCCCF 62a_100000729378_100000757381 [0,1,0,0,0,0|1,2,0]=4 2362 B11R0.3 CCSCCSCCCCCF 62a_100000757381_100000729378 [0,1,0,0,0,0|1,2,0]=4 2363 B11R0.3 CCSCCSCCCCCO 62a_100000746330_100000757381 [0,1,0,0,0,0|1,2,0]=4 2364 B11R0.3 CCSCCSCCCCCO 62a_100000757381_100000746330 [0,1,0,0,0,0|1,2,0]=4 2365 B11R0.3 CCSCCSCCCCOC 62a_100000730899_100000757381 [0,1,0,0,0,0|1,2,0]=4 2366 B11R0.3 CCSCCSCCCCOC 62a_100000757381_100000730899 [0,1,0,0,0,0|1,2,0]=4 2367 B11R0.3 CCSCCSCCOCC#N 62a_100000757381_200000047693 [0,1,0,0,0,0|0,2,1]=4 2368 B11R0.3 CCSCCSCCOCC#N 62a_200000047693_100000757381 [0,1,0,0,0,0|0,2,1]=4 2369 B11R0.3 CCSCCSCCOCCO 62a_100000757381_100011215305 [0,1,0,0,0,0|0,2,0]=3 2370 B11R0.3 CCSCCSCCOCCO 62a_100011215305_100000757381 [0,1,0,0,0,0|0,2,0]=3 2371 B11R0.3 CNCCCOCCCCCF 34a_100000213112_100000729378 [0,1,0,0,0,0|3,0,0]=4 2372 B11R0.3 CNCCCOCCCCCO 34a_100000213112_100000746330 [0,1,0,0,0,0|3,0,0]=4 2373 B11R0.3 CNCCCOCCCCOC 34a_100000213112_100000755781 [0,1,0,0,0,0|3,0,0]=4 2374 B11R0.3 CNCCCOCCOCCO 2230a_100011996194_200000210301 [0,1,0,0,0,0|2,0,0]=3 2375 B11R0.3 CNCCCOCCOCCO 34a_100000213112_100000692535 [0,1,0,0,0,0|2,0,0]=3 2376 B11R0.3 CNCCCOCCOCCO 34a_100011996194_200000210301 [0,1,0,0,0,0|2,0,0]=3 2377 B11R0.3 COCCCCCCOCCBr 34a_100000211926_100011998445 [0,1,0,0,0,0|3,0,0]=4 2378 B11R0.3 COCCCCCCOCCF 34a_200012092642_100011217306 [0,1,0,0,0,0|3,0,0]=4 2379 B11R0.3 COCCCCCCOCCF 7a_200012092642_100011217306 [0,1,0,0,0,0|3,0,0]=4 2380 B11R0.3 COCCCCCCOCCN 34a_100000210304_100011998445 [0,1,0,0,0,0|3,0,0]=4 2381 B11R0.3 COCCCCCCOCCO 34a_200012092642_100000211926 [0,1,0,0,0,0|3,0,0]=4 2382 B11R0.3 COCCCCCCOCCO 7a_200012092642_100000211926 [0,1,0,0,0,0|3,0,0]=4 2383 B11R0.3 COCCCCCCOCSC 34a_200012092642_100011218213 [0,1,0,0,0,0|3,0,0]=4 2384 B11R0.3 COCCCCOCCCCBr 34a_100011216708_100000755781 [0,1,0,0,0,0|3,0,0]=4 2385 B11R0.3 COCCCCOCCCCCl 34a_100000210776_100000755781 [0,1,0,0,0,0|3,0,0]=4 2386 B11R0.3 COCCCCOCCCCCl 7a_100000210776_100000730899 [0,1,0,0,0,0|3,0,0]=4 2387 B11R0.3 COCCCCOCCCCF 34a_100000740925_100000729493 [0,1,0,0,0,0|3,0,0]=4 2388 B11R0.3 COCCCCOCCCCF 34a_100011995726_100000755781 [0,1,0,0,0,0|3,0,0]=4 2389 B11R0.3 COCCCCOCCCCF 7a_100011995726_100000730899 [0,1,0,0,0,0|3,0,0]=4 2390 B11R0.3 COCCCCOCCCCI 34a_200012148704_100000755781 [0,1,0,0,0,0|3,0,0]=4 2391 B11R0.3 COCCCCOCCCCN 34a_100000750430_100000755781 [0,1,0,0,0,0|3,0,0]=4 2392 B11R0.3 COCCCCOCCCCO 34a_100000740925_100011216708 [0,1,0,0,0,0|3,0,0]=4 2393 B11R0.3 COCCCCOCCCOC 34a_100000740835_100000755781 [0,1,0,0,0,0|3,0,0]=4 2394 B11R0.3 COCCCCOCCCOC 34a_100000740925_100000740836 [0,1,0,0,0,0|3,0,0]=4 2395 B11R0.3 COCCCCOCCCSC 34a_100000690336_100000755781 [0,1,0,0,0,0|3,0,0]=4 2396 B11R0.3 COCCCCOCCCSC 7a_100000690336_100000730899 [0,1,0,0,0,0|3,0,0]=4 2397 B11R0.3 COCCCNCCOCCO 2230a_100000211614_100000740836 [0,1,0,0,0,0|3,0,0]=4 2398 B11R0.3 COCCCNCCOCCO 34a_100000211614_100000740836 [0,1,0,0,0,0|3,0,0]=4 2399 B11R0.3 COCCCNCCOCCO 34a_100150723488_100000692535 [0,1,0,0,0,0|3,0,0]=4 2400 B11R0.3 COCCCOCCCCCBr 34a_100000746331_100000740836 [0,1,0,0,0,0|3,0,0]=4 2401 B11R0.3 COCCCOCCCCCBr 7a_100000746331_100000740836 [0,1,0,0,0,0|3,0,0]=4 2402 B11R0.3 COCCCOCCCCCCl 34a_100000746330_100000740836 [0,1,0,0,0,0|3,0,0]=4 2403 B11R0.3 COCCCOCCCCCCl 7a_100000746330_100000740836 [0,1,0,0,0,0|3,0,0]=4 2404 B11R0.3 COCCCOCCCCCF 34a_100000740835_100000729378 [0,1,0,0,0,0|3,0,0]=4 2405 B11R0.3 COCCCOCCCCCI 34a_200012148887_100000740836 [0,1,0,0,0,0|3,0,0]=4 2406 B11R0.3 COCCCOCCCCCI 7a_200012148887_100000740836 [0,1,0,0,0,0|3,0,0]=4 2407 B11R0.3 COCCCOCCCCCN 34a_100000762737_100000740836 [0,1,0,0,0,0|3,0,0]=4 2408 B11R0.3 COCCCOCCCCCO 34a_100000740835_100000746330 [0,1,0,0,0,0|3,0,0]=4 2409 B11R0.3 COCCCOCCCCSC 34a_100011217163_100000740836 [0,1,0,0,0,0|3,0,0]=4 2410 B11R0.3 COCCCOCCCCSC 7a_100011217163_100000740836 [0,1,0,0,0,0|3,0,0]=4 2411 B11R0.3 COCCCOCCCOCF 34a_200011215475_100015361967 [0,1,0,0,0,0|3,0,0]=4 2412 B11R0.3 COCCCOCCCOCF 7a_200011215475_100015361967 [0,1,0,0,0,0|3,0,0]=4 2413 B11R0.3 COCCCOCCOCCBr 34a_100000692535_100000740836 [0,1,0,0,0,0|2,0,0]=3 2414 B11R0.3 COCCCOCCOCCBr 7a_100000692535_100000740836 [0,1,0,0,0,0|2,0,0]=3 2415 B11R0.3 COCCCOCCOCCCl 34a_100011215305_100000740836 [0,1,0,0,0,0|2,0,0]=3 2416 B11R0.3 COCCCOCCOCCCl 7a_100011215305_100000740836 [0,1,0,0,0,0|2,0,0]=3 2417 B11R0.3 COCCCOCCOCCF 34a_200015357709_100000740836 [0,1,0,0,0,0|2,0,0]=3 2418 B11R0.3 COCCCOCCOCCF 7a_200015357709_100000740836 [0,1,0,0,0,0|2,0,0]=3 2419 B11R0.3 COCCCOCCOCCI 34a_100012149058_100000740836 [0,1,0,0,0,0|2,0,0]=3 2420 B11R0.3 COCCCOCCOCCI 7a_100012149058_100000740836 [0,1,0,0,0,0|2,0,0]=3 2421 B11R0.3 COCCCOCCOCCN 34a_100000211614_100000740836 [0,1,0,0,0,0|2,0,0]=3 2422 B11R0.3 COCCCOCCOCCO 34a_100000740835_100000692535 [0,1,0,0,0,0|2,0,0]=3 2423 B11R0.3 COCCCSCCOCCO 62a_100000709357_100011215305 [0,1,0,0,0,0|2,1,0]=4 2424 B11R0.3 COCCCSCCOCCO 62a_100011215305_100000709357 [0,1,0,0,0,0|2,1,0]=4 2425 B11R0.3 CSCCCCOCCCCF 34a_100011217163_100000729493 [0,1,0,0,0,0|3,0,0]=4 2426 B11R0.3 CSCCCCOCCCCF 7a_100011217163_100000729493 [0,1,0,0,0,0|3,0,0]=4 2427 B11R0.3 CSCCCCOCCCCO 34a_100011217163_100011216708 [0,1,0,0,0,0|3,0,0]=4 2428 B11R0.3 CSCCCCOCCCCO 7a_100011217163_100000210776 [0,1,0,0,0,0|3,0,0]=4 2429 B11R0.3 CSCCCNCCOCCO 2230a_100000749238_100011215305 [0,1,0,0,0,0|3,0,0]=4 2430 B11R0.3 CSCCCOCCCCCF 34a_100000690336_100000729378 [0,1,0,0,0,0|3,0,0]=4 2431 B11R0.3 CSCCCOCCCCCF 7a_100000690336_100000729378 [0,1,0,0,0,0|3,0,0]=4 2432 B11R0.3 CSCCCOCCCCCO 34a_100000690336_100000746330 [0,1,0,0,0,0|3,0,0]=4 2433 B11R0.3 CSCCCOCCCCCO 7a_100000690336_100000746330 [0,1,0,0,0,0|3,0,0]=4 2434 B11R0.3 CSCCCOCCOCC#N 7a_100000690336_200000047693 [0,1,0,0,0,0|2,0,1]=4 2435 B11R0.3 CSCCCOCCOCCO 34a_100000690336_100000692535 [0,1,0,0,0,0|2,0,0]=3 2436 B11R0.3 CSCCCOCCOCCO 7a_100000690336_100011215305 [0,1,0,0,0,0|2,0,0]=3 2437 B11R0.3 CSCOCCCCCCCBr 34a_100000760002_100011218213 [0,1,0,0,0,0|3,0,0]=4 2438 B11R0.3 CSCOCCCCCCCN 34a_100011996573_100011218213 [0,1,0,0,0,0|3,0,0]=4 2439 B11R0.3 FCCCCCOCCCCBr 34a_100011216708_100000729378 [0,1,0,0,0,0|3,0,0]=4 2440 B11R0.3 FCCCCCOCCCCCl 34a_100000210776_100000729378 [0,1,0,0,0,0|3,0,0]=4 2441 B11R0.3 FCCCCCOCCCCCl 7a_100000210776_100000729378 [0,1,0,0,0,0|3,0,0]=4 2442 B11R0.3 FCCCCCOCCCCF 34a_100011995726_100000729378 [0,1,0,0,0,0|3,0,0]=4 2443 B11R0.3 FCCCCCOCCCCF 7a_100011995726_100000729378 [0,1,0,0,0,0|3,0,0]=4 2444 B11R0.3 FCCCCCOCCCCI 34a_200012148704_100000729378 [0,1,0,0,0,0|3,0,0]=4 2445 B11R0.3 FCCCCOCCCCCBr 34a_100000746331_100000729493 [0,1,0,0,0,0|3,0,0]=4 2446 B11R0.3 FCCCCOCCCCCBr 7a_100000746331_100000729493 [0,1,0,0,0,0|3,0,0]=4 2447 B11R0.3 FCCCCOCCCCCCl 34a_100000746330_100000729493 [0,1,0,0,0,0|3,0,0]=4 2448 B11R0.3 FCCCCOCCCCCCl 7a_100000746330_100000729493 [0,1,0,0,0,0|3,0,0]=4 2449 B11R0.3 FCCCCOCCCCCI 34a_200012148887_100000729493 [0,1,0,0,0,0|3,0,0]=4 2450 B11R0.3 FCCCCOCCCCCI 7a_200012148887_100000729493 [0,1,0,0,0,0|3,0,0]=4 2451 B11R0.3 FCCCCOCCOCCBr 34a_100000692535_100000729493 [0,1,0,0,0,0|2,0,0]=3 2452 B11R0.3 FCCCCOCCOCCBr 7a_100000692535_100000729493 [0,1,0,0,0,0|2,0,0]=3 2453 B11R0.3 FCCCCOCCOCCCl 34a_100011215305_100000729493 [0,1,0,0,0,0|2,0,0]=3 2454 B11R0.3 FCCCCOCCOCCCl 7a_100011215305_100000729493 [0,1,0,0,0,0|2,0,0]=3 2455 B11R0.3 FCCCCOCCOCCF 34a_200015357709_100000729493 [0,1,0,0,0,0|2,0,0]=3 2456 B11R0.3 FCCCCOCCOCCF 7a_200015357709_100000729493 [0,1,0,0,0,0|2,0,0]=3 2457 B11R0.3 FCCCCOCCOCCI 34a_100012149058_100000729493 [0,1,0,0,0,0|2,0,0]=3 2458 B11R0.3 FCCCCOCCOCCI 7a_100012149058_100000729493 [0,1,0,0,0,0|2,0,0]=3 2459 B11R0.3 FCCOCCCCCCCBr 34a_100000760002_100011217306 [0,1,0,0,0,0|3,0,0]=4 2460 B11R0.3 FCCOCCCCCCCBr 7a_100000760002_100011217306 [0,1,0,0,0,0|3,0,0]=4 2461 B11R0.3 FCOCCCCCCCCBr 34a_100009813846_100015361967 [0,1,0,0,0,0|3,0,0]=4 2462 B11R0.3 FCOCCCCCCCCBr 7a_100009813846_100015361967 [0,1,0,0,0,0|3,0,0]=4 2463 B11R0.3 FCOCCCCCCCCCl 34a_100000033203_100015361967 [0,1,0,0,0,0|3,0,0]=4 2464 B11R0.3 FCOCCCCCCCCCl 7a_100000033203_100015361967 [0,1,0,0,0,0|3,0,0]=4 2465 B11R0.3 FCOCCOCCOCCBr 34a_100010132937_100015361967 [0,1,0,0,0,0|1,0,0]=2 2466 B11R0.3 FCOCCOCCOCCBr 7a_100010132937_100015361967 [0,1,0,0,0,0|1,0,0]=2 2467 B11R0.3 FCOCCOCCOCCCl 34a_100000032323_100015361967 [0,1,0,0,0,0|1,0,0]=2 2468 B11R0.3 FCOCCOCCOCCCl 7a_100000032323_100015361967 [0,1,0,0,0,0|1,0,0]=2 2469 B11R0.3 N#CCCCOCCOCCBr 7a_100000692535_100000687738 [0,1,0,0,0,0|2,0,1]=4 2470 B11R0.3 N#CCCCOCCOCCCl 7a_100011215305_100000687738 [0,1,0,0,0,0|2,0,1]=4 2471 B11R0.3 N#CCCCOCCOCCF 7a_200015357709_100000687738 [0,1,0,0,0,0|2,0,1]=4 2472 B11R0.3 N#CCCCOCCOCCI 7a_100012149058_100000687738 [0,1,0,0,0,0|2,0,1]=4 2473 B11R0.3 N#CCOCCOCCCCCl 7a_100000210776_200000047693 [0,1,0,0,0,0|2,0,1]=4 2474 B11R0.3 N#CCOCCOCCCCF 7a_100011995726_200000047693 [0,1,0,0,0,0|2,0,1]=4 2475 B11R0.3 NCCCCCCCCOCF 34a_102515433106_100015361967 [0,1,0,0,0,0|3,0,0]=4 2476 B11R0.3 NCCCCCCCOCCF 34a_100011996573_100011217306 [0,1,0,0,0,0|3,0,0]=4 2477 B11R0.3 NCCCCCCCOCCO 34a_100011996573_100000211926 [0,1,0,0,0,0|3,0,0]=4 2478 B11R0.3 NCCCCCOCCCCF 34a_100000762737_100000729493 [0,1,0,0,0,0|3,0,0]=4 2479 B11R0.3 NCCCCCOCCCCO 34a_100000762737_100011216708 [0,1,0,0,0,0|3,0,0]=4 2480 B11R0.3 NCCCCOCCCCCF 34a_100000750430_100000729378 [0,1,0,0,0,0|3,0,0]=4 2481 B11R0.3 NCCCCOCCCCCO 34a_100000750430_100000746330 [0,1,0,0,0,0|3,0,0]=4 2482 B11R0.3 NCCCCOCCOCCO 34a_100000750430_100000692535 [0,1,0,0,0,0|2,0,0]=3 2483 B11R0.3 NCCNCCCCCOCF 34a_103619048469_100015361967 [0,1,0,0,0,0|3,0,0]=4 2484 B11R0.3 NCCOCCCCCCCO 34a_100000210304_100000760002 [0,1,0,0,0,0|3,0,0]=4 2485 B11R0.3 NCCOCCOCC#CCO 34a_100000211614_200000047223 [0,1,0,0,0,0|2,0,1]=4 2486 B11R0.3 NCCOCCOCCCCF 34a_100000211614_100000729493 [0,1,0,0,0,0|2,0,0]=3 2487 B11R0.3 NCCOCCOCCCCO 34a_100000211614_100011216708 [0,1,0,0,0,0|2,0,0]=3 2488 B11R0.3 NCCOCCOCCOCF 34a_100011998139_100015361967 [0,1,0,0,0,0|1,0,0]=2 2489 B11R0.3 O=CCCCOCCOCCBr 7a_100000692535_200011292268 [0,1,0,0,0,0|2,0,1]=4 2490 B11R0.3 O=CCCCOCCOCCCl 7a_100011215305_200011292268 [0,1,0,0,0,0|2,0,1]=4 2491 B11R0.3 O=CCCCOCCOCCF 7a_200015357709_200011292268 [0,1,0,0,0,0|2,0,1]=4 2492 B11R0.3 O=CCCCOCCOCCI 7a_100012149058_200011292268 [0,1,0,0,0,0|2,0,1]=4 2493 B11R0.3 OCC#CCOCCOCCBr 34a_100000692535_200000047223 [0,1,0,0,0,0|2,0,1]=4 2494 B11R0.3 OCC#CCOCCOCCBr 7a_100000692535_200000047223 [0,1,0,0,0,0|2,0,1]=4 2495 B11R0.3 OCC#CCOCCOCCCl 34a_100011215305_200000047223 [0,1,0,0,0,0|2,0,1]=4 2496 B11R0.3 OCC#CCOCCOCCCl 7a_100011215305_200000047223 [0,1,0,0,0,0|2,0,1]=4 2497 B11R0.3 OCC#CCOCCOCCF 34a_200015357709_200000047223 [0,1,0,0,0,0|2,0,1]=4 2498 B11R0.3 OCC#CCOCCOCCF 7a_200015357709_200000047223 [0,1,0,0,0,0|2,0,1]=4 2499 B11R0.3 OCC#CCOCCOCCI 34a_100012149058_200000047223 [0,1,0,0,0,0|2,0,1]=4 2500 B11R0.3 OCC#CCOCCOCCI 7a_100012149058_200000047223 [0,1,0,0,0,0|2,0,1]=4 2501 B11R0.3 OCCCCCCCOCCBr 34a_100000211926_100000760002 [0,1,0,0,0,0|3,0,0]=4 2502 B11R0.3 OCCCCCOCCCCBr 34a_100011216708_100000746330 [0,1,0,0,0,0|3,0,0]=4 2503 B11R0.3 OCCCCCOCCCCCl 34a_100000210776_100000746330 [0,1,0,0,0,0|3,0,0]=4 2504 B11R0.3 OCCCCCOCCCCCl 7a_100000210776_100000746330 [0,1,0,0,0,0|3,0,0]=4 2505 B11R0.3 OCCCCCOCCCCF 34a_100011995726_100000746330 [0,1,0,0,0,0|3,0,0]=4 2506 B11R0.3 OCCCCCOCCCCF 7a_100011995726_100000746330 [0,1,0,0,0,0|3,0,0]=4 2507 B11R0.3 OCCCCCOCCCCI 34a_200012148704_100000746330 [0,1,0,0,0,0|3,0,0]=4 2508 B11R0.3 OCCCCNCCOCCO 2230a_100000211614_100000210776 [0,1,0,0,0,0|3,0,0]=4 2509 B11R0.3 OCCCCNCCOCCO 2230a_100000750430_100011215305 [0,1,0,0,0,0|3,0,0]=4 2510 B11R0.3 OCCCCNCCOCCO 34a_100000211614_100011216708 [0,1,0,0,0,0|3,0,0]=4 2511 B11R0.3 OCCCCNCCOCCO 34a_100000750430_100000692535 [0,1,0,0,0,0|3,0,0]=4 2512 B11R0.3 OCCCCOCCCCCBr 34a_100000746331_100011216708 [0,1,0,0,0,0|3,0,0]=4 2513 B11R0.3 OCCCCOCCCCCBr 7a_100000746331_100000210776 [0,1,0,0,0,0|3,0,0]=4 2514 B11R0.3 OCCCCOCCCCCCl 34a_100000746330_100011216708 [0,1,0,0,0,0|3,0,0]=4 2515 B11R0.3 OCCCCOCCCCCCl 7a_100000746330_100000210776 [0,1,0,0,0,0|3,0,0]=4 2516 B11R0.3 OCCCCOCCCCCI 34a_200012148887_100011216708 [0,1,0,0,0,0|3,0,0]=4 2517 B11R0.3 OCCCCOCCCCCI 7a_200012148887_100000210776 [0,1,0,0,0,0|3,0,0]=4 2518 B11R0.3 OCCCCOCCOCCBr 34a_100000692535_100011216708 [0,1,0,0,0,0|2,0,0]=3 2519 B11R0.3 OCCCCOCCOCCBr 7a_100000692535_100000210776 [0,1,0,0,0,0|2,0,0]=3 2520 B11R0.3 OCCCCOCCOCCCl 34a_100011215305_100011216708 [0,1,0,0,0,0|2,0,0]=3 2521 B11R0.3 OCCCCOCCOCCCl 7a_100011215305_100000210776 [0,1,0,0,0,0|2,0,0]=3 2522 B11R0.3 OCCCCOCCOCCF 34a_200015357709_100011216708 [0,1,0,0,0,0|2,0,0]=3 2523 B11R0.3 OCCCCOCCOCCF 7a_200015357709_100000210776 [0,1,0,0,0,0|2,0,0]=3 2524 B11R0.3 OCCCCOCCOCCI 34a_100012149058_100011216708 [0,1,0,0,0,0|2,0,0]=3 2525 B11R0.3 OCCCCOCCOCCI 7a_100012149058_100000210776 [0,1,0,0,0,0|2,0,0]=3 2526 B11R0.3 OCCCCSCCOCCO 62a_100000210776_100011215305 [0,1,0,0,0,0|2,1,0]=4 2527 B11R0.3 OCCCCSCCOCCO 62a_100011215305_100000210776 [0,1,0,0,0,0|2,1,0]=4 2528 B11R0.3 OCCOCCCCCCCBr 34a_100000760002_100000211926 [0,1,0,0,0,0|3,0,0]=4 2529 B11R0.3 OCCOCCCCCCCBr 7a_100000760002_100000211926 [0,1,0,0,0,0|3,0,0]=4 2530 B11R0.3 OCCOCCNCCCCF 2230a_100000211614_100000729493 [0,1,0,0,0,0|3,0,0]=4 2531 B11R0.3 OCCOCCNCCCCF 34a_100000211614_100000729493 [0,1,0,0,0,0|3,0,0]=4 2532 B11R0.3 OCCOCCOCC#CCCl 34a_200000047223_100000692535 [0,1,0,0,0,0|2,0,1]=4 2533 B11R0.3 OCCOCCOCCCCBr 34a_100011216708_100000692535 [0,1,0,0,0,0|2,0,0]=3 2534 B11R0.3 OCCOCCOCCCCCl 34a_100000210776_100000692535 [0,1,0,0,0,0|2,0,0]=3 2535 B11R0.3 OCCOCCOCCCCCl 7a_100000210776_100011215305 [0,1,0,0,0,0|2,0,0]=3 2536 B11R0.3 OCCOCCOCCCCF 34a_100011995726_100000692535 [0,1,0,0,0,0|2,0,0]=3 2537 B11R0.3 OCCOCCOCCCCF 7a_100011995726_100011215305 [0,1,0,0,0,0|2,0,0]=3 2538 B11R0.3 OCCOCCOCCCCI 34a_200012148704_100000692535 [0,1,0,0,0,0|2,0,0]=3 2539 B11R0.3 OCCOCCOCCNCF 34a_100011998139_100015361967 [0,1,0,0,0,0|2,0,0]=3 2540 B11R0.3 OCCOCCOCCSCF 62a_100000032323_100015361967 [0,1,0,0,0,0|1,1,0]=3 2541 B11R0.3 OCCOCCOCCSCF 62a_100015361967_100000032323 [0,1,0,0,0,0|1,1,0]=3 2542 B11R0.3 OCCOCCSCCCCF 62a_100000729493_100011215305 [0,1,0,0,0,0|2,1,0]=4 2543 B11R0.3 OCCOCCSCCCCF 62a_100011215305_100000729493 [0,1,0,0,0,0|2,1,0]=4 2544 B11R0.3 [13CH3]NCCCOCCOCCO 2230a_100011996194_200025704644 [0,1,0,0,0,0|2,0,0]=3 2545 B11R0.3 [13CH3]NCCCOCCOCCO 34a_100011996194_200025704644 [0,1,0,0,0,0|2,0,0]=3 2546 B11R0.4 C/C=C/CCOCC(=O)OCC 34a_100016278192_100000188475 [0,1,0,0,0,0|1,0,2]=4 2547 B11R0.4 C/C=C/CCOCC(C)CCC 34a_100016278192_100011216630 [0,1,0,0,0,0|2,0,1]=4 2548 B11R0.4 C=CCC(C)COCCOCC 34a_100009832082_100000210147 [0,1,0,0,0,0|1,0,2]=4 2549 B11R0.4 C=CCC(C)COCCOCC 7a_100009832082_100011215890 [0,1,0,0,0,0|1,0,2]=4 2550 B11R0.4 C=CC[C@@H](N)COCCOCC 34a_100020615467_100000210147 [0,1,0,0,0,0|1,0,2]=4 2551 B11R0.4 C=COC(=O)COCCOCC 34a_100000210136_100000036128 [0,1,0,0,0,0|0,0,3]=4 2552 B11R0.4 C=COCCOCC(=O)OCC 34a_100000033082_100000188475 [0,1,0,0,0,0|0,0,3]=4 2553 B11R0.4 C=COCCOCC(C)CCC 34a_100000033082_100011216630 [0,1,0,0,0,0|1,0,2]=4 2554 B11R0.4 C=COCCOCC(C)CCC 34a_100000688023_100000039644 [0,1,0,0,0,0|1,0,2]=4 2555 B11R0.4 C=COCCOCC(C)CCC 7a_100000688023_100000039644 [0,1,0,0,0,0|1,0,2]=4 2556 B11R0.4 C=COCCOC[C@@H](N)CCC 34a_100000732646_100000039644 [0,1,0,0,0,0|1,0,2]=4 2557 B11R0.4 CC#CCCOCC(=O)OCC 34a_100000750427_100000188475 [0,1,0,0,0,0|1,0,2]=4 2558 B11R0.4 CC#CCCOCC(C)CCC 34a_100000750427_100011216630 [0,1,0,0,0,0|2,0,1]=4 2559 B11R0.4 CC/C=C\COCC(=O)OCC 34a_100016268518_100000188475 [0,1,0,0,0,0|1,0,2]=4 2560 B11R0.4 CC/C=C\COCC(C)CCC 34a_100000688023_100103147603 [0,1,0,0,0,0|2,0,1]=4 2561 B11R0.4 CC/C=C\COCC(C)CCC 34a_100016268518_100011216630 [0,1,0,0,0,0|2,0,1]=4 2562 B11R0.4 CC/C=C\COCC(C)CCC 7a_100000688023_100103147603 [0,1,0,0,0,0|2,0,1]=4 2563 B11R0.4 CC/C=C\COC[C@@H](N)CCC 34a_100000732646_100103147603 [0,1,0,0,0,0|2,0,1]=4 2564 B11R0.4 CCC#CCOCC(=O)OCC 34a_100000032950_100000188475 [0,1,0,0,0,0|1,0,2]=4 2565 B11R0.4 CCC#CCOCC(C)CCC 34a_100000032950_100011216630 [0,1,0,0,0,0|2,0,1]=4 2566 B11R0.4 CCC#CCOCC(C)CCC 34a_100000688023_100009813939 [0,1,0,0,0,0|2,0,1]=4 2567 B11R0.4 CCC#CCOCC(C)CCC 7a_100000688023_100009813939 [0,1,0,0,0,0|2,0,1]=4 2568 B11R0.4 CCC#CCOC[C@@H](N)CCC 34a_100000732646_100009813939 [0,1,0,0,0,0|2,0,1]=4 2569 B11R0.4 CCCC(=O)CNCCOCC 2230a_102516460346_100000747444 [0,1,0,0,0,0|2,0,1]=4 2570 B11R0.4 CCCC(=O)COCCOCC 7a_100000210136_100000747444 [0,1,0,0,0,0|1,0,1]=3 2571 B11R0.4 CCCC(=O)COCCSCC 7a_100000212035_100000747444 [0,1,0,0,0,0|1,1,1]=4 2572 B11R0.4 CCCC(=O)CSCCOCC 62a_100000210147_100000747444 [0,1,0,0,0,0|1,1,1]=4 2573 B11R0.4 CCCC(=O)CSCCOCC 62a_100000747444_100011215890 [0,1,0,0,0,0|1,1,1]=4 2574 B11R0.4 CCCC(C)CNCCOCC 2230a_102516460346_100011216630 [0,1,0,0,0,0|2,0,0]=3 2575 B11R0.4 CCCC(C)CNCCOCC 270004a_102516460346_100000243154 [0,1,0,0,0,0|2,0,0]=3 2576 B11R0.4 CCCC(C)CNCCOCC 34a_102516460346_100011216630 [0,1,0,0,0,0|2,0,0]=3 2577 B11R0.4 CCCC(C)CNCCSCC 2230a_100000106463_100011216630 [0,1,0,0,0,0|2,1,0]=4 2578 B11R0.4 CCCC(C)CNCCSCC 270004a_100000106463_100000243154 [0,1,0,0,0,0|2,1,0]=4 2579 B11R0.4 CCCC(C)COCCCCBr 34a_100011216708_100011216630 [0,1,0,0,0,0|3,0,0]=4 2580 B11R0.4 CCCC(C)COCCCCCl 34a_100000210776_100011216630 [0,1,0,0,0,0|3,0,0]=4 2581 B11R0.4 CCCC(C)COCCCCCl 7a_100000210776_100011216630 [0,1,0,0,0,0|3,0,0]=4 2582 B11R0.4 CCCC(C)COCCCCF 34a_100000688023_100000729493 [0,1,0,0,0,0|3,0,0]=4 2583 B11R0.4 CCCC(C)COCCCCF 34a_100011995726_100011216630 [0,1,0,0,0,0|3,0,0]=4 2584 B11R0.4 CCCC(C)COCCCCF 7a_100000688023_100000729493 [0,1,0,0,0,0|3,0,0]=4 2585 B11R0.4 CCCC(C)COCCCCF 7a_100011995726_100011216630 [0,1,0,0,0,0|3,0,0]=4 2586 B11R0.4 CCCC(C)COCCCCI 34a_200012148704_100011216630 [0,1,0,0,0,0|3,0,0]=4 2587 B11R0.4 CCCC(C)COCCCCN 34a_100000750430_100011216630 [0,1,0,0,0,0|3,0,0]=4 2588 B11R0.4 CCCC(C)COCCCCO 34a_100000688023_100011216708 [0,1,0,0,0,0|3,0,0]=4 2589 B11R0.4 CCCC(C)COCCCCO 7a_100000688023_100000210776 [0,1,0,0,0,0|3,0,0]=4 2590 B11R0.4 CCCC(C)COCCCNC 34a_100000213112_100011216630 [0,1,0,0,0,0|3,0,0]=4 2591 B11R0.4 CCCC(C)COCCCOC 34a_100000688023_100000740836 [0,1,0,0,0,0|3,0,0]=4 2592 B11R0.4 CCCC(C)COCCCOC 34a_100000740835_100011216630 [0,1,0,0,0,0|3,0,0]=4 2593 B11R0.4 CCCC(C)COCCCOC 7a_100000688023_100000740836 [0,1,0,0,0,0|3,0,0]=4 2594 B11R0.4 CCCC(C)COCCCSC 34a_100000690336_100011216630 [0,1,0,0,0,0|3,0,0]=4 2595 B11R0.4 CCCC(C)COCCCSC 7a_100000690336_100011216630 [0,1,0,0,0,0|3,0,0]=4 2596 B11R0.4 CCCC(C)COCCOCC 34a_100000210136_100011216630 [0,1,0,0,0,0|1,0,0]=2 2597 B11R0.4 CCCC(C)COCCOCC 34a_100000688023_100000210147 [0,1,0,0,0,0|1,0,0]=2 2598 B11R0.4 CCCC(C)COCCOCC 7a_100000210136_100011216630 [0,1,0,0,0,0|1,0,0]=2 2599 B11R0.4 CCCC(C)COCCOCC 7a_100000688023_100011215890 [0,1,0,0,0,0|1,0,0]=2 2600 B11R0.4 CCCC(C)COCCSCC 34a_100000212035_100011216630 [0,1,0,0,0,0|1,1,0]=3 2601 B11R0.4 CCCC(C)COCCSCC 34a_100000688023_100000757381 [0,1,0,0,0,0|1,1,0]=3 2602 B11R0.4 CCCC(C)COCCSCC 7a_100000212035_100011216630 [0,1,0,0,0,0|1,1,0]=3 2603 B11R0.4 CCCC(C)COCCSCC 7a_100000688023_100000757381 [0,1,0,0,0,0|1,1,0]=3 2604 B11R0.4 CCCC(C)CSCCOCC 62a_100000210147_100011216630 [0,1,0,0,0,0|1,1,0]=3 2605 B11R0.4 CCCC(C)CSCCOCC 62a_100011216630_100011215890 [0,1,0,0,0,0|1,1,0]=3 2606 B11R0.4 CCCC(C)CSCCSCC 62a_100000757381_100011216630 [0,1,0,0,0,0|1,2,0]=4 2607 B11R0.4 CCCC(C)CSCCSCC 62a_100011216630_100000757381 [0,1,0,0,0,0|1,2,0]=4 2608 B11R0.4 CCCC(C)NCCCOCC 2230a_100000210961_100000766640 [0,1,0,0,0,0|3,0,0]=4 2609 B11R0.4 CCCC(C)NCCCOCC 2230a_100000741246_100012232248 [0,1,0,0,0,0|3,0,0]=4 2610 B11R0.4 CCCC(C)NCCCOCC 270004a_100000210961_100000211909 [0,1,0,0,0,0|3,0,0]=4 2611 B11R0.4 CCCC(C)NCCCOCC 34a_100000210961_100000766640 [0,1,0,0,0,0|3,0,0]=4 2612 B11R0.4 CCCC(C)OCCCOCC 34a_100000757476_100000766640 [0,1,0,0,0,0|3,0,0]=4 2613 B11R0.4 CCCC(C)OCCCOCC 34a_100000764384_100012232248 [0,1,0,0,0,0|3,0,0]=4 2614 B11R0.4 CCCC(C)OCCCOCC 7a_100000757476_100000766640 [0,1,0,0,0,0|3,0,0]=4 2615 B11R0.4 CCCC(C)OCCCOCC 7a_100000764384_100012232248 [0,1,0,0,0,0|3,0,0]=4 2616 B11R0.4 CCCC(C)SCCCOCC 62a_100000766640_100012232248 [0,1,0,0,0,0|3,0,0]=4 2617 B11R0.4 CCCC(C)SCCCOCC 62a_100012232248_100000766640 [0,1,0,0,0,0|3,0,0]=4 2618 B11R0.4 CCCCCCCC(C)NCC 2230a_100015525214_200011218727 [0,1,0,0,0,0|3,0,0]=4 2619 B11R0.4 CCCCCCCC(C)NCC 270004a_100015525214_100000210596 [0,1,0,0,0,0|3,0,0]=4 2620 B11R0.4 CCCCCCCC(C)OCC 34a_100121572206_200011218727 [0,1,0,0,0,0|2,0,0]=3 2621 B11R0.4 CCCCCCCC(C)OCC 34a_200011215852_100000210202 [0,1,0,0,0,0|2,0,0]=3 2622 B11R0.4 CCCCCCCC(C)OCC 7a_200011215852_100000210202 [0,1,0,0,0,0|2,0,0]=3 2623 B11R0.4 CCCCCCCC(C)OCF 34a_200011215852_100015361967 [0,1,0,0,0,0|3,0,0]=4 2624 B11R0.4 CCCCCCCC(C)OCF 7a_200011215852_100015361967 [0,1,0,0,0,0|3,0,0]=4 2625 B11R0.4 CCCCCCCC(C)SCC 62a_100000210202_200011218727 [0,1,0,0,0,0|2,1,0]=4 2626 B11R0.4 CCCCCCCC(C)SCC 62a_200011218727_100000210202 [0,1,0,0,0,0|2,1,0]=4 2627 B11R0.4 CCCCCNCC(=O)OCC 2230a_100000209983_100000188475 [0,1,0,0,0,0|2,0,1]=4 2628 B11R0.4 CCCCCNCC(C)CCC 2230a_100000209983_100011216630 [0,1,0,0,0,0|3,0,0]=4 2629 B11R0.4 CCCCCNCC(C)CCC 270004a_100000209983_100000243154 [0,1,0,0,0,0|3,0,0]=4 2630 B11R0.4 CCCCCOCC(=O)CCC 7a_100000210253_100000747444 [0,1,0,0,0,0|2,0,1]=4 2631 B11R0.4 CCCCCOCC(=O)NCC 34a_100000210253_100000183381 [0,1,0,0,0,0|2,0,1]=4 2632 B11R0.4 CCCCCOCC(=O)NCC 7a_100000210253_100000183381 [0,1,0,0,0,0|2,0,1]=4 2633 B11R0.4 CCCCCOCC(=O)OCC 34a_100000210253_100000188475 [0,1,0,0,0,0|1,0,1]=3 2634 B11R0.4 CCCCCOCC(=O)OCC 7a_100000210253_100000188475 [0,1,0,0,0,0|1,0,1]=3 2635 B11R0.4 CCCCCOCC(C)CCC 34a_100000210253_100011216630 [0,1,0,0,0,0|2,0,0]=3 2636 B11R0.4 CCCCCOCC(C)CCC 34a_100000688023_100000718602 [0,1,0,0,0,0|2,0,0]=3 2637 B11R0.4 CCCCCOCC(C)CCC 7a_100000210253_100011216630 [0,1,0,0,0,0|2,0,0]=3 2638 B11R0.4 CCCCCOCC(C)CCC 7a_100000688023_100000210326 [0,1,0,0,0,0|2,0,0]=3 2639 B11R0.4 CCCCCOCC(C)CCN 34a_106354213184_100000718602 [0,1,0,0,0,0|3,0,0]=4 2640 B11R0.4 CCCCCOCC(N)COC 34a_100000724102_100000718602 [0,1,0,0,0,0|3,0,0]=4 2641 B11R0.4 CCCCCOCC(O)COC 34a_100000210253_100011215053 [0,1,0,0,0,0|3,0,0]=4 2642 B11R0.4 CCCCCOCC(O)COC 7a_100000210253_100011215053 [0,1,0,0,0,0|3,0,0]=4 2643 B11R0.4 CCCCCOC[C@@H](N)CCC 34a_100000732646_100000718602 [0,1,0,0,0,0|2,0,0]=3 2644 B11R0.4 CCCCCSCC(=O)OCC 62a_100000188475_100000210326 [0,1,0,0,0,0|1,1,1]=4 2645 B11R0.4 CCCCCSCC(=O)OCC 62a_100000210326_100000188475 [0,1,0,0,0,0|1,1,1]=4 2646 B11R0.4 CCCCCSCC(C)CCC 62a_100000210326_100011216630 [0,1,0,0,0,0|2,1,0]=4 2647 B11R0.4 CCCCCSCC(C)CCC 62a_100011216630_100000210326 [0,1,0,0,0,0|2,1,0]=4 2648 B11R0.4 CCC[C@H](N)COCCCCF 34a_100000732646_100000729493 [0,1,0,0,0,0|3,0,0]=4 2649 B11R0.4 CCC[C@H](N)COCCCCO 34a_100000732646_100011216708 [0,1,0,0,0,0|3,0,0]=4 2650 B11R0.4 CCC[C@H](N)COCCCOC 34a_100000732646_100000740836 [0,1,0,0,0,0|3,0,0]=4 2651 B11R0.4 CCC[C@H](N)COCCOCC 34a_100000732646_100000210147 [0,1,0,0,0,0|1,0,0]=2 2652 B11R0.4 CCC[C@H](N)COCCSCC 34a_100000732646_100000757381 [0,1,0,0,0,0|1,1,0]=3 2653 B11R0.4 CCNC(=O)CNCCOCC 2230a_100016988866_100011215890 [0,1,0,0,0,0|2,0,1]=4 2654 B11R0.4 CCNC(=O)CNCCOCC 2230a_102516460346_100000183381 [0,1,0,0,0,0|2,0,1]=4 2655 B11R0.4 CCNC(=O)CNCCOCC 34a_102516460346_100000183381 [0,1,0,0,0,0|2,0,1]=4 2656 B11R0.4 CCNC(=O)COCCOCC 34a_100000210136_100000183381 [0,1,0,0,0,0|1,0,1]=3 2657 B11R0.4 CCNC(=O)COCCOCC 7a_100000210136_100000183381 [0,1,0,0,0,0|1,0,1]=3 2658 B11R0.4 CCNC(=O)COCCSCC 34a_100000212035_100000183381 [0,1,0,0,0,0|1,1,1]=4 2659 B11R0.4 CCNC(=O)COCCSCC 7a_100000212035_100000183381 [0,1,0,0,0,0|1,1,1]=4 2660 B11R0.4 CCNC(=O)CSCCOCC 62a_100000183381_100011215890 [0,1,0,0,0,0|1,1,1]=4 2661 B11R0.4 CCNC(=O)CSCCOCC 62a_100000210147_100000183381 [0,1,0,0,0,0|1,1,1]=4 2662 B11R0.4 CCNCCCCC(=O)OCC 2230a_100015525214_100000750268 [0,1,0,0,0,0|2,0,1]=4 2663 B11R0.4 CCNCCOCC(=O)OCC 2230a_100015525214_100000088970 [0,1,0,0,0,0|1,0,1]=3 2664 B11R0.4 CCOC(=O)CCCCSCC 62a_100000210202_100000750268 [0,1,0,0,0,0|1,1,1]=4 2665 B11R0.4 CCOC(=O)CCCCSCC 62a_100000750268_100000210202 [0,1,0,0,0,0|1,1,1]=4 2666 B11R0.4 CCOC(=O)CNCCSCC 2230a_100000106463_100000188475 [0,1,0,0,0,0|1,1,1]=4 2667 B11R0.4 CCOC(=O)COCCCCBr 34a_100011216708_100000188475 [0,1,0,0,0,0|2,0,1]=4 2668 B11R0.4 CCOC(=O)COCCCCCl 34a_100000210776_100000188475 [0,1,0,0,0,0|2,0,1]=4 2669 B11R0.4 CCOC(=O)COCCCCCl 7a_100000210776_100000188475 [0,1,0,0,0,0|2,0,1]=4 2670 B11R0.4 CCOC(=O)COCCCCF 34a_100011995726_100000188475 [0,1,0,0,0,0|2,0,1]=4 2671 B11R0.4 CCOC(=O)COCCCCF 7a_100011995726_100000188475 [0,1,0,0,0,0|2,0,1]=4 2672 B11R0.4 CCOC(=O)COCCCCI 34a_200012148704_100000188475 [0,1,0,0,0,0|2,0,1]=4 2673 B11R0.4 CCOC(=O)COCCCCN 34a_100000750430_100000188475 [0,1,0,0,0,0|2,0,1]=4 2674 B11R0.4 CCOC(=O)COCCCNC 2230a_106832991635_100009893628 [0,1,0,0,0,0|2,0,1]=4 2675 B11R0.4 CCOC(=O)COCCCNC 34a_100000213112_100000188475 [0,1,0,0,0,0|2,0,1]=4 2676 B11R0.4 CCOC(=O)COCCCNC 34a_100102657272_100009893628 [0,1,0,0,0,0|2,0,1]=4 2677 B11R0.4 CCOC(=O)COCCCNC 7a_106832991635_100009893628 [0,1,0,0,0,0|2,0,1]=4 2678 B11R0.4 CCOC(=O)COCCCOC 34a_100000740835_100000188475 [0,1,0,0,0,0|2,0,1]=4 2679 B11R0.4 CCOC(=O)COCCCOC 34a_100138415774_100009893628 [0,1,0,0,0,0|2,0,1]=4 2680 B11R0.4 CCOC(=O)COCCCSC 34a_100000690336_100000188475 [0,1,0,0,0,0|2,0,1]=4 2681 B11R0.4 CCOC(=O)COCCCSC 62a_100009893628_200000210301 [0,1,0,0,0,0|2,0,1]=4 2682 B11R0.4 CCOC(=O)COCCCSC 62a_200000210301_100009893628 [0,1,0,0,0,0|2,0,1]=4 2683 B11R0.4 CCOC(=O)COCCCSC 7a_100000690336_100000188475 [0,1,0,0,0,0|2,0,1]=4 2684 B11R0.4 CCOC(=O)COCCCS[13CH3] 62a_100009893628_200025704644 [0,1,0,0,0,0|2,0,1]=4 2685 B11R0.4 CCOC(=O)COCCCS[13CH3] 62a_200025704644_100009893628 [0,1,0,0,0,0|2,0,1]=4 2686 B11R0.4 CCOC(=O)COCCSCC 34a_100000212035_100000188475 [0,1,0,0,0,0|0,1,1]=3 2687 B11R0.4 CCOC(=O)COCCSCC 62a_100000088970_100000210202 [0,1,0,0,0,0|0,1,1]=3 2688 B11R0.4 CCOC(=O)COCCSCC 62a_100000210202_100000088970 [0,1,0,0,0,0|0,1,1]=3 2689 B11R0.4 CCOC(=O)COCCSCC 7a_100000212035_100000188475 [0,1,0,0,0,0|0,1,1]=3 2690 B11R0.4 CCOC(=O)COCCSCF 62a_100000088970_100015361967 [0,1,0,0,0,0|1,1,1]=4 2691 B11R0.4 CCOC(=O)COCCSCF 62a_100015361967_100000088970 [0,1,0,0,0,0|1,1,1]=4 2692 B11R0.4 CCOC(=O)CSCCOCF 7a_200000230590_100015361967 [0,1,0,0,0,0|1,1,1]=4 2693 B11R0.4 CCOC(=O)CSCCSCC 62a_100000188475_100000757381 [0,1,0,0,0,0|0,2,1]=4 2694 B11R0.4 CCOC(=O)CSCCSCC 62a_100000757381_100000188475 [0,1,0,0,0,0|0,2,1]=4 2695 B11R0.4 CCOCCCCC(=O)OCC 34a_100121572206_100000750268 [0,1,0,0,0,0|1,0,1]=3 2696 B11R0.4 CCOCCNCC(=O)OCC 2230a_102516460346_100000188475 [0,1,0,0,0,0|1,0,1]=3 2697 B11R0.4 CCOCCNCC(=O)OCC 34a_102516460346_100000188475 [0,1,0,0,0,0|1,0,1]=3 2698 B11R0.4 CCOCCNCC(O)COC 2230a_100000756049_100011215890 [0,1,0,0,0,0|3,0,0]=4 2699 B11R0.4 CCOCCNCC(O)COC 34a_100000756049_100000210147 [0,1,0,0,0,0|3,0,0]=4 2700 B11R0.4 CCOCCNCC(O)COC 34a_102516460346_100011215053 [0,1,0,0,0,0|3,0,0]=4 2701 B11R0.4 CCOCCOCC(=O)NCO 34a_100000210136_100000185155 [0,1,0,0,0,0|2,0,1]=4 2702 B11R0.4 CCOCCOCC(=O)NCO 7a_100000210136_100000185155 [0,1,0,0,0,0|2,0,1]=4 2703 B11R0.4 CCOCCOCC(=O)OCC 34a_100000210136_100000188475 [0,1,0,0,0,0|0,0,1]=2 2704 B11R0.4 CCOCCOCC(=O)OCC 34a_100121572206_100000088970 [0,1,0,0,0,0|0,0,1]=2 2705 B11R0.4 CCOCCOCC(=O)OCC 7a_100000210136_100000188475 [0,1,0,0,0,0|0,0,1]=2 2706 B11R0.4 CCOCCOCC(C)CCN 34a_106354213184_100000210147 [0,1,0,0,0,0|2,0,0]=3 2707 B11R0.4 CCOCCOCC(N)COC 34a_100000724102_100000210147 [0,1,0,0,0,0|2,0,0]=3 2708 B11R0.4 CCOCCOCC(O)COC 34a_100000210136_100011215053 [0,1,0,0,0,0|2,0,0]=3 2709 B11R0.4 CCOCCOCC(O)COC 7a_100000210136_100011215053 [0,1,0,0,0,0|2,0,0]=3 2710 B11R0.4 CCOCCOC[C@@H](O)CC#N 7a_100000210136_100000001066 [0,1,0,0,0,0|2,0,1]=4 2711 B11R0.4 CCOCCSCC(=O)OCC 62a_100000188475_100011215890 [0,1,0,0,0,0|0,1,1]=3 2712 B11R0.4 CCOCCSCC(=O)OCC 62a_100000210147_100000188475 [0,1,0,0,0,0|0,1,1]=3 2713 B11R0.4 CCOCCSCC(=O)OCC 7a_200000230590_100000210202 [0,1,0,0,0,0|0,1,1]=3 2714 B11R0.4 CCOCCSCC(O)COC 62a_100000210147_100011215053 [0,1,0,0,0,0|2,1,0]=4 2715 B11R0.4 CCOCCSCC(O)COC 62a_100011215053_100011215890 [0,1,0,0,0,0|2,1,0]=4 2716 B11R0.4 CCOCSCCC(=O)OCC 62a_100000739092_100000765890 [0,1,0,0,0,0|2,0,1]=4 2717 B11R0.4 CCOCSCCC(=O)OCC 62a_100000765890_100000739092 [0,1,0,0,0,0|2,0,1]=4 2718 B11R0.4 CCSCCOCC(C)CCN 34a_106354213184_100000757381 [0,1,0,0,0,0|2,1,0]=4 2719 B11R0.4 CCSCCOCC(N)COC 34a_100000724102_100000757381 [0,1,0,0,0,0|2,1,0]=4 2720 B11R0.4 CCSCCOCC(O)COC 34a_100000212035_100011215053 [0,1,0,0,0,0|2,1,0]=4 2721 B11R0.4 CCSCCOCC(O)COC 7a_100000212035_100011215053 [0,1,0,0,0,0|2,1,0]=4 2722 B11R0.40 C#CC(=O)CCOCCOCC 1458a_100000211873_100011211534 [0,1,0,0,0,0|1,0,2]=4 2723 B11R0.40 C=CC(=O)CCOCCOCC 1458a_100000185746_100011211534 [0,1,0,0,0,0|1,0,2]=4 2724 B11R0.40 C=COCCOCCC(C)CC 7a_100011215188_100000039644 [0,1,0,0,0,0|1,0,2]=4 2725 B11R0.40 CC/C=C\COCCC(C)CC 7a_100011215188_100103147603 [0,1,0,0,0,0|2,0,1]=4 2726 B11R0.40 CCC#CCOCCC(C)CC 7a_100011215188_100009813939 [0,1,0,0,0,0|2,0,1]=4 2727 B11R0.40 CCC(C)CCCCCOCF 7a_200000035636_100015361967 [0,1,0,0,0,0|3,0,0]=4 2728 B11R0.40 CCC(C)CCOCCCCF 7a_100011215188_100000729493 [0,1,0,0,0,0|3,0,0]=4 2729 B11R0.40 CCC(C)CCOCCCCO 7a_100011215188_100000210776 [0,1,0,0,0,0|3,0,0]=4 2730 B11R0.40 CCC(C)CCOCCCOC 7a_100011215188_100000740836 [0,1,0,0,0,0|3,0,0]=4 2731 B11R0.40 CCCCCCCCC(=O)CC 1458a_100000210188_100000210202 [0,1,0,0,0,0|3,0,0]=4 2732 B11R0.40 CCCCCCCCC(=O)CC 1458a_100000210414_100000210759 [0,1,0,0,0,0|3,0,0]=4 2733 B11R0.40 CCCCCCCCN(C)CC 2230a_100000207567_100000210202 [0,1,0,0,0,0|3,0,0]=4 2734 B11R0.40 CCCCCCCCN(C)CC 2230a_100000225621_100000210759 [0,1,0,0,0,0|3,0,0]=4 2735 B11R0.40 CCCCCCCCN(C)CC 269982a_100000207567_100000204670 [0,1,0,0,0,0|3,0,0]=4 2736 B11R0.40 CCCCCCCCN(C)CC 269982a_100000225621_100000210759 [0,1,0,0,0,0|3,0,0]=4 2737 B11R0.40 CCCCCNCCC(C)CC 2230a_100020591266_100000210326 [0,1,0,0,0,0|3,0,0]=4 2738 B11R0.40 CCCCCOCCC(=O)NC 34a_100000210253_100012179268 [0,1,0,0,0,0|3,0,0]=4 2739 B11R0.40 CCCCCOCCC(=O)NC 34a_100000754576_100000718602 [0,1,0,0,0,0|3,0,0]=4 2740 B11R0.40 CCCCCOCCC(=O)NC 7a_100000210253_100000737683 [0,1,0,0,0,0|3,0,0]=4 2741 B11R0.40 CCCCCOCCC(=O)OC 34a_100000210253_100000742370 [0,1,0,0,0,0|3,0,0]=4 2742 B11R0.40 CCCCCOCCC(=O)OC 7a_100000210253_100000204255 [0,1,0,0,0,0|3,0,0]=4 2743 B11R0.40 CCCCCOCCC(C)CC 7a_100011215188_100000210326 [0,1,0,0,0,0|2,0,0]=3 2744 B11R0.40 CCCCCOCCC(C)OC 7a_100000764861_100000210326 [0,1,0,0,0,0|3,0,0]=4 2745 B11R0.40 CCOCCCCCC(=O)OC 34a_100000074720_100000210202 [0,1,0,0,0,0|3,0,0]=4 2746 B11R0.40 CCOCCCCCC(=O)OC 34a_100121572206_100009816466 [0,1,0,0,0,0|3,0,0]=4 2747 B11R0.40 CCOCCCCCC(=O)OC 7a_100000074720_100000210202 [0,1,0,0,0,0|3,0,0]=4 2748 B11R0.40 CCOCCCCCC(C)CC 7a_200000035636_100000210202 [0,1,0,0,0,0|2,0,0]=3 2749 B11R0.40 CCOCCCNCC(C)CC 2230a_100000210961_100000748023 [0,1,0,0,0,0|3,0,0]=4 2750 B11R0.40 CCOCCCNCC(C)CC 2230a_100020588543_100012232248 [0,1,0,0,0,0|3,0,0]=4 2751 B11R0.40 CCOCCCNCC(C)CC 270004a_100000210961_100000243153 [0,1,0,0,0,0|3,0,0]=4 2752 B11R0.40 CCOCCCNCC(C)CC 34a_100000210961_100000748023 [0,1,0,0,0,0|3,0,0]=4 2753 B11R0.40 CCOCCCNCC(O)CC 2230a_100000210961_100011218378 [0,1,0,0,0,0|3,0,0]=4 2754 B11R0.40 CCOCCCNCC(O)CC 2230a_100011218483_100012232248 [0,1,0,0,0,0|3,0,0]=4 2755 B11R0.40 CCOCCCNCC(O)CC 34a_100000210961_100011218378 [0,1,0,0,0,0|3,0,0]=4 2756 B11R0.40 CCOCCCNC[C@@H](C)CC 2230a_100000210961_100009816398 [0,1,0,0,0,0|3,0,0]=4 2757 B11R0.40 CCOCCCNC[C@@H](C)CC 34a_100000210961_100009816398 [0,1,0,0,0,0|3,0,0]=4 2758 B11R0.40 CCOCCCOCC(=O)CC 34a_100000725409_100012232248 [0,1,0,0,0,0|3,0,0]=4 2759 B11R0.40 CCOCCCOCC(=O)CC 7a_100000757476_100000747405 [0,1,0,0,0,0|3,0,0]=4 2760 B11R0.40 CCOCCCOCC(C)CC 34a_100000757476_100000748023 [0,1,0,0,0,0|3,0,0]=4 2761 B11R0.40 CCOCCCOCC(C)CC 7a_100000757476_100000748023 [0,1,0,0,0,0|3,0,0]=4 2762 B11R0.40 CCOCCCOCC(O)CC 34a_100000757476_100011218378 [0,1,0,0,0,0|3,0,0]=4 2763 B11R0.40 CCOCCCOCC(O)CC 7a_100000757476_100011218378 [0,1,0,0,0,0|3,0,0]=4 2764 B11R0.40 CCOCCCOC[C@@H](C)CC 34a_100000757476_100009816398 [0,1,0,0,0,0|3,0,0]=4 2765 B11R0.40 CCOCCCOC[C@@H](C)CC 7a_100000757476_100009816398 [0,1,0,0,0,0|3,0,0]=4 2766 B11R0.40 CCOCCCOC[C@@H](C)CC 7a_100009816381_100012232248 [0,1,0,0,0,0|3,0,0]=4 2767 B11R0.40 CCOCCCSCC(=O)CC 62a_100000747405_100012232248 [0,1,0,0,0,0|3,0,0]=4 2768 B11R0.40 CCOCCCSCC(=O)CC 62a_100012232248_100000747405 [0,1,0,0,0,0|3,0,0]=4 2769 B11R0.40 CCOCCCSCC(C)CC 62a_100000748023_100012232248 [0,1,0,0,0,0|3,0,0]=4 2770 B11R0.40 CCOCCCSCC(C)CC 62a_100012232248_100000748023 [0,1,0,0,0,0|3,0,0]=4 2771 B11R0.40 CCOCCCSCC(O)CC 62a_100011218378_100012232248 [0,1,0,0,0,0|3,0,0]=4 2772 B11R0.40 CCOCCCSCC(O)CC 62a_100012232248_100011218378 [0,1,0,0,0,0|3,0,0]=4 2773 B11R0.40 CCOCCCSC[C@@H](C)CC 62a_100009816398_100012232248 [0,1,0,0,0,0|3,0,0]=4 2774 B11R0.40 CCOCCCSC[C@@H](C)CC 62a_100012232248_100009816398 [0,1,0,0,0,0|3,0,0]=4 2775 B11R0.40 CCOCCNCCC(=O)NC 2230a_100000738227_100011215890 [0,1,0,0,0,0|3,0,0]=4 2776 B11R0.40 CCOCCNCCC(=O)NC 2230a_102516460346_100000737683 [0,1,0,0,0,0|3,0,0]=4 2777 B11R0.40 CCOCCNCCC(=O)NC 34a_100000738227_100000210147 [0,1,0,0,0,0|3,0,0]=4 2778 B11R0.40 CCOCCNCCC(=O)NC 34a_102516460346_100012179268 [0,1,0,0,0,0|3,0,0]=4 2779 B11R0.40 CCOCCNCCC(=O)OC 2230a_102516460346_100000204255 [0,1,0,0,0,0|3,0,0]=4 2780 B11R0.40 CCOCCNCCC(=O)OC 34a_102516460346_100000742370 [0,1,0,0,0,0|3,0,0]=4 2781 B11R0.40 CCOCCNCCC(C)CC 2230a_100020591266_100011215890 [0,1,0,0,0,0|2,0,0]=3 2782 B11R0.40 CCOCCNCCC(C)CO 2230a_106354213184_100011215890 [0,1,0,0,0,0|3,0,0]=4 2783 B11R0.40 CCOCCNCCC(C)CO 34a_106354213184_100000210147 [0,1,0,0,0,0|3,0,0]=4 2784 B11R0.40 CCOCCOCCC(=NO)N 34a_100000749954_100000210147 [0,1,0,0,0,0|3,0,0]=4 2785 B11R0.40 CCOCCOCCC(=O)CC 1458a_100000210414_100011211534 [0,1,0,0,0,0|1,0,0]=2 2786 B11R0.40 CCOCCOCCC(=O)CO 1458a_100000210174_100011211534 [0,1,0,0,0,0|2,0,0]=3 2787 B11R0.40 CCOCCOCCC(=O)NC 34a_100000210136_100012179268 [0,1,0,0,0,0|2,0,0]=3 2788 B11R0.40 CCOCCOCCC(=O)NC 34a_100000754576_100000210147 [0,1,0,0,0,0|2,0,0]=3 2789 B11R0.40 CCOCCOCCC(=O)NC 7a_100000210136_100000737683 [0,1,0,0,0,0|2,0,0]=3 2790 B11R0.40 CCOCCOCCC(=O)OC 34a_100000210136_100000742370 [0,1,0,0,0,0|2,0,0]=3 2791 B11R0.40 CCOCCOCCC(=O)OC 7a_100000210136_100000204255 [0,1,0,0,0,0|2,0,0]=3 2792 B11R0.40 CCOCCOCCC(C)CC 7a_100011215188_100011215890 [0,1,0,0,0,0|1,0,0]=2 2793 B11R0.40 CCOCCOCCC(C)OC 7a_100000764861_100011215890 [0,1,0,0,0,0|2,0,0]=3 2794 B11R0.40 CCOCCOCCN(C)CC 2230a_100000225621_100011211534 [0,1,0,0,0,0|1,0,0]=2 2795 B11R0.40 CCOCCOCCN(C)CC 269982a_100000225621_100011211534 [0,1,0,0,0,0|1,0,0]=2 2796 B11R0.40 CCOCCSCCC(=O)NC 62a_100000210147_100000737683 [0,1,0,0,0,0|2,1,0]=4 2797 B11R0.40 CCOCCSCCC(=O)NC 62a_100000737683_100011215890 [0,1,0,0,0,0|2,1,0]=4 2798 B11R0.40 CCOCCSCCC(=O)OC 62a_100000204255_100011215890 [0,1,0,0,0,0|2,1,0]=4 2799 B11R0.40 CCOCCSCCC(=O)OC 62a_100000210147_100000204255 [0,1,0,0,0,0|2,1,0]=4 2800 B11R0.40 CCOCSCCCN(C)CC 62a_100000739092_100015186262 [0,1,0,0,0,0|3,0,0]=4 2801 B11R0.40 CCSCCNCCC(C)CC 2230a_100020591266_100000757381 [0,1,0,0,0,0|2,1,0]=4 2802 B11R0.40 CCSCCOCCC(=O)NC 34a_100000212035_100012179268 [0,1,0,0,0,0|2,1,0]=4 2803 B11R0.40 CCSCCOCCC(=O)NC 34a_100000754576_100000757381 [0,1,0,0,0,0|2,1,0]=4 2804 B11R0.40 CCSCCOCCC(=O)NC 7a_100000212035_100000737683 [0,1,0,0,0,0|2,1,0]=4 2805 B11R0.40 CCSCCOCCC(=O)OC 34a_100000212035_100000742370 [0,1,0,0,0,0|2,1,0]=4 2806 B11R0.40 CCSCCOCCC(=O)OC 7a_100000212035_100000204255 [0,1,0,0,0,0|2,1,0]=4 2807 B11R0.40 CCSCCOCCC(C)CC 7a_100011215188_100000757381 [0,1,0,0,0,0|1,1,0]=3 2808 B11R0.40 CCSCCOCCC(C)OC 7a_100000764861_100000757381 [0,1,0,0,0,0|2,1,0]=4 2809 B11R0.81 C#CCCCOC(C)COCC 34a_100000718985_100000695029 [0,1,0,0,0,0|1,0,2]=4 2810 B11R0.81 C#CCCCOC(C)COCC 7a_100000718985_100011215417 [0,1,0,0,0,0|1,0,2]=4 2811 B11R0.81 C/C=C/CCOC(C)CCCC 34a_100016278192_200011215066 [0,1,0,0,0,0|2,0,1]=4 2812 B11R0.81 C=CCCC(C)OCCOCC 34a_100000765329_100000210147 [0,1,0,0,0,0|1,0,2]=4 2813 B11R0.81 C=CCCC(C)OCCOCC 7a_100000765329_100011215890 [0,1,0,0,0,0|1,0,2]=4 2814 B11R0.81 C=CCCCOC(C)COCC 34a_100000718985_100000757094 [0,1,0,0,0,0|1,0,2]=4 2815 B11R0.81 C=CCCCOC(C)COCC 7a_100000718985_100000757094 [0,1,0,0,0,0|1,0,2]=4 2816 B11R0.81 C=COCCOC(C)CCCC 34a_100000033082_200011215066 [0,1,0,0,0,0|1,0,2]=4 2817 B11R0.81 C=COCCOC(C)CCCC 34a_100000687866_100000039644 [0,1,0,0,0,0|1,0,2]=4 2818 B11R0.81 C=COCCOC(C)CCCC 7a_100000687866_100000039644 [0,1,0,0,0,0|1,0,2]=4 2819 B11R0.81 C=COCCOC(C)COCC 34a_100000718985_100000039644 [0,1,0,0,0,0|0,0,2]=3 2820 B11R0.81 C=COCCOC(C)COCC 7a_100000718985_100000039644 [0,1,0,0,0,0|0,0,2]=3 2821 B11R0.81 CC#CCCOC(C)CCCC 34a_100000750427_200011215066 [0,1,0,0,0,0|2,0,1]=4 2822 B11R0.81 CC/C=C\COC(C)CCCC 34a_100000687866_100103147603 [0,1,0,0,0,0|2,0,1]=4 2823 B11R0.81 CC/C=C\COC(C)CCCC 34a_100016268518_200011215066 [0,1,0,0,0,0|2,0,1]=4 2824 B11R0.81 CC/C=C\COC(C)CCCC 7a_100000687866_100103147603 [0,1,0,0,0,0|2,0,1]=4 2825 B11R0.81 CC/C=C\COC(C)COCC 34a_100000718985_100103147603 [0,1,0,0,0,0|1,0,1]=3 2826 B11R0.81 CC/C=C\COC(C)COCC 7a_100000718985_100103147603 [0,1,0,0,0,0|1,0,1]=3 2827 B11R0.81 CCC#CC(C)OCCCCC 34a_100000033903_100000718602 [0,1,0,0,0,0|2,0,1]=4 2828 B11R0.81 CCC#CC(C)OCCCCC 7a_100000033903_100000210326 [0,1,0,0,0,0|2,0,1]=4 2829 B11R0.81 CCC#CC(C)OCCOCC 34a_100000033903_100000210147 [0,1,0,0,0,0|1,0,1]=3 2830 B11R0.81 CCC#CC(C)OCCOCC 7a_100000033903_100011215890 [0,1,0,0,0,0|1,0,1]=3 2831 B11R0.81 CCC#CC(C)OCCSCC 34a_100000033903_100000757381 [0,1,0,0,0,0|1,1,1]=4 2832 B11R0.81 CCC#CC(C)OCCSCC 7a_100000033903_100000757381 [0,1,0,0,0,0|1,1,1]=4 2833 B11R0.81 CCC#CCOC(C)CCCC 34a_100000032950_200011215066 [0,1,0,0,0,0|2,0,1]=4 2834 B11R0.81 CCC#CCOC(C)CCCC 34a_100000687866_100009813939 [0,1,0,0,0,0|2,0,1]=4 2835 B11R0.81 CCC#CCOC(C)CCCC 7a_100000687866_100009813939 [0,1,0,0,0,0|2,0,1]=4 2836 B11R0.81 CCC#CCOC(C)COCC 34a_100000718985_100009813939 [0,1,0,0,0,0|1,0,1]=3 2837 B11R0.81 CCC#CCOC(C)COCC 7a_100000718985_100009813939 [0,1,0,0,0,0|1,0,1]=3 2838 B11R0.81 CCCCC(=O)CCCOCC 1458a_100000210183_100012232248 [0,1,0,0,0,0|2,0,1]=4 2839 B11R0.81 CCCCC(=O)NCCOCC 11a_100011200944_100000210183 [0,1,0,0,0,0|2,0,1]=4 2840 B11R0.81 CCCCC(=O)NCCOCC 1626a_102516460346_100000210183 [0,1,0,0,0,0|2,0,1]=4 2841 B11R0.81 CCCCC(=O)NCCOCC 240690a_100011200944_100000210183 [0,1,0,0,0,0|2,0,1]=4 2842 B11R0.81 CCCCC(=O)NCCOCC 527a_100011200944_100000210183 [0,1,0,0,0,0|2,0,1]=4 2843 B11R0.81 CCCCC(C)NCCOCC 2230a_100000126638_100011215890 [0,1,0,0,0,0|2,0,0]=3 2844 B11R0.81 CCCCC(C)NCCOCC 2230a_102516460346_200011215066 [0,1,0,0,0,0|2,0,0]=3 2845 B11R0.81 CCCCC(C)NCCOCC 270004a_102516460346_100000210087 [0,1,0,0,0,0|2,0,0]=3 2846 B11R0.81 CCCCC(C)NCCOCC 34a_102516460346_200011215066 [0,1,0,0,0,0|2,0,0]=3 2847 B11R0.81 CCCCC(C)NCCSCC 2230a_100000106463_200011215066 [0,1,0,0,0,0|2,1,0]=4 2848 B11R0.81 CCCCC(C)NCCSCC 2230a_100000126638_100000757381 [0,1,0,0,0,0|2,1,0]=4 2849 B11R0.81 CCCCC(C)NCCSCC 270004a_100000106463_100000210087 [0,1,0,0,0,0|2,1,0]=4 2850 B11R0.81 CCCCC(C)OCCCCBr 34a_100011216708_200011215066 [0,1,0,0,0,0|3,0,0]=4 2851 B11R0.81 CCCCC(C)OCCCCCl 34a_100000210776_200011215066 [0,1,0,0,0,0|3,0,0]=4 2852 B11R0.81 CCCCC(C)OCCCCCl 7a_100000210776_200011215066 [0,1,0,0,0,0|3,0,0]=4 2853 B11R0.81 CCCCC(C)OCCCCF 34a_100000687866_100000729493 [0,1,0,0,0,0|3,0,0]=4 2854 B11R0.81 CCCCC(C)OCCCCF 34a_100011995726_200011215066 [0,1,0,0,0,0|3,0,0]=4 2855 B11R0.81 CCCCC(C)OCCCCF 7a_100000687866_100000729493 [0,1,0,0,0,0|3,0,0]=4 2856 B11R0.81 CCCCC(C)OCCCCF 7a_100011995726_200011215066 [0,1,0,0,0,0|3,0,0]=4 2857 B11R0.81 CCCCC(C)OCCCCI 34a_200012148704_200011215066 [0,1,0,0,0,0|3,0,0]=4 2858 B11R0.81 CCCCC(C)OCCCCN 34a_100000750430_200011215066 [0,1,0,0,0,0|3,0,0]=4 2859 B11R0.81 CCCCC(C)OCCCCO 34a_100000687866_100011216708 [0,1,0,0,0,0|3,0,0]=4 2860 B11R0.81 CCCCC(C)OCCCCO 7a_100000687866_100000210776 [0,1,0,0,0,0|3,0,0]=4 2861 B11R0.81 CCCCC(C)OCCCNC 34a_100000213112_200011215066 [0,1,0,0,0,0|3,0,0]=4 2862 B11R0.81 CCCCC(C)OCCCOC 34a_100000687866_100000740836 [0,1,0,0,0,0|3,0,0]=4 2863 B11R0.81 CCCCC(C)OCCCOC 34a_100000740835_200011215066 [0,1,0,0,0,0|3,0,0]=4 2864 B11R0.81 CCCCC(C)OCCCOC 7a_100000687866_100000740836 [0,1,0,0,0,0|3,0,0]=4 2865 B11R0.81 CCCCC(C)OCCCSC 34a_100000690336_200011215066 [0,1,0,0,0,0|3,0,0]=4 2866 B11R0.81 CCCCC(C)OCCCSC 7a_100000690336_200011215066 [0,1,0,0,0,0|3,0,0]=4 2867 B11R0.81 CCCCC(C)OCCOCC 34a_100000210136_200011215066 [0,1,0,0,0,0|1,0,0]=2 2868 B11R0.81 CCCCC(C)OCCOCC 34a_100000687866_100000210147 [0,1,0,0,0,0|1,0,0]=2 2869 B11R0.81 CCCCC(C)OCCOCC 7a_100000210136_200011215066 [0,1,0,0,0,0|1,0,0]=2 2870 B11R0.81 CCCCC(C)OCCOCC 7a_100000687866_100011215890 [0,1,0,0,0,0|1,0,0]=2 2871 B11R0.81 CCCCC(C)OCCSCC 34a_100000212035_200011215066 [0,1,0,0,0,0|1,1,0]=3 2872 B11R0.81 CCCCC(C)OCCSCC 34a_100000687866_100000757381 [0,1,0,0,0,0|1,1,0]=3 2873 B11R0.81 CCCCC(C)OCCSCC 7a_100000212035_200011215066 [0,1,0,0,0,0|1,1,0]=3 2874 B11R0.81 CCCCC(C)OCCSCC 7a_100000687866_100000757381 [0,1,0,0,0,0|1,1,0]=3 2875 B11R0.81 CCCCC(C)SCCOCC 62a_100000210147_200011215066 [0,1,0,0,0,0|1,1,0]=3 2876 B11R0.81 CCCCC(C)SCCOCC 62a_200011215066_100011215890 [0,1,0,0,0,0|1,1,0]=3 2877 B11R0.81 CCCCC(C)SCCSCC 62a_100000757381_200011215066 [0,1,0,0,0,0|1,2,0]=4 2878 B11R0.81 CCCCC(C)SCCSCC 62a_200011215066_100000757381 [0,1,0,0,0,0|1,2,0]=4 2879 B11R0.81 CCCCCCC(=O)COCC 1458a_100000211967_100000210757 [0,1,0,0,0,0|2,0,1]=4 2880 B11R0.81 CCCCCCN(C)COCC 269982a_106256046315_100000739092 [0,1,0,0,0,0|3,0,0]=4 2881 B11R0.81 CCCCCNC(=O)COCC 11a_100000209983_100000211967 [0,1,0,0,0,0|2,0,1]=4 2882 B11R0.81 CCCCCNC(=O)COCC 1626a_100000209983_100000211967 [0,1,0,0,0,0|2,0,1]=4 2883 B11R0.81 CCCCCNC(=O)COCC 240690a_100000209983_100000211967 [0,1,0,0,0,0|2,0,1]=4 2884 B11R0.81 CCCCCNC(=O)COCC 34a_100121572206_100000230301 [0,1,0,0,0,0|2,0,1]=4 2885 B11R0.81 CCCCCNC(=O)COCC 527a_100000209983_100000211967 [0,1,0,0,0,0|2,0,1]=4 2886 B11R0.81 CCCCCNC(C)CCCC 2230a_100000126638_100000210326 [0,1,0,0,0,0|3,0,0]=4 2887 B11R0.81 CCCCCNC(C)CCCC 2230a_100000209983_200011215066 [0,1,0,0,0,0|3,0,0]=4 2888 B11R0.81 CCCCCNC(C)CCCC 270004a_100000209983_100000210087 [0,1,0,0,0,0|3,0,0]=4 2889 B11R0.81 CCCCCNC(C)CSCC 270004a_100000209983_200011216171 [0,1,0,0,0,0|2,1,0]=4 2890 B11R0.81 CCCCCOC(C)CCCC 34a_100000210253_200011215066 [0,1,0,0,0,0|2,0,0]=3 2891 B11R0.81 CCCCCOC(C)CCCC 34a_100000687866_100000718602 [0,1,0,0,0,0|2,0,0]=3 2892 B11R0.81 CCCCCOC(C)CCCC 7a_100000210253_200011215066 [0,1,0,0,0,0|2,0,0]=3 2893 B11R0.81 CCCCCOC(C)CCCC 7a_100000687866_100000210326 [0,1,0,0,0,0|2,0,0]=3 2894 B11R0.81 CCCCCOC(C)CCCCl 34a_200000718107_100000718602 [0,1,0,0,0,0|3,0,0]=4 2895 B11R0.81 CCCCCOC(C)CCCCl 7a_200000718107_100000210326 [0,1,0,0,0,0|3,0,0]=4 2896 B11R0.81 CCCCCOC(C)COCC 34a_100000718985_100000718602 [0,1,0,0,0,0|1,0,0]=2 2897 B11R0.81 CCCCCOC(C)COCC 7a_100000718985_100000210326 [0,1,0,0,0,0|1,0,0]=2 2898 B11R0.81 CCCCCSC(C)CCCC 62a_100000210326_200011215066 [0,1,0,0,0,0|2,1,0]=4 2899 B11R0.81 CCCCCSC(C)CCCC 62a_200011215066_100000210326 [0,1,0,0,0,0|2,1,0]=4 2900 B11R0.81 CCCCN(C)CCCOCC 2230a_100000207549_100012232248 [0,1,0,0,0,0|3,0,0]=4 2901 B11R0.81 CCCCN(C)CCCOCC 269982a_100000207549_100012232248 [0,1,0,0,0,0|3,0,0]=4 2902 B11R0.81 CCCCNCC(O)COCC 2230a_102515437182_100000210211 [0,1,0,0,0,0|3,0,0]=4 2903 B11R0.81 CCCCNCC(O)COCC 34a_102515437182_100000210210 [0,1,0,0,0,0|3,0,0]=4 2904 B11R0.81 CCNCC(=O)OCCOCC 2230a_100015525214_200000101388 [0,1,0,0,0,0|1,0,1]=3 2905 B11R0.81 CCOCC(=O)NCCSCC 11a_100000106463_100000211967 [0,1,0,0,0,0|1,1,1]=4 2906 B11R0.81 CCOCC(=O)NCCSCC 1626a_100000106463_100000211967 [0,1,0,0,0,0|1,1,1]=4 2907 B11R0.81 CCOCC(=O)NCCSCC 240690a_100000106463_100000211967 [0,1,0,0,0,0|1,1,1]=4 2908 B11R0.81 CCOCC(=O)NCCSCC 527a_100000106463_100000211967 [0,1,0,0,0,0|1,1,1]=4 2909 B11R0.81 CCOCC(C)OCC#CCO 34a_100000718985_200000047223 [0,1,0,0,0,0|2,0,1]=4 2910 B11R0.81 CCOCC(C)OCC#CCO 7a_100000718985_200000047223 [0,1,0,0,0,0|2,0,1]=4 2911 B11R0.81 CCOCC(C)OCCCC#N 7a_100000718985_100000687738 [0,1,0,0,0,0|2,0,1]=4 2912 B11R0.81 CCOCC(C)OCCCC=O 7a_100000718985_200011292268 [0,1,0,0,0,0|2,0,1]=4 2913 B11R0.81 CCOCC(C)OCCCCF 34a_100000718985_100000729493 [0,1,0,0,0,0|2,0,0]=3 2914 B11R0.81 CCOCC(C)OCCCCF 7a_100000718985_100000729493 [0,1,0,0,0,0|2,0,0]=3 2915 B11R0.81 CCOCC(C)OCCCCO 34a_100000718985_100011216708 [0,1,0,0,0,0|2,0,0]=3 2916 B11R0.81 CCOCC(C)OCCCCO 7a_100000718985_100000210776 [0,1,0,0,0,0|2,0,0]=3 2917 B11R0.81 CCOCC(C)OCCCOC 34a_100000718985_100000740836 [0,1,0,0,0,0|2,0,0]=3 2918 B11R0.81 CCOCC(C)OCCCOC 7a_100000718985_100000740836 [0,1,0,0,0,0|2,0,0]=3 2919 B11R0.81 CCOCC(C)OCCSCC 34a_100000718985_100000757381 [0,1,0,0,0,0|0,1,0]=2 2920 B11R0.81 CCOCC(C)OCCSCC 7a_100000718985_100000757381 [0,1,0,0,0,0|0,1,0]=2 2921 B11R0.81 CCOCCCC(=O)COCC 1458a_100000211967_100012232248 [0,1,0,0,0,0|1,0,1]=3 2922 B11R0.81 CCOCCCC(=O)CSCC 1458a_100000230394_100012232248 [0,1,0,0,0,0|1,1,1]=4 2923 B11R0.81 CCOCCNC(=O)COCC 11a_100011200944_100000211967 [0,1,0,0,0,0|1,0,1]=3 2924 B11R0.81 CCOCCNC(=O)COCC 1626a_102516460346_100000211967 [0,1,0,0,0,0|1,0,1]=3 2925 B11R0.81 CCOCCNC(=O)COCC 240690a_100011200944_100000211967 [0,1,0,0,0,0|1,0,1]=3 2926 B11R0.81 CCOCCNC(=O)COCC 527a_100011200944_100000211967 [0,1,0,0,0,0|1,0,1]=3 2927 B11R0.81 CCOCCNC(=O)CSCC 11a_100011200944_100000230394 [0,1,0,0,0,0|1,1,1]=4 2928 B11R0.81 CCOCCNC(=O)CSCC 1626a_102516460346_100000230394 [0,1,0,0,0,0|1,1,1]=4 2929 B11R0.81 CCOCCNC(=O)CSCC 240690a_100011200944_100000230394 [0,1,0,0,0,0|1,1,1]=4 2930 B11R0.81 CCOCCNC(=O)CSCC 527a_100011200944_100000230394 [0,1,0,0,0,0|1,1,1]=4 2931 B11R0.81 CCOCCNC(C)CCOC 270004a_102516460346_100000742357 [0,1,0,0,0,0|3,0,0]=4 2932 B11R0.81 CCOCCNC(C)CCSC 270004a_102516460346_100011217047 [0,1,0,0,0,0|3,0,0]=4 2933 B11R0.81 CCOCCNC(C)CSCC 270004a_102516460346_200011216171 [0,1,0,0,0,0|1,1,0]=3 2934 B11R0.81 CCOCCOC(=O)COCC 34a_100121572206_200000101388 [0,1,0,0,0,0|0,0,1]=2 2935 B11R0.81 CCOCCOC(=O)CSCC 62a_100000210202_200000101388 [0,1,0,0,0,0|0,1,1]=3 2936 B11R0.81 CCOCCOC(=O)CSCC 62a_200000101388_100000210202 [0,1,0,0,0,0|0,1,1]=3 2937 B11R0.81 CCOCCOC(=O)CSCF 62a_100015361967_200000101388 [0,1,0,0,0,0|1,1,1]=4 2938 B11R0.81 CCOCCOC(=O)CSCF 62a_200000101388_100015361967 [0,1,0,0,0,0|1,1,1]=4 2939 B11R0.81 CCOCCOC(C)CCCCl 34a_200000718107_100000210147 [0,1,0,0,0,0|2,0,0]=3 2940 B11R0.81 CCOCCOC(C)CCCCl 7a_200000718107_100011215890 [0,1,0,0,0,0|2,0,0]=3 2941 B11R0.81 CCOCCOC(C)COCC 34a_100000718985_100000210147 [0,1,0,0,0,0|0,0,0]=1 2942 B11R0.81 CCOCCOC(C)COCC 7a_100000718985_100011215890 [0,1,0,0,0,0|0,0,0]=1 2943 B11R0.81 CCSCCNC(C)CSCC 270004a_100000106463_200011216171 [0,1,0,0,0,0|1,2,0]=4 2944 B11R0.81 CCSCCOC(C)CCCCl 34a_200000718107_100000757381 [0,1,0,0,0,0|2,1,0]=4 2945 B11R0.81 CCSCCOC(C)CCCCl 7a_200000718107_100000757381 [0,1,0,0,0,0|2,1,0]=4 2946 B11R0.140 C=COCCC(=O)CCOCC 1458a_100000749530_100000039644 [0,1,0,0,0,0|1,0,2]=4 2947 B11R0.140 CC/C=C/CC(=O)CCOCC 1458a_100016274230_100011215890 [0,1,0,0,0,0|2,0,1]=4 2948 B11R0.140 CC/C=C\CC(=O)CCOCC 1458a_100000749530_100103147603 [0,1,0,0,0,0|2,0,1]=4 2949 B11R0.140 CCC#CCC(=O)CCOCC 1458a_100000749530_100009813939 [0,1,0,0,0,0|2,0,1]=4 2950 B11R0.140 CCCCCC(=O)CCCCC 1458a_100000212188_100000210326 [0,1,0,0,0,0|3,0,0]=4 2951 B11R0.140 CCCCCC(=O)CCOCC 1458a_100000212188_100011215890 [0,1,0,0,0,0|2,0,0]=3 2952 B11R0.140 CCCCCC(=O)CCOCC 1458a_100000749530_100000210326 [0,1,0,0,0,0|2,0,0]=3 2953 B11R0.140 CCCCCC(=O)CCSCC 1458a_100000212188_100000757381 [0,1,0,0,0,0|2,1,0]=4 2954 B11R0.140 CCCCCC(=O)CCSCC 1458a_100000230768_100000210326 [0,1,0,0,0,0|2,1,0]=4 2955 B11R0.140 CCCCCC(C)SCOCC 62a_100000739092_200011218191 [0,1,0,0,0,0|3,0,0]=4 2956 B11R0.140 CCCCCC(C)SCOCC 62a_200011218191_100000739092 [0,1,0,0,0,0|3,0,0]=4 2957 B11R0.140 CCCCCN(C)CCCCC 2230a_100000210580_200000210301 [0,1,0,0,0,0|3,0,0]=4 2958 B11R0.140 CCCCCN(C)CCCCC 2230a_100000223495_100000210326 [0,1,0,0,0,0|3,0,0]=4 2959 B11R0.140 CCCCCN(C)CCCCC 269982a_100000210580_200000210301 [0,1,0,0,0,0|3,0,0]=4 2960 B11R0.140 CCCCCN(C)CCCCC 269982a_100000223495_100000210215 [0,1,0,0,0,0|3,0,0]=4 2961 B11R0.140 CCCCCN(C)CCOCC 2230a_100000223495_100011215890 [0,1,0,0,0,0|2,0,0]=3 2962 B11R0.140 CCCCCN(C)CCOCC 269982a_100000223495_100011215890 [0,1,0,0,0,0|2,0,0]=3 2963 B11R0.140 CCCCCN(C)CCSCC 2230a_100000223495_100000757381 [0,1,0,0,0,0|2,1,0]=4 2964 B11R0.140 CCCCCN(C)CCSCC 269982a_100000223495_100000757381 [0,1,0,0,0,0|2,1,0]=4 2965 B11R0.140 CCCCCN([13CH3])CCCCC 2230a_100000210580_200025704644 [0,1,0,0,0,0|3,0,0]=4 2966 B11R0.140 CCCCCN([13CH3])CCCCC 269982a_100000210580_200025704644 [0,1,0,0,0,0|3,0,0]=4 2967 B11R0.140 CCCCNC(=O)CCOCC 11a_100000102301_100000749530 [0,1,0,0,0,0|3,0,0]=4 2968 B11R0.140 CCCCNC(=O)CCOCC 1626a_100000102301_100000749530 [0,1,0,0,0,0|3,0,0]=4 2969 B11R0.140 CCCCNC(=O)CCOCC 240690a_100000102301_100000749530 [0,1,0,0,0,0|3,0,0]=4 2970 B11R0.140 CCCCNC(=O)CCOCC 527a_100000102301_100000749530 [0,1,0,0,0,0|3,0,0]=4 2971 B11R0.140 CCCCNC(C)CCOCC 270004a_100000102301_200011216536 [0,1,0,0,0,0|3,0,0]=4 2972 B11R0.140 CCCOCC(=O)CCOCC 1458a_100000745993_100011215890 [0,1,0,0,0,0|3,0,0]=4 2973 B11R0.140 CCCSCC(=O)CCOCC 1458a_100000217233_100011215890 [0,1,0,0,0,0|3,0,0]=4 2974 B11R0.140 CCOC=CC(=O)CCOCC 1458a_100016266692_100011215890 [0,1,0,0,0,0|1,0,2]=4 2975 B11R0.140 CCOCCC(=O)CCCCF 1458a_100000749530_100000729493 [0,1,0,0,0,0|3,0,0]=4 2976 B11R0.140 CCOCCC(=O)CCCCO 1458a_100000695505_100011215890 [0,1,0,0,0,0|3,0,0]=4 2977 B11R0.140 CCOCCC(=O)CCCCO 1458a_100000749530_100000210776 [0,1,0,0,0,0|3,0,0]=4 2978 B11R0.140 CCOCCC(=O)CCCOC 1458a_100000741012_100011215890 [0,1,0,0,0,0|3,0,0]=4 2979 B11R0.140 CCOCCC(=O)CCCOC 1458a_100000749530_100000740836 [0,1,0,0,0,0|3,0,0]=4 2980 B11R0.140 CCOCCC(=O)CCCSC 1458a_100000173376_100011215890 [0,1,0,0,0,0|3,0,0]=4 2981 B11R0.140 CCOCCC(=O)CCOCC 1458a_100000749530_100011215890 [0,1,0,0,0,0|1,0,0]=2 2982 B11R0.140 CCOCCC(=O)CCSCC 1458a_100000230768_100011215890 [0,1,0,0,0,0|1,1,0]=3 2983 B11R0.140 CCOCCC(=O)CCSCC 1458a_100000749530_100000757381 [0,1,0,0,0,0|1,1,0]=3 2984 B11R0.140 CCOCCN(C)CCCCO 2230a_100000717598_100011215890 [0,1,0,0,0,0|3,0,0]=4 2985 B11R0.140 CCOCCN(C)CCCCO 269982a_100000717598_100011215890 [0,1,0,0,0,0|3,0,0]=4 2986 B11R0.140 CCOCCN(C)CCCOC 2230a_100000224831_100011215890 [0,1,0,0,0,0|3,0,0]=4 2987 B11R0.140 CCOCCN(C)CCCOC 269982a_100000224831_100011215890 [0,1,0,0,0,0|3,0,0]=4 2988 B11R0.140 CCOCCN(C)CCOCC 2230a_100011216575_200000210301 [0,1,0,0,0,0|1,0,0]=2 2989 B11R0.140 CCOCCN(C)CCOCC 269982a_100011216575_200000210301 [0,1,0,0,0,0|1,0,0]=2 2990 B11R0.140 CCOCCN([13CH3])CCOCC 2230a_100011216575_200025704644 [0,1,0,0,0,0|1,0,0]=2 2991 B11R0.140 CCOCCN([13CH3])CCOCC 269982a_100011216575_200025704644 [0,1,0,0,0,0|1,0,0]=2 2992 B11R0.140 CCSCCC(=O)CCSCC 1458a_100000230768_100000757381 [0,1,0,0,0,0|1,2,0]=4 2993 B11R0.148 C#CCCCOCCOC(C)C 34a_100000211219_100000695029 [0,1,0,0,0,0|1,0,2]=4 2994 B11R0.148 C#CCCCOCCOC(C)C 34a_100000215630_100000211751 [0,1,0,0,0,0|1,0,2]=4 2995 B11R0.148 C#CCCCOCCOC(C)C 7a_100000211219_100011215417 [0,1,0,0,0,0|1,0,2]=4 2996 B11R0.148 C#CCCCOCCOC(C)C 7a_100000215630_100000211751 [0,1,0,0,0,0|1,0,2]=4 2997 B11R0.148 C/C=C/CCOCCCC(C)C 34a_100016278192_100011214892 [0,1,0,0,0,0|2,0,1]=4 2998 B11R0.148 C/C=C/CCOCCCC(C)O 34a_100016278192_200000718107 [0,1,0,0,0,0|2,0,1]=4 2999 B11R0.148 C/C=C/CCOCCOC(=O)C 34a_100016278192_100009814007 [0,1,0,0,0,0|1,0,2]=4 3000 B11R0.148 C/C=C/CCOCCOC(C)C 34a_100016278192_100000211751 [0,1,0,0,0,0|1,0,1]=3 3001 B11R0.148 C/C=C/CCOCCSC(C)C 34a_100016278192_100000730970 [0,1,0,0,0,0|1,1,1]=4 3002 B11R0.148 C=CCCCOCCOC(C)C 34a_100000211219_100000757094 [0,1,0,0,0,0|1,0,2]=4 3003 B11R0.148 C=CCCCOCCOC(C)C 34a_100000758997_100000211751 [0,1,0,0,0,0|1,0,2]=4 3004 B11R0.148 C=CCCCOCCOC(C)C 7a_100000211219_100000757094 [0,1,0,0,0,0|1,0,2]=4 3005 B11R0.148 C=CCCCOCCOC(C)C 7a_100000758997_100000211751 [0,1,0,0,0,0|1,0,2]=4 3006 B11R0.148 C=COCCNCCOC(C)C 2230a_100000701111_100000039644 [0,1,0,0,0,0|1,0,2]=4 3007 B11R0.148 C=COCCNCCOC(C)C 34a_100000701111_100000039644 [0,1,0,0,0,0|1,0,2]=4 3008 B11R0.148 C=COCCOCCCC(C)C 34a_100000033082_100011214892 [0,1,0,0,0,0|1,0,2]=4 3009 B11R0.148 C=COCCOCCCC(C)C 34a_100000210774_100000039644 [0,1,0,0,0,0|1,0,2]=4 3010 B11R0.148 C=COCCOCCCC(C)C 7a_100000210774_100000039644 [0,1,0,0,0,0|1,0,2]=4 3011 B11R0.148 C=COCCOCCCC(C)O 34a_100000033082_200000718107 [0,1,0,0,0,0|1,0,2]=4 3012 B11R0.148 C=COCCOCCNC(C)C 34a_100000224655_100000039644 [0,1,0,0,0,0|1,0,2]=4 3013 B11R0.148 C=COCCOCCOC(=O)C 34a_100000033082_100009814007 [0,1,0,0,0,0|0,0,3]=4 3014 B11R0.148 C=COCCOCCOC(C)C 34a_100000033082_100000211751 [0,1,0,0,0,0|0,0,2]=3 3015 B11R0.148 C=COCCOCCOC(C)C 34a_100000039918_100000210206 [0,1,0,0,0,0|0,0,2]=3 3016 B11R0.148 C=COCCOCCOC(C)C 34a_100000211219_100000039644 [0,1,0,0,0,0|0,0,2]=3 3017 B11R0.148 C=COCCOCCOC(C)C 7a_100000039918_100000210206 [0,1,0,0,0,0|0,0,2]=3 3018 B11R0.148 C=COCCOCCOC(C)C 7a_100000211219_100000039644 [0,1,0,0,0,0|0,0,2]=3 3019 B11R0.148 C=COCCOCCSC(C)C 34a_100000033082_100000730970 [0,1,0,0,0,0|0,1,2]=4 3020 B11R0.148 C=COCCOCCSC(C)C 34a_200011212901_100000039644 [0,1,0,0,0,0|0,1,2]=4 3021 B11R0.148 C=COCCOCCSC(C)C 7a_200011212901_100000039644 [0,1,0,0,0,0|0,1,2]=4 3022 B11R0.148 C=COCCSCCOC(C)C 62a_100000039644_100000211751 [0,1,0,0,0,0|0,1,2]=4 3023 B11R0.148 C=COCCSCCOC(C)C 62a_100000211751_100000039644 [0,1,0,0,0,0|0,1,2]=4 3024 B11R0.148 CC#CCCOCCCC(C)C 34a_100000750427_100011214892 [0,1,0,0,0,0|2,0,1]=4 3025 B11R0.148 CC#CCCOCCCC(C)O 34a_100000750427_200000718107 [0,1,0,0,0,0|2,0,1]=4 3026 B11R0.148 CC#CCCOCCOC(=O)C 34a_100000750427_100009814007 [0,1,0,0,0,0|1,0,2]=4 3027 B11R0.148 CC#CCCOCCOC(C)C 34a_100000750427_100000211751 [0,1,0,0,0,0|1,0,1]=3 3028 B11R0.148 CC#CCCOCCSC(C)C 34a_100000750427_100000730970 [0,1,0,0,0,0|1,1,1]=4 3029 B11R0.148 CC(=O)OCCOCCCCBr 34a_100011216708_100009814007 [0,1,0,0,0,0|2,0,1]=4 3030 B11R0.148 CC(=O)OCCOCCCCCl 34a_100000210776_100009814007 [0,1,0,0,0,0|2,0,1]=4 3031 B11R0.148 CC(=O)OCCOCCCCCl 7a_100000210776_100009814007 [0,1,0,0,0,0|2,0,1]=4 3032 B11R0.148 CC(=O)OCCOCCCCF 34a_100011995726_100009814007 [0,1,0,0,0,0|2,0,1]=4 3033 B11R0.148 CC(=O)OCCOCCCCF 7a_100011995726_100009814007 [0,1,0,0,0,0|2,0,1]=4 3034 B11R0.148 CC(=O)OCCOCCCCI 34a_200012148704_100009814007 [0,1,0,0,0,0|2,0,1]=4 3035 B11R0.148 CC(=O)OCCOCCCCN 34a_100000750430_100009814007 [0,1,0,0,0,0|2,0,1]=4 3036 B11R0.148 CC(=O)OCCOCCSCF 62a_100015361967_200000083610 [0,1,0,0,0,0|1,1,1]=4 3037 B11R0.148 CC(=O)OCCOCCSCF 62a_200000083610_100015361967 [0,1,0,0,0,0|1,1,1]=4 3038 B11R0.148 CC(C)CCCOCCCCBr 34a_100011216708_100011214892 [0,1,0,0,0,0|3,0,0]=4 3039 B11R0.148 CC(C)CCCOCCCCCl 34a_100000210776_100011214892 [0,1,0,0,0,0|3,0,0]=4 3040 B11R0.148 CC(C)CCCOCCCCCl 7a_100000210776_100011214892 [0,1,0,0,0,0|3,0,0]=4 3041 B11R0.148 CC(C)CCCOCCCCF 34a_100000210774_100000729493 [0,1,0,0,0,0|3,0,0]=4 3042 B11R0.148 CC(C)CCCOCCCCF 34a_100011995726_100011214892 [0,1,0,0,0,0|3,0,0]=4 3043 B11R0.148 CC(C)CCCOCCCCF 7a_100000210774_100000729493 [0,1,0,0,0,0|3,0,0]=4 3044 B11R0.148 CC(C)CCCOCCCCF 7a_100011995726_100011214892 [0,1,0,0,0,0|3,0,0]=4 3045 B11R0.148 CC(C)CCCOCCCCI 34a_200012148704_100011214892 [0,1,0,0,0,0|3,0,0]=4 3046 B11R0.148 CC(C)CCCOCCCCN 34a_100000750430_100011214892 [0,1,0,0,0,0|3,0,0]=4 3047 B11R0.148 CC(C)CCCOCCCCO 34a_100000210774_100011216708 [0,1,0,0,0,0|3,0,0]=4 3048 B11R0.148 CC(C)CCCOCCCCO 7a_100000210774_100000210776 [0,1,0,0,0,0|3,0,0]=4 3049 B11R0.148 CC(C)NCCCCCOCF 34a_100011629493_100015361967 [0,1,0,0,0,0|3,0,0]=4 3050 B11R0.148 CC(C)NCCOCCCCF 34a_100000224655_100000729493 [0,1,0,0,0,0|3,0,0]=4 3051 B11R0.148 CC(C)NCCOCCCCO 34a_100000224655_100011216708 [0,1,0,0,0,0|3,0,0]=4 3052 B11R0.148 CC(C)OCCCCCCCBr 34a_100000760002_100000210206 [0,1,0,0,0,0|3,0,0]=4 3053 B11R0.148 CC(C)OCCCCCCCBr 7a_100000760002_100000210206 [0,1,0,0,0,0|3,0,0]=4 3054 B11R0.148 CC(C)OCCCCCCCN 34a_100011996573_100000210206 [0,1,0,0,0,0|3,0,0]=4 3055 B11R0.148 CC(C)OCCCCCCCO 34a_100000212225_100000760002 [0,1,0,0,0,0|3,0,0]=4 3056 B11R0.148 CC(C)OCCNCCCCF 2230a_100000701111_100000729493 [0,1,0,0,0,0|3,0,0]=4 3057 B11R0.148 CC(C)OCCNCCCCF 34a_100000701111_100000729493 [0,1,0,0,0,0|3,0,0]=4 3058 B11R0.148 CC(C)OCCNCCCCO 2230a_100000701111_100000210776 [0,1,0,0,0,0|3,0,0]=4 3059 B11R0.148 CC(C)OCCNCCCCO 2230a_100000750430_100000211751 [0,1,0,0,0,0|3,0,0]=4 3060 B11R0.148 CC(C)OCCNCCCCO 34a_100000701111_100011216708 [0,1,0,0,0,0|3,0,0]=4 3061 B11R0.148 CC(C)OCCNCCCCO 34a_100000750430_100000211751 [0,1,0,0,0,0|3,0,0]=4 3062 B11R0.148 CC(C)OCCOCC#CCCl 34a_200000047223_100000211751 [0,1,0,0,0,0|2,0,1]=4 3063 B11R0.148 CC(C)OCCOCC#CCO 34a_100000211219_200000047223 [0,1,0,0,0,0|2,0,1]=4 3064 B11R0.148 CC(C)OCCOCC#CCO 7a_100000211219_200000047223 [0,1,0,0,0,0|2,0,1]=4 3065 B11R0.148 CC(C)OCCOCCCC#N 7a_100000211219_100000687738 [0,1,0,0,0,0|2,0,1]=4 3066 B11R0.148 CC(C)OCCOCCCC=O 7a_100000211219_200011292268 [0,1,0,0,0,0|2,0,1]=4 3067 B11R0.148 CC(C)OCCOCCCCBr 34a_100011216708_100000211751 [0,1,0,0,0,0|2,0,0]=3 3068 B11R0.148 CC(C)OCCOCCCCCl 34a_100000210776_100000211751 [0,1,0,0,0,0|2,0,0]=3 3069 B11R0.148 CC(C)OCCOCCCCCl 7a_100000210776_100000211751 [0,1,0,0,0,0|2,0,0]=3 3070 B11R0.148 CC(C)OCCOCCCCF 34a_100000211219_100000729493 [0,1,0,0,0,0|2,0,0]=3 3071 B11R0.148 CC(C)OCCOCCCCF 34a_100011995726_100000211751 [0,1,0,0,0,0|2,0,0]=3 3072 B11R0.148 CC(C)OCCOCCCCF 7a_100000211219_100000729493 [0,1,0,0,0,0|2,0,0]=3 3073 B11R0.148 CC(C)OCCOCCCCF 7a_100011995726_100000211751 [0,1,0,0,0,0|2,0,0]=3 3074 B11R0.148 CC(C)OCCOCCCCI 34a_200012148704_100000211751 [0,1,0,0,0,0|2,0,0]=3 3075 B11R0.148 CC(C)OCCOCCCCN 34a_100000750430_100000211751 [0,1,0,0,0,0|2,0,0]=3 3076 B11R0.148 CC(C)OCCOCCCCO 34a_100000211219_100011216708 [0,1,0,0,0,0|2,0,0]=3 3077 B11R0.148 CC(C)OCCOCCCCO 7a_100000211219_100000210776 [0,1,0,0,0,0|2,0,0]=3 3078 B11R0.148 CC(C)OCCSCCCCF 62a_100000211751_100000729493 [0,1,0,0,0,0|2,1,0]=4 3079 B11R0.148 CC(C)OCCSCCCCF 62a_100000729493_100000211751 [0,1,0,0,0,0|2,1,0]=4 3080 B11R0.148 CC(C)OCCSCCCCO 62a_100000210776_100000211751 [0,1,0,0,0,0|2,1,0]=4 3081 B11R0.148 CC(C)OCCSCCCCO 62a_100000211751_100000210776 [0,1,0,0,0,0|2,1,0]=4 3082 B11R0.148 CC(C)SCCOCCCCBr 34a_100011216708_100000730970 [0,1,0,0,0,0|2,1,0]=4 3083 B11R0.148 CC(C)SCCOCCCCCl 34a_100000210776_100000730970 [0,1,0,0,0,0|2,1,0]=4 3084 B11R0.148 CC(C)SCCOCCCCCl 7a_100000210776_100000730970 [0,1,0,0,0,0|2,1,0]=4 3085 B11R0.148 CC(C)SCCOCCCCF 34a_100011995726_100000730970 [0,1,0,0,0,0|2,1,0]=4 3086 B11R0.148 CC(C)SCCOCCCCF 34a_200011212901_100000729493 [0,1,0,0,0,0|2,1,0]=4 3087 B11R0.148 CC(C)SCCOCCCCF 7a_100011995726_100000730970 [0,1,0,0,0,0|2,1,0]=4 3088 B11R0.148 CC(C)SCCOCCCCF 7a_200011212901_100000729493 [0,1,0,0,0,0|2,1,0]=4 3089 B11R0.148 CC(C)SCCOCCCCI 34a_200012148704_100000730970 [0,1,0,0,0,0|2,1,0]=4 3090 B11R0.148 CC(C)SCCOCCCCN 34a_100000750430_100000730970 [0,1,0,0,0,0|2,1,0]=4 3091 B11R0.148 CC(C)SCCOCCCCO 34a_200011212901_100011216708 [0,1,0,0,0,0|2,1,0]=4 3092 B11R0.148 CC(C)SCCOCCCCO 7a_200011212901_100000210776 [0,1,0,0,0,0|2,1,0]=4 3093 B11R0.148 CC(O)CCCOCCCCBr 34a_100011216708_200000718107 [0,1,0,0,0,0|3,0,0]=4 3094 B11R0.148 CC(O)CCCOCCCCCl 34a_100000210776_200000718107 [0,1,0,0,0,0|3,0,0]=4 3095 B11R0.148 CC(O)CCCOCCCCCl 7a_100000210776_200000718107 [0,1,0,0,0,0|3,0,0]=4 3096 B11R0.148 CC(O)CCCOCCCCF 34a_100011995726_200000718107 [0,1,0,0,0,0|3,0,0]=4 3097 B11R0.148 CC(O)CCCOCCCCF 7a_100011995726_200000718107 [0,1,0,0,0,0|3,0,0]=4 3098 B11R0.148 CC(O)CCCOCCCCI 34a_200012148704_200000718107 [0,1,0,0,0,0|3,0,0]=4 3099 B11R0.148 CC(O)CCCOCCCCN 34a_100000750430_200000718107 [0,1,0,0,0,0|3,0,0]=4 3100 B11R0.148 CC/C=C\CCCCOC(C)C 34a_100016287862_100000210206 [0,1,0,0,0,0|2,0,1]=4 3101 B11R0.148 CC/C=C\CCCCOC(C)C 7a_100016287862_100000210206 [0,1,0,0,0,0|2,0,1]=4 3102 B11R0.148 CC/C=C\CNCCOC(C)C 2230a_100000701111_100103147603 [0,1,0,0,0,0|2,0,1]=4 3103 B11R0.148 CC/C=C\CNCCOC(C)C 34a_100000701111_100103147603 [0,1,0,0,0,0|2,0,1]=4 3104 B11R0.148 CC/C=C\COCCCC(C)C 34a_100000210774_100103147603 [0,1,0,0,0,0|2,0,1]=4 3105 B11R0.148 CC/C=C\COCCCC(C)C 34a_100016268518_100011214892 [0,1,0,0,0,0|2,0,1]=4 3106 B11R0.148 CC/C=C\COCCCC(C)C 7a_100000210774_100103147603 [0,1,0,0,0,0|2,0,1]=4 3107 B11R0.148 CC/C=C\COCCCC(C)O 34a_100016268518_200000718107 [0,1,0,0,0,0|2,0,1]=4 3108 B11R0.148 CC/C=C\COCCNC(C)C 34a_100000224655_100103147603 [0,1,0,0,0,0|2,0,1]=4 3109 B11R0.148 CC/C=C\COCCOC(=O)C 34a_100016268518_100009814007 [0,1,0,0,0,0|1,0,2]=4 3110 B11R0.148 CC/C=C\COCCOC(C)C 34a_100000211219_100103147603 [0,1,0,0,0,0|1,0,1]=3 3111 B11R0.148 CC/C=C\COCCOC(C)C 34a_100016268518_100000211751 [0,1,0,0,0,0|1,0,1]=3 3112 B11R0.148 CC/C=C\COCCOC(C)C 7a_100000211219_100103147603 [0,1,0,0,0,0|1,0,1]=3 3113 B11R0.148 CC/C=C\COCCSC(C)C 34a_100016268518_100000730970 [0,1,0,0,0,0|1,1,1]=4 3114 B11R0.148 CC/C=C\COCCSC(C)C 34a_200011212901_100103147603 [0,1,0,0,0,0|1,1,1]=4 3115 B11R0.148 CC/C=C\COCCSC(C)C 7a_200011212901_100103147603 [0,1,0,0,0,0|1,1,1]=4 3116 B11R0.148 CC/C=C\CSCCOC(C)C 62a_100000211751_100103147603 [0,1,0,0,0,0|1,1,1]=4 3117 B11R0.148 CC/C=C\CSCCOC(C)C 62a_100103147603_100000211751 [0,1,0,0,0,0|1,1,1]=4 3118 B11R0.148 CCC#CCNCCOC(C)C 2230a_100000701111_100009813939 [0,1,0,0,0,0|2,0,1]=4 3119 B11R0.148 CCC#CCNCCOC(C)C 34a_100000701111_100009813939 [0,1,0,0,0,0|2,0,1]=4 3120 B11R0.148 CCC#CCOCCCC(C)C 34a_100000032950_100011214892 [0,1,0,0,0,0|2,0,1]=4 3121 B11R0.148 CCC#CCOCCCC(C)C 34a_100000210774_100009813939 [0,1,0,0,0,0|2,0,1]=4 3122 B11R0.148 CCC#CCOCCCC(C)C 7a_100000210774_100009813939 [0,1,0,0,0,0|2,0,1]=4 3123 B11R0.148 CCC#CCOCCCC(C)O 34a_100000032950_200000718107 [0,1,0,0,0,0|2,0,1]=4 3124 B11R0.148 CCC#CCOCCNC(C)C 34a_100000224655_100009813939 [0,1,0,0,0,0|2,0,1]=4 3125 B11R0.148 CCC#CCOCCOC(=O)C 34a_100000032950_100009814007 [0,1,0,0,0,0|1,0,2]=4 3126 B11R0.148 CCC#CCOCCOC(C)C 34a_100000032950_100000211751 [0,1,0,0,0,0|1,0,1]=3 3127 B11R0.148 CCC#CCOCCOC(C)C 34a_100000211219_100009813939 [0,1,0,0,0,0|1,0,1]=3 3128 B11R0.148 CCC#CCOCCOC(C)C 7a_100000211219_100009813939 [0,1,0,0,0,0|1,0,1]=3 3129 B11R0.148 CCC#CCOCCSC(C)C 34a_100000032950_100000730970 [0,1,0,0,0,0|1,1,1]=4 3130 B11R0.148 CCC#CCOCCSC(C)C 34a_200011212901_100009813939 [0,1,0,0,0,0|1,1,1]=4 3131 B11R0.148 CCC#CCOCCSC(C)C 7a_200011212901_100009813939 [0,1,0,0,0,0|1,1,1]=4 3132 B11R0.148 CCC#CCSCCOC(C)C 62a_100000211751_100009813939 [0,1,0,0,0,0|1,1,1]=4 3133 B11R0.148 CCC#CCSCCOC(C)C 62a_100009813939_100000211751 [0,1,0,0,0,0|1,1,1]=4 3134 B11R0.148 CCCC/C=C\CCOC(C)C 34a_200016286491_100000210206 [0,1,0,0,0,0|2,0,1]=4 3135 B11R0.148 CCCC/C=C\CCOC(C)C 7a_200016286491_100000210206 [0,1,0,0,0,0|2,0,1]=4 3136 B11R0.148 CCCCC#CCCOC(C)C 34a_100000037610_100000210206 [0,1,0,0,0,0|2,0,1]=4 3137 B11R0.148 CCCCC#CCCOC(C)C 7a_100000037610_100000210206 [0,1,0,0,0,0|2,0,1]=4 3138 B11R0.148 CCCCC/C=C/COC(C)C 34a_100016258190_100000210206 [0,1,0,0,0,0|2,0,1]=4 3139 B11R0.148 CCCCC/C=C/COC(C)C 7a_100016258190_100000210206 [0,1,0,0,0,0|2,0,1]=4 3140 B11R0.148 CCCCCC#CCOC(C)C 34a_100000212225_100009816472 [0,1,0,0,0,0|2,0,1]=4 3141 B11R0.148 CCCCCC#CCOC(C)C 34a_200000033628_100000210206 [0,1,0,0,0,0|2,0,1]=4 3142 B11R0.148 CCCCCC#CCOC(C)C 7a_200000033628_100000210206 [0,1,0,0,0,0|2,0,1]=4 3143 B11R0.148 CCCCCCCCNC(C)C 2230a_100000229939_100000210206 [0,1,0,0,0,0|3,0,0]=4 3144 B11R0.148 CCCCCCCCNC(C)C 2230a_100138425928_100000210759 [0,1,0,0,0,0|3,0,0]=4 3145 B11R0.148 CCCCCCCCNC(C)C 34a_100000229939_100000210206 [0,1,0,0,0,0|3,0,0]=4 3146 B11R0.148 CCCCCCCCNC(C)C 34a_100138425928_100000210759 [0,1,0,0,0,0|3,0,0]=4 3147 B11R0.148 CCCCCCCCOC(C)C 34a_100000210232_100000210206 [0,1,0,0,0,0|2,0,0]=3 3148 B11R0.148 CCCCCCCCOC(C)C 34a_100000212225_100000210759 [0,1,0,0,0,0|2,0,0]=3 3149 B11R0.148 CCCCCCCCOC(C)C 7a_100000210232_100000210206 [0,1,0,0,0,0|2,0,0]=3 3150 B11R0.148 CCCCCCCCSC(C)C 62a_100000210206_100000210317 [0,1,0,0,0,0|2,1,0]=4 3151 B11R0.148 CCCCCCCCSC(C)C 62a_100000210759_100000210206 [0,1,0,0,0,0|2,1,0]=4 3152 B11R0.148 CCCCCCNCOC(C)C 2230a_100000210581_100000709892 [0,1,0,0,0,0|3,0,0]=4 3153 B11R0.148 CCCCCCOCOC(C)C 34a_100000210259_100000709892 [0,1,0,0,0,0|3,0,0]=4 3154 B11R0.148 CCCCCCSCOC(C)C 62a_100000210314_100000709892 [0,1,0,0,0,0|3,0,0]=4 3155 B11R0.148 CCCCCCSCOC(C)C 62a_100000709892_100000210757 [0,1,0,0,0,0|3,0,0]=4 3156 B11R0.148 CCCCCNCCCC(C)C 2230a_100000209983_100011214892 [0,1,0,0,0,0|3,0,0]=4 3157 B11R0.148 CCCCCNCCCC(C)C 2230a_200000737386_100000210326 [0,1,0,0,0,0|3,0,0]=4 3158 B11R0.148 CCCCCNCCCC(C)C 34a_200000737386_100000718602 [0,1,0,0,0,0|3,0,0]=4 3159 B11R0.148 CCCCCNCCCC(C)O 2230a_100000209983_200000718107 [0,1,0,0,0,0|3,0,0]=4 3160 B11R0.148 CCCCCNCCOC(C)C 2230a_100000209983_100000211751 [0,1,0,0,0,0|2,0,0]=3 3161 B11R0.148 CCCCCNCCOC(C)C 2230a_100000701111_100000210326 [0,1,0,0,0,0|2,0,0]=3 3162 B11R0.148 CCCCCNCCOC(C)C 34a_100000224656_100000210206 [0,1,0,0,0,0|2,0,0]=3 3163 B11R0.148 CCCCCNCCOC(C)C 34a_100000701111_100000718602 [0,1,0,0,0,0|2,0,0]=3 3164 B11R0.148 CCCCCNCCSC(C)C 2230a_100000209983_100000730970 [0,1,0,0,0,0|2,1,0]=4 3165 B11R0.148 CCCCCNCCSC(C)C 2230a_100000731138_100000210326 [0,1,0,0,0,0|2,1,0]=4 3166 B11R0.148 CCCCCNCCSC(C)C 34a_100000731138_100000718602 [0,1,0,0,0,0|2,1,0]=4 3167 B11R0.148 CCCCCOCCC=C(C)C 34a_100000210253_100011217483 [0,1,0,0,0,0|2,0,1]=4 3168 B11R0.148 CCCCCOCCC=C(C)C 7a_100000210253_100011217483 [0,1,0,0,0,0|2,0,1]=4 3169 B11R0.148 CCCCCOCCCC(=O)C 34a_100000210253_100000685027 [0,1,0,0,0,0|2,0,1]=4 3170 B11R0.148 CCCCCOCCCC(=O)C 34a_100000759063_100000718602 [0,1,0,0,0,0|2,0,1]=4 3171 B11R0.148 CCCCCOCCCC(=O)C 7a_100000210253_100011215641 [0,1,0,0,0,0|2,0,1]=4 3172 B11R0.148 CCCCCOCCCC(=O)C 7a_100000759063_100000210326 [0,1,0,0,0,0|2,0,1]=4 3173 B11R0.148 CCCCCOCCCC(C)C 34a_100000210253_100011214892 [0,1,0,0,0,0|2,0,0]=3 3174 B11R0.148 CCCCCOCCCC(C)C 34a_100000210774_100000718602 [0,1,0,0,0,0|2,0,0]=3 3175 B11R0.148 CCCCCOCCCC(C)C 7a_100000210253_100011214892 [0,1,0,0,0,0|2,0,0]=3 3176 B11R0.148 CCCCCOCCCC(C)C 7a_100000210774_100000210326 [0,1,0,0,0,0|2,0,0]=3 3177 B11R0.148 CCCCCOCCCC(C)O 34a_100000210253_200000718107 [0,1,0,0,0,0|2,0,0]=3 3178 B11R0.148 CCCCCOCCCC(C)O 7a_100000210253_200000718107 [0,1,0,0,0,0|2,0,0]=3 3179 B11R0.148 CCCCCOCCCN(C)C 7a_100000210253_100000757444 [0,1,0,0,0,0|3,0,0]=4 3180 B11R0.148 CCCCCOCCNC(=O)C 34a_100000158858_100000718602 [0,1,0,0,0,0|2,0,1]=4 3181 B11R0.148 CCCCCOCCNC(=O)C 7a_100000210253_100000189650 [0,1,0,0,0,0|2,0,1]=4 3182 B11R0.148 CCCCCOCCNC(C)C 34a_100000224655_100000718602 [0,1,0,0,0,0|2,0,0]=3 3183 B11R0.148 CCCCCOCCOC(=O)C 34a_100000210253_100009814007 [0,1,0,0,0,0|1,0,1]=3 3184 B11R0.148 CCCCCOCCOC(=O)C 7a_100000210253_100009814007 [0,1,0,0,0,0|1,0,1]=3 3185 B11R0.148 CCCCCOCCOC(=O)N 34a_100000210253_200011214921 [0,1,0,0,0,0|2,0,1]=4 3186 B11R0.148 CCCCCOCCOC(=O)N 7a_100000210253_200011214921 [0,1,0,0,0,0|2,0,1]=4 3187 B11R0.148 CCCCCOCCOC(=O)N 7a_100000766696_100000210326 [0,1,0,0,0,0|2,0,1]=4 3188 B11R0.148 CCCCCOCCOC(C)C 34a_100000210253_100000211751 [0,1,0,0,0,0|1,0,0]=2 3189 B11R0.148 CCCCCOCCOC(C)C 34a_100000211219_100000718602 [0,1,0,0,0,0|1,0,0]=2 3190 B11R0.148 CCCCCOCCOC(C)C 34a_100011215259_100000210206 [0,1,0,0,0,0|1,0,0]=2 3191 B11R0.148 CCCCCOCCOC(C)C 7a_100000210253_100000211751 [0,1,0,0,0,0|1,0,0]=2 3192 B11R0.148 CCCCCOCCOC(C)C 7a_100000211219_100000210326 [0,1,0,0,0,0|1,0,0]=2 3193 B11R0.148 CCCCCOCCOC(C)C 7a_100011215259_100000210206 [0,1,0,0,0,0|1,0,0]=2 3194 B11R0.148 CCCCCOCCSC(C)C 34a_100000210253_100000730970 [0,1,0,0,0,0|1,1,0]=3 3195 B11R0.148 CCCCCOCCSC(C)C 34a_200011212901_100000718602 [0,1,0,0,0,0|1,1,0]=3 3196 B11R0.148 CCCCCOCCSC(C)C 7a_100000210253_100000730970 [0,1,0,0,0,0|1,1,0]=3 3197 B11R0.148 CCCCCOCCSC(C)C 7a_200011212901_100000210326 [0,1,0,0,0,0|1,1,0]=3 3198 B11R0.148 CCCCCSCCCC(C)C 62a_100000210326_100011214892 [0,1,0,0,0,0|2,1,0]=4 3199 B11R0.148 CCCCCSCCCC(C)C 62a_100011214892_100000210326 [0,1,0,0,0,0|2,1,0]=4 3200 B11R0.148 CCCCCSCCCC(C)O 62a_100000210326_200000718107 [0,1,0,0,0,0|2,1,0]=4 3201 B11R0.148 CCCCCSCCCC(C)O 62a_200000718107_100000210326 [0,1,0,0,0,0|2,1,0]=4 3202 B11R0.148 CCCCCSCCOC(=O)C 62a_100000210326_100009814007 [0,1,0,0,0,0|1,1,1]=4 3203 B11R0.148 CCCCCSCCOC(=O)C 62a_100009814007_100000210326 [0,1,0,0,0,0|1,1,1]=4 3204 B11R0.148 CCCCCSCCOC(C)C 62a_100000210326_100000211751 [0,1,0,0,0,0|1,1,0]=3 3205 B11R0.148 CCCCCSCCOC(C)C 62a_100000211751_100000210326 [0,1,0,0,0,0|1,1,0]=3 3206 B11R0.148 CCCCCSCCSC(C)C 62a_100000210326_100000730970 [0,1,0,0,0,0|1,2,0]=4 3207 B11R0.148 CCCCCSCCSC(C)C 62a_100000730970_100000210326 [0,1,0,0,0,0|1,2,0]=4 3208 B11R0.148 CCCCNCCCOC(C)C 2230a_100000737246_100000210211 [0,1,0,0,0,0|3,0,0]=4 3209 B11R0.148 CCCCNCCCOC(C)C 34a_100000737246_100000210210 [0,1,0,0,0,0|3,0,0]=4 3210 B11R0.148 CCCCOCCCOC(C)C 34a_200011215613_100000210206 [0,1,0,0,0,0|3,0,0]=4 3211 B11R0.148 CCCCOCCCOC(C)C 7a_200011215613_100000210206 [0,1,0,0,0,0|3,0,0]=4 3212 B11R0.148 CCCOCOCCOC(=O)C 34a_100000210258_100000076355 [0,1,0,0,0,0|2,0,1]=4 3213 B11R0.148 CCCSCOCCOC(=O)C 62a_100000076355_100000210303 [0,1,0,0,0,0|2,0,1]=4 3214 B11R0.148 CCCSCOCCOC(=O)C 62a_100000210303_100000076355 [0,1,0,0,0,0|2,0,1]=4 3215 B11R0.148 CCNCCCCCCC(C)C 2230a_100000211014_100000210202 [0,1,0,0,0,0|3,0,0]=4 3216 B11R0.148 CCNCCCCCCC(C)C 34a_100000211014_100000210202 [0,1,0,0,0,0|3,0,0]=4 3217 B11R0.148 CCNCCCCCOC(=O)C 2230a_100015525214_100009813381 [0,1,0,0,0,0|2,0,1]=4 3218 B11R0.148 CCNCCOCCOC(=O)C 2230a_100015525214_200000083610 [0,1,0,0,0,0|1,0,1]=3 3219 B11R0.148 CCOCCCCCNC(C)C 34a_100011629493_100000210202 [0,1,0,0,0,0|2,0,0]=3 3220 B11R0.148 CCOCCCCCOC(=O)C 34a_100121572206_100000033007 [0,1,0,0,0,0|1,0,1]=3 3221 B11R0.148 CCOCCCNCCC(C)C 2230a_100000210961_100000210312 [0,1,0,0,0,0|3,0,0]=4 3222 B11R0.148 CCOCCCNCCC(C)C 269862a_100000210961_100000185833 [0,1,0,0,0,0|3,0,0]=4 3223 B11R0.148 CCOCCCNCCC(C)C 34a_100000210961_100000210312 [0,1,0,0,0,0|3,0,0]=4 3224 B11R0.148 CCOCCCNCCC(C)O 2230a_100000210961_100012276601 [0,1,0,0,0,0|3,0,0]=4 3225 B11R0.148 CCOCCCNCCC(C)O 2230a_200000755665_100012232248 [0,1,0,0,0,0|3,0,0]=4 3226 B11R0.148 CCOCCCNCCC(C)O 34a_100000210961_100012276601 [0,1,0,0,0,0|3,0,0]=4 3227 B11R0.148 CCOCCCNCOC(=O)C 34a_100000210961_100009813279 [0,1,0,0,0,0|2,0,1]=4 3228 B11R0.148 CCOCCCNCOC(C)C 2230a_100000210961_100000709892 [0,1,0,0,0,0|2,0,0]=3 3229 B11R0.148 CCOCCCNCOC(C)C 34a_100000210961_100000709892 [0,1,0,0,0,0|2,0,0]=3 3230 B11R0.148 CCOCCCOCCC(C)Br 34a_100009893172_100012232248 [0,1,0,0,0,0|3,0,0]=4 3231 B11R0.148 CCOCCCOCCC(C)C 34a_100000210254_100012232248 [0,1,0,0,0,0|3,0,0]=4 3232 B11R0.148 CCOCCCOCCC(C)C 34a_100000757476_100000210312 [0,1,0,0,0,0|3,0,0]=4 3233 B11R0.148 CCOCCCOCCC(C)C 7a_100000210254_100012232248 [0,1,0,0,0,0|3,0,0]=4 3234 B11R0.148 CCOCCCOCCC(C)C 7a_100000757476_100000210626 [0,1,0,0,0,0|3,0,0]=4 3235 B11R0.148 CCOCCCOCCC(C)O 34a_100000757476_100012276601 [0,1,0,0,0,0|3,0,0]=4 3236 B11R0.148 CCOCCCOCCC(C)O 7a_100000757476_100012276601 [0,1,0,0,0,0|3,0,0]=4 3237 B11R0.148 CCOCCCOCC[C@@H](C)N 34a_100000706166_100012232248 [0,1,0,0,0,0|3,0,0]=4 3238 B11R0.148 CCOCCCOCOC(=O)C 34a_100000757476_100009813279 [0,1,0,0,0,0|2,0,1]=4 3239 B11R0.148 CCOCCCOCOC(C)C 34a_100000757476_100000709892 [0,1,0,0,0,0|2,0,0]=3 3240 B11R0.148 CCOCCCSCCC(C)C 62a_100000210312_100012232248 [0,1,0,0,0,0|3,0,0]=4 3241 B11R0.148 CCOCCCSCCC(C)C 62a_100012232248_100000210312 [0,1,0,0,0,0|3,0,0]=4 3242 B11R0.148 CCOCCCSCCC(C)O 62a_100012232248_100012276601 [0,1,0,0,0,0|3,0,0]=4 3243 B11R0.148 CCOCCCSCCC(C)O 62a_100012276601_100012232248 [0,1,0,0,0,0|3,0,0]=4 3244 B11R0.148 CCOCCCSCOC(=O)C 62a_100000076356_100012232248 [0,1,0,0,0,0|2,0,1]=4 3245 B11R0.148 CCOCCCSCOC(=O)C 62a_100012232248_100000076356 [0,1,0,0,0,0|2,0,1]=4 3246 B11R0.148 CCOCCCSCOC(C)C 62a_100000709892_100012232248 [0,1,0,0,0,0|2,0,0]=3 3247 B11R0.148 CCOCCCSCOC(C)C 62a_100012232248_100000709892 [0,1,0,0,0,0|2,0,0]=3 3248 B11R0.148 CCOCCNCCC=C(C)C 2230a_102516460346_100011217483 [0,1,0,0,0,0|2,0,1]=4 3249 B11R0.148 CCOCCNCCC=C(C)C 34a_102516460346_100011217483 [0,1,0,0,0,0|2,0,1]=4 3250 B11R0.148 CCOCCNCCCC(=O)C 34a_102516460346_100000685027 [0,1,0,0,0,0|2,0,1]=4 3251 B11R0.148 CCOCCNCCCC(C)C 2230a_102516460346_100011214892 [0,1,0,0,0,0|2,0,0]=3 3252 B11R0.148 CCOCCNCCCC(C)C 2230a_200000737386_100011215890 [0,1,0,0,0,0|2,0,0]=3 3253 B11R0.148 CCOCCNCCCC(C)C 34a_102516460346_100011214892 [0,1,0,0,0,0|2,0,0]=3 3254 B11R0.148 CCOCCNCCCC(C)C 34a_200000737386_100000210147 [0,1,0,0,0,0|2,0,0]=3 3255 B11R0.148 CCOCCNCCCC(C)O 2230a_102516460346_200000718107 [0,1,0,0,0,0|2,0,0]=3 3256 B11R0.148 CCOCCNCCCC(C)O 34a_102516460346_200000718107 [0,1,0,0,0,0|2,0,0]=3 3257 B11R0.148 CCOCCNCCCS(=O)C 2230a_200000753449_100011215890 [0,1,0,0,0,0|3,0,0]=4 3258 B11R0.148 CCOCCNCCNC(=O)C 2230a_100000209853_100011215890 [0,1,0,0,0,0|2,0,1]=4 3259 B11R0.148 CCOCCNCCNC(=O)C 2230a_102516460346_100000189650 [0,1,0,0,0,0|2,0,1]=4 3260 B11R0.148 CCOCCNCCOC(=O)C 34a_102516460346_100009814007 [0,1,0,0,0,0|1,0,1]=3 3261 B11R0.148 CCOCCNCCOC(=O)N 34a_102516460346_200011214921 [0,1,0,0,0,0|2,0,1]=4 3262 B11R0.148 CCOCCNCCOC(C)C 2230a_100000701111_100011215890 [0,1,0,0,0,0|1,0,0]=2 3263 B11R0.148 CCOCCNCCOC(C)C 2230a_102516460346_100000211751 [0,1,0,0,0,0|1,0,0]=2 3264 B11R0.148 CCOCCNCCOC(C)C 34a_100000701111_100000210147 [0,1,0,0,0,0|1,0,0]=2 3265 B11R0.148 CCOCCNCCOC(C)C 34a_102516460346_100000211751 [0,1,0,0,0,0|1,0,0]=2 3266 B11R0.148 CCOCCNCCSC(C)C 2230a_100000731138_100011215890 [0,1,0,0,0,0|1,1,0]=3 3267 B11R0.148 CCOCCNCCSC(C)C 2230a_102516460346_100000730970 [0,1,0,0,0,0|1,1,0]=3 3268 B11R0.148 CCOCCNCCSC(C)C 34a_100000731138_100000210147 [0,1,0,0,0,0|1,1,0]=3 3269 B11R0.148 CCOCCNCCSC(C)C 34a_102516460346_100000730970 [0,1,0,0,0,0|1,1,0]=3 3270 B11R0.148 CCOCCOCCC=C(C)C 34a_100000210136_100011217483 [0,1,0,0,0,0|1,0,1]=3 3271 B11R0.148 CCOCCOCCC=C(C)C 7a_100000210136_100011217483 [0,1,0,0,0,0|1,0,1]=3 3272 B11R0.148 CCOCCOCCC=C(F)F 34a_100000210136_200009816681 [0,1,0,0,0,0|2,0,1]=4 3273 B11R0.148 CCOCCOCCC=C(F)F 7a_100000210136_200009816681 [0,1,0,0,0,0|2,0,1]=4 3274 B11R0.148 CCOCCOCCCC(=O)C 34a_100000210136_100000685027 [0,1,0,0,0,0|1,0,1]=3 3275 B11R0.148 CCOCCOCCCC(=O)C 34a_100000759063_100000210147 [0,1,0,0,0,0|1,0,1]=3 3276 B11R0.148 CCOCCOCCCC(=O)C 7a_100000210136_100011215641 [0,1,0,0,0,0|1,0,1]=3 3277 B11R0.148 CCOCCOCCCC(=O)C 7a_100000759063_100011215890 [0,1,0,0,0,0|1,0,1]=3 3278 B11R0.148 CCOCCOCCCC(=O)N 34a_100000210136_100102525003 [0,1,0,0,0,0|2,0,1]=4 3279 B11R0.148 CCOCCOCCCC(=O)N 7a_100000210136_100102525003 [0,1,0,0,0,0|2,0,1]=4 3280 B11R0.148 CCOCCOCCCC(C)C 34a_100000210136_100011214892 [0,1,0,0,0,0|1,0,0]=2 3281 B11R0.148 CCOCCOCCCC(C)C 34a_100000210774_100000210147 [0,1,0,0,0,0|1,0,0]=2 3282 B11R0.148 CCOCCOCCCC(C)C 7a_100000210136_100011214892 [0,1,0,0,0,0|1,0,0]=2 3283 B11R0.148 CCOCCOCCCC(C)C 7a_100000210774_100011215890 [0,1,0,0,0,0|1,0,0]=2 3284 B11R0.148 CCOCCOCCCC(C)O 34a_100000210136_200000718107 [0,1,0,0,0,0|1,0,0]=2 3285 B11R0.148 CCOCCOCCCC(C)O 7a_100000210136_200000718107 [0,1,0,0,0,0|1,0,0]=2 3286 B11R0.148 CCOCCOCCCN(C)C 7a_100000210136_100000757444 [0,1,0,0,0,0|2,0,0]=3 3287 B11R0.148 CCOCCOCCC[N+](=O)[O-] 34a_200000037920_100000210147 [0,1,0,0,0,0|3,0,0]=4 3288 B11R0.148 CCOCCOCCNC(=O)C 11a_100102712874_100015343762 [0,1,0,0,0,0|1,0,1]=3 3289 B11R0.148 CCOCCOCCNC(=O)C 1626a_100102712874_100015343762 [0,1,0,0,0,0|1,0,1]=3 3290 B11R0.148 CCOCCOCCNC(=O)C 240690a_100102712874_100015343762 [0,1,0,0,0,0|1,0,1]=3 3291 B11R0.148 CCOCCOCCNC(=O)C 34a_100000158858_100000210147 [0,1,0,0,0,0|1,0,1]=3 3292 B11R0.148 CCOCCOCCNC(=O)C 527a_100102712874_100103153847 [0,1,0,0,0,0|1,0,1]=3 3293 B11R0.148 CCOCCOCCNC(=O)C 7a_100000210136_100000189650 [0,1,0,0,0,0|1,0,1]=3 3294 B11R0.148 CCOCCOCCNC(=O)N 34a_100000181757_100000210147 [0,1,0,0,0,0|2,0,1]=4 3295 B11R0.148 CCOCCOCCNC(=O)N 7a_100000210136_200000034859 [0,1,0,0,0,0|2,0,1]=4 3296 B11R0.148 CCOCCOCCNC(C)C 2230a_100102712874_100000210206 [0,1,0,0,0,0|1,0,0]=2 3297 B11R0.148 CCOCCOCCNC(C)C 2230a_100138425928_100011211534 [0,1,0,0,0,0|1,0,0]=2 3298 B11R0.148 CCOCCOCCNC(C)C 34a_100000224655_100000210147 [0,1,0,0,0,0|1,0,0]=2 3299 B11R0.148 CCOCCOCCNC(C)C 34a_100102712874_100000210206 [0,1,0,0,0,0|1,0,0]=2 3300 B11R0.148 CCOCCOCCNC(C)C 34a_100138425928_100011211534 [0,1,0,0,0,0|1,0,0]=2 3301 B11R0.148 CCOCCOCCOC(=O)C 34a_100000210136_100009814007 [0,1,0,0,0,0|0,0,1]=2 3302 B11R0.148 CCOCCOCCOC(=O)C 34a_100121572206_200000083610 [0,1,0,0,0,0|0,0,1]=2 3303 B11R0.148 CCOCCOCCOC(=O)C 7a_100000210136_100009814007 [0,1,0,0,0,0|0,0,1]=2 3304 B11R0.148 CCOCCOCCOC(=O)N 34a_100000210136_200011214921 [0,1,0,0,0,0|1,0,1]=3 3305 B11R0.148 CCOCCOCCOC(=O)N 7a_100000210136_200011214921 [0,1,0,0,0,0|1,0,1]=3 3306 B11R0.148 CCOCCOCCOC(=O)N 7a_100000766696_100011215890 [0,1,0,0,0,0|1,0,1]=3 3307 B11R0.148 CCOCCOCCOC(C)C 34a_100000210136_100000211751 [0,1,0,0,0,0|0,0,0]=1 3308 B11R0.148 CCOCCOCCOC(C)C 34a_100000210240_100000210206 [0,1,0,0,0,0|0,0,0]=1 3309 B11R0.148 CCOCCOCCOC(C)C 34a_100000211219_100000210147 [0,1,0,0,0,0|0,0,0]=1 3310 B11R0.148 CCOCCOCCOC(C)C 34a_100000212225_100011211534 [0,1,0,0,0,0|0,0,0]=1 3311 B11R0.148 CCOCCOCCOC(C)C 7a_100000210136_100000211751 [0,1,0,0,0,0|0,0,0]=1 3312 B11R0.148 CCOCCOCCOC(C)C 7a_100000210240_100000210206 [0,1,0,0,0,0|0,0,0]=1 3313 B11R0.148 CCOCCOCCOC(C)C 7a_100000211219_100011215890 [0,1,0,0,0,0|0,0,0]=1 3314 B11R0.148 CCOCCOCCSC(C)C 34a_100000210136_100000730970 [0,1,0,0,0,0|0,1,0]=2 3315 B11R0.148 CCOCCOCCSC(C)C 34a_200011212901_100000210147 [0,1,0,0,0,0|0,1,0]=2 3316 B11R0.148 CCOCCOCCSC(C)C 62a_100000210206_100011211534 [0,1,0,0,0,0|0,1,0]=2 3317 B11R0.148 CCOCCOCCSC(C)C 62a_100011211534_100000210206 [0,1,0,0,0,0|0,1,0]=2 3318 B11R0.148 CCOCCOCCSC(C)C 7a_100000210136_100000730970 [0,1,0,0,0,0|0,1,0]=2 3319 B11R0.148 CCOCCOCCSC(C)C 7a_200011212901_100011215890 [0,1,0,0,0,0|0,1,0]=2 3320 B11R0.148 CCOCCSCCC=C(C)C 62a_100000210147_100011217483 [0,1,0,0,0,0|1,1,1]=4 3321 B11R0.148 CCOCCSCCC=C(C)C 62a_100011217483_100011215890 [0,1,0,0,0,0|1,1,1]=4 3322 B11R0.148 CCOCCSCCCC(=O)C 62a_100000210147_100011215641 [0,1,0,0,0,0|1,1,1]=4 3323 B11R0.148 CCOCCSCCCC(=O)C 62a_100011215641_100011215890 [0,1,0,0,0,0|1,1,1]=4 3324 B11R0.148 CCOCCSCCCC(C)C 62a_100000210147_100011214892 [0,1,0,0,0,0|1,1,0]=3 3325 B11R0.148 CCOCCSCCCC(C)C 62a_100011214892_100011215890 [0,1,0,0,0,0|1,1,0]=3 3326 B11R0.148 CCOCCSCCCC(C)O 62a_100000210147_200000718107 [0,1,0,0,0,0|1,1,0]=3 3327 B11R0.148 CCOCCSCCCC(C)O 62a_200000718107_100011215890 [0,1,0,0,0,0|1,1,0]=3 3328 B11R0.148 CCOCCSCCCN(C)C 62a_100000210147_100000757444 [0,1,0,0,0,0|2,1,0]=4 3329 B11R0.148 CCOCCSCCNC(=O)C 62a_100000189650_100011215890 [0,1,0,0,0,0|1,1,1]=4 3330 B11R0.148 CCOCCSCCNC(=O)C 62a_100000210147_100000189650 [0,1,0,0,0,0|1,1,1]=4 3331 B11R0.148 CCOCCSCCOC(=O)C 62a_100000210147_100009814007 [0,1,0,0,0,0|0,1,1]=3 3332 B11R0.148 CCOCCSCCOC(=O)C 62a_100009814007_100011215890 [0,1,0,0,0,0|0,1,1]=3 3333 B11R0.148 CCOCCSCCOC(=O)N 62a_100000210147_200011214921 [0,1,0,0,0,0|1,1,1]=4 3334 B11R0.148 CCOCCSCCOC(=O)N 62a_200011214921_100011215890 [0,1,0,0,0,0|1,1,1]=4 3335 B11R0.148 CCOCCSCCOC(C)C 62a_100000210147_100000211751 [0,1,0,0,0,0|0,1,0]=2 3336 B11R0.148 CCOCCSCCOC(C)C 62a_100000211751_100011215890 [0,1,0,0,0,0|0,1,0]=2 3337 B11R0.148 CCOCCSCCSC(C)C 62a_100000210147_100000730970 [0,1,0,0,0,0|0,2,0]=3 3338 B11R0.148 CCOCCSCCSC(C)C 62a_100000730970_100011215890 [0,1,0,0,0,0|0,2,0]=3 3339 B11R0.148 CCOCSCCCCC(C)C 62a_100000739092_100011216152 [0,1,0,0,0,0|3,0,0]=4 3340 B11R0.148 CCOCSCCCCC(C)C 62a_100011216152_100000739092 [0,1,0,0,0,0|3,0,0]=4 3341 B11R0.148 CCOCSCCCOC(=O)C 62a_100000042594_100000739092 [0,1,0,0,0,0|2,0,1]=4 3342 B11R0.148 CCOCSCCCOC(=O)C 62a_100000739092_100000042594 [0,1,0,0,0,0|2,0,1]=4 3343 B11R0.148 CCOCSCCCOC(=S)C 62a_100000739092_200135323944 [0,1,0,0,0,0|2,0,1]=4 3344 B11R0.148 CCOCSCCCOC(=S)C 62a_200135323944_100000739092 [0,1,0,0,0,0|2,0,1]=4 3345 B11R0.148 CCSCCCCCOC(=O)C 62a_100000033007_100000210202 [0,1,0,0,0,0|1,1,1]=4 3346 B11R0.148 CCSCCCCCOC(=O)C 62a_100000210202_100000033007 [0,1,0,0,0,0|1,1,1]=4 3347 B11R0.148 CCSCCCOCOC(C)C 34a_100011216438_100000709892 [0,1,0,0,0,0|2,1,0]=4 3348 B11R0.148 CCSCCNCCCC(C)C 2230a_100000106463_100011214892 [0,1,0,0,0,0|2,1,0]=4 3349 B11R0.148 CCSCCNCCCC(C)C 2230a_200000737386_100000757381 [0,1,0,0,0,0|2,1,0]=4 3350 B11R0.148 CCSCCNCCCC(C)C 34a_200000737386_100000757381 [0,1,0,0,0,0|2,1,0]=4 3351 B11R0.148 CCSCCNCCCC(C)O 2230a_100000106463_200000718107 [0,1,0,0,0,0|2,1,0]=4 3352 B11R0.148 CCSCCNCCOC(C)C 2230a_100000106463_100000211751 [0,1,0,0,0,0|1,1,0]=3 3353 B11R0.148 CCSCCNCCOC(C)C 2230a_100000701111_100000757381 [0,1,0,0,0,0|1,1,0]=3 3354 B11R0.148 CCSCCNCCOC(C)C 34a_100000701111_100000757381 [0,1,0,0,0,0|1,1,0]=3 3355 B11R0.148 CCSCCNCCSC(C)C 2230a_100000106463_100000730970 [0,1,0,0,0,0|1,2,0]=4 3356 B11R0.148 CCSCCNCCSC(C)C 2230a_100000731138_100000757381 [0,1,0,0,0,0|1,2,0]=4 3357 B11R0.148 CCSCCNCCSC(C)C 34a_100000731138_100000757381 [0,1,0,0,0,0|1,2,0]=4 3358 B11R0.148 CCSCCOCCC=C(C)C 34a_100000212035_100011217483 [0,1,0,0,0,0|1,1,1]=4 3359 B11R0.148 CCSCCOCCC=C(C)C 7a_100000212035_100011217483 [0,1,0,0,0,0|1,1,1]=4 3360 B11R0.148 CCSCCOCCCC(=O)C 34a_100000212035_100000685027 [0,1,0,0,0,0|1,1,1]=4 3361 B11R0.148 CCSCCOCCCC(=O)C 34a_100000759063_100000757381 [0,1,0,0,0,0|1,1,1]=4 3362 B11R0.148 CCSCCOCCCC(=O)C 7a_100000212035_100011215641 [0,1,0,0,0,0|1,1,1]=4 3363 B11R0.148 CCSCCOCCCC(=O)C 7a_100000759063_100000757381 [0,1,0,0,0,0|1,1,1]=4 3364 B11R0.148 CCSCCOCCCC(C)C 34a_100000210774_100000757381 [0,1,0,0,0,0|1,1,0]=3 3365 B11R0.148 CCSCCOCCCC(C)C 34a_100000212035_100011214892 [0,1,0,0,0,0|1,1,0]=3 3366 B11R0.148 CCSCCOCCCC(C)C 7a_100000210774_100000757381 [0,1,0,0,0,0|1,1,0]=3 3367 B11R0.148 CCSCCOCCCC(C)C 7a_100000212035_100011214892 [0,1,0,0,0,0|1,1,0]=3 3368 B11R0.148 CCSCCOCCCC(C)O 34a_100000212035_200000718107 [0,1,0,0,0,0|1,1,0]=3 3369 B11R0.148 CCSCCOCCCC(C)O 7a_100000212035_200000718107 [0,1,0,0,0,0|1,1,0]=3 3370 B11R0.148 CCSCCOCCCN(C)C 7a_100000212035_100000757444 [0,1,0,0,0,0|2,1,0]=4 3371 B11R0.148 CCSCCOCCNC(=O)C 34a_100000158858_100000757381 [0,1,0,0,0,0|1,1,1]=4 3372 B11R0.148 CCSCCOCCNC(=O)C 7a_100000212035_100000189650 [0,1,0,0,0,0|1,1,1]=4 3373 B11R0.148 CCSCCOCCNC(C)C 34a_100000224655_100000757381 [0,1,0,0,0,0|1,1,0]=3 3374 B11R0.148 CCSCCOCCOC(=O)C 34a_100000212035_100009814007 [0,1,0,0,0,0|0,1,1]=3 3375 B11R0.148 CCSCCOCCOC(=O)C 62a_100000210202_200000083610 [0,1,0,0,0,0|0,1,1]=3 3376 B11R0.148 CCSCCOCCOC(=O)C 62a_200000083610_100000210202 [0,1,0,0,0,0|0,1,1]=3 3377 B11R0.148 CCSCCOCCOC(=O)C 7a_100000212035_100009814007 [0,1,0,0,0,0|0,1,1]=3 3378 B11R0.148 CCSCCOCCOC(=O)N 34a_100000212035_200011214921 [0,1,0,0,0,0|1,1,1]=4 3379 B11R0.148 CCSCCOCCOC(=O)N 7a_100000212035_200011214921 [0,1,0,0,0,0|1,1,1]=4 3380 B11R0.148 CCSCCOCCOC(=O)N 7a_100000766696_100000757381 [0,1,0,0,0,0|1,1,1]=4 3381 B11R0.148 CCSCCOCCOC(C)C 34a_100000211219_100000757381 [0,1,0,0,0,0|0,1,0]=2 3382 B11R0.148 CCSCCOCCOC(C)C 34a_100000212035_100000211751 [0,1,0,0,0,0|0,1,0]=2 3383 B11R0.148 CCSCCOCCOC(C)C 7a_100000211219_100000757381 [0,1,0,0,0,0|0,1,0]=2 3384 B11R0.148 CCSCCOCCOC(C)C 7a_100000212035_100000211751 [0,1,0,0,0,0|0,1,0]=2 3385 B11R0.148 CCSCCOCCSC(C)C 34a_100000212035_100000730970 [0,1,0,0,0,0|0,2,0]=3 3386 B11R0.148 CCSCCOCCSC(C)C 34a_200011212901_100000757381 [0,1,0,0,0,0|0,2,0]=3 3387 B11R0.148 CCSCCOCCSC(C)C 7a_100000212035_100000730970 [0,1,0,0,0,0|0,2,0]=3 3388 B11R0.148 CCSCCOCCSC(C)C 7a_200011212901_100000757381 [0,1,0,0,0,0|0,2,0]=3 3389 B11R0.148 CCSCCSCCCC(C)C 62a_100000757381_100011214892 [0,1,0,0,0,0|1,2,0]=4 3390 B11R0.148 CCSCCSCCCC(C)C 62a_100011214892_100000757381 [0,1,0,0,0,0|1,2,0]=4 3391 B11R0.148 CCSCCSCCCC(C)O 62a_100000757381_200000718107 [0,1,0,0,0,0|1,2,0]=4 3392 B11R0.148 CCSCCSCCCC(C)O 62a_200000718107_100000757381 [0,1,0,0,0,0|1,2,0]=4 3393 B11R0.148 CCSCCSCCOC(=O)C 62a_100000757381_100009814007 [0,1,0,0,0,0|0,2,1]=4 3394 B11R0.148 CCSCCSCCOC(=O)C 62a_100009814007_100000757381 [0,1,0,0,0,0|0,2,1]=4 3395 B11R0.148 CCSCCSCCOC(C)C 62a_100000211751_100000757381 [0,1,0,0,0,0|0,2,0]=3 3396 B11R0.148 CCSCCSCCOC(C)C 62a_100000757381_100000211751 [0,1,0,0,0,0|0,2,0]=3 3397 B11R0.148 CCSCCSCCSC(C)C 62a_100000730970_100000757381 [0,1,0,0,0,0|0,3,0]=4 3398 B11R0.148 CCSCCSCCSC(C)C 62a_100000757381_100000730970 [0,1,0,0,0,0|0,3,0]=4 3399 B11R0.148 CNCCCOCCCC(C)C 34a_100000213112_100011214892 [0,1,0,0,0,0|3,0,0]=4 3400 B11R0.148 CNCCCOCCCC(C)O 34a_100000213112_200000718107 [0,1,0,0,0,0|3,0,0]=4 3401 B11R0.148 CNCCCOCCOC(=O)C 34a_100000213112_100009814007 [0,1,0,0,0,0|2,0,1]=4 3402 B11R0.148 CNCCCOCCOC(C)C 34a_100000213112_100000211751 [0,1,0,0,0,0|2,0,0]=3 3403 B11R0.148 CNCCCOCCSC(C)C 34a_100000213112_100000730970 [0,1,0,0,0,0|2,1,0]=4 3404 B11R0.148 COCCCCCCOC(C)C 34a_100000212225_100011998445 [0,1,0,0,0,0|3,0,0]=4 3405 B11R0.148 COCCCCCCOC(C)C 34a_200012092642_100000210206 [0,1,0,0,0,0|3,0,0]=4 3406 B11R0.148 COCCCCCCOC(C)C 7a_200012092642_100000210206 [0,1,0,0,0,0|3,0,0]=4 3407 B11R0.148 COCCCNCCOC(C)C 2230a_100000701111_100000740836 [0,1,0,0,0,0|3,0,0]=4 3408 B11R0.148 COCCCNCCOC(C)C 34a_100000701111_100000740836 [0,1,0,0,0,0|3,0,0]=4 3409 B11R0.148 COCCCNCCOC(C)C 34a_100150723488_100000211751 [0,1,0,0,0,0|3,0,0]=4 3410 B11R0.148 COCCCOCCCC(C)C 34a_100000210774_100000740836 [0,1,0,0,0,0|3,0,0]=4 3411 B11R0.148 COCCCOCCCC(C)C 34a_100000740835_100011214892 [0,1,0,0,0,0|3,0,0]=4 3412 B11R0.148 COCCCOCCCC(C)C 7a_100000210774_100000740836 [0,1,0,0,0,0|3,0,0]=4 3413 B11R0.148 COCCCOCCCC(C)O 34a_100000740835_200000718107 [0,1,0,0,0,0|3,0,0]=4 3414 B11R0.148 COCCCOCCNC(C)C 34a_100000224655_100000740836 [0,1,0,0,0,0|3,0,0]=4 3415 B11R0.148 COCCCOCCOC(=O)C 34a_100000740835_100009814007 [0,1,0,0,0,0|2,0,1]=4 3416 B11R0.148 COCCCOCCOC(C)C 34a_100000211219_100000740836 [0,1,0,0,0,0|2,0,0]=3 3417 B11R0.148 COCCCOCCOC(C)C 34a_100000740835_100000211751 [0,1,0,0,0,0|2,0,0]=3 3418 B11R0.148 COCCCOCCOC(C)C 7a_100000211219_100000740836 [0,1,0,0,0,0|2,0,0]=3 3419 B11R0.148 COCCCOCCSC(C)C 34a_100000740835_100000730970 [0,1,0,0,0,0|2,1,0]=4 3420 B11R0.148 COCCCOCCSC(C)C 34a_200011212901_100000740836 [0,1,0,0,0,0|2,1,0]=4 3421 B11R0.148 COCCCOCCSC(C)C 7a_200011212901_100000740836 [0,1,0,0,0,0|2,1,0]=4 3422 B11R0.148 COCCCSCCOC(C)C 62a_100000211751_100000709357 [0,1,0,0,0,0|2,1,0]=4 3423 B11R0.148 COCCCSCCOC(C)C 62a_100000709357_100000211751 [0,1,0,0,0,0|2,1,0]=4 3424 B11R0.148 CSCCCNCCOC(C)C 2230a_100000749238_100000211751 [0,1,0,0,0,0|3,0,0]=4 3425 B11R0.148 CSCCCOCCCC(C)C 34a_100000690336_100011214892 [0,1,0,0,0,0|3,0,0]=4 3426 B11R0.148 CSCCCOCCCC(C)C 7a_100000690336_100011214892 [0,1,0,0,0,0|3,0,0]=4 3427 B11R0.148 CSCCCOCCCC(C)O 34a_100000690336_200000718107 [0,1,0,0,0,0|3,0,0]=4 3428 B11R0.148 CSCCCOCCCC(C)O 7a_100000690336_200000718107 [0,1,0,0,0,0|3,0,0]=4 3429 B11R0.148 CSCCCOCCOC(=O)C 34a_100000690336_100009814007 [0,1,0,0,0,0|2,0,1]=4 3430 B11R0.148 CSCCCOCCOC(=O)C 7a_100000690336_100009814007 [0,1,0,0,0,0|2,0,1]=4 3431 B11R0.148 CSCCCOCCOC(C)C 34a_100000690336_100000211751 [0,1,0,0,0,0|2,0,0]=3 3432 B11R0.148 CSCCCOCCOC(C)C 7a_100000690336_100000211751 [0,1,0,0,0,0|2,0,0]=3 3433 B11R0.148 CSCCCOCCSC(C)C 34a_100000690336_100000730970 [0,1,0,0,0,0|2,1,0]=4 3434 B11R0.148 CSCCCOCCSC(C)C 7a_100000690336_100000730970 [0,1,0,0,0,0|2,1,0]=4 3435 B11R1.4 BrCCCCOC1CCCC1 34a_100011216708_100000179811 [0,0,0,1,0,0|3,0,0]=4 3436 B11R1.4 BrCCCCOC1CCOC1 34a_100011216708_100000690089 [0,0,0,1,0,0|2,0,0]=3 3437 B11R1.4 C#CCCCOC1CCOC1 34a_100000215630_100000690089 [0,0,0,1,0,0|1,0,2]=4 3438 B11R1.4 C#CCCCOC1CCOC1 7a_100000215630_100000731011 [0,0,0,1,0,0|1,0,2]=4 3439 B11R1.4 C#CCCCO[C@H]1CCOC1 34a_100000717292_100000695029 [0,0,0,1,0,0|1,0,2]=4 3440 B11R1.4 C/C=C/CCOC1CCCC1 34a_100016278192_100000179811 [0,0,0,1,0,0|2,0,1]=4 3441 B11R1.4 C/C=C/CCOC1CCOC1 34a_100016278192_100000690089 [0,0,0,1,0,0|1,0,1]=3 3442 B11R1.4 C=CCCCOC1CCOC1 34a_100000758997_100000690089 [0,0,0,1,0,0|1,0,2]=4 3443 B11R1.4 C=CCCCOC1CCOC1 7a_100000758997_100000731011 [0,0,0,1,0,0|1,0,2]=4 3444 B11R1.4 C=CCCCO[C@H]1CCOC1 34a_100000717292_100000757094 [0,0,0,1,0,0|1,0,2]=4 3445 B11R1.4 C=COCCN[C@@H]1CCOC1 2230a_200015188469_100000039644 [0,0,0,1,0,0|1,0,2]=4 3446 B11R1.4 C=COCCN[C@H]1CCOC1 2230a_100015188467_100000039644 [0,0,0,1,0,0|1,0,2]=4 3447 B11R1.4 C=COCCN[C@H]1CCOC1 34a_100015188467_100000039644 [0,0,0,1,0,0|1,0,2]=4 3448 B11R1.4 C=COCCOC1CCCC1 34a_100000033082_100000179811 [0,0,0,1,0,0|1,0,2]=4 3449 B11R1.4 C=COCCOC1CCCC1 34a_100000210269_100000039644 [0,0,0,1,0,0|1,0,2]=4 3450 B11R1.4 C=COCCOC1CCCC1 7a_100000210269_100000039644 [0,0,0,1,0,0|1,0,2]=4 3451 B11R1.4 C=COCCOC1CCOC1 34a_100000033082_100000690089 [0,0,0,1,0,0|0,0,2]=3 3452 B11R1.4 C=COCCOC1CCSC1 7a_100011232664_100000039644 [0,0,0,1,0,0|0,1,2]=4 3453 B11R1.4 C=COCCO[C@H]1CCOC1 34a_100000717292_100000039644 [0,0,0,1,0,0|0,0,2]=3 3454 B11R1.4 C=COCCSC1CCOC1 62a_100000039644_100000690089 [0,0,0,1,0,0|0,1,2]=4 3455 B11R1.4 CC#CCCOC1CCCC1 34a_100000750427_100000179811 [0,0,0,1,0,0|2,0,1]=4 3456 B11R1.4 CC#CCCOC1CCOC1 34a_100000750427_100000690089 [0,0,0,1,0,0|1,0,1]=3 3457 B11R1.4 CC/C=C\CN[C@@H]1CCOC1 2230a_200015188469_100103147603 [0,0,0,1,0,0|2,0,1]=4 3458 B11R1.4 CC/C=C\CN[C@H]1CCOC1 2230a_100015188467_100103147603 [0,0,0,1,0,0|2,0,1]=4 3459 B11R1.4 CC/C=C\CN[C@H]1CCOC1 34a_100015188467_100103147603 [0,0,0,1,0,0|2,0,1]=4 3460 B11R1.4 CC/C=C\COC1CCCC1 34a_100000210269_100103147603 [0,0,0,1,0,0|2,0,1]=4 3461 B11R1.4 CC/C=C\COC1CCCC1 34a_100016268518_100000179811 [0,0,0,1,0,0|2,0,1]=4 3462 B11R1.4 CC/C=C\COC1CCCC1 7a_100000210269_100103147603 [0,0,0,1,0,0|2,0,1]=4 3463 B11R1.4 CC/C=C\COC1CCOC1 34a_100016268518_100000690089 [0,0,0,1,0,0|1,0,1]=3 3464 B11R1.4 CC/C=C\COC1CCSC1 7a_100011232664_100103147603 [0,0,0,1,0,0|1,1,1]=4 3465 B11R1.4 CC/C=C\CO[C@H]1CCOC1 34a_100000717292_100103147603 [0,0,0,1,0,0|1,0,1]=3 3466 B11R1.4 CC/C=C\CSC1CCOC1 62a_100103147603_100000690089 [0,0,0,1,0,0|1,1,1]=4 3467 B11R1.4 CCC#CCN[C@@H]1CCOC1 2230a_200015188469_100009813939 [0,0,0,1,0,0|2,0,1]=4 3468 B11R1.4 CCC#CCN[C@H]1CCOC1 2230a_100015188467_100009813939 [0,0,0,1,0,0|2,0,1]=4 3469 B11R1.4 CCC#CCN[C@H]1CCOC1 34a_100015188467_100009813939 [0,0,0,1,0,0|2,0,1]=4 3470 B11R1.4 CCC#CCOC1CCCC1 34a_100000032950_100000179811 [0,0,0,1,0,0|2,0,1]=4 3471 B11R1.4 CCC#CCOC1CCCC1 34a_100000210269_100009813939 [0,0,0,1,0,0|2,0,1]=4 3472 B11R1.4 CCC#CCOC1CCCC1 7a_100000210269_100009813939 [0,0,0,1,0,0|2,0,1]=4 3473 B11R1.4 CCC#CCOC1CCOC1 34a_100000032950_100000690089 [0,0,0,1,0,0|1,0,1]=3 3474 B11R1.4 CCC#CCOC1CCSC1 7a_100011232664_100009813939 [0,0,0,1,0,0|1,1,1]=4 3475 B11R1.4 CCC#CCO[C@H]1CCOC1 34a_100000717292_100009813939 [0,0,0,1,0,0|1,0,1]=3 3476 B11R1.4 CCC#CCSC1CCOC1 62a_100009813939_100000690089 [0,0,0,1,0,0|1,1,1]=4 3477 B11R1.4 CCCCCNC1CCCC1 2230a_100000209983_100000179811 [0,0,0,1,0,0|3,0,0]=4 3478 B11R1.4 CCCCCNC1CCCC1 2230a_100000211070_100000210326 [0,0,0,1,0,0|3,0,0]=4 3479 B11R1.4 CCCCCNC1CCCC1 270004a_100000209983_100000210133 [0,0,0,1,0,0|3,0,0]=4 3480 B11R1.4 CCCCCNC1CCCC1 34a_100000211070_100000718602 [0,0,0,1,0,0|3,0,0]=4 3481 B11R1.4 CCCCCNC1CCOC1 2230a_100000209983_100000731011 [0,0,0,1,0,0|2,0,0]=3 3482 B11R1.4 CCCCCNC1CCOC1 270004a_100000209983_100000752484 [0,0,0,1,0,0|2,0,0]=3 3483 B11R1.4 CCCCCNC1CCSC1 270004a_100000209983_100000212027 [0,0,0,1,0,0|2,1,0]=4 3484 B11R1.4 CCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210326 [0,0,0,1,0,0|2,0,0]=3 3485 B11R1.4 CCCCCN[C@H]1CCOC1 2230a_100015188467_100000210326 [0,0,0,1,0,0|2,0,0]=3 3486 B11R1.4 CCCCCN[C@H]1CCOC1 34a_100015188467_100000718602 [0,0,0,1,0,0|2,0,0]=3 3487 B11R1.4 CCCCCOC1CCCC1 34a_100000210253_100000179811 [0,0,0,1,0,0|2,0,0]=3 3488 B11R1.4 CCCCCOC1CCCC1 34a_100000210269_100000718602 [0,0,0,1,0,0|2,0,0]=3 3489 B11R1.4 CCCCCOC1CCCC1 7a_100000210253_100000179811 [0,0,0,1,0,0|2,0,0]=3 3490 B11R1.4 CCCCCOC1CCCC1 7a_100000210269_100000210326 [0,0,0,1,0,0|2,0,0]=3 3491 B11R1.4 CCCCCOC1CCCO1 34a_100000085407_100000718602 [0,0,0,1,0,0|3,0,0]=4 3492 B11R1.4 CCCCCOC1CCOC1 34a_100000210253_100000690089 [0,0,0,1,0,0|1,0,0]=2 3493 B11R1.4 CCCCCOC1CCOC1 7a_100000210253_100000731011 [0,0,0,1,0,0|1,0,0]=2 3494 B11R1.4 CCCCCOC1CCSC1 7a_100011232664_100000210326 [0,0,0,1,0,0|1,1,0]=3 3495 B11R1.4 CCCCCO[C@H]1CCOC1 34a_100000717292_100000718602 [0,0,0,1,0,0|1,0,0]=2 3496 B11R1.4 CCCCCSC1CCCC1 62a_100000210326_100000179811 [0,0,0,1,0,0|2,1,0]=4 3497 B11R1.4 CCCCCSC1CCCC1 62a_100011217020_100000210326 [0,0,0,1,0,0|2,1,0]=4 3498 B11R1.4 CCCCCSC1CCOC1 62a_100000210326_100000690089 [0,0,0,1,0,0|1,1,0]=3 3499 B11R1.4 CCCCNCC1CCOC1 2230a_100000102301_100000702531 [0,0,0,1,0,0|3,0,0]=4 3500 B11R1.4 CCCCNCC1CCOC1 2230a_100000737293_100000210211 [0,0,0,1,0,0|3,0,0]=4 3501 B11R1.4 CCCCNCC1CCOC1 34a_100000737293_100000210210 [0,0,0,1,0,0|3,0,0]=4 3502 B11R1.4 CCCCNCC1CCOC1 7a_106832991798_100000702531 [0,0,0,1,0,0|3,0,0]=4 3503 B11R1.4 CCCCOCC1CCOC1 34a_100000210227_100011261433 [0,0,0,1,0,0|3,0,0]=4 3504 B11R1.4 CCCCOCC1CCOC1 34a_100000740260_100000210210 [0,0,0,1,0,0|3,0,0]=4 3505 B11R1.4 CCCCOCC1CCOC1 7a_100000210227_100000702531 [0,0,0,1,0,0|3,0,0]=4 3506 B11R1.4 CCCCSCC1CCOC1 62a_100000210211_100000702531 [0,0,0,1,0,0|3,0,0]=4 3507 B11R1.4 CCCCSCC1CCOC1 62a_100000702531_100000210210 [0,0,0,1,0,0|3,0,0]=4 3508 B11R1.4 CCCOCCC1CCOC1 34a_100011879284_100000210303 [0,0,0,1,0,0|3,0,0]=4 3509 B11R1.4 CCNCCCC1CCCC1 2230a_100000736752_100000210202 [0,0,0,1,0,0|3,0,0]=4 3510 B11R1.4 CCNCCCC1CCCC1 2230a_100015525214_100011713738 [0,0,0,1,0,0|3,0,0]=4 3511 B11R1.4 CCNCCCC1CCCC1 34a_100000736752_100000210202 [0,0,0,1,0,0|3,0,0]=4 3512 B11R1.4 CCNCCOC1CCCC1 34a_100000741755_100000210202 [0,0,0,1,0,0|2,0,0]=3 3513 B11R1.4 CCOCCCC1CCCC1 34a_100011215328_100000210202 [0,0,0,1,0,0|2,0,0]=3 3514 B11R1.4 CCOCCCC1CCCC1 34a_100121572206_100011713738 [0,0,0,1,0,0|2,0,0]=3 3515 B11R1.4 CCOCCCC1CCCC1 7a_100011215328_100000210202 [0,0,0,1,0,0|2,0,0]=3 3516 B11R1.4 CCOCCCN1CCCC1 2230a_100000188435_100012232248 [0,0,0,1,0,0|3,0,0]=4 3517 B11R1.4 CCOCCCN1CCCC1 269982a_100000188435_100012232248 [0,0,0,1,0,0|3,0,0]=4 3518 B11R1.4 CCOCCCN1CCCC1 34a_100121572206_100016991639 [0,0,0,1,0,0|3,0,0]=4 3519 B11R1.4 CCOCCCN1CCSC1 2230a_100011215254_100012232248 [0,0,0,1,0,0|2,1,0]=4 3520 B11R1.4 CCOCCCN1CCSC1 269982a_100011215254_100012232248 [0,0,0,1,0,0|2,1,0]=4 3521 B11R1.4 CCOCCNC1CC=CC1 2230a_100015188752_100011215890 [0,0,0,1,0,0|2,0,1]=4 3522 B11R1.4 CCOCCNC1CCCC1 2230a_100000211070_100011215890 [0,0,0,1,0,0|2,0,0]=3 3523 B11R1.4 CCOCCNC1CCCC1 2230a_102516460346_100000179811 [0,0,0,1,0,0|2,0,0]=3 3524 B11R1.4 CCOCCNC1CCCC1 270004a_102516460346_100000210133 [0,0,0,1,0,0|2,0,0]=3 3525 B11R1.4 CCOCCNC1CCCC1 34a_100000211070_100000210147 [0,0,0,1,0,0|2,0,0]=3 3526 B11R1.4 CCOCCNC1CCCC1 34a_102516460346_100000179811 [0,0,0,1,0,0|2,0,0]=3 3527 B11R1.4 CCOCCNC1CCCC1 34a_200000200444_100000210202 [0,0,0,1,0,0|2,0,0]=3 3528 B11R1.4 CCOCCNC1CCOC1 2230a_102516460346_100000731011 [0,0,0,1,0,0|1,0,0]=2 3529 B11R1.4 CCOCCNC1CCOC1 270004a_102516460346_100000752484 [0,0,0,1,0,0|1,0,0]=2 3530 B11R1.4 CCOCCNC1CCOC1 34a_102516460346_100000690089 [0,0,0,1,0,0|1,0,0]=2 3531 B11R1.4 CCOCCNC1CCSC1 270004a_102516460346_100000212027 [0,0,0,1,0,0|1,1,0]=3 3532 B11R1.4 CCOCCN[C@@H]1CCOC1 2230a_200015188469_100011215890 [0,0,0,1,0,0|1,0,0]=2 3533 B11R1.4 CCOCCN[C@H]1CCOC1 2230a_100015188467_100011215890 [0,0,0,1,0,0|1,0,0]=2 3534 B11R1.4 CCOCCN[C@H]1CCOC1 34a_100015188467_100000210147 [0,0,0,1,0,0|1,0,0]=2 3535 B11R1.4 CCOCCOC1CCCC1 34a_100000210136_100000179811 [0,0,0,1,0,0|1,0,0]=2 3536 B11R1.4 CCOCCOC1CCCC1 34a_100000210269_100000210147 [0,0,0,1,0,0|1,0,0]=2 3537 B11R1.4 CCOCCOC1CCCC1 34a_100000738311_100000210202 [0,0,0,1,0,0|1,0,0]=2 3538 B11R1.4 CCOCCOC1CCCC1 7a_100000210136_100000179811 [0,0,0,1,0,0|1,0,0]=2 3539 B11R1.4 CCOCCOC1CCCC1 7a_100000210269_100011215890 [0,0,0,1,0,0|1,0,0]=2 3540 B11R1.4 CCOCCOC1CCCC1 7a_100000738311_100000210202 [0,0,0,1,0,0|1,0,0]=2 3541 B11R1.4 CCOCCOC1CCCO1 34a_100000085407_100000210147 [0,0,0,1,0,0|2,0,0]=3 3542 B11R1.4 CCOCCOC1CCOC1 34a_100000210136_100000690089 [0,0,0,1,0,0|0,0,0]=1 3543 B11R1.4 CCOCCOC1CCOC1 7a_100000210136_100000731011 [0,0,0,1,0,0|0,0,0]=1 3544 B11R1.4 CCOCCOC1CCSC1 7a_100011232664_100011215890 [0,0,0,1,0,0|0,1,0]=2 3545 B11R1.4 CCOCCO[C@H]1CCOC1 34a_100000717292_100000210147 [0,0,0,1,0,0|0,0,0]=1 3546 B11R1.4 CCOCCSC1CCCC1 62a_100000210147_100000179811 [0,0,0,1,0,0|1,1,0]=3 3547 B11R1.4 CCOCCSC1CCCC1 62a_100011217020_100011215890 [0,0,0,1,0,0|1,1,0]=3 3548 B11R1.4 CCOCCSC1CCOC1 62a_100000210147_100000690089 [0,0,0,1,0,0|0,1,0]=2 3549 B11R1.4 CCOCSCC1CCCC1 62a_100000739092_100000740388 [0,0,0,1,0,0|3,0,0]=4 3550 B11R1.4 CCOCSCC1CCCC1 62a_100000740388_100000739092 [0,0,0,1,0,0|3,0,0]=4 3551 B11R1.4 CCOCSCC1CCOC1 62a_100000702531_100000739092 [0,0,0,1,0,0|2,0,0]=3 3552 B11R1.4 CCOCSCC1CCOC1 62a_100000739092_100000702531 [0,0,0,1,0,0|2,0,0]=3 3553 B11R1.4 CCSCCCC1CCCC1 62a_100000210202_100011713738 [0,0,0,1,0,0|2,1,0]=4 3554 B11R1.4 CCSCCCC1CCCC1 62a_100011713738_100000210202 [0,0,0,1,0,0|2,1,0]=4 3555 B11R1.4 CCSCCNC1CCCC1 2230a_100000106463_100000179811 [0,0,0,1,0,0|2,1,0]=4 3556 B11R1.4 CCSCCNC1CCCC1 2230a_100000211070_100000757381 [0,0,0,1,0,0|2,1,0]=4 3557 B11R1.4 CCSCCNC1CCCC1 270004a_100000106463_100000210133 [0,0,0,1,0,0|2,1,0]=4 3558 B11R1.4 CCSCCNC1CCCC1 34a_100000211070_100000757381 [0,0,0,1,0,0|2,1,0]=4 3559 B11R1.4 CCSCCNC1CCOC1 2230a_100000106463_100000731011 [0,0,0,1,0,0|1,1,0]=3 3560 B11R1.4 CCSCCNC1CCOC1 270004a_100000106463_100000752484 [0,0,0,1,0,0|1,1,0]=3 3561 B11R1.4 CCSCCNC1CCSC1 270004a_100000106463_100000212027 [0,0,0,1,0,0|1,2,0]=4 3562 B11R1.4 CCSCCN[C@@H]1CCOC1 2230a_200015188469_100000757381 [0,0,0,1,0,0|1,1,0]=3 3563 B11R1.4 CCSCCN[C@H]1CCOC1 2230a_100015188467_100000757381 [0,0,0,1,0,0|1,1,0]=3 3564 B11R1.4 CCSCCN[C@H]1CCOC1 34a_100015188467_100000757381 [0,0,0,1,0,0|1,1,0]=3 3565 B11R1.4 CCSCCOC1CCCC1 34a_100000210269_100000757381 [0,0,0,1,0,0|1,1,0]=3 3566 B11R1.4 CCSCCOC1CCCC1 34a_100000212035_100000179811 [0,0,0,1,0,0|1,1,0]=3 3567 B11R1.4 CCSCCOC1CCCC1 7a_100000210269_100000757381 [0,0,0,1,0,0|1,1,0]=3 3568 B11R1.4 CCSCCOC1CCCC1 7a_100000212035_100000179811 [0,0,0,1,0,0|1,1,0]=3 3569 B11R1.4 CCSCCOC1CCCO1 34a_100000085407_100000757381 [0,0,0,1,0,0|2,1,0]=4 3570 B11R1.4 CCSCCOC1CCOC1 34a_100000212035_100000690089 [0,0,0,1,0,0|0,1,0]=2 3571 B11R1.4 CCSCCOC1CCOC1 7a_100000212035_100000731011 [0,0,0,1,0,0|0,1,0]=2 3572 B11R1.4 CCSCCOC1CCSC1 7a_100011232664_100000757381 [0,0,0,1,0,0|0,2,0]=3 3573 B11R1.4 CCSCCO[C@H]1CCOC1 34a_100000717292_100000757381 [0,0,0,1,0,0|0,1,0]=2 3574 B11R1.4 CCSCCSC1CCCC1 62a_100000757381_100000179811 [0,0,0,1,0,0|1,2,0]=4 3575 B11R1.4 CCSCCSC1CCCC1 62a_100011217020_100000757381 [0,0,0,1,0,0|1,2,0]=4 3576 B11R1.4 CCSCCSC1CCOC1 62a_100000757381_100000690089 [0,0,0,1,0,0|0,2,0]=3 3577 B11R1.4 CNCCCOC1CCCC1 34a_100000213112_100000179811 [0,0,0,1,0,0|3,0,0]=4 3578 B11R1.4 CNCCCOC1CCCC1 34a_100000747560_200000210301 [0,0,0,1,0,0|3,0,0]=4 3579 B11R1.4 CNCCCOC1CCOC1 34a_100000213112_100000690089 [0,0,0,1,0,0|2,0,0]=3 3580 B11R1.4 COCCCNC1CCOC1 270004a_100150723488_100000752484 [0,0,0,1,0,0|3,0,0]=4 3581 B11R1.4 COCCCNC1CCOC1 34a_100150723488_100000690089 [0,0,0,1,0,0|3,0,0]=4 3582 B11R1.4 COCCCN[C@@H]1CCOC1 2230a_200015188469_100000740836 [0,0,0,1,0,0|3,0,0]=4 3583 B11R1.4 COCCCN[C@H]1CCOC1 2230a_100015188467_100000740836 [0,0,0,1,0,0|3,0,0]=4 3584 B11R1.4 COCCCN[C@H]1CCOC1 34a_100015188467_100000740836 [0,0,0,1,0,0|3,0,0]=4 3585 B11R1.4 COCCCOC1CCCC1 34a_100000210269_100000740836 [0,0,0,1,0,0|3,0,0]=4 3586 B11R1.4 COCCCOC1CCCC1 34a_100000740835_100000179811 [0,0,0,1,0,0|3,0,0]=4 3587 B11R1.4 COCCCOC1CCCC1 7a_100000210269_100000740836 [0,0,0,1,0,0|3,0,0]=4 3588 B11R1.4 COCCCOC1CCOC1 34a_100000740835_100000690089 [0,0,0,1,0,0|2,0,0]=3 3589 B11R1.4 COCCCOC1CCSC1 7a_100011232664_100000740836 [0,0,0,1,0,0|2,1,0]=4 3590 B11R1.4 COCCCO[C@H]1CCOC1 34a_100000717292_100000740836 [0,0,0,1,0,0|2,0,0]=3 3591 B11R1.4 COCCCSC1CCOC1 62a_100000709357_100000690089 [0,0,0,1,0,0|2,1,0]=4 3592 B11R1.4 CSCCCNC1CCOC1 2230a_100000749238_100000731011 [0,0,0,1,0,0|3,0,0]=4 3593 B11R1.4 CSCCCNC1CCOC1 270004a_100000749238_100000752484 [0,0,0,1,0,0|3,0,0]=4 3594 B11R1.4 CSCCCOC1CCCC1 34a_100000690336_100000179811 [0,0,0,1,0,0|3,0,0]=4 3595 B11R1.4 CSCCCOC1CCCC1 7a_100000690336_100000179811 [0,0,0,1,0,0|3,0,0]=4 3596 B11R1.4 CSCCCOC1CCOC1 34a_100000690336_100000690089 [0,0,0,1,0,0|2,0,0]=3 3597 B11R1.4 CSCCCOC1CCOC1 7a_100000690336_100000731011 [0,0,0,1,0,0|2,0,0]=3 3598 B11R1.4 ClCC#CCOC1CCOC1 34a_200000047223_100000690089 [0,0,0,1,0,0|2,0,1]=4 3599 B11R1.4 ClCCCCOC1CCCC1 34a_100000210776_100000179811 [0,0,0,1,0,0|3,0,0]=4 3600 B11R1.4 ClCCCCOC1CCCC1 7a_100000210776_100000179811 [0,0,0,1,0,0|3,0,0]=4 3601 B11R1.4 ClCCCCOC1CCOC1 34a_100000210776_100000690089 [0,0,0,1,0,0|2,0,0]=3 3602 B11R1.4 ClCCCCOC1CCOC1 7a_100000210776_100000731011 [0,0,0,1,0,0|2,0,0]=3 3603 B11R1.4 FCCCCN[C@@H]1CCOC1 2230a_200015188469_100000729493 [0,0,0,1,0,0|3,0,0]=4 3604 B11R1.4 FCCCCN[C@H]1CCOC1 2230a_100015188467_100000729493 [0,0,0,1,0,0|3,0,0]=4 3605 B11R1.4 FCCCCN[C@H]1CCOC1 34a_100015188467_100000729493 [0,0,0,1,0,0|3,0,0]=4 3606 B11R1.4 FCCCCOC1CCCC1 34a_100000210269_100000729493 [0,0,0,1,0,0|3,0,0]=4 3607 B11R1.4 FCCCCOC1CCCC1 34a_100011995726_100000179811 [0,0,0,1,0,0|3,0,0]=4 3608 B11R1.4 FCCCCOC1CCCC1 7a_100000210269_100000729493 [0,0,0,1,0,0|3,0,0]=4 3609 B11R1.4 FCCCCOC1CCCC1 7a_100011995726_100000179811 [0,0,0,1,0,0|3,0,0]=4 3610 B11R1.4 FCCCCOC1CCOC1 34a_100011995726_100000690089 [0,0,0,1,0,0|2,0,0]=3 3611 B11R1.4 FCCCCOC1CCOC1 7a_100011995726_100000731011 [0,0,0,1,0,0|2,0,0]=3 3612 B11R1.4 FCCCCOC1CCSC1 7a_100011232664_100000729493 [0,0,0,1,0,0|2,1,0]=4 3613 B11R1.4 FCCCCO[C@H]1CCOC1 34a_100000717292_100000729493 [0,0,0,1,0,0|2,0,0]=3 3614 B11R1.4 FCCCCSC1CCOC1 62a_100000729493_100000690089 [0,0,0,1,0,0|2,1,0]=4 3615 B11R1.4 FCNCCOC1CCCC1 34a_100000741755_100015361967 [0,0,0,1,0,0|3,0,0]=4 3616 B11R1.4 FCOCCCC1CCCC1 34a_100011215328_100015361967 [0,0,0,1,0,0|3,0,0]=4 3617 B11R1.4 FCOCCCC1CCCC1 7a_100011215328_100015361967 [0,0,0,1,0,0|3,0,0]=4 3618 B11R1.4 FCOCCNC1CCCC1 34a_200000200444_100015361967 [0,0,0,1,0,0|3,0,0]=4 3619 B11R1.4 FCOCCOC1CCCC1 34a_100000738311_100015361967 [0,0,0,1,0,0|2,0,0]=3 3620 B11R1.4 FCOCCOC1CCCC1 7a_100000738311_100015361967 [0,0,0,1,0,0|2,0,0]=3 3621 B11R1.4 ICCCCOC1CCCC1 34a_200012148704_100000179811 [0,0,0,1,0,0|3,0,0]=4 3622 B11R1.4 ICCCCOC1CCOC1 34a_200012148704_100000690089 [0,0,0,1,0,0|2,0,0]=3 3623 B11R1.4 NCCCCOC1CCCC1 34a_100000750430_100000179811 [0,0,0,1,0,0|3,0,0]=4 3624 B11R1.4 NCCCCOC1CCOC1 34a_100000750430_100000690089 [0,0,0,1,0,0|2,0,0]=3 3625 B11R1.4 OCC#CCO[C@H]1CCOC1 34a_100000717292_200000047223 [0,0,0,1,0,0|2,0,1]=4 3626 B11R1.4 OCCCCNC1CCOC1 2230a_100000750430_100000731011 [0,0,0,1,0,0|3,0,0]=4 3627 B11R1.4 OCCCCNC1CCOC1 270004a_100000750430_100000752484 [0,0,0,1,0,0|3,0,0]=4 3628 B11R1.4 OCCCCNC1CCOC1 34a_100000750430_100000690089 [0,0,0,1,0,0|3,0,0]=4 3629 B11R1.4 OCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210776 [0,0,0,1,0,0|3,0,0]=4 3630 B11R1.4 OCCCCN[C@H]1CCOC1 2230a_100015188467_100000210776 [0,0,0,1,0,0|3,0,0]=4 3631 B11R1.4 OCCCCN[C@H]1CCOC1 34a_100015188467_100011216708 [0,0,0,1,0,0|3,0,0]=4 3632 B11R1.4 OCCCCOC1CCCC1 34a_100000210269_100011216708 [0,0,0,1,0,0|3,0,0]=4 3633 B11R1.4 OCCCCOC1CCCC1 7a_100000210269_100000210776 [0,0,0,1,0,0|3,0,0]=4 3634 B11R1.4 OCCCCOC1CCSC1 7a_100011232664_100000210776 [0,0,0,1,0,0|2,1,0]=4 3635 B11R1.4 OCCCCO[C@H]1CCOC1 34a_100000717292_100011216708 [0,0,0,1,0,0|2,0,0]=3 3636 B11R1.4 OCCCCSC1CCOC1 62a_100000210776_100000690089 [0,0,0,1,0,0|2,1,0]=4 3637 B11R1.4 [13CH3]NCCCOC1CCCC1 34a_100000747560_200025704644 [0,0,0,1,0,0|3,0,0]=4 3638 B11R1.17 CCOCC1CCCCN1C 34a_100000225079_100000210202 [0,0,0,1,0,0|3,0,0]=4 3639 B11R1.17 CCOCC1CCCCN1C 34a_100121572206_100015186950 [0,0,0,1,0,0|3,0,0]=4 3640 B11R1.17 CCOCN1CCCCC1C 269982a_100000211376_100000739092 [0,0,0,1,0,0|3,0,0]=4 3641 B11R1.18 CCN1CCC[C@@H]1COCF 34a_100011739246_100015361967 [0,0,0,1,0,0|3,0,0]=4 3642 B11R1.18 CCN1CCC[C@@H]1COCF 7a_100011739246_100015361967 [0,0,0,1,0,0|3,0,0]=4 3643 B11R1.18 CCNCC1CCCN1CC 2230a_100000211693_100000210202 [0,0,0,1,0,0|3,0,0]=4 3644 B11R1.18 CCOCN1CCCC1CC 269982a_100000754278_100000739092 [0,0,0,1,0,0|3,0,0]=4 3645 B11R1.18 CCOC[C@H]1CCCN1CC 34a_100011739246_100000210202 [0,0,0,1,0,0|2,0,0]=3 3646 B11R1.18 CCOC[C@H]1CCCN1CC 7a_100011739246_100000210202 [0,0,0,1,0,0|2,0,0]=3 3647 B11R1.28 C=COCCN1CCOCC1 2230a_100015191051_100000039644 [0,0,0,1,0,0|1,0,2]=4 3648 B11R1.28 C=COCCN1CCOCC1 269982a_100015191051_100000039644 [0,0,0,1,0,0|1,0,2]=4 3649 B11R1.28 C=COCCN1CCOCC1 34a_100015191051_100000039644 [0,0,0,1,0,0|1,0,2]=4 3650 B11R1.28 CC/C=C\CN1CCOCC1 2230a_100015191051_100103147603 [0,0,0,1,0,0|2,0,1]=4 3651 B11R1.28 CC/C=C\CN1CCOCC1 269982a_100015191051_100103147603 [0,0,0,1,0,0|2,0,1]=4 3652 B11R1.28 CC/C=C\CN1CCOCC1 34a_100015191051_100103147603 [0,0,0,1,0,0|2,0,1]=4 3653 B11R1.28 CCC#CCN1CCOCC1 2230a_100015191051_100009813939 [0,0,0,1,0,0|2,0,1]=4 3654 B11R1.28 CCC#CCN1CCOCC1 34a_100015191051_100009813939 [0,0,0,1,0,0|2,0,1]=4 3655 B11R1.28 CCCCCN1CCOCC1 2230a_100015191051_100000210326 [0,0,0,1,0,0|2,0,0]=3 3656 B11R1.28 CCCCCN1CCOCC1 269982a_100015191051_100000210215 [0,0,0,1,0,0|2,0,0]=3 3657 B11R1.28 CCCCCN1CCOCC1 34a_100015191051_100000718602 [0,0,0,1,0,0|2,0,0]=3 3658 B11R1.28 CCCCCN1CCSCC1 2230a_100000737611_100000210326 [0,0,0,1,0,0|2,1,0]=4 3659 B11R1.28 CCCCCN1CCSCC1 269982a_100000737611_100000210215 [0,0,0,1,0,0|2,1,0]=4 3660 B11R1.28 CCCCNC1CCOCC1 2230a_100000741149_100000210211 [0,0,0,1,0,0|3,0,0]=4 3661 B11R1.28 CCCCNC1CCOCC1 270004a_100000102301_100011217826 [0,0,0,1,0,0|3,0,0]=4 3662 B11R1.28 CCCCNC1CCOCC1 34a_100000741149_100000210210 [0,0,0,1,0,0|3,0,0]=4 3663 B11R1.28 CCCCNC1CCOCC1 7a_106832991798_100000686592 [0,0,0,1,0,0|3,0,0]=4 3664 B11R1.28 CCCCOC1CCOCC1 34a_100000744328_100000210210 [0,0,0,1,0,0|3,0,0]=4 3665 B11R1.28 CCCCOC1CCOCC1 7a_100000210227_100000686592 [0,0,0,1,0,0|3,0,0]=4 3666 B11R1.28 CCCCSC1CCOCC1 62a_100000210211_100011324220 [0,0,0,1,0,0|3,0,0]=4 3667 B11R1.28 CCCNCC1CCOCC1 2230a_100000746373_100000210303 [0,0,0,1,0,0|3,0,0]=4 3668 B11R1.28 CCCNCC1CCOCC1 269862a_100020643023_100000749017 [0,0,0,1,0,0|3,0,0]=4 3669 B11R1.28 CCCNCC1CCOCC1 34a_100000746373_100000210303 [0,0,0,1,0,0|3,0,0]=4 3670 B11R1.28 CCCOCC1CCOCC1 34a_100000210258_100000754603 [0,0,0,1,0,0|3,0,0]=4 3671 B11R1.28 CCCOCC1CCOCC1 34a_100000749013_100000210303 [0,0,0,1,0,0|3,0,0]=4 3672 B11R1.28 CCCSCC1CCOCC1 62a_100000210303_100000749018 [0,0,0,1,0,0|3,0,0]=4 3673 B11R1.28 CCCSCC1CCOCC1 62a_100000754603_100000210303 [0,0,0,1,0,0|3,0,0]=4 3674 B11R1.28 CCNCCC1CCCCC1 2230a_100000738074_100000210202 [0,0,0,1,0,0|3,0,0]=4 3675 B11R1.28 CCNCCC1CCCCC1 2230a_100015525214_100012355289 [0,0,0,1,0,0|3,0,0]=4 3676 B11R1.28 CCNCCC1CCCCC1 270004a_100015525214_100011713444 [0,0,0,1,0,0|3,0,0]=4 3677 B11R1.28 CCNCCC1CCCCC1 34a_100000738074_100000210202 [0,0,0,1,0,0|3,0,0]=4 3678 B11R1.28 CCNCCC1CCOCC1 2230a_100000755988_100000210202 [0,0,0,1,0,0|2,0,0]=3 3679 B11R1.28 CCNCCC1CCOCC1 2230a_100015525214_100011934994 [0,0,0,1,0,0|2,0,0]=3 3680 B11R1.28 CCNCCC1CCOCC1 34a_100000755988_100000210202 [0,0,0,1,0,0|2,0,0]=3 3681 B11R1.28 CCNCCN1CCCCC1 2230a_100015525214_100000739454 [0,0,0,1,0,0|3,0,0]=4 3682 B11R1.28 CCNCCN1CCOCC1 2230a_100015525214_100025781966 [0,0,0,1,0,0|2,0,0]=3 3683 B11R1.28 CCNCCN1CCSCC1 2230a_100000755026_100000210202 [0,0,0,1,0,0|2,1,0]=4 3684 B11R1.28 CCOCCC1CCCCC1 34a_100011217863_100000210202 [0,0,0,1,0,0|2,0,0]=3 3685 B11R1.28 CCOCCC1CCCCC1 34a_100121572206_100011209188 [0,0,0,1,0,0|2,0,0]=3 3686 B11R1.28 CCOCCC1CCCCC1 7a_100011217863_100000210202 [0,0,0,1,0,0|2,0,0]=3 3687 B11R1.28 CCOCCC1CCCCN1 34a_100000211664_100000210202 [0,0,0,1,0,0|3,0,0]=4 3688 B11R1.28 CCOCCC1CCCNC1 34a_100000752241_100000210202 [0,0,0,1,0,0|3,0,0]=4 3689 B11R1.28 CCOCCC1CCNCC1 34a_100015190746_100000210202 [0,0,0,1,0,0|2,0,0]=3 3690 B11R1.28 CCOCCC1CCOCC1 34a_100011933979_100000210202 [0,0,0,1,0,0|1,0,0]=2 3691 B11R1.28 CCOCCC1CCOCC1 34a_100121572206_100011934994 [0,0,0,1,0,0|1,0,0]=2 3692 B11R1.28 CCOCCC1CCOCC1 7a_100011933979_100000210202 [0,0,0,1,0,0|1,0,0]=2 3693 B11R1.28 CCOCCN1CC=CCC1 2230a_100000698166_100011215890 [0,0,0,1,0,0|2,0,1]=4 3694 B11R1.28 CCOCCN1CC=CCC1 269982a_100000698166_100011215890 [0,0,0,1,0,0|2,0,1]=4 3695 B11R1.28 CCOCCN1CC=CCC1 34a_100000698166_100000210147 [0,0,0,1,0,0|2,0,1]=4 3696 B11R1.28 CCOCCN1CCCCC1 34a_100121572206_100000739454 [0,0,0,1,0,0|2,0,0]=3 3697 B11R1.28 CCOCCN1CCCOC1 2230a_100000131196_100011215890 [0,0,0,1,0,0|3,0,0]=4 3698 B11R1.28 CCOCCN1CCCOC1 269982a_100000131196_100011215890 [0,0,0,1,0,0|3,0,0]=4 3699 B11R1.28 CCOCCN1CCCOC1 34a_100000131196_100000210147 [0,0,0,1,0,0|3,0,0]=4 3700 B11R1.28 CCOCCN1CCOCC1 2230a_100015191051_100011215890 [0,0,0,1,0,0|1,0,0]=2 3701 B11R1.28 CCOCCN1CCOCC1 269982a_100015191051_100011215890 [0,0,0,1,0,0|1,0,0]=2 3702 B11R1.28 CCOCCN1CCOCC1 34a_100015191051_100000210147 [0,0,0,1,0,0|1,0,0]=2 3703 B11R1.28 CCOCCN1CCSCC1 2230a_100000737611_100011215890 [0,0,0,1,0,0|1,1,0]=3 3704 B11R1.28 CCOCCN1CCSCC1 269982a_100000737611_100011215890 [0,0,0,1,0,0|1,1,0]=3 3705 B11R1.28 CCOCCN1CCSCC1 7a_100000686052_100000210202 [0,0,0,1,0,0|1,1,0]=3 3706 B11R1.28 CCOCOC1CCCCC1 34a_100121572206_100011935260 [0,0,0,1,0,0|3,0,0]=4 3707 B11R1.28 CCOCSC1CCCCC1 62a_100000210327_100000739092 [0,0,0,1,0,0|3,0,0]=4 3708 B11R1.28 CCOCSC1CCCCC1 62a_100000739092_100000210327 [0,0,0,1,0,0|3,0,0]=4 3709 B11R1.28 CCOCSC1CCOCC1 62a_100000739092_100011324220 [0,0,0,1,0,0|2,0,0]=3 3710 B11R1.28 CCOCSC1CCSCC1 62a_100000739092_100000069128 [0,0,0,1,0,0|2,1,0]=4 3711 B11R1.28 CCSCCC1CCCCC1 62a_100000210202_100012355289 [0,0,0,1,0,0|2,1,0]=4 3712 B11R1.28 CCSCCC1CCCCC1 62a_100012355289_100000210202 [0,0,0,1,0,0|2,1,0]=4 3713 B11R1.28 CCSCCC1CCOCC1 62a_100000210202_100011934994 [0,0,0,1,0,0|1,1,0]=3 3714 B11R1.28 CCSCCC1CCOCC1 62a_100011934994_100000210202 [0,0,0,1,0,0|1,1,0]=3 3715 B11R1.28 CCSCCN1CCCCC1 62a_100000210202_100000739454 [0,0,0,1,0,0|2,1,0]=4 3716 B11R1.28 CCSCCN1CCCCC1 62a_100000739454_100000210202 [0,0,0,1,0,0|2,1,0]=4 3717 B11R1.28 CCSCCN1CCOCC1 2230a_100015191051_100000757381 [0,0,0,1,0,0|1,1,0]=3 3718 B11R1.28 CCSCCN1CCOCC1 269982a_100015191051_100000757381 [0,0,0,1,0,0|1,1,0]=3 3719 B11R1.28 CCSCCN1CCOCC1 34a_100015191051_100000757381 [0,0,0,1,0,0|1,1,0]=3 3720 B11R1.28 CCSCCN1CCOCC1 62a_100000210202_100000211760 [0,0,0,1,0,0|1,1,0]=3 3721 B11R1.28 CCSCCN1CCSCC1 2230a_100000737611_100000757381 [0,0,0,1,0,0|1,2,0]=4 3722 B11R1.28 CCSCCN1CCSCC1 269982a_100000737611_100000757381 [0,0,0,1,0,0|1,2,0]=4 3723 B11R1.28 CNCCCN1CCOCC1 2230a_106832991635_100000748698 [0,0,0,1,0,0|3,0,0]=4 3724 B11R1.28 CNCCCN1CCOCC1 34a_100102657272_100000748698 [0,0,0,1,0,0|3,0,0]=4 3725 B11R1.28 CNCCCN1CCOCC1 7a_106832991635_100000748698 [0,0,0,1,0,0|3,0,0]=4 3726 B11R1.28 COCCCN1CCOCC1 2230a_100015191051_100000740836 [0,0,0,1,0,0|3,0,0]=4 3727 B11R1.28 COCCCN1CCOCC1 269982a_100015191051_100000740836 [0,0,0,1,0,0|3,0,0]=4 3728 B11R1.28 COCCCN1CCOCC1 34a_100000212840_200000210301 [0,0,0,1,0,0|3,0,0]=4 3729 B11R1.28 COCCCN1CCOCC1 34a_100015191051_100000740836 [0,0,0,1,0,0|3,0,0]=4 3730 B11R1.28 COCCCN1CCOCC1 34a_100138415774_100000748698 [0,0,0,1,0,0|3,0,0]=4 3731 B11R1.28 CSCCCN1CCOCC1 62a_200000210301_100000748698 [0,0,0,1,0,0|3,0,0]=4 3732 B11R1.28 FCCCCN1CCOCC1 2230a_100015191051_100000729493 [0,0,0,1,0,0|3,0,0]=4 3733 B11R1.28 FCCCCN1CCOCC1 269982a_100015191051_100000729493 [0,0,0,1,0,0|3,0,0]=4 3734 B11R1.28 FCCCCN1CCOCC1 34a_100015191051_100000729493 [0,0,0,1,0,0|3,0,0]=4 3735 B11R1.28 FCNCCC1CCOCC1 34a_100000755988_100015361967 [0,0,0,1,0,0|3,0,0]=4 3736 B11R1.28 FCOCCC1CCCCC1 34a_100011217863_100015361967 [0,0,0,1,0,0|3,0,0]=4 3737 B11R1.28 FCOCCC1CCCCC1 7a_100011217863_100015361967 [0,0,0,1,0,0|3,0,0]=4 3738 B11R1.28 FCOCCC1CCNCC1 34a_100015190746_100015361967 [0,0,0,1,0,0|3,0,0]=4 3739 B11R1.28 FCOCCC1CCOCC1 34a_100011933979_100015361967 [0,0,0,1,0,0|2,0,0]=3 3740 B11R1.28 FCOCCC1CCOCC1 7a_100011933979_100015361967 [0,0,0,1,0,0|2,0,0]=3 3741 B11R1.28 FCOCCN1CCSCC1 7a_100000686052_100015361967 [0,0,0,1,0,0|2,1,0]=4 3742 B11R1.28 FCSCCC1CCOCC1 62a_100011934994_100015361967 [0,0,0,1,0,0|2,1,0]=4 3743 B11R1.28 FCSCCC1CCOCC1 62a_100015361967_100011934994 [0,0,0,1,0,0|2,1,0]=4 3744 B11R1.28 FCSCCN1CCOCC1 62a_100015361967_100000211760 [0,0,0,1,0,0|2,1,0]=4 3745 B11R1.28 OCCCCN1CCOCC1 2230a_100015191051_100000210776 [0,0,0,1,0,0|3,0,0]=4 3746 B11R1.28 OCCCCN1CCOCC1 269982a_100015191051_100000210776 [0,0,0,1,0,0|3,0,0]=4 3747 B11R1.28 OCCCCN1CCOCC1 34a_100015191051_100011216708 [0,0,0,1,0,0|3,0,0]=4 3748 B11R1.28 [13CH3]OCCCN1CCOCC1 34a_100000212840_200025704644 [0,0,0,1,0,0|3,0,0]=4 3749 B11R1.28 [13CH3]SCCCN1CCOCC1 62a_200025704644_100000748698 [0,0,0,1,0,0|3,0,0]=4 3750 B11R1.41 CCC1CCCCC1OCF 34a_100000210738_100015361967 [0,0,0,1,0,0|3,0,0]=4 3751 B11R1.41 CCC1CCCCC1OCF 7a_100000210738_100015361967 [0,0,0,1,0,0|3,0,0]=4 3752 B11R1.41 CCCC1CCCCN1CC 2230a_100000701414_100000210202 [0,0,0,1,0,0|3,0,0]=4 3753 B11R1.41 CCCC1CCCCN1CC 269982a_100000701414_100000204670 [0,0,0,1,0,0|3,0,0]=4 3754 B11R1.41 CCCC1CCCCN1CC 34a_100000701414_100000210202 [0,0,0,1,0,0|3,0,0]=4 3755 B11R1.41 CCCC1COCCN1CC 2230a_102495339903_100000210202 [0,0,0,1,0,0|2,0,0]=3 3756 B11R1.41 CCCC1COCCN1CC 269982a_102495339903_100000204670 [0,0,0,1,0,0|2,0,0]=3 3757 B11R1.41 CCCC1COCCN1CC 34a_102495339903_100000210202 [0,0,0,1,0,0|2,0,0]=3 3758 B11R1.41 CCCC1COCCN1CF 269982a_102495339903_100015361967 [0,0,0,1,0,0|3,0,0]=4 3759 B11R1.41 CCCC1COCCN1CF 34a_102495339903_100015361967 [0,0,0,1,0,0|3,0,0]=4 3760 B11R1.41 CCN1CCOC[C@@H]1COC 2230a_100016989928_100000210202 [0,0,0,1,0,0|3,0,0]=4 3761 B11R1.41 CCN1CCOC[C@@H]1COC 269982a_100016989928_100000204670 [0,0,0,1,0,0|3,0,0]=4 3762 B11R1.41 CCN1CCOC[C@@H]1COC 34a_100016989928_100000210202 [0,0,0,1,0,0|3,0,0]=4 3763 B11R1.41 CCNC1CCCCC1CC 269862a_100015525214_100000757040 [0,0,0,1,0,0|3,0,0]=4 3764 B11R1.41 CCNC1CCCCC1CC 270004a_100015525214_100000757040 [0,0,0,1,0,0|3,0,0]=4 3765 B11R1.41 CCOC1CCCCC1CC 34a_100000210738_100000210202 [0,0,0,1,0,0|2,0,0]=3 3766 B11R1.41 CCOC1CCCCC1CC 7a_100000210738_100000210202 [0,0,0,1,0,0|2,0,0]=3 3767 B11R1.41 CCOC1CCCCC1CN 34a_100011216029_100000210202 [0,0,0,1,0,0|3,0,0]=4 3768 B11R1.41 CCOC1CCCCC1NC 270004a_106832991635_200000031474 [0,0,0,1,0,0|3,0,0]=4 3769 B11R1.41 CCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000210202 [0,0,0,1,0,0|3,0,0]=4 3770 B11R1.41 CCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000210202 [0,0,0,1,0,0|3,0,0]=4 3771 B11R1.41 CCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000210202 [0,0,0,1,0,0|3,0,0]=4 3772 B11R1.46 C=COCCOCC1CC1C 34a_100000744939_100000039644 [0,0,0,1,0,0|1,0,2]=4 3773 B11R1.46 C=COCCOCC1CC1C 7a_100000744939_100000039644 [0,0,0,1,0,0|1,0,2]=4 3774 B11R1.46 CC/C=C\COCC1CC1C 34a_100000744939_100103147603 [0,0,0,1,0,0|2,0,1]=4 3775 B11R1.46 CC/C=C\COCC1CC1C 7a_100000744939_100103147603 [0,0,0,1,0,0|2,0,1]=4 3776 B11R1.46 CC1CC1COCCCCF 34a_100000744939_100000729493 [0,0,0,1,0,0|3,0,0]=4 3777 B11R1.46 CC1CC1COCCCCF 7a_100000744939_100000729493 [0,0,0,1,0,0|3,0,0]=4 3778 B11R1.46 CC1CC1COCCCCO 34a_100000744939_100011216708 [0,0,0,1,0,0|3,0,0]=4 3779 B11R1.46 CC1CC1COCCCCO 7a_100000744939_100000210776 [0,0,0,1,0,0|3,0,0]=4 3780 B11R1.46 CCC#CCOCC1CC1C 34a_100000744939_100009813939 [0,0,0,1,0,0|2,0,1]=4 3781 B11R1.46 CCC#CCOCC1CC1C 7a_100000744939_100009813939 [0,0,0,1,0,0|2,0,1]=4 3782 B11R1.46 CCCCCOCC1CC1C 34a_100000744939_100000718602 [0,0,0,1,0,0|2,0,0]=3 3783 B11R1.46 CCCCCOCC1CC1C 7a_100000744939_100000210326 [0,0,0,1,0,0|2,0,0]=3 3784 B11R1.46 CCOCCOCC1CC1C 34a_100000744939_100000210147 [0,0,0,1,0,0|1,0,0]=2 3785 B11R1.46 CCOCCOCC1CC1C 7a_100000744939_100011215890 [0,0,0,1,0,0|1,0,0]=2 3786 B11R1.46 CCSCCOCC1CC1C 34a_100000744939_100000757381 [0,0,0,1,0,0|1,1,0]=3 3787 B11R1.46 CCSCCOCC1CC1C 7a_100000744939_100000757381 [0,0,0,1,0,0|1,1,0]=3 3788 B11R1.46 COCCCOCC1CC1C 34a_100000744939_100000740836 [0,0,0,1,0,0|3,0,0]=4 3789 B11R1.46 COCCCOCC1CC1C 7a_100000744939_100000740836 [0,0,0,1,0,0|3,0,0]=4 3790 B11R1.47 BrCCCCOCC1CCC1 34a_100011216708_100000763275 [0,0,0,1,0,0|3,0,0]=4 3791 B11R1.47 BrCCCCOCC1CCO1 34a_100011216708_100000103362 [0,0,0,1,0,0|2,0,0]=3 3792 B11R1.47 C#CCCCOCC1CCO1 34a_100000039022_100000695029 [0,0,0,1,0,0|1,0,2]=4 3793 B11R1.47 C#CCCCOCC1CCO1 34a_100000215630_100000103362 [0,0,0,1,0,0|1,0,2]=4 3794 B11R1.47 C#CCCCOCC1CCO1 7a_100000215630_100000103362 [0,0,0,1,0,0|1,0,2]=4 3795 B11R1.47 C/C=C/CCOCC1CCC1 34a_100016278192_100000763275 [0,0,0,1,0,0|2,0,1]=4 3796 B11R1.47 C/C=C/CCOCC1CCO1 34a_100016278192_100000103362 [0,0,0,1,0,0|1,0,1]=3 3797 B11R1.47 C=CCCCOCC1CCO1 34a_100000039022_100000757094 [0,0,0,1,0,0|1,0,2]=4 3798 B11R1.47 C=CCCCOCC1CCO1 34a_100000758997_100000103362 [0,0,0,1,0,0|1,0,2]=4 3799 B11R1.47 C=CCCCOCC1CCO1 7a_100000758997_100000103362 [0,0,0,1,0,0|1,0,2]=4 3800 B11R1.47 C=COCCNC[C@@H]1CCO1 2230a_100020831831_100000039644 [0,0,0,1,0,0|1,0,2]=4 3801 B11R1.47 C=COCCNC[C@@H]1CCO1 34a_100020831831_100000039644 [0,0,0,1,0,0|1,0,2]=4 3802 B11R1.47 C=COCCOCC1CCC1 34a_100000033082_100000763275 [0,0,0,1,0,0|1,0,2]=4 3803 B11R1.47 C=COCCOCC1CCC1 34a_100000760304_100000039644 [0,0,0,1,0,0|1,0,2]=4 3804 B11R1.47 C=COCCOCC1CCO1 34a_100000033082_100000103362 [0,0,0,1,0,0|0,0,2]=3 3805 B11R1.47 C=COCCOCC1CCO1 34a_100000039022_100000039644 [0,0,0,1,0,0|0,0,2]=3 3806 B11R1.47 C=COCCSCC1CCO1 62a_100000039644_100000103362 [0,0,0,1,0,0|0,1,2]=4 3807 B11R1.47 C=COCCSCC1CCO1 62a_100000103362_100000039644 [0,0,0,1,0,0|0,1,2]=4 3808 B11R1.47 CC#CCCOCC1CCC1 34a_100000750427_100000763275 [0,0,0,1,0,0|2,0,1]=4 3809 B11R1.47 CC#CCCOCC1CCO1 34a_100000750427_100000103362 [0,0,0,1,0,0|1,0,1]=3 3810 B11R1.47 CC/C=C\CNC[C@@H]1CCO1 2230a_100020831831_100103147603 [0,0,0,1,0,0|2,0,1]=4 3811 B11R1.47 CC/C=C\CNC[C@@H]1CCO1 34a_100020831831_100103147603 [0,0,0,1,0,0|2,0,1]=4 3812 B11R1.47 CC/C=C\COCC1CCC1 34a_100000760304_100103147603 [0,0,0,1,0,0|2,0,1]=4 3813 B11R1.47 CC/C=C\COCC1CCC1 34a_100016268518_100000763275 [0,0,0,1,0,0|2,0,1]=4 3814 B11R1.47 CC/C=C\COCC1CCO1 34a_100000039022_100103147603 [0,0,0,1,0,0|1,0,1]=3 3815 B11R1.47 CC/C=C\COCC1CCO1 34a_100016268518_100000103362 [0,0,0,1,0,0|1,0,1]=3 3816 B11R1.47 CC/C=C\CSCC1CCO1 62a_100000103362_100103147603 [0,0,0,1,0,0|1,1,1]=4 3817 B11R1.47 CC/C=C\CSCC1CCO1 62a_100103147603_100000103362 [0,0,0,1,0,0|1,1,1]=4 3818 B11R1.47 CCC#CCNC[C@@H]1CCO1 2230a_100020831831_100009813939 [0,0,0,1,0,0|2,0,1]=4 3819 B11R1.47 CCC#CCNC[C@@H]1CCO1 34a_100020831831_100009813939 [0,0,0,1,0,0|2,0,1]=4 3820 B11R1.47 CCC#CCOCC1CCC1 34a_100000032950_100000763275 [0,0,0,1,0,0|2,0,1]=4 3821 B11R1.47 CCC#CCOCC1CCC1 34a_100000760304_100009813939 [0,0,0,1,0,0|2,0,1]=4 3822 B11R1.47 CCC#CCOCC1CCO1 34a_100000032950_100000103362 [0,0,0,1,0,0|1,0,1]=3 3823 B11R1.47 CCC#CCOCC1CCO1 34a_100000039022_100009813939 [0,0,0,1,0,0|1,0,1]=3 3824 B11R1.47 CCC#CCSCC1CCO1 62a_100000103362_100009813939 [0,0,0,1,0,0|1,1,1]=4 3825 B11R1.47 CCC#CCSCC1CCO1 62a_100009813939_100000103362 [0,0,0,1,0,0|1,1,1]=4 3826 B11R1.47 CCCCCNCC1CCC1 2230a_100000209983_100000763275 [0,0,0,1,0,0|3,0,0]=4 3827 B11R1.47 CCCCCNCC1CCC1 2230a_100000738700_100000210326 [0,0,0,1,0,0|3,0,0]=4 3828 B11R1.47 CCCCCNCC1CCC1 269862a_100000209983_100000753134 [0,0,0,1,0,0|3,0,0]=4 3829 B11R1.47 CCCCCNCC1CCC1 34a_100000738700_100000718602 [0,0,0,1,0,0|3,0,0]=4 3830 B11R1.47 CCCCCNCC1CCO1 2230a_100000209983_100000103362 [0,0,0,1,0,0|2,0,0]=3 3831 B11R1.47 CCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210326 [0,0,0,1,0,0|2,0,0]=3 3832 B11R1.47 CCCCCNC[C@@H]1CCO1 34a_100020831831_100000718602 [0,0,0,1,0,0|2,0,0]=3 3833 B11R1.47 CCCCCOCC1CCC1 34a_100000210253_100000763275 [0,0,0,1,0,0|2,0,0]=3 3834 B11R1.47 CCCCCOCC1CCC1 34a_100000760304_100000718602 [0,0,0,1,0,0|2,0,0]=3 3835 B11R1.47 CCCCCOCC1CCC1 7a_100000210253_100000763275 [0,0,0,1,0,0|2,0,0]=3 3836 B11R1.47 CCCCCOCC1CCO1 34a_100000039022_100000718602 [0,0,0,1,0,0|1,0,0]=2 3837 B11R1.47 CCCCCOCC1CCO1 34a_100000210253_100000103362 [0,0,0,1,0,0|1,0,0]=2 3838 B11R1.47 CCCCCOCC1CCO1 7a_100000210253_100000103362 [0,0,0,1,0,0|1,0,0]=2 3839 B11R1.47 CCCCCOCC1CNC1 34a_100016987283_100000718602 [0,0,0,1,0,0|3,0,0]=4 3840 B11R1.47 CCCCCOCC1COC1 34a_100000060846_100000718602 [0,0,0,1,0,0|3,0,0]=4 3841 B11R1.47 CCCCCOCC1COC1 34a_100000210253_100010264016 [0,0,0,1,0,0|3,0,0]=4 3842 B11R1.47 CCCCCOCC1COC1 7a_100000210253_100010264016 [0,0,0,1,0,0|3,0,0]=4 3843 B11R1.47 CCCCCSCC1CCC1 62a_100000210326_100000763275 [0,0,0,1,0,0|2,1,0]=4 3844 B11R1.47 CCCCCSCC1CCC1 62a_100000763275_100000210326 [0,0,0,1,0,0|2,1,0]=4 3845 B11R1.47 CCCCCSCC1CCO1 62a_100000103362_100000210326 [0,0,0,1,0,0|1,1,0]=3 3846 B11R1.47 CCCCCSCC1CCO1 62a_100000210326_100000103362 [0,0,0,1,0,0|1,1,0]=3 3847 B11R1.47 CCOCCCNC1CCC1 2230a_100000749019_100012232248 [0,0,0,1,0,0|3,0,0]=4 3848 B11R1.47 CCOCCCNC1CCC1 270004a_100000210961_100000241760 [0,0,0,1,0,0|3,0,0]=4 3849 B11R1.47 CCOCCCNC1CCC1 34a_100000210961_100000749161 [0,0,0,1,0,0|3,0,0]=4 3850 B11R1.47 CCOCCCNC1CCC1 34a_100000749019_100012232248 [0,0,0,1,0,0|3,0,0]=4 3851 B11R1.47 CCOCCCOC1CCC1 34a_100000748187_100012232248 [0,0,0,1,0,0|3,0,0]=4 3852 B11R1.47 CCOCCCOC1CCC1 34a_100000757476_100000749161 [0,0,0,1,0,0|3,0,0]=4 3853 B11R1.47 CCOCCCSC1CCC1 62a_100012232248_100000749161 [0,0,0,1,0,0|3,0,0]=4 3854 B11R1.47 CCOCCNCC1CCC1 2230a_100000738700_100011215890 [0,0,0,1,0,0|2,0,0]=3 3855 B11R1.47 CCOCCNCC1CCC1 2230a_102516460346_100000763275 [0,0,0,1,0,0|2,0,0]=3 3856 B11R1.47 CCOCCNCC1CCC1 269862a_100011200944_100000753134 [0,0,0,1,0,0|2,0,0]=3 3857 B11R1.47 CCOCCNCC1CCC1 34a_100000738700_100000210147 [0,0,0,1,0,0|2,0,0]=3 3858 B11R1.47 CCOCCNCC1CCC1 34a_102516460346_100000763275 [0,0,0,1,0,0|2,0,0]=3 3859 B11R1.47 CCOCCNCC1CCO1 2230a_102516460346_100000103362 [0,0,0,1,0,0|1,0,0]=2 3860 B11R1.47 CCOCCNCC1CCO1 34a_102516460346_100000103362 [0,0,0,1,0,0|1,0,0]=2 3861 B11R1.47 CCOCCNCC1COC1 2230a_100015281925_100011215890 [0,0,0,1,0,0|3,0,0]=4 3862 B11R1.47 CCOCCNCC1COC1 2230a_102516460346_100010264016 [0,0,0,1,0,0|3,0,0]=4 3863 B11R1.47 CCOCCNCC1COC1 34a_100015281925_100000210147 [0,0,0,1,0,0|3,0,0]=4 3864 B11R1.47 CCOCCNCC1COC1 34a_102516460346_100010264016 [0,0,0,1,0,0|3,0,0]=4 3865 B11R1.47 CCOCCNC[C@@H]1CCO1 2230a_100020831831_100011215890 [0,0,0,1,0,0|1,0,0]=2 3866 B11R1.47 CCOCCNC[C@@H]1CCO1 34a_100020831831_100000210147 [0,0,0,1,0,0|1,0,0]=2 3867 B11R1.47 CCOCCOCC1CCC1 34a_100000210136_100000763275 [0,0,0,1,0,0|1,0,0]=2 3868 B11R1.47 CCOCCOCC1CCC1 34a_100000760304_100000210147 [0,0,0,1,0,0|1,0,0]=2 3869 B11R1.47 CCOCCOCC1CCC1 7a_100000210136_100000763275 [0,0,0,1,0,0|1,0,0]=2 3870 B11R1.47 CCOCCOCC1CCO1 34a_100000039022_100000210147 [0,0,0,1,0,0|0,0,0]=1 3871 B11R1.47 CCOCCOCC1CCO1 34a_100000210136_100000103362 [0,0,0,1,0,0|0,0,0]=1 3872 B11R1.47 CCOCCOCC1CCO1 7a_100000210136_100000103362 [0,0,0,1,0,0|0,0,0]=1 3873 B11R1.47 CCOCCOCC1CNC1 34a_100016987283_100000210147 [0,0,0,1,0,0|2,0,0]=3 3874 B11R1.47 CCOCCOCC1COC1 34a_100000060846_100000210147 [0,0,0,1,0,0|2,0,0]=3 3875 B11R1.47 CCOCCOCC1COC1 34a_100000210136_100010264016 [0,0,0,1,0,0|2,0,0]=3 3876 B11R1.47 CCOCCOCC1COC1 7a_100000210136_100010264016 [0,0,0,1,0,0|2,0,0]=3 3877 B11R1.47 CCOCCSCC1CCC1 62a_100000210147_100000763275 [0,0,0,1,0,0|1,1,0]=3 3878 B11R1.47 CCOCCSCC1CCC1 62a_100000763275_100011215890 [0,0,0,1,0,0|1,1,0]=3 3879 B11R1.47 CCOCCSCC1CCO1 62a_100000103362_100011215890 [0,0,0,1,0,0|0,1,0]=2 3880 B11R1.47 CCOCCSCC1CCO1 62a_100000210147_100000103362 [0,0,0,1,0,0|0,1,0]=2 3881 B11R1.47 CCOCCSCC1COC1 62a_100000210147_100010264016 [0,0,0,1,0,0|2,1,0]=4 3882 B11R1.47 CCOCCSCC1COC1 62a_100010264016_100011215890 [0,0,0,1,0,0|2,1,0]=4 3883 B11R1.47 CCSCCNCC1CCC1 2230a_100000106463_100000763275 [0,0,0,1,0,0|2,1,0]=4 3884 B11R1.47 CCSCCNCC1CCC1 2230a_100000738700_100000757381 [0,0,0,1,0,0|2,1,0]=4 3885 B11R1.47 CCSCCNCC1CCC1 269862a_100000106463_100000753134 [0,0,0,1,0,0|2,1,0]=4 3886 B11R1.47 CCSCCNCC1CCC1 34a_100000738700_100000757381 [0,0,0,1,0,0|2,1,0]=4 3887 B11R1.47 CCSCCNCC1CCO1 2230a_100000106463_100000103362 [0,0,0,1,0,0|1,1,0]=3 3888 B11R1.47 CCSCCNC[C@@H]1CCO1 2230a_100020831831_100000757381 [0,0,0,1,0,0|1,1,0]=3 3889 B11R1.47 CCSCCNC[C@@H]1CCO1 34a_100020831831_100000757381 [0,0,0,1,0,0|1,1,0]=3 3890 B11R1.47 CCSCCOCC1CCC1 34a_100000212035_100000763275 [0,0,0,1,0,0|1,1,0]=3 3891 B11R1.47 CCSCCOCC1CCC1 34a_100000760304_100000757381 [0,0,0,1,0,0|1,1,0]=3 3892 B11R1.47 CCSCCOCC1CCC1 7a_100000212035_100000763275 [0,0,0,1,0,0|1,1,0]=3 3893 B11R1.47 CCSCCOCC1CCO1 34a_100000039022_100000757381 [0,0,0,1,0,0|0,1,0]=2 3894 B11R1.47 CCSCCOCC1CCO1 34a_100000212035_100000103362 [0,0,0,1,0,0|0,1,0]=2 3895 B11R1.47 CCSCCOCC1CCO1 7a_100000212035_100000103362 [0,0,0,1,0,0|0,1,0]=2 3896 B11R1.47 CCSCCOCC1CNC1 34a_100016987283_100000757381 [0,0,0,1,0,0|2,1,0]=4 3897 B11R1.47 CCSCCOCC1COC1 34a_100000060846_100000757381 [0,0,0,1,0,0|2,1,0]=4 3898 B11R1.47 CCSCCOCC1COC1 34a_100000212035_100010264016 [0,0,0,1,0,0|2,1,0]=4 3899 B11R1.47 CCSCCOCC1COC1 7a_100000212035_100010264016 [0,0,0,1,0,0|2,1,0]=4 3900 B11R1.47 CCSCCSCC1CCC1 62a_100000757381_100000763275 [0,0,0,1,0,0|1,2,0]=4 3901 B11R1.47 CCSCCSCC1CCC1 62a_100000763275_100000757381 [0,0,0,1,0,0|1,2,0]=4 3902 B11R1.47 CCSCCSCC1CCO1 62a_100000103362_100000757381 [0,0,0,1,0,0|0,2,0]=3 3903 B11R1.47 CCSCCSCC1CCO1 62a_100000757381_100000103362 [0,0,0,1,0,0|0,2,0]=3 3904 B11R1.47 CNCCCOCC1CCC1 34a_100000213112_100000763275 [0,0,0,1,0,0|3,0,0]=4 3905 B11R1.47 CNCCCOCC1CCO1 34a_100000213112_100000103362 [0,0,0,1,0,0|2,0,0]=3 3906 B11R1.47 COCCCNCC1CCO1 34a_100150723488_100000103362 [0,0,0,1,0,0|3,0,0]=4 3907 B11R1.47 COCCCNC[C@@H]1CCO1 2230a_100020831831_100000740836 [0,0,0,1,0,0|3,0,0]=4 3908 B11R1.47 COCCCNC[C@@H]1CCO1 34a_100020831831_100000740836 [0,0,0,1,0,0|3,0,0]=4 3909 B11R1.47 COCCCOCC1CCC1 34a_100000740835_100000763275 [0,0,0,1,0,0|3,0,0]=4 3910 B11R1.47 COCCCOCC1CCC1 34a_100000760304_100000740836 [0,0,0,1,0,0|3,0,0]=4 3911 B11R1.47 COCCCOCC1CCO1 34a_100000039022_100000740836 [0,0,0,1,0,0|2,0,0]=3 3912 B11R1.47 COCCCOCC1CCO1 34a_100000740835_100000103362 [0,0,0,1,0,0|2,0,0]=3 3913 B11R1.47 COCCCSCC1CCO1 62a_100000103362_100000709357 [0,0,0,1,0,0|2,1,0]=4 3914 B11R1.47 COCCCSCC1CCO1 62a_100000709357_100000103362 [0,0,0,1,0,0|2,1,0]=4 3915 B11R1.47 CSCCCNCC1CCO1 2230a_100000749238_100000103362 [0,0,0,1,0,0|3,0,0]=4 3916 B11R1.47 CSCCCOCC1CCC1 34a_100000690336_100000763275 [0,0,0,1,0,0|3,0,0]=4 3917 B11R1.47 CSCCCOCC1CCC1 7a_100000690336_100000763275 [0,0,0,1,0,0|3,0,0]=4 3918 B11R1.47 CSCCCOCC1CCO1 34a_100000690336_100000103362 [0,0,0,1,0,0|2,0,0]=3 3919 B11R1.47 CSCCCOCC1CCO1 7a_100000690336_100000103362 [0,0,0,1,0,0|2,0,0]=3 3920 B11R1.47 ClCC#CCOCC1CCO1 34a_200000047223_100000103362 [0,0,0,1,0,0|2,0,1]=4 3921 B11R1.47 ClCCCCOCC1CCC1 34a_100000210776_100000763275 [0,0,0,1,0,0|3,0,0]=4 3922 B11R1.47 ClCCCCOCC1CCC1 7a_100000210776_100000763275 [0,0,0,1,0,0|3,0,0]=4 3923 B11R1.47 ClCCCCOCC1CCO1 34a_100000210776_100000103362 [0,0,0,1,0,0|2,0,0]=3 3924 B11R1.47 ClCCCCOCC1CCO1 7a_100000210776_100000103362 [0,0,0,1,0,0|2,0,0]=3 3925 B11R1.47 FCCCCNC[C@@H]1CCO1 2230a_100020831831_100000729493 [0,0,0,1,0,0|3,0,0]=4 3926 B11R1.47 FCCCCNC[C@@H]1CCO1 34a_100020831831_100000729493 [0,0,0,1,0,0|3,0,0]=4 3927 B11R1.47 FCCCCOCC1CCC1 34a_100000760304_100000729493 [0,0,0,1,0,0|3,0,0]=4 3928 B11R1.47 FCCCCOCC1CCC1 34a_100011995726_100000763275 [0,0,0,1,0,0|3,0,0]=4 3929 B11R1.47 FCCCCOCC1CCC1 7a_100011995726_100000763275 [0,0,0,1,0,0|3,0,0]=4 3930 B11R1.47 FCCCCOCC1CCO1 34a_100000039022_100000729493 [0,0,0,1,0,0|2,0,0]=3 3931 B11R1.47 FCCCCOCC1CCO1 34a_100011995726_100000103362 [0,0,0,1,0,0|2,0,0]=3 3932 B11R1.47 FCCCCOCC1CCO1 7a_100011995726_100000103362 [0,0,0,1,0,0|2,0,0]=3 3933 B11R1.47 FCCCCSCC1CCO1 62a_100000103362_100000729493 [0,0,0,1,0,0|2,1,0]=4 3934 B11R1.47 FCCCCSCC1CCO1 62a_100000729493_100000103362 [0,0,0,1,0,0|2,1,0]=4 3935 B11R1.47 ICCCCOCC1CCC1 34a_200012148704_100000763275 [0,0,0,1,0,0|3,0,0]=4 3936 B11R1.47 ICCCCOCC1CCO1 34a_200012148704_100000103362 [0,0,0,1,0,0|2,0,0]=3 3937 B11R1.47 NCCCCOCC1CCC1 34a_100000750430_100000763275 [0,0,0,1,0,0|3,0,0]=4 3938 B11R1.47 NCCCCOCC1CCO1 34a_100000750430_100000103362 [0,0,0,1,0,0|2,0,0]=3 3939 B11R1.47 OCC#CCOCC1CCO1 34a_100000039022_200000047223 [0,0,0,1,0,0|2,0,1]=4 3940 B11R1.47 OCCCCNCC1CCO1 2230a_100000750430_100000103362 [0,0,0,1,0,0|3,0,0]=4 3941 B11R1.47 OCCCCNCC1CCO1 34a_100000750430_100000103362 [0,0,0,1,0,0|3,0,0]=4 3942 B11R1.47 OCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210776 [0,0,0,1,0,0|3,0,0]=4 3943 B11R1.47 OCCCCNC[C@@H]1CCO1 34a_100020831831_100011216708 [0,0,0,1,0,0|3,0,0]=4 3944 B11R1.47 OCCCCOCC1CCC1 34a_100000760304_100011216708 [0,0,0,1,0,0|3,0,0]=4 3945 B11R1.47 OCCCCOCC1CCO1 34a_100000039022_100011216708 [0,0,0,1,0,0|2,0,0]=3 3946 B11R1.47 OCCCCSCC1CCO1 62a_100000103362_100000210776 [0,0,0,1,0,0|2,1,0]=4 3947 B11R1.47 OCCCCSCC1CCO1 62a_100000210776_100000103362 [0,0,0,1,0,0|2,1,0]=4 3948 B11R1.99 BrCCCCOCCC1CC1 34a_100011216708_100000694398 [0,0,0,1,0,0|3,0,0]=4 3949 B11R1.99 C/C=C/CCOCCC1CC1 34a_100016278192_100000694398 [0,0,0,1,0,0|2,0,1]=4 3950 B11R1.99 C=COCCOCCC1CC1 34a_100000033082_100000694398 [0,0,0,1,0,0|1,0,2]=4 3951 B11R1.99 C=COCCOCCC1CC1 34a_100000754188_100000039644 [0,0,0,1,0,0|1,0,2]=4 3952 B11R1.99 C=COCCOCCC1CC1 7a_100000754188_100000039644 [0,0,0,1,0,0|1,0,2]=4 3953 B11R1.99 CC#CCCOCCC1CC1 34a_100000750427_100000694398 [0,0,0,1,0,0|2,0,1]=4 3954 B11R1.99 CC/C=C\COCCC1CC1 34a_100000754188_100103147603 [0,0,0,1,0,0|2,0,1]=4 3955 B11R1.99 CC/C=C\COCCC1CC1 34a_100016268518_100000694398 [0,0,0,1,0,0|2,0,1]=4 3956 B11R1.99 CC/C=C\COCCC1CC1 7a_100000754188_100103147603 [0,0,0,1,0,0|2,0,1]=4 3957 B11R1.99 CCC#CCOCCC1CC1 34a_100000032950_100000694398 [0,0,0,1,0,0|2,0,1]=4 3958 B11R1.99 CCC#CCOCCC1CC1 34a_100000754188_100009813939 [0,0,0,1,0,0|2,0,1]=4 3959 B11R1.99 CCC#CCOCCC1CC1 7a_100000754188_100009813939 [0,0,0,1,0,0|2,0,1]=4 3960 B11R1.99 CCCCCNCCC1CC1 2230a_100000209983_100000694398 [0,0,0,1,0,0|3,0,0]=4 3961 B11R1.99 CCCCCNCCC1CC1 34a_100000764129_100000718602 [0,0,0,1,0,0|3,0,0]=4 3962 B11R1.99 CCCCCOCCC1CC1 34a_100000210253_100000694398 [0,0,0,1,0,0|2,0,0]=3 3963 B11R1.99 CCCCCOCCC1CC1 34a_100000754188_100000718602 [0,0,0,1,0,0|2,0,0]=3 3964 B11R1.99 CCCCCOCCC1CC1 7a_100000210253_100000764125 [0,0,0,1,0,0|2,0,0]=3 3965 B11R1.99 CCCCCOCCC1CC1 7a_100000754188_100000210326 [0,0,0,1,0,0|2,0,0]=3 3966 B11R1.99 CCCCCOCCC1CO1 34a_100000210253_100000732470 [0,0,0,1,0,0|3,0,0]=4 3967 B11R1.99 CCCCCOCCC1CO1 7a_100000210253_100000732470 [0,0,0,1,0,0|3,0,0]=4 3968 B11R1.99 CCCCCOCC[C@@H]1CO1 34a_100009820653_100000718602 [0,0,0,1,0,0|3,0,0]=4 3969 B11R1.99 CCCCCSCCC1CC1 62a_100000210326_100000764125 [0,0,0,1,0,0|2,1,0]=4 3970 B11R1.99 CCCCCSCCC1CC1 62a_100000764125_100000210326 [0,0,0,1,0,0|2,1,0]=4 3971 B11R1.99 CCOCCCNCC1CC1 2230a_100000210961_100000742324 [0,0,0,1,0,0|3,0,0]=4 3972 B11R1.99 CCOCCCNCC1CC1 2230a_100000735609_100012232248 [0,0,0,1,0,0|3,0,0]=4 3973 B11R1.99 CCOCCCNCC1CC1 269862a_100000210961_100000741477 [0,0,0,1,0,0|3,0,0]=4 3974 B11R1.99 CCOCCCNCC1CC1 34a_100000210961_100000742324 [0,0,0,1,0,0|3,0,0]=4 3975 B11R1.99 CCOCCCNCC1CC1 34a_100000735609_100012232248 [0,0,0,1,0,0|3,0,0]=4 3976 B11R1.99 CCOCCCOCC1CC1 34a_100000211283_100012232248 [0,0,0,1,0,0|3,0,0]=4 3977 B11R1.99 CCOCCCOCC1CC1 34a_100000757476_100000742324 [0,0,0,1,0,0|3,0,0]=4 3978 B11R1.99 CCOCCCOCC1CC1 7a_100000757476_100000742324 [0,0,0,1,0,0|3,0,0]=4 3979 B11R1.99 CCOCCCSCC1CC1 62a_100000756562_100012232248 [0,0,0,1,0,0|3,0,0]=4 3980 B11R1.99 CCOCCCSCC1CC1 62a_100012232248_100000742324 [0,0,0,1,0,0|3,0,0]=4 3981 B11R1.99 CCOCCNCCC1CC1 2230a_102516460346_100000694398 [0,0,0,1,0,0|2,0,0]=3 3982 B11R1.99 CCOCCNCCC1CC1 34a_100000764129_100000210147 [0,0,0,1,0,0|2,0,0]=3 3983 B11R1.99 CCOCCNCCC1CC1 34a_102516460346_100000694398 [0,0,0,1,0,0|2,0,0]=3 3984 B11R1.99 CCOCCNCCC1CO1 2230a_102516460346_100000732470 [0,0,0,1,0,0|3,0,0]=4 3985 B11R1.99 CCOCCNCCC1CO1 34a_102516460346_100000732470 [0,0,0,1,0,0|3,0,0]=4 3986 B11R1.99 CCOCCOCCC1CC1 34a_100000210136_100000694398 [0,0,0,1,0,0|1,0,0]=2 3987 B11R1.99 CCOCCOCCC1CC1 34a_100000754188_100000210147 [0,0,0,1,0,0|1,0,0]=2 3988 B11R1.99 CCOCCOCCC1CC1 7a_100000210136_100000764125 [0,0,0,1,0,0|1,0,0]=2 3989 B11R1.99 CCOCCOCCC1CC1 7a_100000754188_100011215890 [0,0,0,1,0,0|1,0,0]=2 3990 B11R1.99 CCOCCOCCC1CO1 34a_100000210136_100000732470 [0,0,0,1,0,0|2,0,0]=3 3991 B11R1.99 CCOCCOCCC1CO1 7a_100000210136_100000732470 [0,0,0,1,0,0|2,0,0]=3 3992 B11R1.99 CCOCCOCC[C@@H]1CO1 34a_100009820653_100000210147 [0,0,0,1,0,0|2,0,0]=3 3993 B11R1.99 CCOCCSCCC1CC1 62a_100000210147_100000764125 [0,0,0,1,0,0|1,1,0]=3 3994 B11R1.99 CCOCCSCCC1CC1 62a_100000764125_100011215890 [0,0,0,1,0,0|1,1,0]=3 3995 B11R1.99 CCOCCSCCC1CO1 62a_100000210147_100000732470 [0,0,0,1,0,0|2,1,0]=4 3996 B11R1.99 CCOCCSCCC1CO1 62a_100000732470_100011215890 [0,0,0,1,0,0|2,1,0]=4 3997 B11R1.99 CCSCCNCCC1CC1 2230a_100000106463_100000694398 [0,0,0,1,0,0|2,1,0]=4 3998 B11R1.99 CCSCCNCCC1CC1 34a_100000764129_100000757381 [0,0,0,1,0,0|2,1,0]=4 3999 B11R1.99 CCSCCOCCC1CC1 34a_100000212035_100000694398 [0,0,0,1,0,0|1,1,0]=3 4000 B11R1.99 CCSCCOCCC1CC1 34a_100000754188_100000757381 [0,0,0,1,0,0|1,1,0]=3 4001 B11R1.99 CCSCCOCCC1CC1 7a_100000212035_100000764125 [0,0,0,1,0,0|1,1,0]=3 4002 B11R1.99 CCSCCOCCC1CC1 7a_100000754188_100000757381 [0,0,0,1,0,0|1,1,0]=3 4003 B11R1.99 CCSCCOCCC1CO1 34a_100000212035_100000732470 [0,0,0,1,0,0|2,1,0]=4 4004 B11R1.99 CCSCCOCCC1CO1 7a_100000212035_100000732470 [0,0,0,1,0,0|2,1,0]=4 4005 B11R1.99 CCSCCOCC[C@@H]1CO1 34a_100009820653_100000757381 [0,0,0,1,0,0|2,1,0]=4 4006 B11R1.99 CCSCCSCCC1CC1 62a_100000757381_100000764125 [0,0,0,1,0,0|1,2,0]=4 4007 B11R1.99 CCSCCSCCC1CC1 62a_100000764125_100000757381 [0,0,0,1,0,0|1,2,0]=4 4008 B11R1.99 CNCCCOCCC1CC1 34a_100000213112_100000694398 [0,0,0,1,0,0|3,0,0]=4 4009 B11R1.99 COCCCOCCC1CC1 34a_100000740835_100000694398 [0,0,0,1,0,0|3,0,0]=4 4010 B11R1.99 COCCCOCCC1CC1 34a_100000754188_100000740836 [0,0,0,1,0,0|3,0,0]=4 4011 B11R1.99 COCCCOCCC1CC1 7a_100000754188_100000740836 [0,0,0,1,0,0|3,0,0]=4 4012 B11R1.99 CSCCCOCCC1CC1 34a_100000690336_100000694398 [0,0,0,1,0,0|3,0,0]=4 4013 B11R1.99 CSCCCOCCC1CC1 7a_100000690336_100000764125 [0,0,0,1,0,0|3,0,0]=4 4014 B11R1.99 ClCCCCOCCC1CC1 34a_100000210776_100000694398 [0,0,0,1,0,0|3,0,0]=4 4015 B11R1.99 ClCCCCOCCC1CC1 7a_100000210776_100000764125 [0,0,0,1,0,0|3,0,0]=4 4016 B11R1.99 FCCCCOCCC1CC1 34a_100000754188_100000729493 [0,0,0,1,0,0|3,0,0]=4 4017 B11R1.99 FCCCCOCCC1CC1 34a_100011995726_100000694398 [0,0,0,1,0,0|3,0,0]=4 4018 B11R1.99 FCCCCOCCC1CC1 7a_100000754188_100000729493 [0,0,0,1,0,0|3,0,0]=4 4019 B11R1.99 FCCCCOCCC1CC1 7a_100011995726_100000764125 [0,0,0,1,0,0|3,0,0]=4 4020 B11R1.99 ICCCCOCCC1CC1 34a_200012148704_100000694398 [0,0,0,1,0,0|3,0,0]=4 4021 B11R1.99 NCCCCOCCC1CC1 34a_100000750430_100000694398 [0,0,0,1,0,0|3,0,0]=4 4022 B11R1.99 OCCCCOCCC1CC1 34a_100000754188_100011216708 [0,0,0,1,0,0|3,0,0]=4 4023 B11R1.99 OCCCCOCCC1CC1 7a_100000754188_100000210776 [0,0,0,1,0,0|3,0,0]=4 4024 B11R1.109 CCCC1CCCC1NCC 269862a_100015525214_100000723119 [0,0,0,1,0,0|3,0,0]=4 4025 B11R1.109 CCCC1CCCC1NCC 270004a_100015525214_100000723119 [0,0,0,1,0,0|3,0,0]=4 4026 B11R1.117 CCNC1CCCCCCC1 2230a_100000211152_100000210202 [0,0,0,1,0,0|3,0,0]=4 4027 B11R1.117 CCNC1CCCCCCC1 270004a_100015525214_100000210524 [0,0,0,1,0,0|3,0,0]=4 4028 B11R1.117 CCNC1CCCCCCC1 34a_100000211152_100000210202 [0,0,0,1,0,0|3,0,0]=4 4029 B11R1.117 CCOC1C=CCCCCC1 34a_100000688657_100000210202 [0,0,0,1,0,0|2,0,1]=4 4030 B11R1.117 CCOC1CC/C=C\CCC1 34a_100016989180_100000210202 [0,0,0,1,0,0|2,0,1]=4 4031 B11R1.117 CCOC1CC/C=C\CCC1 34a_100121572206_100021000466 [0,0,0,1,0,0|2,0,1]=4 4032 B11R1.117 CCOC1CCCCCCC1 34a_100000210054_100000210202 [0,0,0,1,0,0|2,0,0]=3 4033 B11R1.117 CCOC1CCCCCCC1 7a_100000210054_100000210202 [0,0,0,1,0,0|2,0,0]=3 4034 B11R1.117 FCOC1CCCCCCC1 34a_100000210054_100015361967 [0,0,0,1,0,0|3,0,0]=4 4035 B11R1.117 FCOC1CCCCCCC1 7a_100000210054_100015361967 [0,0,0,1,0,0|3,0,0]=4 4036 B11R1.180 CCCCCN1CCC[C@@H]1C 2230a_100020605311_100000210326 [0,0,0,1,0,0|3,0,0]=4 4037 B11R1.180 CCCCCN1CCC[C@@H]1C 269982a_100020605311_100000210215 [0,0,0,1,0,0|3,0,0]=4 4038 B11R1.180 CCCCCN1CCC[C@H]1C 2230a_100015189458_100000210326 [0,0,0,1,0,0|3,0,0]=4 4039 B11R1.180 CCCCCN1CCC[C@H]1C 269982a_100015189458_100000210215 [0,0,0,1,0,0|3,0,0]=4 4040 B11R1.180 CCCCCN1CCC[C@H]1C 34a_100015189458_100000718602 [0,0,0,1,0,0|3,0,0]=4 4041 B11R1.180 CCCCCN1CCSC1C 2230a_200011216479_100000210326 [0,0,0,1,0,0|2,1,0]=4 4042 B11R1.180 CCCCCN1CCSC1C 269982a_200011216479_100000210215 [0,0,0,1,0,0|2,1,0]=4 4043 B11R1.180 CCCCCN1CCSC1C 34a_200011216479_100000718602 [0,0,0,1,0,0|2,1,0]=4 4044 B11R1.180 CCCCNC1CCOC1C 270004a_100000102301_100000691750 [0,0,0,1,0,0|3,0,0]=4 4045 B11R1.180 CCOCCC1CCCN1C 34a_100011215177_100000210202 [0,0,0,1,0,0|3,0,0]=4 4046 B11R1.180 CCOCCC1CCCN1C 34a_100121572206_100000005710 [0,0,0,1,0,0|3,0,0]=4 4047 B11R1.180 CCOCCC1CCCN1C 7a_100011215177_100000210202 [0,0,0,1,0,0|3,0,0]=4 4048 B11R1.180 CCOCCN1CCC[C@@H]1C 2230a_100020605311_100011215890 [0,0,0,1,0,0|2,0,0]=3 4049 B11R1.180 CCOCCN1CCC[C@@H]1C 269982a_100020605311_100011215890 [0,0,0,1,0,0|2,0,0]=3 4050 B11R1.180 CCOCCN1CCC[C@H]1C 2230a_100015189458_100011215890 [0,0,0,1,0,0|2,0,0]=3 4051 B11R1.180 CCOCCN1CCC[C@H]1C 269982a_100015189458_100011215890 [0,0,0,1,0,0|2,0,0]=3 4052 B11R1.180 CCOCCN1CCC[C@H]1C 34a_100015189458_100000210147 [0,0,0,1,0,0|2,0,0]=3 4053 B11R1.180 CCOCCN1CCSC1C 2230a_200011216479_100011215890 [0,0,0,1,0,0|1,1,0]=3 4054 B11R1.180 CCOCCN1CCSC1C 269982a_200011216479_100011215890 [0,0,0,1,0,0|1,1,0]=3 4055 B11R1.180 CCOCCN1CCSC1C 34a_200011216479_100000210147 [0,0,0,1,0,0|1,1,0]=3 4056 B11R1.180 CCSCCN1CCC[C@@H]1C 2230a_100020605311_100000757381 [0,0,0,1,0,0|2,1,0]=4 4057 B11R1.180 CCSCCN1CCC[C@@H]1C 269982a_100020605311_100000757381 [0,0,0,1,0,0|2,1,0]=4 4058 B11R1.180 CCSCCN1CCC[C@H]1C 2230a_100015189458_100000757381 [0,0,0,1,0,0|2,1,0]=4 4059 B11R1.180 CCSCCN1CCC[C@H]1C 269982a_100015189458_100000757381 [0,0,0,1,0,0|2,1,0]=4 4060 B11R1.180 CCSCCN1CCC[C@H]1C 34a_100015189458_100000757381 [0,0,0,1,0,0|2,1,0]=4 4061 B11R1.180 CCSCCN1CCSC1C 2230a_200011216479_100000757381 [0,0,0,1,0,0|1,2,0]=4 4062 B11R1.180 CCSCCN1CCSC1C 269982a_200011216479_100000757381 [0,0,0,1,0,0|1,2,0]=4 4063 B11R1.180 CCSCCN1CCSC1C 34a_200011216479_100000757381 [0,0,0,1,0,0|1,2,0]=4 4064 B11R1.190 CCOCCCN1CCC1C 269982a_100000755817_100012232248 [0,0,0,1,0,0|3,0,0]=4 4065 B11R1.190 CCOCCCN1CCC1C 34a_100000755817_100012232248 [0,0,0,1,0,0|3,0,0]=4 4066 B11R1.190 CCOCCOC1CCC1=O 34a_100000210136_100009892977 [0,0,0,1,0,0|2,0,1]=4 4067 B11R1.190 CCOCCOC1CCC1=O 7a_100000210136_100009892977 [0,0,0,1,0,0|2,0,1]=4 4068 B11R1.203 CCCCN1CCCOCC1 2230a_100000685342_100000210211 [0,0,0,1,0,0|3,0,0]=4 4069 B11R1.203 CCCCN1CCCOCC1 269982a_100000685342_100000210211 [0,0,0,1,0,0|3,0,0]=4 4070 B11R1.203 CCCCN1CCCOCC1 34a_100000685342_100000210210 [0,0,0,1,0,0|3,0,0]=4 4071 B11R1.203 CCNCC1CCCCCC1 2230a_100015204231_100000210202 [0,0,0,1,0,0|3,0,0]=4 4072 B11R1.203 CCNCC1CCCCCC1 2230a_100015525214_200000696569 [0,0,0,1,0,0|3,0,0]=4 4073 B11R1.203 CCNCC1CCCCCC1 269862a_100015525214_200000763224 [0,0,0,1,0,0|3,0,0]=4 4074 B11R1.203 CCNCC1CCCCCC1 34a_100015204231_100000210202 [0,0,0,1,0,0|3,0,0]=4 4075 B11R1.203 CCOCC1CCCCCC1 34a_100000699130_100000210202 [0,0,0,1,0,0|2,0,0]=3 4076 B11R1.203 CCOCC1CCCCCC1 34a_100121572206_200000696569 [0,0,0,1,0,0|2,0,0]=3 4077 B11R1.203 CCOCC1CCCCCC1 7a_100000699130_100000210202 [0,0,0,1,0,0|2,0,0]=3 4078 B11R1.203 CCOCN1CCCCCC1 269982a_100000185865_100000739092 [0,0,0,1,0,0|3,0,0]=4 4079 B11R1.203 CCOCN1CCCOCC1 269982a_100000685342_100000739092 [0,0,0,1,0,0|2,0,0]=3 4080 B11R1.203 CCSCC1CCCCCC1 62a_100000210202_200000696569 [0,0,0,1,0,0|2,1,0]=4 4081 B11R1.203 CCSCC1CCCCCC1 62a_200000696569_100000210202 [0,0,0,1,0,0|2,1,0]=4 4082 B11R1.203 FCOCC1CCCCCC1 34a_100000699130_100015361967 [0,0,0,1,0,0|3,0,0]=4 4083 B11R1.203 FCOCC1CCCCCC1 7a_100000699130_100015361967 [0,0,0,1,0,0|3,0,0]=4 4084 B11R1.248 CCN1CCCCCCCC1 2230a_100000039187_100000210202 [0,0,0,1,0,0|3,0,0]=4 4085 B11R1.248 CCN1CCCCCCCC1 269982a_100000039187_100000204670 [0,0,0,1,0,0|3,0,0]=4 4086 B11R1.248 CCN1CCCCCCCC1 34a_100000039187_100000210202 [0,0,0,1,0,0|3,0,0]=4 4087 B8R0.4 C#CCCCCOCC 34a_100000766709_100000210202 [2,0,0,0,0,0|0,0,2]=4 4088 B8R0.4 C#CCCCCOCC 34a_100121572206_100010269958 [2,0,0,0,0,0|0,0,2]=4 4089 B8R0.4 C#CCCCCOCC 7a_100000766709_100000210202 [2,0,0,0,0,0|0,0,2]=4 4090 B8R0.4 C#CCCOCCCC 34a_100000210227_100000688953 [2,0,0,0,0,0|0,0,2]=4 4091 B8R0.4 C#CCCOCCCC 34a_100011215631_100000210210 [2,0,0,0,0,0|0,0,2]=4 4092 B8R0.4 C#CCCOCCCC 7a_100000210227_100000688953 [2,0,0,0,0,0|0,0,2]=4 4093 B8R0.4 C#CCCOCCOC 34a_100000210237_100000688953 [2,0,0,0,0,0|0,0,2]=4 4094 B8R0.4 C#CCCOCCOC 34a_100011215631_100011201679 [2,0,0,0,0,0|0,0,2]=4 4095 B8R0.4 C#CCOCCOCC 34a_100000054580_100000210202 [2,0,0,0,0,0|0,0,2]=4 4096 B8R0.4 C#CCOCCOCC 34a_100000210136_100000184674 [2,0,0,0,0,0|0,0,2]=4 4097 B8R0.4 C#CCOCCOCC 34a_100000210247_100000210147 [2,0,0,0,0,0|0,0,2]=4 4098 B8R0.4 C#CCOCCOCC 34a_100121572206_100010402529 [2,0,0,0,0,0|0,0,2]=4 4099 B8R0.4 C#CCOCCOCC 7a_100000054580_100000210202 [2,0,0,0,0,0|0,0,2]=4 4100 B8R0.4 C#CCOCCOCC 7a_100000210136_100000038162 [2,0,0,0,0,0|0,0,2]=4 4101 B8R0.4 C/C=C/CCOCCC 34a_100016278192_100000210303 [2,0,0,0,0,0|1,0,1]=4 4102 B8R0.4 C/C=C/CCOCCO 34a_100016278192_100000211926 [2,0,0,0,0,0|1,0,1]=4 4103 B8R0.4 C/C=C/COCCCC 34a_100000210227_100102629194 [2,0,0,0,0,0|0,0,2]=4 4104 B8R0.4 C/C=C/COCCCC 34a_100016270725_100000210210 [2,0,0,0,0,0|0,0,2]=4 4105 B8R0.4 C/C=C/COCCCC 7a_100000210227_100102629194 [2,0,0,0,0,0|0,0,2]=4 4106 B8R0.4 C/C=C/COCCOC 34a_100000210237_100102629194 [2,0,0,0,0,0|0,0,2]=4 4107 B8R0.4 C/C=C/COCCOC 34a_100016270725_100011201679 [2,0,0,0,0,0|0,0,2]=4 4108 B8R0.4 C=CCCCCOCC 34a_100000766645_100000210202 [2,0,0,0,0,0|0,0,2]=4 4109 B8R0.4 C=CCCCCOCC 34a_100121572206_100011215482 [2,0,0,0,0,0|0,0,2]=4 4110 B8R0.4 C=CCCCCOCC 7a_100000766645_100000210202 [2,0,0,0,0,0|0,0,2]=4 4111 B8R0.4 C=CCCOCCCC 34a_100000210227_100000754431 [2,0,0,0,0,0|0,0,2]=4 4112 B8R0.4 C=CCCOCCCC 34a_100011205117_100000210210 [2,0,0,0,0,0|0,0,2]=4 4113 B8R0.4 C=CCCOCCCC 7a_100000210227_100000754431 [2,0,0,0,0,0|0,0,2]=4 4114 B8R0.4 C=CCCOCCOC 34a_100000210237_100000754431 [2,0,0,0,0,0|0,0,2]=4 4115 B8R0.4 C=CCCOCCOC 34a_100011205117_100011201679 [2,0,0,0,0,0|0,0,2]=4 4116 B8R0.4 C=CCOCCOCC 34a_100000037705_100000210202 [2,0,0,0,0,0|0,0,2]=4 4117 B8R0.4 C=CCOCCOCC 34a_100000210136_100015514636 [2,0,0,0,0,0|0,0,2]=4 4118 B8R0.4 C=CCOCCOCC 34a_200000210373_100000210147 [2,0,0,0,0,0|0,0,2]=4 4119 B8R0.4 C=CCOCCOCC 7a_100000037705_100000210202 [2,0,0,0,0,0|0,0,2]=4 4120 B8R0.4 C=CCOCCOCC 7a_100000210136_100015514636 [2,0,0,0,0,0|0,0,2]=4 4121 B8R0.4 C=COCCCCOC 34a_100000031558_200000210301 [2,0,0,0,0,0|0,0,2]=4 4122 B8R0.4 C=COCCCCOC 7a_100000031558_200000210301 [2,0,0,0,0,0|0,0,2]=4 4123 B8R0.4 C=COCCCCO[13CH3] 34a_100000031558_200025704644 [2,0,0,0,0,0|0,0,2]=4 4124 B8R0.4 C=COCCCCO[13CH3] 7a_100000031558_200025704644 [2,0,0,0,0,0|0,0,2]=4 4125 B8R0.4 C=COCCOCCC 34a_100000033082_100000210303 [2,0,0,0,0,0|0,0,2]=4 4126 B8R0.4 C=COCCOCCC 34a_100000210258_100000039644 [2,0,0,0,0,0|0,0,2]=4 4127 B8R0.4 C=COCCOCCO 34a_100000033082_100000211926 [2,0,0,0,0,0|0,0,2]=4 4128 B8R0.4 CC#CCCOCCC 34a_100000750427_100000210303 [2,0,0,0,0,0|1,0,1]=4 4129 B8R0.4 CC#CCCOCCO 34a_100000750427_100000211926 [2,0,0,0,0,0|1,0,1]=4 4130 B8R0.4 CC#CCOCCCC 34a_100000210227_100000748600 [2,0,0,0,0,0|0,0,2]=4 4131 B8R0.4 CC#CCOCCCC 34a_100000761923_100000210210 [2,0,0,0,0,0|0,0,2]=4 4132 B8R0.4 CC#CCOCCCC 7a_100000210227_100000748600 [2,0,0,0,0,0|0,0,2]=4 4133 B8R0.4 CC#CCOCCOC 34a_100000210237_100000748600 [2,0,0,0,0,0|0,0,2]=4 4134 B8R0.4 CC#CCOCCOC 34a_100000761923_100011201679 [2,0,0,0,0,0|0,0,2]=4 4135 B8R0.4 CC/C=C/CCCOC 34a_100016287902_200000210301 [2,0,0,0,0,0|1,0,1]=4 4136 B8R0.4 CC/C=C/CCCOC 7a_100016287902_200000210301 [2,0,0,0,0,0|1,0,1]=4 4137 B8R0.4 CC/C=C/CCCO[13CH3] 34a_100016287902_200025704644 [2,0,0,0,0,0|1,0,1]=4 4138 B8R0.4 CC/C=C/CCCO[13CH3] 7a_100016287902_200025704644 [2,0,0,0,0,0|1,0,1]=4 4139 B8R0.4 CC/C=C\CCOCC 34a_100016288707_100000210202 [2,0,0,0,0,0|0,0,2]=4 4140 B8R0.4 CC/C=C\CCOCC 34a_100121572206_100015370543 [2,0,0,0,0,0|0,0,2]=4 4141 B8R0.4 CC/C=C\CCOCC 7a_100016288707_100000210202 [2,0,0,0,0,0|0,0,2]=4 4142 B8R0.4 CC/C=C\COCCC 34a_100000210258_100103147603 [2,0,0,0,0,0|1,0,1]=4 4143 B8R0.4 CC/C=C\COCCC 34a_100016268518_100000210303 [2,0,0,0,0,0|1,0,1]=4 4144 B8R0.4 CC/C=C\COCCO 34a_100016268518_100000211926 [2,0,0,0,0,0|1,0,1]=4 4145 B8R0.4 CC=CCCCOCC 34a_100020645299_100000210202 [2,0,0,0,0,0|0,0,2]=4 4146 B8R0.4 CC=CCOCCCC 34a_100000210227_100000070051 [2,0,0,0,0,0|0,0,2]=4 4147 B8R0.4 CC=CCOCCCC 7a_100000210227_100000070051 [2,0,0,0,0,0|0,0,2]=4 4148 B8R0.4 CC=CCOCCOC 34a_100000210237_100000070051 [2,0,0,0,0,0|0,0,2]=4 4149 B8R0.4 CCC#CCCOCC 34a_100000036655_100000210202 [2,0,0,0,0,0|0,0,2]=4 4150 B8R0.4 CCC#CCCOCC 7a_100000036655_100000210202 [2,0,0,0,0,0|0,0,2]=4 4151 B8R0.4 CCC#CCOCCC 34a_100000032950_100000210303 [2,0,0,0,0,0|1,0,1]=4 4152 B8R0.4 CCC#CCOCCC 34a_100000210258_100009813939 [2,0,0,0,0,0|1,0,1]=4 4153 B8R0.4 CCC#CCOCCO 34a_100000032950_100000211926 [2,0,0,0,0,0|1,0,1]=4 4154 B8R0.4 CCC/C=C/COCC 34a_100016278788_100000210202 [2,0,0,0,0,0|0,0,2]=4 4155 B8R0.4 CCC/C=C/COCC 7a_100016278788_100000210202 [2,0,0,0,0,0|0,0,2]=4 4156 B8R0.4 CCCC#CCCOC 34a_100000042726_200000210301 [2,0,0,0,0,0|1,0,1]=4 4157 B8R0.4 CCCC#CCCOC 7a_100000042726_200000210301 [2,0,0,0,0,0|1,0,1]=4 4158 B8R0.4 CCCC#CCCO[13CH3] 34a_100000042726_200025704644 [2,0,0,0,0,0|1,0,1]=4 4159 B8R0.4 CCCC#CCCO[13CH3] 7a_100000042726_200025704644 [2,0,0,0,0,0|1,0,1]=4 4160 B8R0.4 CCCC#CCOCC 34a_100000034806_100000210202 [2,0,0,0,0,0|0,0,2]=4 4161 B8R0.4 CCCC#CCOCC 7a_100000034806_100000210202 [2,0,0,0,0,0|0,0,2]=4 4162 B8R0.4 CCCC/C=C/COC 34a_200016272032_200000210301 [2,0,0,0,0,0|1,0,1]=4 4163 B8R0.4 CCCC/C=C/COC 7a_200016272032_200000210301 [2,0,0,0,0,0|1,0,1]=4 4164 B8R0.4 CCCC/C=C/CO[13CH3] 34a_200016272032_200025704644 [2,0,0,0,0,0|1,0,1]=4 4165 B8R0.4 CCCC/C=C/CO[13CH3] 7a_200016272032_200025704644 [2,0,0,0,0,0|1,0,1]=4 4166 B8R0.4 CCCCC#CCOC 34a_200000034558_200000210301 [2,0,0,0,0,0|1,0,1]=4 4167 B8R0.4 CCCCC#CCOC 7a_200000034558_200000210301 [2,0,0,0,0,0|1,0,1]=4 4168 B8R0.4 CCCCC#CCO[13CH3] 34a_200000034558_200025704644 [2,0,0,0,0,0|1,0,1]=4 4169 B8R0.4 CCCCC#CCO[13CH3] 7a_200000034558_200025704644 [2,0,0,0,0,0|1,0,1]=4 4170 B8R0.4 CCCCCCCNC 2230a_100000229938_200000210301 [2,0,0,0,0,0|2,0,0]=4 4171 B8R0.4 CCCCCCCNC 2230a_106832991635_100000210681 [2,0,0,0,0,0|2,0,0]=4 4172 B8R0.4 CCCCCCCNC 34a_100102657272_100000210614 [2,0,0,0,0,0|2,0,0]=4 4173 B8R0.4 CCCCCCCNC 7a_106832991635_100000210614 [2,0,0,0,0,0|2,0,0]=4 4174 B8R0.4 CCCCCCCN[13CH3] 2230a_100000229938_200025704644 [2,0,0,0,0,0|2,0,0]=4 4175 B8R0.4 CCCCCCCOC 34a_100000210272_200000210301 [2,0,0,0,0,0|1,0,0]=3 4176 B8R0.4 CCCCCCCOC 34a_100138415774_100000210614 [2,0,0,0,0,0|1,0,0]=3 4177 B8R0.4 CCCCCCCOC 7a_100000210272_200000210301 [2,0,0,0,0,0|1,0,0]=3 4178 B8R0.4 CCCCCCCO[13CH3] 34a_100000210272_200025704644 [2,0,0,0,0,0|1,0,0]=3 4179 B8R0.4 CCCCCCCO[13CH3] 7a_100000210272_200025704644 [2,0,0,0,0,0|1,0,0]=3 4180 B8R0.4 CCCCCCCSC 62a_100000210614_200000210301 [2,0,0,0,0,0|1,1,0]=4 4181 B8R0.4 CCCCCCCSC 62a_200000210301_100000210316 [2,0,0,0,0,0|1,1,0]=4 4182 B8R0.4 CCCCCCCS[13CH3] 62a_100000210614_200025704644 [2,0,0,0,0,0|1,1,0]=4 4183 B8R0.4 CCCCCCCS[13CH3] 62a_200025704644_100000210316 [2,0,0,0,0,0|1,1,0]=4 4184 B8R0.4 CCCCCCNCC 2230a_100000210581_100000210202 [2,0,0,0,0,0|1,0,0]=3 4185 B8R0.4 CCCCCCNCC 2230a_100015525214_100000210314 [2,0,0,0,0,0|1,0,0]=3 4186 B8R0.4 CCCCCCOCC 34a_100000210259_100000210202 [2,0,0,0,0,0|0,0,0]=2 4187 B8R0.4 CCCCCCOCC 34a_100121572206_100000210314 [2,0,0,0,0,0|0,0,0]=2 4188 B8R0.4 CCCCCCOCC 7a_100000210259_100000210202 [2,0,0,0,0,0|0,0,0]=2 4189 B8R0.4 CCCCCCOCF 34a_100000210259_100015361967 [2,0,0,0,0,0|1,0,0]=3 4190 B8R0.4 CCCCCCOCF 7a_100000210259_100015361967 [2,0,0,0,0,0|1,0,0]=3 4191 B8R0.4 CCCCCCSCC 62a_100000210202_100000210757 [2,0,0,0,0,0|0,1,0]=3 4192 B8R0.4 CCCCCCSCC 62a_100000210314_100000210202 [2,0,0,0,0,0|0,1,0]=3 4193 B8R0.4 CCCCCCSCF 62a_100000210314_100015361967 [2,0,0,0,0,0|1,1,0]=4 4194 B8R0.4 CCCCCCSCF 62a_100015361967_100000210757 [2,0,0,0,0,0|1,1,0]=4 4195 B8R0.4 CCCCCNCCC 2230a_100000209983_100000210303 [2,0,0,0,0,0|2,0,0]=4 4196 B8R0.4 CCCCCNCCO 2230a_100000209983_100000211926 [2,0,0,0,0,0|2,0,0]=4 4197 B8R0.4 CCCCCNCCO 2230a_100016997473_100000210326 [2,0,0,0,0,0|2,0,0]=4 4198 B8R0.4 CCCCCNCCO 34a_100016990907_100000718602 [2,0,0,0,0,0|2,0,0]=4 4199 B8R0.4 CCCCCNCOC 2230a_100000209983_100000766300 [2,0,0,0,0,0|2,0,0]=4 4200 B8R0.4 CCCCCOCCBr 34a_100000211926_100000718602 [2,0,0,0,0,0|2,0,0]=4 4201 B8R0.4 CCCCCOCCC 34a_100000210253_100000210303 [2,0,0,0,0,0|1,0,0]=3 4202 B8R0.4 CCCCCOCCC 34a_100000210258_100000718602 [2,0,0,0,0,0|1,0,0]=3 4203 B8R0.4 CCCCCOCCC 7a_100000210253_100000210303 [2,0,0,0,0,0|1,0,0]=3 4204 B8R0.4 CCCCCOCCF 34a_100000210253_100011217306 [2,0,0,0,0,0|2,0,0]=4 4205 B8R0.4 CCCCCOCCF 7a_100000210253_100011217306 [2,0,0,0,0,0|2,0,0]=4 4206 B8R0.4 CCCCCOCCN 34a_100000210304_100000718602 [2,0,0,0,0,0|2,0,0]=4 4207 B8R0.4 CCCCCOCCO 34a_100000210253_100000211926 [2,0,0,0,0,0|1,0,0]=3 4208 B8R0.4 CCCCCOCCO 7a_100000210253_100000211926 [2,0,0,0,0,0|1,0,0]=3 4209 B8R0.4 CCCCCOCSC 34a_100000210253_100011218213 [2,0,0,0,0,0|1,1,0]=4 4210 B8R0.4 CCCCCSCCC 62a_100000210303_100000210326 [2,0,0,0,0,0|1,1,0]=4 4211 B8R0.4 CCCCCSCCC 62a_100000210326_100000210303 [2,0,0,0,0,0|1,1,0]=4 4212 B8R0.4 CCCCCSCCO 62a_100000210326_100000211926 [2,0,0,0,0,0|1,1,0]=4 4213 B8R0.4 CCCCCSCCO 62a_100000211926_100000210326 [2,0,0,0,0,0|1,1,0]=4 4214 B8R0.4 CCCCCSCOC 62a_100000210326_100000766300 [2,0,0,0,0,0|1,1,0]=4 4215 B8R0.4 CCCCCSCOC 62a_100000766300_100000210326 [2,0,0,0,0,0|1,1,0]=4 4216 B8R0.4 CCCCNCCCC 2230a_100000102301_100000210211 [2,0,0,0,0,0|1,0,0]=3 4217 B8R0.4 CCCCNCCCC 7a_106832991798_100000210211 [2,0,0,0,0,0|1,0,0]=3 4218 B8R0.4 CCCCNCCCF 2230a_100000102301_100011934791 [2,0,0,0,0,0|2,0,0]=4 4219 B8R0.4 CCCCNCCCF 2230a_100015189416_100000210211 [2,0,0,0,0,0|2,0,0]=4 4220 B8R0.4 CCCCNCCCF 34a_100015189416_100000210210 [2,0,0,0,0,0|2,0,0]=4 4221 B8R0.4 CCCCNCCCF 7a_106832991798_100011934791 [2,0,0,0,0,0|2,0,0]=4 4222 B8R0.4 CCCCNCCCO 2230a_100000102301_100000230001 [2,0,0,0,0,0|2,0,0]=4 4223 B8R0.4 CCCCNCCCO 7a_106832991798_100011215043 [2,0,0,0,0,0|2,0,0]=4 4224 B8R0.4 CCCCNCCOC 2230a_100000102301_100011201679 [2,0,0,0,0,0|1,0,0]=3 4225 B8R0.4 CCCCNCCOC 2230a_100000209980_100000210211 [2,0,0,0,0,0|1,0,0]=3 4226 B8R0.4 CCCCNCCOC 7a_106832991798_100000233755 [2,0,0,0,0,0|1,0,0]=3 4227 B8R0.4 CCCCNCCSC 2230a_100000102301_100000751147 [2,0,0,0,0,0|1,1,0]=4 4228 B8R0.4 CCCCNCCSC 2230a_100020590264_100000210211 [2,0,0,0,0,0|1,1,0]=4 4229 B8R0.4 CCCCNCCSC 7a_106832991798_100000212216 [2,0,0,0,0,0|1,1,0]=4 4230 B8R0.4 CCCCOCCC#N 7a_100000210227_100000184422 [2,0,0,0,0,0|1,0,1]=4 4231 B8R0.4 CCCCOCCCBr 34a_100011217188_100000210210 [2,0,0,0,0,0|1,0,0]=3 4232 B8R0.4 CCCCOCCCC 34a_100000210227_100000210210 [2,0,0,0,0,0|0,0,0]=2 4233 B8R0.4 CCCCOCCCC 7a_100000210227_100000210211 [2,0,0,0,0,0|0,0,0]=2 4234 B8R0.4 CCCCOCCCCl 34a_100000230001_100000210210 [2,0,0,0,0,0|1,0,0]=3 4235 B8R0.4 CCCCOCCCF 34a_100000210227_100011934791 [2,0,0,0,0,0|1,0,0]=3 4236 B8R0.4 CCCCOCCCF 34a_100000759539_100000210210 [2,0,0,0,0,0|1,0,0]=3 4237 B8R0.4 CCCCOCCCF 7a_100000210227_100011934791 [2,0,0,0,0,0|1,0,0]=3 4238 B8R0.4 CCCCOCCCN 34a_100000182051_100000210210 [2,0,0,0,0,0|1,0,0]=3 4239 B8R0.4 CCCCOCCCO 34a_100000210227_100000230001 [2,0,0,0,0,0|1,0,0]=3 4240 B8R0.4 CCCCOCCCO 7a_100000210227_100011215043 [2,0,0,0,0,0|1,0,0]=3 4241 B8R0.4 CCCCOCCNC 2230a_106832991635_100000743108 [2,0,0,0,0,0|1,0,0]=3 4242 B8R0.4 CCCCOCCNC 34a_100102657272_100000743108 [2,0,0,0,0,0|1,0,0]=3 4243 B8R0.4 CCCCOCCNC 7a_106832991635_100000743108 [2,0,0,0,0,0|1,0,0]=3 4244 B8R0.4 CCCCOCCOC 34a_100000210227_100011201679 [2,0,0,0,0,0|0,0,0]=2 4245 B8R0.4 CCCCOCCOC 34a_100000210237_100000210210 [2,0,0,0,0,0|0,0,0]=2 4246 B8R0.4 CCCCOCCOC 34a_100000210238_200000210301 [2,0,0,0,0,0|0,0,0]=2 4247 B8R0.4 CCCCOCCOC 34a_100138415774_100000743108 [2,0,0,0,0,0|0,0,0]=2 4248 B8R0.4 CCCCOCCOC 7a_100000210227_100000233755 [2,0,0,0,0,0|0,0,0]=2 4249 B8R0.4 CCCCOCCOC 7a_100000210238_200000210301 [2,0,0,0,0,0|0,0,0]=2 4250 B8R0.4 CCCCOCCON 34a_100000700252_100000210210 [2,0,0,0,0,0|1,0,0]=3 4251 B8R0.4 CCCCOCCO[13CH3] 34a_100000210238_200025704644 [2,0,0,0,0,0|0,0,0]=2 4252 B8R0.4 CCCCOCCO[13CH3] 7a_100000210238_200025704644 [2,0,0,0,0,0|0,0,0]=2 4253 B8R0.4 CCCCOCCSC 34a_100000210227_100000212216 [2,0,0,0,0,0|0,1,0]=3 4254 B8R0.4 CCCCOCCSC 34a_100000230434_100000210210 [2,0,0,0,0,0|0,1,0]=3 4255 B8R0.4 CCCCOCCSC 62a_100000743108_200000210301 [2,0,0,0,0,0|0,1,0]=3 4256 B8R0.4 CCCCOCCSC 62a_200000210301_100000743108 [2,0,0,0,0,0|0,1,0]=3 4257 B8R0.4 CCCCOCCSC 7a_100000210227_100000212216 [2,0,0,0,0,0|0,1,0]=3 4258 B8R0.4 CCCCOCCSC 7a_100000230434_100000210211 [2,0,0,0,0,0|0,1,0]=3 4259 B8R0.4 CCCCOCCS[13CH3] 62a_100000743108_200025704644 [2,0,0,0,0,0|0,1,0]=3 4260 B8R0.4 CCCCOCCS[13CH3] 62a_200025704644_100000743108 [2,0,0,0,0,0|0,1,0]=3 4261 B8R0.4 CCCCOCNCC 2230a_100015525214_100011995733 [2,0,0,0,0,0|1,0,0]=3 4262 B8R0.4 CCCCOCOCC 34a_100121572206_100011995733 [2,0,0,0,0,0|0,0,0]=2 4263 B8R0.4 CCCCOCSCC 62a_100000210202_100011995733 [2,0,0,0,0,0|0,1,0]=3 4264 B8R0.4 CCCCOCSCC 62a_100011995733_100000210202 [2,0,0,0,0,0|0,1,0]=3 4265 B8R0.4 CCCCOCSCF 62a_100011995733_100015361967 [2,0,0,0,0,0|1,1,0]=4 4266 B8R0.4 CCCCOCSCF 62a_100015361967_100011995733 [2,0,0,0,0,0|1,1,0]=4 4267 B8R0.4 CCCCSCCCC 62a_100000210211_100000210210 [2,0,0,0,0,0|0,1,0]=3 4268 B8R0.4 CCCCSCCCF 62a_100000210211_100011934791 [2,0,0,0,0,0|1,1,0]=4 4269 B8R0.4 CCCCSCCCF 62a_100011934791_100000210210 [2,0,0,0,0,0|1,1,0]=4 4270 B8R0.4 CCCCSCCCO 62a_100000210211_100011215043 [2,0,0,0,0,0|1,1,0]=4 4271 B8R0.4 CCCCSCCCO 62a_100011215043_100000210210 [2,0,0,0,0,0|1,1,0]=4 4272 B8R0.4 CCCCSCCNC 2230a_100025743550_200000210301 [2,0,0,0,0,0|1,1,0]=4 4273 B8R0.4 CCCCSCCN[13CH3] 2230a_100025743550_200025704644 [2,0,0,0,0,0|1,1,0]=4 4274 B8R0.4 CCCCSCCOC 34a_200000230436_200000210301 [2,0,0,0,0,0|0,1,0]=3 4275 B8R0.4 CCCCSCCOC 62a_100000210211_100000233755 [2,0,0,0,0,0|0,1,0]=3 4276 B8R0.4 CCCCSCCOC 62a_100000233755_100000210210 [2,0,0,0,0,0|0,1,0]=3 4277 B8R0.4 CCCCSCCOC 7a_200000230436_200000210301 [2,0,0,0,0,0|0,1,0]=3 4278 B8R0.4 CCCCSCCO[13CH3] 34a_200000230436_200025704644 [2,0,0,0,0,0|0,1,0]=3 4279 B8R0.4 CCCCSCCO[13CH3] 7a_200000230436_200025704644 [2,0,0,0,0,0|0,1,0]=3 4280 B8R0.4 CCCCSCCSC 62a_100000210211_100000751147 [2,0,0,0,0,0|0,2,0]=4 4281 B8R0.4 CCCCSCCSC 62a_100000212216_100000210210 [2,0,0,0,0,0|0,2,0]=4 4282 B8R0.4 CCCCSCOCC 62a_100000210211_100000739092 [2,0,0,0,0,0|0,1,0]=3 4283 B8R0.4 CCCCSCOCC 62a_100000739092_100000210210 [2,0,0,0,0,0|0,1,0]=3 4284 B8R0.4 CCCNCCCOC 34a_100150723488_100000210303 [2,0,0,0,0,0|2,0,0]=4 4285 B8R0.4 CCCNCCOCC 2230a_102516460346_100000210303 [2,0,0,0,0,0|1,0,0]=3 4286 B8R0.4 CCCNCCOCC 34a_102516460346_100000210303 [2,0,0,0,0,0|1,0,0]=3 4287 B8R0.4 CCCNCCSCC 2230a_100000106463_100000210303 [2,0,0,0,0,0|1,1,0]=4 4288 B8R0.4 CCCOCCCCBr 34a_100011216708_100000210303 [2,0,0,0,0,0|2,0,0]=4 4289 B8R0.4 CCCOCCCCCl 34a_100000210776_100000210303 [2,0,0,0,0,0|2,0,0]=4 4290 B8R0.4 CCCOCCCCCl 7a_100000210776_100000210303 [2,0,0,0,0,0|2,0,0]=4 4291 B8R0.4 CCCOCCCCF 34a_100000210258_100000729493 [2,0,0,0,0,0|2,0,0]=4 4292 B8R0.4 CCCOCCCCF 34a_100011995726_100000210303 [2,0,0,0,0,0|2,0,0]=4 4293 B8R0.4 CCCOCCCCF 7a_100011995726_100000210303 [2,0,0,0,0,0|2,0,0]=4 4294 B8R0.4 CCCOCCCCI 34a_200012148704_100000210303 [2,0,0,0,0,0|2,0,0]=4 4295 B8R0.4 CCCOCCCCN 34a_100000750430_100000210303 [2,0,0,0,0,0|2,0,0]=4 4296 B8R0.4 CCCOCCCCO 34a_100000210258_100011216708 [2,0,0,0,0,0|2,0,0]=4 4297 B8R0.4 CCCOCCCNC 2230a_100011217757_200000210301 [2,0,0,0,0,0|2,0,0]=4 4298 B8R0.4 CCCOCCCNC 34a_100000213112_100000210303 [2,0,0,0,0,0|2,0,0]=4 4299 B8R0.4 CCCOCCCNC 34a_100011217757_200000210301 [2,0,0,0,0,0|2,0,0]=4 4300 B8R0.4 CCCOCCCN[13CH3] 2230a_100011217757_200025704644 [2,0,0,0,0,0|2,0,0]=4 4301 B8R0.4 CCCOCCCN[13CH3] 34a_100011217757_200025704644 [2,0,0,0,0,0|2,0,0]=4 4302 B8R0.4 CCCOCCCOC 34a_100000210258_100000740836 [2,0,0,0,0,0|2,0,0]=4 4303 B8R0.4 CCCOCCCOC 34a_100000740835_100000210303 [2,0,0,0,0,0|2,0,0]=4 4304 B8R0.4 CCCOCCCSC 34a_100000690336_100000210303 [2,0,0,0,0,0|2,0,0]=4 4305 B8R0.4 CCCOCCCSC 7a_100000690336_100000210303 [2,0,0,0,0,0|2,0,0]=4 4306 B8R0.4 CCCOCCNCC 2230a_100015525214_100011215938 [2,0,0,0,0,0|1,0,0]=3 4307 B8R0.4 CCCOCCNCC 2230a_100161115042_100000210202 [2,0,0,0,0,0|1,0,0]=3 4308 B8R0.4 CCCOCCNCC 34a_100161115042_100000210202 [2,0,0,0,0,0|1,0,0]=3 4309 B8R0.4 CCCOCCNCF 34a_100161115042_100015361967 [2,0,0,0,0,0|2,0,0]=4 4310 B8R0.4 CCCOCCOCC 34a_100000210136_100000210303 [2,0,0,0,0,0|0,0,0]=2 4311 B8R0.4 CCCOCCOCC 34a_100000210258_100000210147 [2,0,0,0,0,0|0,0,0]=2 4312 B8R0.4 CCCOCCOCC 34a_100000752267_100000210202 [2,0,0,0,0,0|0,0,0]=2 4313 B8R0.4 CCCOCCOCC 34a_100121572206_100011215938 [2,0,0,0,0,0|0,0,0]=2 4314 B8R0.4 CCCOCCOCC 7a_100000210136_100000210303 [2,0,0,0,0,0|0,0,0]=2 4315 B8R0.4 CCCOCCOCC 7a_100000752267_100000210202 [2,0,0,0,0,0|0,0,0]=2 4316 B8R0.4 CCCOCCOCF 34a_100000752267_100015361967 [2,0,0,0,0,0|1,0,0]=3 4317 B8R0.4 CCCOCCOCF 7a_100000752267_100015361967 [2,0,0,0,0,0|1,0,0]=3 4318 B8R0.4 CCCOCCSCC 34a_100000210258_100000757381 [2,0,0,0,0,0|0,1,0]=3 4319 B8R0.4 CCCOCCSCC 34a_100000212035_100000210303 [2,0,0,0,0,0|0,1,0]=3 4320 B8R0.4 CCCOCCSCC 62a_100000210202_100011215938 [2,0,0,0,0,0|0,1,0]=3 4321 B8R0.4 CCCOCCSCC 62a_100011215938_100000210202 [2,0,0,0,0,0|0,1,0]=3 4322 B8R0.4 CCCOCCSCC 7a_100000212035_100000210303 [2,0,0,0,0,0|0,1,0]=3 4323 B8R0.4 CCCOCCSCF 62a_100011215938_100015361967 [2,0,0,0,0,0|1,1,0]=4 4324 B8R0.4 CCCOCCSCF 62a_100015361967_100011215938 [2,0,0,0,0,0|1,1,0]=4 4325 B8R0.4 CCCSCCCOC 62a_100000210303_100000709357 [2,0,0,0,0,0|2,0,0]=4 4326 B8R0.4 CCCSCCCOC 62a_100000709357_100000210303 [2,0,0,0,0,0|2,0,0]=4 4327 B8R0.4 CCCSCCNCC 2230a_100020603323_100000210202 [2,0,0,0,0,0|1,1,0]=4 4328 B8R0.4 CCCSCCOCC 34a_200000230433_100000210202 [2,0,0,0,0,0|0,1,0]=3 4329 B8R0.4 CCCSCCOCC 62a_100000210147_100000210303 [2,0,0,0,0,0|0,1,0]=3 4330 B8R0.4 CCCSCCOCC 62a_100000210303_100011215890 [2,0,0,0,0,0|0,1,0]=3 4331 B8R0.4 CCCSCCOCC 7a_200000230433_100000210202 [2,0,0,0,0,0|0,1,0]=3 4332 B8R0.4 CCCSCCOCF 34a_200000230433_100015361967 [2,0,0,0,0,0|1,1,0]=4 4333 B8R0.4 CCCSCCOCF 7a_200000230433_100015361967 [2,0,0,0,0,0|1,1,0]=4 4334 B8R0.4 CCCSCCSCC 62a_100000210303_100000757381 [2,0,0,0,0,0|0,2,0]=4 4335 B8R0.4 CCCSCCSCC 62a_100000757381_100000210303 [2,0,0,0,0,0|0,2,0]=4 4336 B8R0.4 CCNCCCCCF 2230a_100015525214_100000729378 [2,0,0,0,0,0|2,0,0]=4 4337 B8R0.4 CCNCCCCCO 2230a_100000762737_100000210202 [2,0,0,0,0,0|2,0,0]=4 4338 B8R0.4 CCNCCCCCO 2230a_100015525214_100000746330 [2,0,0,0,0,0|2,0,0]=4 4339 B8R0.4 CCNCCCCCO 34a_100000762737_100000210202 [2,0,0,0,0,0|2,0,0]=4 4340 B8R0.4 CCNCCCCOC 2230a_100015525214_100000730899 [2,0,0,0,0,0|1,0,0]=3 4341 B8R0.4 CCNCCCOCC 2230a_100000210961_100000210202 [2,0,0,0,0,0|1,0,0]=3 4342 B8R0.4 CCNCCCOCC 2230a_100015525214_100012232248 [2,0,0,0,0,0|1,0,0]=3 4343 B8R0.4 CCNCCCOCC 34a_100000210961_100000210202 [2,0,0,0,0,0|1,0,0]=3 4344 B8R0.4 CCNCCOCCO 2230a_100000211614_100000210202 [2,0,0,0,0,0|1,0,0]=3 4345 B8R0.4 CCNCCOCCO 2230a_100015525214_100011215305 [2,0,0,0,0,0|1,0,0]=3 4346 B8R0.4 CCNCCOCCO 34a_100000211614_100000210202 [2,0,0,0,0,0|1,0,0]=3 4347 B8R0.4 CCNCCSCCO 2230a_100011219999_100000210202 [2,0,0,0,0,0|1,1,0]=4 4348 B8R0.4 CCNCOCCOC 2230a_100015525214_100000231047 [2,0,0,0,0,0|1,0,0]=3 4349 B8R0.4 CCOCCCCCBr 34a_100000746331_100000210202 [2,0,0,0,0,0|1,0,0]=3 4350 B8R0.4 CCOCCCCCBr 7a_100000746331_100000210202 [2,0,0,0,0,0|1,0,0]=3 4351 B8R0.4 CCOCCCCCCl 34a_100000746330_100000210202 [2,0,0,0,0,0|1,0,0]=3 4352 B8R0.4 CCOCCCCCCl 7a_100000746330_100000210202 [2,0,0,0,0,0|1,0,0]=3 4353 B8R0.4 CCOCCCCCF 34a_100121572206_100000729378 [2,0,0,0,0,0|1,0,0]=3 4354 B8R0.4 CCOCCCCCI 34a_200012148887_100000210202 [2,0,0,0,0,0|1,0,0]=3 4355 B8R0.4 CCOCCCCCI 7a_200012148887_100000210202 [2,0,0,0,0,0|1,0,0]=3 4356 B8R0.4 CCOCCCCCN 34a_100000762737_100000210202 [2,0,0,0,0,0|1,0,0]=3 4357 B8R0.4 CCOCCCCCO 34a_100121572206_100000746330 [2,0,0,0,0,0|1,0,0]=3 4358 B8R0.4 CCOCCCCOC 34a_100000740925_100000210202 [2,0,0,0,0,0|0,0,0]=2 4359 B8R0.4 CCOCCCCOC 34a_100121572206_100000755781 [2,0,0,0,0,0|0,0,0]=2 4360 B8R0.4 CCOCCCCSC 34a_100011217163_100000210202 [2,0,0,0,0,0|0,1,0]=3 4361 B8R0.4 CCOCCCCSC 7a_100011217163_100000210202 [2,0,0,0,0,0|0,1,0]=3 4362 B8R0.4 CCOCCCNCF 34a_100000210961_100015361967 [2,0,0,0,0,0|2,0,0]=4 4363 B8R0.4 CCOCCCOCC 34a_100000757476_100000210202 [2,0,0,0,0,0|0,0,0]=2 4364 B8R0.4 CCOCCCOCC 34a_100121572206_100012232248 [2,0,0,0,0,0|0,0,0]=2 4365 B8R0.4 CCOCCCOCC 7a_100000757476_100000210202 [2,0,0,0,0,0|0,0,0]=2 4366 B8R0.4 CCOCCCOCF 34a_100000757476_100015361967 [2,0,0,0,0,0|1,0,0]=3 4367 B8R0.4 CCOCCCOCF 7a_100000757476_100015361967 [2,0,0,0,0,0|1,0,0]=3 4368 B8R0.4 CCOCCCSCC 34a_100011216438_100000210202 [2,0,0,0,0,0|0,1,0]=3 4369 B8R0.4 CCOCCCSCC 62a_100000210202_100012232248 [2,0,0,0,0,0|0,1,0]=3 4370 B8R0.4 CCOCCCSCC 62a_100012232248_100000210202 [2,0,0,0,0,0|0,1,0]=3 4371 B8R0.4 CCOCCCSCC 7a_100011216438_100000210202 [2,0,0,0,0,0|0,1,0]=3 4372 B8R0.4 CCOCCCSCF 62a_100012232248_100015361967 [2,0,0,0,0,0|1,1,0]=4 4373 B8R0.4 CCOCCCSCF 62a_100015361967_100012232248 [2,0,0,0,0,0|1,1,0]=4 4374 B8R0.4 CCOCCNCCF 2230a_102516460346_100011217306 [2,0,0,0,0,0|2,0,0]=4 4375 B8R0.4 CCOCCNCCF 34a_100000724931_100000210147 [2,0,0,0,0,0|2,0,0]=4 4376 B8R0.4 CCOCCNCCF 34a_102516460346_100011217306 [2,0,0,0,0,0|2,0,0]=4 4377 B8R0.4 CCOCCNCCO 2230a_100016997473_100011215890 [2,0,0,0,0,0|1,0,0]=3 4378 B8R0.4 CCOCCNCCO 2230a_102516460346_100000211926 [2,0,0,0,0,0|1,0,0]=3 4379 B8R0.4 CCOCCNCCO 34a_100016990907_100000210147 [2,0,0,0,0,0|1,0,0]=3 4380 B8R0.4 CCOCCNCCO 34a_102516460346_100000211926 [2,0,0,0,0,0|1,0,0]=3 4381 B8R0.4 CCOCCNCOC 2230a_102516460346_100000766300 [2,0,0,0,0,0|1,0,0]=3 4382 B8R0.4 CCOCCNCSC 2230a_102516460346_100011218213 [2,0,0,0,0,0|1,1,0]=4 4383 B8R0.4 CCOCCNCSC 34a_102516460346_100011218213 [2,0,0,0,0,0|1,1,0]=4 4384 B8R0.4 CCOCCOCC#N 7a_100000210136_100011215382 [2,0,0,0,0,0|1,0,1]=4 4385 B8R0.4 CCOCCOCC=O 34a_100000210136_200009817547 [2,0,0,0,0,0|0,0,2]=4 4386 B8R0.4 CCOCCOCC=O 7a_100000210136_200015260668 [2,0,0,0,0,0|0,0,2]=4 4387 B8R0.4 CCOCCOCCBr 34a_100000211926_100000210147 [2,0,0,0,0,0|1,0,0]=3 4388 B8R0.4 CCOCCOCCBr 34a_100000692535_100000210202 [2,0,0,0,0,0|1,0,0]=3 4389 B8R0.4 CCOCCOCCBr 7a_100000692535_100000210202 [2,0,0,0,0,0|1,0,0]=3 4390 B8R0.4 CCOCCOCCCl 34a_100011215305_100000210202 [2,0,0,0,0,0|1,0,0]=3 4391 B8R0.4 CCOCCOCCCl 7a_100011215305_100000210202 [2,0,0,0,0,0|1,0,0]=3 4392 B8R0.4 CCOCCOCCF 34a_100000210136_100011217306 [2,0,0,0,0,0|1,0,0]=3 4393 B8R0.4 CCOCCOCCF 34a_200015357709_100000210202 [2,0,0,0,0,0|1,0,0]=3 4394 B8R0.4 CCOCCOCCF 7a_100000210136_100011217306 [2,0,0,0,0,0|1,0,0]=3 4395 B8R0.4 CCOCCOCCF 7a_200015357709_100000210202 [2,0,0,0,0,0|1,0,0]=3 4396 B8R0.4 CCOCCOCCI 34a_100012149058_100000210202 [2,0,0,0,0,0|1,0,0]=3 4397 B8R0.4 CCOCCOCCI 7a_100012149058_100000210202 [2,0,0,0,0,0|1,0,0]=3 4398 B8R0.4 CCOCCOCCN 34a_100000210304_100000210147 [2,0,0,0,0,0|1,0,0]=3 4399 B8R0.4 CCOCCOCCN 34a_100000211614_100000210202 [2,0,0,0,0,0|1,0,0]=3 4400 B8R0.4 CCOCCOCCO 34a_100000210136_100000211926 [2,0,0,0,0,0|0,0,0]=2 4401 B8R0.4 CCOCCOCCO 34a_100121572206_100000692535 [2,0,0,0,0,0|0,0,0]=2 4402 B8R0.4 CCOCCOCCO 7a_100000210136_100000211926 [2,0,0,0,0,0|0,0,0]=2 4403 B8R0.4 CCOCCOCSC 34a_100000210136_100011218213 [2,0,0,0,0,0|0,1,0]=3 4404 B8R0.4 CCOCCSCCF 62a_100000210147_100011217306 [2,0,0,0,0,0|1,1,0]=4 4405 B8R0.4 CCOCCSCCF 62a_100011217306_100011215890 [2,0,0,0,0,0|1,1,0]=4 4406 B8R0.4 CCOCCSCCO 62a_100000210147_100000211926 [2,0,0,0,0,0|0,1,0]=3 4407 B8R0.4 CCOCCSCCO 62a_100000211926_100011215890 [2,0,0,0,0,0|0,1,0]=3 4408 B8R0.4 CCOCCSCOC 62a_100000210147_100000766300 [2,0,0,0,0,0|0,1,0]=3 4409 B8R0.4 CCOCCSCOC 62a_100000766300_100011215890 [2,0,0,0,0,0|0,1,0]=3 4410 B8R0.4 CCOCCSCSC 62a_100000210147_100011218213 [2,0,0,0,0,0|0,2,0]=4 4411 B8R0.4 CCOCCSCSC 62a_100011218213_100011215890 [2,0,0,0,0,0|0,2,0]=4 4412 B8R0.4 CCOCSCCCF 62a_100000739092_100011934791 [2,0,0,0,0,0|1,1,0]=4 4413 B8R0.4 CCOCSCCCF 62a_100011934791_100000739092 [2,0,0,0,0,0|1,1,0]=4 4414 B8R0.4 CCOCSCCCO 62a_100000739092_100011215043 [2,0,0,0,0,0|1,1,0]=4 4415 B8R0.4 CCOCSCCCO 62a_100011215043_100000739092 [2,0,0,0,0,0|1,1,0]=4 4416 B8R0.4 CCOCSCCOC 62a_100000233755_100000739092 [2,0,0,0,0,0|0,1,0]=3 4417 B8R0.4 CCOCSCCOC 62a_100000739092_100000233755 [2,0,0,0,0,0|0,1,0]=3 4418 B8R0.4 CCOCSCCSC 62a_100000212216_100000739092 [2,0,0,0,0,0|0,2,0]=4 4419 B8R0.4 CCOCSCCSC 62a_100000739092_100000751147 [2,0,0,0,0,0|0,2,0]=4 4420 B8R0.4 CCOCSCOCC 62a_100000739092_100000739092 [2,0,0,0,0,0|0,1,0]=3 4421 B8R0.4 CCSCCCCCF 62a_100000210202_100000729378 [2,0,0,0,0,0|1,1,0]=4 4422 B8R0.4 CCSCCCCCF 62a_100000729378_100000210202 [2,0,0,0,0,0|1,1,0]=4 4423 B8R0.4 CCSCCCCCO 62a_100000210202_100000746330 [2,0,0,0,0,0|1,1,0]=4 4424 B8R0.4 CCSCCCCCO 62a_100000746330_100000210202 [2,0,0,0,0,0|1,1,0]=4 4425 B8R0.4 CCSCCCCOC 62a_100000210202_100000730899 [2,0,0,0,0,0|0,1,0]=3 4426 B8R0.4 CCSCCCCOC 62a_100000730899_100000210202 [2,0,0,0,0,0|0,1,0]=3 4427 B8R0.4 CCSCCCOCF 34a_100011216438_100015361967 [2,0,0,0,0,0|1,1,0]=4 4428 B8R0.4 CCSCCCOCF 7a_100011216438_100015361967 [2,0,0,0,0,0|1,1,0]=4 4429 B8R0.4 CCSCCNCCO 2230a_100000106463_100000211926 [2,0,0,0,0,0|1,1,0]=4 4430 B8R0.4 CCSCCNCCO 2230a_100016997473_100000757381 [2,0,0,0,0,0|1,1,0]=4 4431 B8R0.4 CCSCCNCCO 34a_100016990907_100000757381 [2,0,0,0,0,0|1,1,0]=4 4432 B8R0.4 CCSCCNCOC 2230a_100000106463_100000766300 [2,0,0,0,0,0|1,1,0]=4 4433 B8R0.4 CCSCCOCCBr 34a_100000211926_100000757381 [2,0,0,0,0,0|1,1,0]=4 4434 B8R0.4 CCSCCOCCF 34a_100000212035_100011217306 [2,0,0,0,0,0|1,1,0]=4 4435 B8R0.4 CCSCCOCCF 7a_100000212035_100011217306 [2,0,0,0,0,0|1,1,0]=4 4436 B8R0.4 CCSCCOCCN 34a_100000210304_100000757381 [2,0,0,0,0,0|1,1,0]=4 4437 B8R0.4 CCSCCOCCO 34a_100000212035_100000211926 [2,0,0,0,0,0|0,1,0]=3 4438 B8R0.4 CCSCCOCCO 62a_100000210202_100011215305 [2,0,0,0,0,0|0,1,0]=3 4439 B8R0.4 CCSCCOCCO 62a_100011215305_100000210202 [2,0,0,0,0,0|0,1,0]=3 4440 B8R0.4 CCSCCOCCO 7a_100000212035_100000211926 [2,0,0,0,0,0|0,1,0]=3 4441 B8R0.4 CCSCCOCSC 34a_100000212035_100011218213 [2,0,0,0,0,0|0,2,0]=4 4442 B8R0.4 CCSCCSCCO 62a_100000211926_100000757381 [2,0,0,0,0,0|0,2,0]=4 4443 B8R0.4 CCSCCSCCO 62a_100000757381_100000211926 [2,0,0,0,0,0|0,2,0]=4 4444 B8R0.4 CCSCCSCOC 62a_100000757381_100000766300 [2,0,0,0,0,0|0,2,0]=4 4445 B8R0.4 CCSCCSCOC 62a_100000766300_100000757381 [2,0,0,0,0,0|0,2,0]=4 4446 B8R0.4 CCSCOCCOC 62a_100000210202_100000231047 [2,0,0,0,0,0|0,1,0]=3 4447 B8R0.4 CCSCOCCOC 62a_100000231047_100000210202 [2,0,0,0,0,0|0,1,0]=3 4448 B8R0.4 CNCCCCCOC 2230a_100000747528_200000210301 [2,0,0,0,0,0|2,0,0]=4 4449 B8R0.4 CNCCCCCOC 34a_100000722520_200000210301 [2,0,0,0,0,0|2,0,0]=4 4450 B8R0.4 CNCCCCCOC 34a_100000747528_200000210301 [2,0,0,0,0,0|2,0,0]=4 4451 B8R0.4 CNCCCCCO[13CH3] 34a_100000722520_200025704644 [2,0,0,0,0,0|2,0,0]=4 4452 B8R0.4 CNCCCOCCO 34a_100000213112_100000211926 [2,0,0,0,0,0|2,0,0]=4 4453 B8R0.4 CNCCOCCOC 2230a_100000745349_200000210301 [2,0,0,0,0,0|1,0,0]=3 4454 B8R0.4 CNCCOCCOC 2230a_106832991635_100000695917 [2,0,0,0,0,0|1,0,0]=3 4455 B8R0.4 CNCCOCCOC 34a_100000228057_200000210301 [2,0,0,0,0,0|1,0,0]=3 4456 B8R0.4 CNCCOCCOC 34a_100000745349_200000210301 [2,0,0,0,0,0|1,0,0]=3 4457 B8R0.4 CNCCOCCOC 34a_100102657272_100000695917 [2,0,0,0,0,0|1,0,0]=3 4458 B8R0.4 CNCCOCCOC 7a_106832991635_100000695917 [2,0,0,0,0,0|1,0,0]=3 4459 B8R0.4 CNCCOCCO[13CH3] 34a_100000228057_200025704644 [2,0,0,0,0,0|1,0,0]=3 4460 B8R0.4 COCCCCCCBr 34a_100011215345_200000210301 [2,0,0,0,0,0|2,0,0]=4 4461 B8R0.4 COCCCCCCBr 7a_100011215345_200000210301 [2,0,0,0,0,0|2,0,0]=4 4462 B8R0.4 COCCCCCCCl 34a_100000766143_200000210301 [2,0,0,0,0,0|2,0,0]=4 4463 B8R0.4 COCCCCCCCl 7a_100000766143_200000210301 [2,0,0,0,0,0|2,0,0]=4 4464 B8R0.4 COCCCCCCF 34a_100000732779_200000210301 [2,0,0,0,0,0|2,0,0]=4 4465 B8R0.4 COCCCCCCF 34a_100138415774_100015922095 [2,0,0,0,0,0|2,0,0]=4 4466 B8R0.4 COCCCCCCF 7a_100000732779_200000210301 [2,0,0,0,0,0|2,0,0]=4 4467 B8R0.4 COCCCCCCN 34a_100000686447_200000210301 [2,0,0,0,0,0|2,0,0]=4 4468 B8R0.4 COCCCCCCO 34a_100138415774_100000766143 [2,0,0,0,0,0|2,0,0]=4 4469 B8R0.4 COCCCCCN[13CH3] 2230a_100000747528_200025704644 [2,0,0,0,0,0|2,0,0]=4 4470 B8R0.4 COCCCCCN[13CH3] 34a_100000747528_200025704644 [2,0,0,0,0,0|2,0,0]=4 4471 B8R0.4 COCCCCOCF 34a_100000740925_100015361967 [2,0,0,0,0,0|1,0,0]=3 4472 B8R0.4 COCCCCSCF 62a_100000730899_100015361967 [2,0,0,0,0,0|1,1,0]=4 4473 B8R0.4 COCCCCSCF 62a_100015361967_100000730899 [2,0,0,0,0,0|1,1,0]=4 4474 B8R0.4 COCCCOCCO 34a_100000740835_100000211926 [2,0,0,0,0,0|2,0,0]=4 4475 B8R0.4 COCCCSCOC 62a_100000709357_100000766300 [2,0,0,0,0,0|2,0,0]=4 4476 B8R0.4 COCCCSCOC 62a_100000766300_100000709357 [2,0,0,0,0,0|2,0,0]=4 4477 B8R0.4 COCCNCCCF 2230a_100000209980_100011934791 [2,0,0,0,0,0|2,0,0]=4 4478 B8R0.4 COCCNCCCF 2230a_100015189416_100011201679 [2,0,0,0,0,0|2,0,0]=4 4479 B8R0.4 COCCNCCCF 34a_100015189416_100011201679 [2,0,0,0,0,0|2,0,0]=4 4480 B8R0.4 COCCNCCCO 2230a_100000209980_100000230001 [2,0,0,0,0,0|2,0,0]=4 4481 B8R0.4 COCCNCCOC 2230a_100000209980_100011201679 [2,0,0,0,0,0|1,0,0]=3 4482 B8R0.4 COCCNCCSC 2230a_100000209980_100000751147 [2,0,0,0,0,0|1,1,0]=4 4483 B8R0.4 COCCNCCSC 2230a_100020590264_100011201679 [2,0,0,0,0,0|1,1,0]=4 4484 B8R0.4 COCCOCCCBr 34a_100011217188_100011201679 [2,0,0,0,0,0|1,0,0]=3 4485 B8R0.4 COCCOCCCCl 34a_100000230001_100011201679 [2,0,0,0,0,0|1,0,0]=3 4486 B8R0.4 COCCOCCCF 34a_100000210237_100011934791 [2,0,0,0,0,0|1,0,0]=3 4487 B8R0.4 COCCOCCCF 34a_100000759539_100011201679 [2,0,0,0,0,0|1,0,0]=3 4488 B8R0.4 COCCOCCCN 34a_100000182051_100011201679 [2,0,0,0,0,0|1,0,0]=3 4489 B8R0.4 COCCOCCCO 34a_100000210237_100000230001 [2,0,0,0,0,0|1,0,0]=3 4490 B8R0.4 COCCOCCN[13CH3] 2230a_100000745349_200025704644 [2,0,0,0,0,0|1,0,0]=3 4491 B8R0.4 COCCOCCN[13CH3] 34a_100000745349_200025704644 [2,0,0,0,0,0|1,0,0]=3 4492 B8R0.4 COCCOCCOC 34a_100000210237_100011201679 [2,0,0,0,0,0|0,0,0]=2 4493 B8R0.4 COCCOCCOC 34a_100011215163_200000210301 [2,0,0,0,0,0|0,0,0]=2 4494 B8R0.4 COCCOCCOC 34a_100138415774_100000695917 [2,0,0,0,0,0|0,0,0]=2 4495 B8R0.4 COCCOCCOC 7a_100011215163_200000210301 [2,0,0,0,0,0|0,0,0]=2 4496 B8R0.4 COCCOCCON 34a_100000700252_100011201679 [2,0,0,0,0,0|1,0,0]=3 4497 B8R0.4 COCCOCCO[13CH3] 34a_100011215163_200025704644 [2,0,0,0,0,0|0,0,0]=2 4498 B8R0.4 COCCOCCO[13CH3] 7a_100011215163_200025704644 [2,0,0,0,0,0|0,0,0]=2 4499 B8R0.4 COCCOCCSC 34a_100000210237_100000212216 [2,0,0,0,0,0|0,1,0]=3 4500 B8R0.4 COCCOCCSC 34a_100000230434_100011201679 [2,0,0,0,0,0|0,1,0]=3 4501 B8R0.4 COCCOCCSC 62a_100000695917_200000210301 [2,0,0,0,0,0|0,1,0]=3 4502 B8R0.4 COCCOCCSC 62a_200000210301_100000695917 [2,0,0,0,0,0|0,1,0]=3 4503 B8R0.4 COCCOCCSC 7a_100000230434_100000233755 [2,0,0,0,0,0|0,1,0]=3 4504 B8R0.4 COCCOCCS[13CH3] 62a_100000695917_200025704644 [2,0,0,0,0,0|0,1,0]=3 4505 B8R0.4 COCCOCCS[13CH3] 62a_200025704644_100000695917 [2,0,0,0,0,0|0,1,0]=3 4506 B8R0.4 COCCOCSCF 62a_100000231047_100015361967 [2,0,0,0,0,0|1,1,0]=4 4507 B8R0.4 COCCOCSCF 62a_100015361967_100000231047 [2,0,0,0,0,0|1,1,0]=4 4508 B8R0.4 COCCSCCCF 62a_100000233755_100011934791 [2,0,0,0,0,0|1,1,0]=4 4509 B8R0.4 COCCSCCCF 62a_100011934791_100000233755 [2,0,0,0,0,0|1,1,0]=4 4510 B8R0.4 COCCSCCCO 62a_100000233755_100011215043 [2,0,0,0,0,0|1,1,0]=4 4511 B8R0.4 COCCSCCCO 62a_100011215043_100000233755 [2,0,0,0,0,0|1,1,0]=4 4512 B8R0.4 COCCSCCOC 62a_100000233755_100000233755 [2,0,0,0,0,0|0,1,0]=3 4513 B8R0.4 COCCSCCSC 62a_100000212216_100000233755 [2,0,0,0,0,0|0,2,0]=4 4514 B8R0.4 COCCSCCSC 62a_100000233755_100000751147 [2,0,0,0,0,0|0,2,0]=4 4515 B8R0.4 CSCCCCOCF 34a_100011217163_100015361967 [2,0,0,0,0,0|1,1,0]=4 4516 B8R0.4 CSCCCCOCF 7a_100011217163_100015361967 [2,0,0,0,0,0|1,1,0]=4 4517 B8R0.4 CSCCCOCCO 34a_100000690336_100000211926 [2,0,0,0,0,0|2,0,0]=4 4518 B8R0.4 CSCCCOCCO 7a_100000690336_100000211926 [2,0,0,0,0,0|2,0,0]=4 4519 B8R0.4 CSCCOCCCBr 34a_100011217188_100000212216 [2,0,0,0,0,0|1,1,0]=4 4520 B8R0.4 CSCCOCCCCl 34a_100000230001_100000212216 [2,0,0,0,0,0|1,1,0]=4 4521 B8R0.4 CSCCOCCCF 34a_100000230434_100011934791 [2,0,0,0,0,0|1,1,0]=4 4522 B8R0.4 CSCCOCCCF 34a_100000759539_100000212216 [2,0,0,0,0,0|1,1,0]=4 4523 B8R0.4 CSCCOCCCF 7a_100000230434_100011934791 [2,0,0,0,0,0|1,1,0]=4 4524 B8R0.4 CSCCOCCCN 34a_100000182051_100000212216 [2,0,0,0,0,0|1,1,0]=4 4525 B8R0.4 CSCCOCCCO 34a_100000230434_100000230001 [2,0,0,0,0,0|1,1,0]=4 4526 B8R0.4 CSCCOCCCO 7a_100000230434_100011215043 [2,0,0,0,0,0|1,1,0]=4 4527 B8R0.4 CSCCOCCON 34a_100000700252_100000212216 [2,0,0,0,0,0|1,1,0]=4 4528 B8R0.4 CSCCOCCSC 34a_100000230434_100000212216 [2,0,0,0,0,0|0,2,0]=4 4529 B8R0.4 CSCCOCCSC 7a_100000230434_100000212216 [2,0,0,0,0,0|0,2,0]=4 4530 B8R0.4 FCCCOCCCBr 34a_100011217188_100011934791 [2,0,0,0,0,0|2,0,0]=4 4531 B8R0.4 FCCCOCCCCl 34a_100000230001_100011934791 [2,0,0,0,0,0|2,0,0]=4 4532 B8R0.4 FCCCOCCCF 34a_100000759539_100011934791 [2,0,0,0,0,0|2,0,0]=4 4533 B8R0.4 FCCOCCOCF 34a_200015357709_100015361967 [2,0,0,0,0,0|2,0,0]=4 4534 B8R0.4 FCCOCCOCF 7a_200015357709_100015361967 [2,0,0,0,0,0|2,0,0]=4 4535 B8R0.4 FCOCCCCCBr 34a_100000746331_100015361967 [2,0,0,0,0,0|2,0,0]=4 4536 B8R0.4 FCOCCCCCBr 7a_100000746331_100015361967 [2,0,0,0,0,0|2,0,0]=4 4537 B8R0.4 FCOCCCCCCl 34a_100000746330_100015361967 [2,0,0,0,0,0|2,0,0]=4 4538 B8R0.4 FCOCCCCCCl 7a_100000746330_100015361967 [2,0,0,0,0,0|2,0,0]=4 4539 B8R0.4 FCOCCCCCI 34a_200012148887_100015361967 [2,0,0,0,0,0|2,0,0]=4 4540 B8R0.4 FCOCCCCCI 7a_200012148887_100015361967 [2,0,0,0,0,0|2,0,0]=4 4541 B8R0.4 FCOCCOCCBr 34a_100000692535_100015361967 [2,0,0,0,0,0|2,0,0]=4 4542 B8R0.4 FCOCCOCCBr 7a_100000692535_100015361967 [2,0,0,0,0,0|2,0,0]=4 4543 B8R0.4 FCOCCOCCCl 34a_100011215305_100015361967 [2,0,0,0,0,0|2,0,0]=4 4544 B8R0.4 FCOCCOCCCl 7a_100011215305_100015361967 [2,0,0,0,0,0|2,0,0]=4 4545 B8R0.4 FCOCCOCCI 34a_100012149058_100015361967 [2,0,0,0,0,0|2,0,0]=4 4546 B8R0.4 FCOCCOCCI 7a_100012149058_100015361967 [2,0,0,0,0,0|2,0,0]=4 4547 B8R0.4 NCCCCCOCF 34a_100000762737_100015361967 [2,0,0,0,0,0|2,0,0]=4 4548 B8R0.4 NCCCCOCCO 34a_100000750430_100000211926 [2,0,0,0,0,0|2,0,0]=4 4549 B8R0.4 NCCCOCCCF 34a_100000182051_100011934791 [2,0,0,0,0,0|2,0,0]=4 4550 B8R0.4 NCCCOCCCO 34a_100000182051_100000230001 [2,0,0,0,0,0|2,0,0]=4 4551 B8R0.4 NCCOCCOCF 34a_100000211614_100015361967 [2,0,0,0,0,0|2,0,0]=4 4552 B8R0.4 NOCCOCCCF 34a_100000700252_100011934791 [2,0,0,0,0,0|2,0,0]=4 4553 B8R0.4 NOCCOCCCO 34a_100000700252_100000230001 [2,0,0,0,0,0|2,0,0]=4 4554 B8R0.4 OCCCOCCCBr 34a_100011217188_100000230001 [2,0,0,0,0,0|2,0,0]=4 4555 B8R0.4 OCCCOCCCCl 34a_100000230001_100000230001 [2,0,0,0,0,0|2,0,0]=4 4556 B8R0.4 OCCCOCCCF 34a_100000759539_100000230001 [2,0,0,0,0,0|2,0,0]=4 4557 B8R0.4 OCCOCCCCBr 34a_100011216708_100000211926 [2,0,0,0,0,0|2,0,0]=4 4558 B8R0.4 OCCOCCCCCl 34a_100000210776_100000211926 [2,0,0,0,0,0|2,0,0]=4 4559 B8R0.4 OCCOCCCCCl 7a_100000210776_100000211926 [2,0,0,0,0,0|2,0,0]=4 4560 B8R0.4 OCCOCCCCF 34a_100011995726_100000211926 [2,0,0,0,0,0|2,0,0]=4 4561 B8R0.4 OCCOCCCCF 7a_100011995726_100000211926 [2,0,0,0,0,0|2,0,0]=4 4562 B8R0.4 OCCOCCCCI 34a_200012148704_100000211926 [2,0,0,0,0,0|2,0,0]=4 4563 B8R0.4 OCCOCCNCF 34a_100000211614_100015361967 [2,0,0,0,0,0|2,0,0]=4 4564 B8R0.4 OCCOCCSCF 62a_100011215305_100015361967 [2,0,0,0,0,0|1,1,0]=4 4565 B8R0.4 OCCOCCSCF 62a_100015361967_100011215305 [2,0,0,0,0,0|1,1,0]=4 4566 B8R0.4 [13CH3]OCCCCCCBr 34a_100011215345_200025704644 [2,0,0,0,0,0|2,0,0]=4 4567 B8R0.4 [13CH3]OCCCCCCBr 7a_100011215345_200025704644 [2,0,0,0,0,0|2,0,0]=4 4568 B8R0.4 [13CH3]OCCCCCCCl 34a_100000766143_200025704644 [2,0,0,0,0,0|2,0,0]=4 4569 B8R0.4 [13CH3]OCCCCCCCl 7a_100000766143_200025704644 [2,0,0,0,0,0|2,0,0]=4 4570 B8R0.4 [13CH3]OCCCCCCF 34a_100000732779_200025704644 [2,0,0,0,0,0|2,0,0]=4 4571 B8R0.4 [13CH3]OCCCCCCF 7a_100000732779_200025704644 [2,0,0,0,0,0|2,0,0]=4 4572 B8R0.4 [13CH3]OCCCCCCN 34a_100000686447_200025704644 [2,0,0,0,0,0|2,0,0]=4 4573 B10R0.1 C#CCC(C)OCCOCC 34a_100000685586_100000210147 [1,1,0,0,0,0|0,0,2]=4 4574 B10R0.1 C#CCC(C)OCCOCC 7a_100000685586_100011215890 [1,1,0,0,0,0|0,0,2]=4 4575 B10R0.1 C/C=C/C(C)OCCOCC 34a_200102604097_100000210147 [1,1,0,0,0,0|0,0,2]=4 4576 B10R0.1 C/C=C/CCOC(C)CCC 34a_100016278192_100000766640 [1,1,0,0,0,0|1,0,1]=4 4577 B10R0.1 C/C=C/CCOC(C)COC 34a_100016278192_100000765312 [1,1,0,0,0,0|1,0,1]=4 4578 B10R0.1 C=CC[C@@H](C)OCCOCC 34a_100000731007_100000210147 [1,1,0,0,0,0|0,0,2]=4 4579 B10R0.1 C=CC[C@@H](C)OCCOCC 7a_100000731007_100011215890 [1,1,0,0,0,0|0,0,2]=4 4580 B10R0.1 C=COCCOC(C)CCC 34a_100000033082_100000766640 [1,1,0,0,0,0|0,0,2]=4 4581 B10R0.1 C=COCCOC(C)CCC 34a_100000764384_100000039644 [1,1,0,0,0,0|0,0,2]=4 4582 B10R0.1 C=COCCOC(C)CCC 7a_100000764384_100000039644 [1,1,0,0,0,0|0,0,2]=4 4583 B10R0.1 C=COCCOC(C)COC 34a_100000033082_100000765312 [1,1,0,0,0,0|0,0,2]=4 4584 B10R0.1 C=COCCO[C@H](C)COC 34a_100011934205_100000039644 [1,1,0,0,0,0|0,0,2]=4 4585 B10R0.1 CC#CC(C)OCCOCC 34a_100011216543_100000210147 [1,1,0,0,0,0|0,0,2]=4 4586 B10R0.1 CC#CCCOC(C)CCC 34a_100000750427_100000766640 [1,1,0,0,0,0|1,0,1]=4 4587 B10R0.1 CC#CCCOC(C)COC 34a_100000750427_100000765312 [1,1,0,0,0,0|1,0,1]=4 4588 B10R0.1 CC/C=C\COC(C)CCC 34a_100000764384_100103147603 [1,1,0,0,0,0|1,0,1]=4 4589 B10R0.1 CC/C=C\COC(C)CCC 34a_100016268518_100000766640 [1,1,0,0,0,0|1,0,1]=4 4590 B10R0.1 CC/C=C\COC(C)CCC 7a_100000764384_100103147603 [1,1,0,0,0,0|1,0,1]=4 4591 B10R0.1 CC/C=C\COC(C)COC 34a_100016268518_100000765312 [1,1,0,0,0,0|1,0,1]=4 4592 B10R0.1 CC/C=C\CO[C@H](C)COC 34a_100011934205_100103147603 [1,1,0,0,0,0|1,0,1]=4 4593 B10R0.1 CCC#CCOC(C)CCC 34a_100000032950_100000766640 [1,1,0,0,0,0|1,0,1]=4 4594 B10R0.1 CCC#CCOC(C)CCC 34a_100000764384_100009813939 [1,1,0,0,0,0|1,0,1]=4 4595 B10R0.1 CCC#CCOC(C)CCC 7a_100000764384_100009813939 [1,1,0,0,0,0|1,0,1]=4 4596 B10R0.1 CCC#CCOC(C)COC 34a_100000032950_100000765312 [1,1,0,0,0,0|1,0,1]=4 4597 B10R0.1 CCC#CCO[C@H](C)COC 34a_100011934205_100009813939 [1,1,0,0,0,0|1,0,1]=4 4598 B10R0.1 CCCC(=O)CCCOCC 1458a_100000211992_100012232248 [1,1,0,0,0,0|1,0,1]=4 4599 B10R0.1 CCCC(=O)COCCOC 1458a_100000211095_100000210303 [1,1,0,0,0,0|1,0,1]=4 4600 B10R0.1 CCCC(=O)NCCOCC 11a_100011200944_100000211992 [1,1,0,0,0,0|1,0,1]=4 4601 B10R0.1 CCCC(=O)NCCOCC 1626a_102516460346_100000211992 [1,1,0,0,0,0|1,0,1]=4 4602 B10R0.1 CCCC(=O)NCCOCC 240690a_100011200944_100000211992 [1,1,0,0,0,0|1,0,1]=4 4603 B10R0.1 CCCC(=O)NCCOCC 527a_100011200944_100000211992 [1,1,0,0,0,0|1,0,1]=4 4604 B10R0.1 CCCC(C)CCCOCC 34a_100011713154_100000210202 [1,1,0,0,0,0|1,0,0]=3 4605 B10R0.1 CCCC(C)CCCOCC 7a_100011713154_100000210202 [1,1,0,0,0,0|1,0,0]=3 4606 B10R0.1 CCCC(C)CCCOCF 34a_100011713154_100015361967 [1,1,0,0,0,0|2,0,0]=4 4607 B10R0.1 CCCC(C)CCCOCF 7a_100011713154_100015361967 [1,1,0,0,0,0|2,0,0]=4 4608 B10R0.1 CCCC(C)CNCCOC 2230a_100000209980_100011216630 [1,1,0,0,0,0|2,0,0]=4 4609 B10R0.1 CCCC(C)CNCCOC 270004a_100000209980_100000243154 [1,1,0,0,0,0|2,0,0]=4 4610 B10R0.1 CCCC(C)COCCCBr 34a_100011217188_100011216630 [1,1,0,0,0,0|2,0,0]=4 4611 B10R0.1 CCCC(C)COCCCCl 34a_100000230001_100011216630 [1,1,0,0,0,0|2,0,0]=4 4612 B10R0.1 CCCC(C)COCCCF 34a_100000688023_100011934791 [1,1,0,0,0,0|2,0,0]=4 4613 B10R0.1 CCCC(C)COCCCF 34a_100000759539_100011216630 [1,1,0,0,0,0|2,0,0]=4 4614 B10R0.1 CCCC(C)COCCCF 7a_100000688023_100011934791 [1,1,0,0,0,0|2,0,0]=4 4615 B10R0.1 CCCC(C)COCCCN 34a_100000182051_100011216630 [1,1,0,0,0,0|2,0,0]=4 4616 B10R0.1 CCCC(C)COCCCO 34a_100000688023_100000230001 [1,1,0,0,0,0|2,0,0]=4 4617 B10R0.1 CCCC(C)COCCCO 7a_100000688023_100011215043 [1,1,0,0,0,0|2,0,0]=4 4618 B10R0.1 CCCC(C)COCCOC 34a_100000210237_100011216630 [1,1,0,0,0,0|1,0,0]=3 4619 B10R0.1 CCCC(C)COCCOC 34a_100000688023_100011201679 [1,1,0,0,0,0|1,0,0]=3 4620 B10R0.1 CCCC(C)COCCOC 7a_100000688023_100000233755 [1,1,0,0,0,0|1,0,0]=3 4621 B10R0.1 CCCC(C)COCCON 34a_100000700252_100011216630 [1,1,0,0,0,0|2,0,0]=4 4622 B10R0.1 CCCC(C)COCCSC 34a_100000230434_100011216630 [1,1,0,0,0,0|1,1,0]=4 4623 B10R0.1 CCCC(C)COCCSC 34a_100000688023_100000212216 [1,1,0,0,0,0|1,1,0]=4 4624 B10R0.1 CCCC(C)COCCSC 7a_100000230434_100011216630 [1,1,0,0,0,0|1,1,0]=4 4625 B10R0.1 CCCC(C)COCCSC 7a_100000688023_100000212216 [1,1,0,0,0,0|1,1,0]=4 4626 B10R0.1 CCCC(C)CSCCOC 62a_100000233755_100011216630 [1,1,0,0,0,0|1,1,0]=4 4627 B10R0.1 CCCC(C)CSCCOC 62a_100011216630_100000233755 [1,1,0,0,0,0|1,1,0]=4 4628 B10R0.1 CCCC(C)CSCOCC 62a_100000739092_100011216630 [1,1,0,0,0,0|1,1,0]=4 4629 B10R0.1 CCCC(C)CSCOCC 62a_100011216630_100000739092 [1,1,0,0,0,0|1,1,0]=4 4630 B10R0.1 CCCC(C)NCCOCC 2230a_100000741246_100011215890 [1,1,0,0,0,0|1,0,0]=3 4631 B10R0.1 CCCC(C)NCCOCC 2230a_102516460346_100000766640 [1,1,0,0,0,0|1,0,0]=3 4632 B10R0.1 CCCC(C)NCCOCC 270004a_102516460346_100000211909 [1,1,0,0,0,0|1,0,0]=3 4633 B10R0.1 CCCC(C)NCCOCC 34a_102516460346_100000766640 [1,1,0,0,0,0|1,0,0]=3 4634 B10R0.1 CCCC(C)NCCSCC 2230a_100000106463_100000766640 [1,1,0,0,0,0|1,1,0]=4 4635 B10R0.1 CCCC(C)NCCSCC 2230a_100000741246_100000757381 [1,1,0,0,0,0|1,1,0]=4 4636 B10R0.1 CCCC(C)NCCSCC 270004a_100000106463_100000211909 [1,1,0,0,0,0|1,1,0]=4 4637 B10R0.1 CCCC(C)OCCCCBr 34a_100011216708_100000766640 [1,1,0,0,0,0|2,0,0]=4 4638 B10R0.1 CCCC(C)OCCCCCl 34a_100000210776_100000766640 [1,1,0,0,0,0|2,0,0]=4 4639 B10R0.1 CCCC(C)OCCCCCl 7a_100000210776_100000766640 [1,1,0,0,0,0|2,0,0]=4 4640 B10R0.1 CCCC(C)OCCCCF 34a_100000764384_100000729493 [1,1,0,0,0,0|2,0,0]=4 4641 B10R0.1 CCCC(C)OCCCCF 34a_100011995726_100000766640 [1,1,0,0,0,0|2,0,0]=4 4642 B10R0.1 CCCC(C)OCCCCF 7a_100000764384_100000729493 [1,1,0,0,0,0|2,0,0]=4 4643 B10R0.1 CCCC(C)OCCCCF 7a_100011995726_100000766640 [1,1,0,0,0,0|2,0,0]=4 4644 B10R0.1 CCCC(C)OCCCCI 34a_200012148704_100000766640 [1,1,0,0,0,0|2,0,0]=4 4645 B10R0.1 CCCC(C)OCCCCN 34a_100000750430_100000766640 [1,1,0,0,0,0|2,0,0]=4 4646 B10R0.1 CCCC(C)OCCCCO 34a_100000764384_100011216708 [1,1,0,0,0,0|2,0,0]=4 4647 B10R0.1 CCCC(C)OCCCCO 7a_100000764384_100000210776 [1,1,0,0,0,0|2,0,0]=4 4648 B10R0.1 CCCC(C)OCCCNC 34a_100000213112_100000766640 [1,1,0,0,0,0|2,0,0]=4 4649 B10R0.1 CCCC(C)OCCCOC 34a_100000740835_100000766640 [1,1,0,0,0,0|2,0,0]=4 4650 B10R0.1 CCCC(C)OCCCOC 34a_100000764384_100000740836 [1,1,0,0,0,0|2,0,0]=4 4651 B10R0.1 CCCC(C)OCCCOC 7a_100000764384_100000740836 [1,1,0,0,0,0|2,0,0]=4 4652 B10R0.1 CCCC(C)OCCCSC 34a_100000690336_100000766640 [1,1,0,0,0,0|2,0,0]=4 4653 B10R0.1 CCCC(C)OCCCSC 7a_100000690336_100000766640 [1,1,0,0,0,0|2,0,0]=4 4654 B10R0.1 CCCC(C)OCCOCC 34a_100000210136_100000766640 [1,1,0,0,0,0|0,0,0]=2 4655 B10R0.1 CCCC(C)OCCOCC 34a_100000764384_100000210147 [1,1,0,0,0,0|0,0,0]=2 4656 B10R0.1 CCCC(C)OCCOCC 7a_100000210136_100000766640 [1,1,0,0,0,0|0,0,0]=2 4657 B10R0.1 CCCC(C)OCCOCC 7a_100000764384_100011215890 [1,1,0,0,0,0|0,0,0]=2 4658 B10R0.1 CCCC(C)OCCSCC 34a_100000212035_100000766640 [1,1,0,0,0,0|0,1,0]=3 4659 B10R0.1 CCCC(C)OCCSCC 34a_100000764384_100000757381 [1,1,0,0,0,0|0,1,0]=3 4660 B10R0.1 CCCC(C)OCCSCC 7a_100000212035_100000766640 [1,1,0,0,0,0|0,1,0]=3 4661 B10R0.1 CCCC(C)OCCSCC 7a_100000764384_100000757381 [1,1,0,0,0,0|0,1,0]=3 4662 B10R0.1 CCCC(C)SCCOCC 62a_100000210147_100000766640 [1,1,0,0,0,0|0,1,0]=3 4663 B10R0.1 CCCC(C)SCCOCC 62a_100000766640_100011215890 [1,1,0,0,0,0|0,1,0]=3 4664 B10R0.1 CCCC(C)SCCSCC 62a_100000757381_100000766640 [1,1,0,0,0,0|0,2,0]=4 4665 B10R0.1 CCCC(C)SCCSCC 62a_100000766640_100000757381 [1,1,0,0,0,0|0,2,0]=4 4666 B10R0.1 CCCCCCC(C)NCC 2230a_100000210919_100000210202 [1,1,0,0,0,0|2,0,0]=4 4667 B10R0.1 CCCCCCC(C)NCC 2230a_100015525214_100011215978 [1,1,0,0,0,0|2,0,0]=4 4668 B10R0.1 CCCCCCC(C)NCC 270004a_100015525214_100000210826 [1,1,0,0,0,0|2,0,0]=4 4669 B10R0.1 CCCCCCC(C)NCC 34a_100000210919_100000210202 [1,1,0,0,0,0|2,0,0]=4 4670 B10R0.1 CCCCCCC(C)OCC 34a_100000210265_100000210202 [1,1,0,0,0,0|1,0,0]=3 4671 B10R0.1 CCCCCCC(C)OCC 34a_100121572206_100011215978 [1,1,0,0,0,0|1,0,0]=3 4672 B10R0.1 CCCCCCC(C)OCC 7a_100000210265_100000210202 [1,1,0,0,0,0|1,0,0]=3 4673 B10R0.1 CCCCCCC(C)OCF 34a_100000210265_100015361967 [1,1,0,0,0,0|2,0,0]=4 4674 B10R0.1 CCCCCCC(C)OCF 7a_100000210265_100015361967 [1,1,0,0,0,0|2,0,0]=4 4675 B10R0.1 CCCCCCC(C)SCC 62a_100000210202_100011215978 [1,1,0,0,0,0|1,1,0]=4 4676 B10R0.1 CCCCCCC(C)SCC 62a_100011215978_100000210202 [1,1,0,0,0,0|1,1,0]=4 4677 B10R0.1 CCCCCNC(C)CCC 2230a_100000209983_100000766640 [1,1,0,0,0,0|2,0,0]=4 4678 B10R0.1 CCCCCNC(C)CCC 2230a_100000741246_100000210326 [1,1,0,0,0,0|2,0,0]=4 4679 B10R0.1 CCCCCNC(C)CCC 270004a_100000209983_100000211909 [1,1,0,0,0,0|2,0,0]=4 4680 B10R0.1 CCCCCNC(C)COC 2230a_100000209983_100000765312 [1,1,0,0,0,0|2,0,0]=4 4681 B10R0.1 CCCCCNC(C)COC 270004a_100000209983_100000749346 [1,1,0,0,0,0|2,0,0]=4 4682 B10R0.1 CCCCCN[C@H](C)COC 2230a_100000764878_100000210326 [1,1,0,0,0,0|2,0,0]=4 4683 B10R0.1 CCCCCOC(C)CCBr 34a_100012276601_100000718602 [1,1,0,0,0,0|2,0,0]=4 4684 B10R0.1 CCCCCOC(C)CCC 34a_100000210253_100000766640 [1,1,0,0,0,0|1,0,0]=3 4685 B10R0.1 CCCCCOC(C)CCC 34a_100000764384_100000718602 [1,1,0,0,0,0|1,0,0]=3 4686 B10R0.1 CCCCCOC(C)CCC 7a_100000210253_100000766640 [1,1,0,0,0,0|1,0,0]=3 4687 B10R0.1 CCCCCOC(C)CCC 7a_100000764384_100000210326 [1,1,0,0,0,0|1,0,0]=3 4688 B10R0.1 CCCCCOC(C)CCO 34a_100000210253_100009893172 [1,1,0,0,0,0|2,0,0]=4 4689 B10R0.1 CCCCCOC(C)CCO 7a_100000210253_100009893172 [1,1,0,0,0,0|2,0,0]=4 4690 B10R0.1 CCCCCOC(C)COC 34a_100000210253_100000765312 [1,1,0,0,0,0|1,0,0]=3 4691 B10R0.1 CCCCCOC(C)COC 7a_100000210253_100000765312 [1,1,0,0,0,0|1,0,0]=3 4692 B10R0.1 CCCCCO[C@H](C)COC 34a_100011934205_100000718602 [1,1,0,0,0,0|1,0,0]=3 4693 B10R0.1 CCCCCSC(C)CCC 62a_100000210326_100000766640 [1,1,0,0,0,0|1,1,0]=4 4694 B10R0.1 CCCCCSC(C)CCC 62a_100000766640_100000210326 [1,1,0,0,0,0|1,1,0]=4 4695 B10R0.1 CCCCCSC(C)COC 62a_100000210326_100000765312 [1,1,0,0,0,0|1,1,0]=4 4696 B10R0.1 CCCCCSC(C)COC 62a_100000765312_100000210326 [1,1,0,0,0,0|1,1,0]=4 4697 B10R0.1 CCCCNCC(=O)OCC 2230a_100000102301_100000188475 [1,1,0,0,0,0|1,0,1]=4 4698 B10R0.1 CCCCNCC(=O)OCC 7a_106832991798_100000188475 [1,1,0,0,0,0|1,0,1]=4 4699 B10R0.1 CCCCNCC(C)CCC 2230a_100000102301_100011216630 [1,1,0,0,0,0|2,0,0]=4 4700 B10R0.1 CCCCNCC(C)CCC 270004a_100000102301_100000243154 [1,1,0,0,0,0|2,0,0]=4 4701 B10R0.1 CCCCNCC(C)CCC 7a_106832991798_100011216630 [1,1,0,0,0,0|2,0,0]=4 4702 B10R0.1 CCCCOCC(=O)CCC 1458a_100000211992_100011995733 [1,1,0,0,0,0|1,0,1]=4 4703 B10R0.1 CCCCOCC(=O)CCC 1458a_100000757543_100000210303 [1,1,0,0,0,0|1,0,1]=4 4704 B10R0.1 CCCCOCC(=O)CCC 7a_100000210227_100000747444 [1,1,0,0,0,0|1,0,1]=4 4705 B10R0.1 CCCCOCC(=O)NCC 11a_100015525214_100000757543 [1,1,0,0,0,0|1,0,1]=4 4706 B10R0.1 CCCCOCC(=O)NCC 240690a_100015525214_100000757543 [1,1,0,0,0,0|1,0,1]=4 4707 B10R0.1 CCCCOCC(=O)NCC 34a_100000210227_100000183381 [1,1,0,0,0,0|1,0,1]=4 4708 B10R0.1 CCCCOCC(=O)NCC 527a_100015525214_100000757543 [1,1,0,0,0,0|1,0,1]=4 4709 B10R0.1 CCCCOCC(=O)NCC 7a_100000210227_100000183381 [1,1,0,0,0,0|1,0,1]=4 4710 B10R0.1 CCCCOCC(=O)OCC 34a_100000210227_100000188475 [1,1,0,0,0,0|0,0,1]=3 4711 B10R0.1 CCCCOCC(=O)OCC 7a_100000210227_100000188475 [1,1,0,0,0,0|0,0,1]=3 4712 B10R0.1 CCCCOCC(C)CCC 34a_100000210227_100011216630 [1,1,0,0,0,0|1,0,0]=3 4713 B10R0.1 CCCCOCC(C)CCC 34a_100000688023_100000210210 [1,1,0,0,0,0|1,0,0]=3 4714 B10R0.1 CCCCOCC(C)CCC 7a_100000210227_100011216630 [1,1,0,0,0,0|1,0,0]=3 4715 B10R0.1 CCCCOCC(C)CCC 7a_100000688023_100000210211 [1,1,0,0,0,0|1,0,0]=3 4716 B10R0.1 CCCCOCC(C)CCN 34a_106354213184_100000210210 [1,1,0,0,0,0|2,0,0]=4 4717 B10R0.1 CCCCOCC(C)OCC 34a_100011217071_100000210202 [1,1,0,0,0,0|0,0,0]=2 4718 B10R0.1 CCCCOCC(C)OCC 7a_100011217071_100000210202 [1,1,0,0,0,0|0,0,0]=2 4719 B10R0.1 CCCCOCC(C)OCF 34a_100011217071_100015361967 [1,1,0,0,0,0|1,0,0]=3 4720 B10R0.1 CCCCOCC(C)OCF 7a_100011217071_100015361967 [1,1,0,0,0,0|1,0,0]=3 4721 B10R0.1 CCCCOCC(N)COC 34a_100000724102_100000210210 [1,1,0,0,0,0|2,0,0]=4 4722 B10R0.1 CCCCOCC(O)COC 34a_100000210227_100011215053 [1,1,0,0,0,0|2,0,0]=4 4723 B10R0.1 CCCCOCC(O)COC 7a_100000210227_100011215053 [1,1,0,0,0,0|2,0,0]=4 4724 B10R0.1 CCCCOCN(C)CCC 2230a_100000747261_100011995733 [1,1,0,0,0,0|2,0,0]=4 4725 B10R0.1 CCCCOCN(C)CCC 269982a_100000747261_100011995733 [1,1,0,0,0,0|2,0,0]=4 4726 B10R0.1 CCCCOC[C@@H](N)CCC 34a_100000732646_100000210210 [1,1,0,0,0,0|1,0,0]=3 4727 B10R0.1 CCCCSCC(=O)OCC 62a_100000188475_100000210210 [1,1,0,0,0,0|0,1,1]=4 4728 B10R0.1 CCCCSCC(=O)OCC 62a_100000210211_100000188475 [1,1,0,0,0,0|0,1,1]=4 4729 B10R0.1 CCCCSCC(C)CCC 62a_100000210211_100011216630 [1,1,0,0,0,0|1,1,0]=4 4730 B10R0.1 CCCCSCC(C)CCC 62a_100011216630_100000210210 [1,1,0,0,0,0|1,1,0]=4 4731 B10R0.1 CCCN(C)CCCOCC 2230a_100000747261_100012232248 [1,1,0,0,0,0|2,0,0]=4 4732 B10R0.1 CCCN(C)CCCOCC 269982a_100000747261_100012232248 [1,1,0,0,0,0|2,0,0]=4 4733 B10R0.1 CCCN(C)COCCOC 2230a_100000747261_100000231047 [1,1,0,0,0,0|2,0,0]=4 4734 B10R0.1 CCCN(C)COCCOC 269982a_100000747261_100000231047 [1,1,0,0,0,0|2,0,0]=4 4735 B10R0.1 CCC[C@H](N)COCCCF 34a_100000732646_100011934791 [1,1,0,0,0,0|2,0,0]=4 4736 B10R0.1 CCC[C@H](N)COCCCO 34a_100000732646_100000230001 [1,1,0,0,0,0|2,0,0]=4 4737 B10R0.1 CCC[C@H](N)COCCOC 34a_100000732646_100011201679 [1,1,0,0,0,0|1,0,0]=3 4738 B10R0.1 CCC[C@H](N)COCCSC 34a_100000732646_100000212216 [1,1,0,0,0,0|1,1,0]=4 4739 B10R0.1 CCNC(=O)COCCOC 11a_100015525214_100000211095 [1,1,0,0,0,0|1,0,1]=4 4740 B10R0.1 CCNC(=O)COCCOC 240690a_100015525214_100000211095 [1,1,0,0,0,0|1,0,1]=4 4741 B10R0.1 CCNC(=O)COCCOC 34a_100000210237_100000183381 [1,1,0,0,0,0|1,0,1]=4 4742 B10R0.1 CCNC(=O)COCCOC 527a_100015525214_100000211095 [1,1,0,0,0,0|1,0,1]=4 4743 B10R0.1 CCNCCCC(=O)OCC 2230a_100015525214_100009991533 [1,1,0,0,0,0|1,0,1]=4 4744 B10R0.1 CCOC(=O)CCCCOC 34a_100138415774_100000750268 [1,1,0,0,0,0|1,0,1]=4 4745 B10R0.1 CCOC(=O)CCCOCF 7a_100012001163_100015361967 [1,1,0,0,0,0|1,0,1]=4 4746 B10R0.1 CCOC(=O)CCCSCC 62a_100000210202_100009991533 [1,1,0,0,0,0|0,1,1]=4 4747 B10R0.1 CCOC(=O)CCCSCC 62a_100009991533_100000210202 [1,1,0,0,0,0|0,1,1]=4 4748 B10R0.1 CCOC(=O)CNCCOC 2230a_100000209980_100000188475 [1,1,0,0,0,0|1,0,1]=4 4749 B10R0.1 CCOC(=O)COCCCBr 34a_100011217188_100000188475 [1,1,0,0,0,0|1,0,1]=4 4750 B10R0.1 CCOC(=O)COCCCCl 34a_100000230001_100000188475 [1,1,0,0,0,0|1,0,1]=4 4751 B10R0.1 CCOC(=O)COCCCF 34a_100000759539_100000188475 [1,1,0,0,0,0|1,0,1]=4 4752 B10R0.1 CCOC(=O)COCCCN 34a_100000182051_100000188475 [1,1,0,0,0,0|1,0,1]=4 4753 B10R0.1 CCOC(=O)COCCNC 2230a_106832991635_100000088970 [1,1,0,0,0,0|1,0,1]=4 4754 B10R0.1 CCOC(=O)COCCNC 34a_100102657272_100000088970 [1,1,0,0,0,0|1,0,1]=4 4755 B10R0.1 CCOC(=O)COCCNC 7a_106832991635_100000088970 [1,1,0,0,0,0|1,0,1]=4 4756 B10R0.1 CCOC(=O)COCCOC 34a_100000210237_100000188475 [1,1,0,0,0,0|0,0,1]=3 4757 B10R0.1 CCOC(=O)COCCOC 34a_100138415774_100000088970 [1,1,0,0,0,0|0,0,1]=3 4758 B10R0.1 CCOC(=O)COCCON 34a_100000700252_100000188475 [1,1,0,0,0,0|1,0,1]=4 4759 B10R0.1 CCOC(=O)COCCSC 34a_100000230434_100000188475 [1,1,0,0,0,0|0,1,1]=4 4760 B10R0.1 CCOC(=O)COCCSC 62a_100000088970_200000210301 [1,1,0,0,0,0|0,1,1]=4 4761 B10R0.1 CCOC(=O)COCCSC 62a_200000210301_100000088970 [1,1,0,0,0,0|0,1,1]=4 4762 B10R0.1 CCOC(=O)COCCSC 7a_100000230434_100000188475 [1,1,0,0,0,0|0,1,1]=4 4763 B10R0.1 CCOC(=O)COCCS[13CH3] 62a_100000088970_200025704644 [1,1,0,0,0,0|0,1,1]=4 4764 B10R0.1 CCOC(=O)COCCS[13CH3] 62a_200025704644_100000088970 [1,1,0,0,0,0|0,1,1]=4 4765 B10R0.1 CCOC(=O)CSCCOC 62a_100000188475_100000233755 [1,1,0,0,0,0|0,1,1]=4 4766 B10R0.1 CCOC(=O)CSCCOC 62a_100000233755_100000188475 [1,1,0,0,0,0|0,1,1]=4 4767 B10R0.1 CCOC(=O)CSCCOC 7a_200000230590_200000210301 [1,1,0,0,0,0|0,1,1]=4 4768 B10R0.1 CCOC(=O)CSCCO[13CH3] 7a_200000230590_200025704644 [1,1,0,0,0,0|0,1,1]=4 4769 B10R0.1 CCOCCCC(=O)COC 1458a_100000210968_100012232248 [1,1,0,0,0,0|1,0,1]=4 4770 B10R0.1 CCOCCCC(=O)OCC 34a_100121572206_100009991533 [1,1,0,0,0,0|0,0,1]=3 4771 B10R0.1 CCOCCCC(=O)OCC 7a_100012001163_100000210202 [1,1,0,0,0,0|0,0,1]=3 4772 B10R0.1 CCOCCNC(=O)COC 11a_100011200944_100000210968 [1,1,0,0,0,0|1,0,1]=4 4773 B10R0.1 CCOCCNC(=O)COC 1626a_102516460346_100000210968 [1,1,0,0,0,0|1,0,1]=4 4774 B10R0.1 CCOCCNC(=O)COC 240690a_100011200944_100000210968 [1,1,0,0,0,0|1,0,1]=4 4775 B10R0.1 CCOCCNC(=O)COC 527a_100011200944_100000210968 [1,1,0,0,0,0|1,0,1]=4 4776 B10R0.1 CCOCCNC(=O)OCC 34a_100000158857_100000210202 [1,1,0,0,0,0|1,0,1]=4 4777 B10R0.1 CCOCCNC(C)CCO 2230a_102516460346_100009893172 [1,1,0,0,0,0|2,0,0]=4 4778 B10R0.1 CCOCCNC(C)CCO 34a_102516460346_100009893172 [1,1,0,0,0,0|2,0,0]=4 4779 B10R0.1 CCOCCNC(C)COC 2230a_102516460346_100000765312 [1,1,0,0,0,0|1,0,0]=3 4780 B10R0.1 CCOCCNC(C)COC 270004a_102516460346_100000749346 [1,1,0,0,0,0|1,0,0]=3 4781 B10R0.1 CCOCCNC(C)COC 34a_102516460346_100000765312 [1,1,0,0,0,0|1,0,0]=3 4782 B10R0.1 CCOCCNC(C)CSC 270004a_102516460346_100011216314 [1,1,0,0,0,0|1,1,0]=4 4783 B10R0.1 CCOCCN[C@H](C)CCO 2230a_100000706166_100011215890 [1,1,0,0,0,0|2,0,0]=4 4784 B10R0.1 CCOCCN[C@H](C)CCO 34a_100000706166_100000210147 [1,1,0,0,0,0|2,0,0]=4 4785 B10R0.1 CCOCCN[C@H](C)COC 2230a_100000764878_100011215890 [1,1,0,0,0,0|1,0,0]=3 4786 B10R0.1 CCOCCOC(=O)CNC 2230a_106832991635_200000101388 [1,1,0,0,0,0|1,0,1]=4 4787 B10R0.1 CCOCCOC(=O)CNC 34a_100102657272_200000101388 [1,1,0,0,0,0|1,0,1]=4 4788 B10R0.1 CCOCCOC(=O)CNC 7a_106832991635_200000101388 [1,1,0,0,0,0|1,0,1]=4 4789 B10R0.1 CCOCCOC(=O)COC 34a_100138415774_200000101388 [1,1,0,0,0,0|0,0,1]=3 4790 B10R0.1 CCOCCOC(=O)CSC 62a_200000101388_200000210301 [1,1,0,0,0,0|0,1,1]=4 4791 B10R0.1 CCOCCOC(=O)CSC 62a_200000210301_200000101388 [1,1,0,0,0,0|0,1,1]=4 4792 B10R0.1 CCOCCOC(=O)CS[13CH3] 62a_200000101388_200025704644 [1,1,0,0,0,0|0,1,1]=4 4793 B10R0.1 CCOCCOC(=O)CS[13CH3] 62a_200025704644_200000101388 [1,1,0,0,0,0|0,1,1]=4 4794 B10R0.1 CCOCCOC(C)CC#N 7a_100000210136_100009813641 [1,1,0,0,0,0|1,0,1]=4 4795 B10R0.1 CCOCCOC(C)CCBr 34a_100012276601_100000210147 [1,1,0,0,0,0|1,0,0]=3 4796 B10R0.1 CCOCCOC(C)CCO 34a_100000210136_100009893172 [1,1,0,0,0,0|1,0,0]=3 4797 B10R0.1 CCOCCOC(C)CCO 7a_100000210136_100009893172 [1,1,0,0,0,0|1,0,0]=3 4798 B10R0.1 CCOCCOC(C)COC 34a_100000210136_100000765312 [1,1,0,0,0,0|0,0,0]=2 4799 B10R0.1 CCOCCOC(C)COC 7a_100000210136_100000765312 [1,1,0,0,0,0|0,0,0]=2 4800 B10R0.1 CCOCCO[C@H](C)COC 34a_100011934205_100000210147 [1,1,0,0,0,0|0,0,0]=2 4801 B10R0.1 CCOCCSC(C)CCO 62a_100000210147_100009893172 [1,1,0,0,0,0|1,1,0]=4 4802 B10R0.1 CCOCCSC(C)CCO 62a_100009893172_100011215890 [1,1,0,0,0,0|1,1,0]=4 4803 B10R0.1 CCOCCSC(C)COC 62a_100000210147_100000765312 [1,1,0,0,0,0|0,1,0]=3 4804 B10R0.1 CCOCCSC(C)COC 62a_100000765312_100011215890 [1,1,0,0,0,0|0,1,0]=3 4805 B10R0.1 CCOCSCC(=O)OCC 62a_100000188475_100000739092 [1,1,0,0,0,0|0,1,1]=4 4806 B10R0.1 CCOCSCC(=O)OCC 62a_100000739092_100000188475 [1,1,0,0,0,0|0,1,1]=4 4807 B10R0.1 CCOCSCC(O)COC 62a_100000739092_100011215053 [1,1,0,0,0,0|2,0,0]=4 4808 B10R0.1 CCOCSCC(O)COC 62a_100011215053_100000739092 [1,1,0,0,0,0|2,0,0]=4 4809 B10R0.1 CCSCCNC(C)COC 2230a_100000106463_100000765312 [1,1,0,0,0,0|1,1,0]=4 4810 B10R0.1 CCSCCNC(C)COC 270004a_100000106463_100000749346 [1,1,0,0,0,0|1,1,0]=4 4811 B10R0.1 CCSCCN[C@H](C)COC 2230a_100000764878_100000757381 [1,1,0,0,0,0|1,1,0]=4 4812 B10R0.1 CCSCCOC(C)CCBr 34a_100012276601_100000757381 [1,1,0,0,0,0|1,1,0]=4 4813 B10R0.1 CCSCCOC(C)CCO 34a_100000212035_100009893172 [1,1,0,0,0,0|1,1,0]=4 4814 B10R0.1 CCSCCOC(C)CCO 7a_100000212035_100009893172 [1,1,0,0,0,0|1,1,0]=4 4815 B10R0.1 CCSCCOC(C)COC 34a_100000212035_100000765312 [1,1,0,0,0,0|0,1,0]=3 4816 B10R0.1 CCSCCOC(C)COC 7a_100000212035_100000765312 [1,1,0,0,0,0|0,1,0]=3 4817 B10R0.1 CCSCCO[C@H](C)COC 34a_100011934205_100000757381 [1,1,0,0,0,0|0,1,0]=3 4818 B10R0.1 CCSCCSC(C)COC 62a_100000757381_100000765312 [1,1,0,0,0,0|0,2,0]=4 4819 B10R0.1 CCSCCSC(C)COC 62a_100000765312_100000757381 [1,1,0,0,0,0|0,2,0]=4 4820 B10R0.1 CNCCCOC(C)COC 34a_100000213112_100000765312 [1,1,0,0,0,0|2,0,0]=4 4821 B10R0.1 COCC(C)OCCCCBr 34a_100011216708_100000765312 [1,1,0,0,0,0|2,0,0]=4 4822 B10R0.1 COCC(C)OCCCCCl 34a_100000210776_100000765312 [1,1,0,0,0,0|2,0,0]=4 4823 B10R0.1 COCC(C)OCCCCCl 7a_100000210776_100000765312 [1,1,0,0,0,0|2,0,0]=4 4824 B10R0.1 COCC(C)OCCCCF 34a_100011995726_100000765312 [1,1,0,0,0,0|2,0,0]=4 4825 B10R0.1 COCC(C)OCCCCF 7a_100011995726_100000765312 [1,1,0,0,0,0|2,0,0]=4 4826 B10R0.1 COCC(C)OCCCCI 34a_200012148704_100000765312 [1,1,0,0,0,0|2,0,0]=4 4827 B10R0.1 COCC(C)OCCCCN 34a_100000750430_100000765312 [1,1,0,0,0,0|2,0,0]=4 4828 B10R0.1 COCC(C)OCCCSC 34a_100000690336_100000765312 [1,1,0,0,0,0|2,0,0]=4 4829 B10R0.1 COCC(C)OCCCSC 7a_100000690336_100000765312 [1,1,0,0,0,0|2,0,0]=4 4830 B10R0.1 COCCCOC(C)COC 34a_100000740835_100000765312 [1,1,0,0,0,0|2,0,0]=4 4831 B10R0.1 COCCCO[C@H](C)COC 34a_100011934205_100000740836 [1,1,0,0,0,0|2,0,0]=4 4832 B10R0.1 COCCOCC(C)CCN 34a_106354213184_100011201679 [1,1,0,0,0,0|2,0,0]=4 4833 B10R0.1 COCCOCC(N)COC 34a_100000724102_100011201679 [1,1,0,0,0,0|2,0,0]=4 4834 B10R0.1 COCCOCC(O)COC 34a_100000210237_100011215053 [1,1,0,0,0,0|2,0,0]=4 4835 B10R0.1 COC[C@@H](C)OCCCCF 34a_100011934205_100000729493 [1,1,0,0,0,0|2,0,0]=4 4836 B10R0.1 COC[C@@H](C)OCCCCO 34a_100011934205_100011216708 [1,1,0,0,0,0|2,0,0]=4 4837 B10R0.4 C#CCCOCCOC(C)C 34a_100000211219_100000688953 [1,1,0,0,0,0|0,0,2]=4 4838 B10R0.4 C#CCCOCCOC(C)C 34a_100011215631_100000211751 [1,1,0,0,0,0|0,0,2]=4 4839 B10R0.4 C#CCCOCCOC(C)C 7a_100000211219_100000688953 [1,1,0,0,0,0|0,0,2]=4 4840 B10R0.4 C/C=C/CCOCCC(C)C 34a_100016278192_100000210312 [1,1,0,0,0,0|1,0,1]=4 4841 B10R0.4 C/C=C/CCOCCC(C)O 34a_100016278192_100012276601 [1,1,0,0,0,0|1,0,1]=4 4842 B10R0.4 C/C=C/CCOCOC(C)C 34a_100016278192_100000709892 [1,1,0,0,0,0|1,0,1]=4 4843 B10R0.4 C/C=C/COCCOC(C)C 34a_100000211219_100102629194 [1,1,0,0,0,0|0,0,2]=4 4844 B10R0.4 C/C=C/COCCOC(C)C 34a_100016270725_100000211751 [1,1,0,0,0,0|0,0,2]=4 4845 B10R0.4 C/C=C/COCCOC(C)C 7a_100000211219_100102629194 [1,1,0,0,0,0|0,0,2]=4 4846 B10R0.4 C=C(Br)CCOCCOCC 34a_100009813270_100000210147 [1,1,0,0,0,0|0,0,2]=4 4847 B10R0.4 C=C(C)CCNCCOCC 2230a_102516460346_100000730704 [1,1,0,0,0,0|1,0,1]=4 4848 B10R0.4 C=C(C)CCNCCOCC 34a_102516460346_100000730704 [1,1,0,0,0,0|1,0,1]=4 4849 B10R0.4 C=C(C)CCOCCCCC 34a_100000210253_100000730704 [1,1,0,0,0,0|1,0,1]=4 4850 B10R0.4 C=C(C)CCOCCCCC 34a_100000764851_100000718602 [1,1,0,0,0,0|1,0,1]=4 4851 B10R0.4 C=C(C)CCOCCCCC 7a_100000210253_100000730704 [1,1,0,0,0,0|1,0,1]=4 4852 B10R0.4 C=C(C)CCOCCOCC 34a_100000210136_100000730704 [1,1,0,0,0,0|0,0,1]=3 4853 B10R0.4 C=C(C)CCOCCOCC 34a_100000764851_100000210147 [1,1,0,0,0,0|0,0,1]=3 4854 B10R0.4 C=C(C)CCOCCOCC 7a_100000210136_100000730704 [1,1,0,0,0,0|0,0,1]=3 4855 B10R0.4 C=C(C)CCOCCSCC 34a_100000212035_100000730704 [1,1,0,0,0,0|0,1,1]=4 4856 B10R0.4 C=C(C)CCOCCSCC 34a_100000764851_100000757381 [1,1,0,0,0,0|0,1,1]=4 4857 B10R0.4 C=C(C)CCOCCSCC 7a_100000212035_100000730704 [1,1,0,0,0,0|0,1,1]=4 4858 B10R0.4 C=C(C)CCSCCOCC 62a_100000210147_100000730704 [1,1,0,0,0,0|0,1,1]=4 4859 B10R0.4 C=C(C)CCSCCOCC 62a_100000730704_100011215890 [1,1,0,0,0,0|0,1,1]=4 4860 B10R0.4 C=CCCOCCOC(C)C 34a_100000211219_100000754431 [1,1,0,0,0,0|0,0,2]=4 4861 B10R0.4 C=CCCOCCOC(C)C 34a_100011205117_100000211751 [1,1,0,0,0,0|0,0,2]=4 4862 B10R0.4 C=CCCOCCOC(C)C 7a_100000211219_100000754431 [1,1,0,0,0,0|0,0,2]=4 4863 B10R0.4 C=COCCCCOC(C)C 34a_100000031558_100000210206 [1,1,0,0,0,0|0,0,2]=4 4864 B10R0.4 C=COCCCCOC(C)C 7a_100000031558_100000210206 [1,1,0,0,0,0|0,0,2]=4 4865 B10R0.4 C=COCCOCCC(C)Br 34a_100009893172_100000039644 [1,1,0,0,0,0|0,0,2]=4 4866 B10R0.4 C=COCCOCCC(C)C 34a_100000033082_100000210312 [1,1,0,0,0,0|0,0,2]=4 4867 B10R0.4 C=COCCOCCC(C)C 34a_100000210254_100000039644 [1,1,0,0,0,0|0,0,2]=4 4868 B10R0.4 C=COCCOCCC(C)C 7a_100000210254_100000039644 [1,1,0,0,0,0|0,0,2]=4 4869 B10R0.4 C=COCCOCCC(C)O 34a_100000033082_100012276601 [1,1,0,0,0,0|0,0,2]=4 4870 B10R0.4 C=COCCOCC[C@@H](C)N 34a_100000706166_100000039644 [1,1,0,0,0,0|0,0,2]=4 4871 B10R0.4 C=COCCOCOC(C)C 34a_100000033082_100000709892 [1,1,0,0,0,0|0,0,2]=4 4872 B10R0.4 CC#CCCOCCC(C)C 34a_100000750427_100000210312 [1,1,0,0,0,0|1,0,1]=4 4873 B10R0.4 CC#CCCOCCC(C)O 34a_100000750427_100012276601 [1,1,0,0,0,0|1,0,1]=4 4874 B10R0.4 CC#CCCOCOC(C)C 34a_100000750427_100000709892 [1,1,0,0,0,0|1,0,1]=4 4875 B10R0.4 CC#CCOCCOC(C)C 34a_100000211219_100000748600 [1,1,0,0,0,0|0,0,2]=4 4876 B10R0.4 CC#CCOCCOC(C)C 34a_100000761923_100000211751 [1,1,0,0,0,0|0,0,2]=4 4877 B10R0.4 CC#CCOCCOC(C)C 7a_100000211219_100000748600 [1,1,0,0,0,0|0,0,2]=4 4878 B10R0.4 CC(=O)OCCCCOCF 34a_100000073216_100015361967 [1,1,0,0,0,0|1,0,1]=4 4879 B10R0.4 CC(=O)OCCCCOCF 7a_100000073216_100015361967 [1,1,0,0,0,0|1,0,1]=4 4880 B10R0.4 CC(=O)OCCOCCCBr 34a_100011217188_100009814007 [1,1,0,0,0,0|1,0,1]=4 4881 B10R0.4 CC(=O)OCCOCCCCl 34a_100000230001_100009814007 [1,1,0,0,0,0|1,0,1]=4 4882 B10R0.4 CC(=O)OCCOCCCF 34a_100000759539_100009814007 [1,1,0,0,0,0|1,0,1]=4 4883 B10R0.4 CC(=O)OCCOCCCN 34a_100000182051_100009814007 [1,1,0,0,0,0|1,0,1]=4 4884 B10R0.4 CC(=O)OCCOCCON 34a_100000700252_100009814007 [1,1,0,0,0,0|1,0,1]=4 4885 B10R0.4 CC(=O)OCCOCCS[13CH3] 62a_200000083610_200025704644 [1,1,0,0,0,0|0,1,1]=4 4886 B10R0.4 CC(=O)OCCOCCS[13CH3] 62a_200025704644_200000083610 [1,1,0,0,0,0|0,1,1]=4 4887 B10R0.4 CC(Br)CCOCCCCF 34a_100009893172_100000729493 [1,1,0,0,0,0|2,0,0]=4 4888 B10R0.4 CC(Br)CCOCCCCO 34a_100009893172_100011216708 [1,1,0,0,0,0|2,0,0]=4 4889 B10R0.4 CC(C)CCCCCOCF 34a_100011995859_100015361967 [1,1,0,0,0,0|2,0,0]=4 4890 B10R0.4 CC(C)CCCCCOCF 7a_100011995859_100015361967 [1,1,0,0,0,0|2,0,0]=4 4891 B10R0.4 CC(C)CCCOCCCBr 34a_100011217188_100011214892 [1,1,0,0,0,0|2,0,0]=4 4892 B10R0.4 CC(C)CCCOCCCCl 34a_100000230001_100011214892 [1,1,0,0,0,0|2,0,0]=4 4893 B10R0.4 CC(C)CCCOCCCF 34a_100000210774_100011934791 [1,1,0,0,0,0|2,0,0]=4 4894 B10R0.4 CC(C)CCCOCCCF 34a_100000759539_100011214892 [1,1,0,0,0,0|2,0,0]=4 4895 B10R0.4 CC(C)CCCOCCCF 7a_100000210774_100011934791 [1,1,0,0,0,0|2,0,0]=4 4896 B10R0.4 CC(C)CCCOCCCN 34a_100000182051_100011214892 [1,1,0,0,0,0|2,0,0]=4 4897 B10R0.4 CC(C)CCCOCCCO 34a_100000210774_100000230001 [1,1,0,0,0,0|2,0,0]=4 4898 B10R0.4 CC(C)CCCOCCCO 7a_100000210774_100011215043 [1,1,0,0,0,0|2,0,0]=4 4899 B10R0.4 CC(C)CCCOCCON 34a_100000700252_100011214892 [1,1,0,0,0,0|2,0,0]=4 4900 B10R0.4 CC(C)CCOCCCCBr 34a_100011216708_100000210312 [1,1,0,0,0,0|2,0,0]=4 4901 B10R0.4 CC(C)CCOCCCCCl 34a_100000210776_100000210312 [1,1,0,0,0,0|2,0,0]=4 4902 B10R0.4 CC(C)CCOCCCCCl 7a_100000210776_100000210626 [1,1,0,0,0,0|2,0,0]=4 4903 B10R0.4 CC(C)CCOCCCCF 34a_100000210254_100000729493 [1,1,0,0,0,0|2,0,0]=4 4904 B10R0.4 CC(C)CCOCCCCF 34a_100011995726_100000210312 [1,1,0,0,0,0|2,0,0]=4 4905 B10R0.4 CC(C)CCOCCCCF 7a_100000210254_100000729493 [1,1,0,0,0,0|2,0,0]=4 4906 B10R0.4 CC(C)CCOCCCCF 7a_100011995726_100000210626 [1,1,0,0,0,0|2,0,0]=4 4907 B10R0.4 CC(C)CCOCCCCI 34a_200012148704_100000210312 [1,1,0,0,0,0|2,0,0]=4 4908 B10R0.4 CC(C)CCOCCCCN 34a_100000750430_100000210312 [1,1,0,0,0,0|2,0,0]=4 4909 B10R0.4 CC(C)CCOCCCCO 34a_100000210254_100011216708 [1,1,0,0,0,0|2,0,0]=4 4910 B10R0.4 CC(C)CCOCCCCO 7a_100000210254_100000210776 [1,1,0,0,0,0|2,0,0]=4 4911 B10R0.4 CC(C)NCCCCCO[13CH3] 34a_100011629493_200025704644 [1,1,0,0,0,0|2,0,0]=4 4912 B10R0.4 CC(C)NCCCCOCF 34a_100011521146_100015361967 [1,1,0,0,0,0|2,0,0]=4 4913 B10R0.4 CC(C)NCCOCCCF 34a_100000224655_100011934791 [1,1,0,0,0,0|2,0,0]=4 4914 B10R0.4 CC(C)NCCOCCCO 34a_100000224655_100000230001 [1,1,0,0,0,0|2,0,0]=4 4915 B10R0.4 CC(C)OCCCCCCBr 34a_100011215345_100000210206 [1,1,0,0,0,0|2,0,0]=4 4916 B10R0.4 CC(C)OCCCCCCBr 7a_100011215345_100000210206 [1,1,0,0,0,0|2,0,0]=4 4917 B10R0.4 CC(C)OCCCCCCCl 34a_100000766143_100000210206 [1,1,0,0,0,0|2,0,0]=4 4918 B10R0.4 CC(C)OCCCCCCCl 7a_100000766143_100000210206 [1,1,0,0,0,0|2,0,0]=4 4919 B10R0.4 CC(C)OCCCCCCF 34a_100000212225_100015922095 [1,1,0,0,0,0|2,0,0]=4 4920 B10R0.4 CC(C)OCCCCCCF 34a_100000732779_100000210206 [1,1,0,0,0,0|2,0,0]=4 4921 B10R0.4 CC(C)OCCCCCCF 7a_100000732779_100000210206 [1,1,0,0,0,0|2,0,0]=4 4922 B10R0.4 CC(C)OCCCCCCN 34a_100000686447_100000210206 [1,1,0,0,0,0|2,0,0]=4 4923 B10R0.4 CC(C)OCCCCCCO 34a_100000212225_100000766143 [1,1,0,0,0,0|2,0,0]=4 4924 B10R0.4 CC(C)OCCNCCCF 2230a_100000701111_100011934791 [1,1,0,0,0,0|2,0,0]=4 4925 B10R0.4 CC(C)OCCNCCCF 2230a_100015189416_100000211751 [1,1,0,0,0,0|2,0,0]=4 4926 B10R0.4 CC(C)OCCNCCCF 34a_100000701111_100011934791 [1,1,0,0,0,0|2,0,0]=4 4927 B10R0.4 CC(C)OCCNCCCF 34a_100015189416_100000211751 [1,1,0,0,0,0|2,0,0]=4 4928 B10R0.4 CC(C)OCCNCCCO 2230a_100000701111_100000230001 [1,1,0,0,0,0|2,0,0]=4 4929 B10R0.4 CC(C)OCCNCCCO 34a_100000701111_100000230001 [1,1,0,0,0,0|2,0,0]=4 4930 B10R0.4 CC(C)OCCOCCC#N 7a_100000211219_100000184422 [1,1,0,0,0,0|1,0,1]=4 4931 B10R0.4 CC(C)OCCOCCCBr 34a_100011217188_100000211751 [1,1,0,0,0,0|1,0,0]=3 4932 B10R0.4 CC(C)OCCOCCCCl 34a_100000230001_100000211751 [1,1,0,0,0,0|1,0,0]=3 4933 B10R0.4 CC(C)OCCOCCCF 34a_100000211219_100011934791 [1,1,0,0,0,0|1,0,0]=3 4934 B10R0.4 CC(C)OCCOCCCF 34a_100000759539_100000211751 [1,1,0,0,0,0|1,0,0]=3 4935 B10R0.4 CC(C)OCCOCCCF 7a_100000211219_100011934791 [1,1,0,0,0,0|1,0,0]=3 4936 B10R0.4 CC(C)OCCOCCCN 34a_100000182051_100000211751 [1,1,0,0,0,0|1,0,0]=3 4937 B10R0.4 CC(C)OCCOCCCO 34a_100000211219_100000230001 [1,1,0,0,0,0|1,0,0]=3 4938 B10R0.4 CC(C)OCCOCCCO 7a_100000211219_100011215043 [1,1,0,0,0,0|1,0,0]=3 4939 B10R0.4 CC(C)OCCOCCON 34a_100000700252_100000211751 [1,1,0,0,0,0|1,0,0]=3 4940 B10R0.4 CC(C)OCCSCCCF 62a_100000211751_100011934791 [1,1,0,0,0,0|1,1,0]=4 4941 B10R0.4 CC(C)OCCSCCCF 62a_100011934791_100000211751 [1,1,0,0,0,0|1,1,0]=4 4942 B10R0.4 CC(C)OCCSCCCO 62a_100000211751_100011215043 [1,1,0,0,0,0|1,1,0]=4 4943 B10R0.4 CC(C)OCCSCCCO 62a_100011215043_100000211751 [1,1,0,0,0,0|1,1,0]=4 4944 B10R0.4 CC(C)OCOCCCCBr 34a_100011216708_100000709892 [1,1,0,0,0,0|2,0,0]=4 4945 B10R0.4 CC(C)OCOCCCCCl 34a_100000210776_100000709892 [1,1,0,0,0,0|2,0,0]=4 4946 B10R0.4 CC(C)OCOCCCCF 34a_100011995726_100000709892 [1,1,0,0,0,0|2,0,0]=4 4947 B10R0.4 CC(C)OCOCCCCI 34a_200012148704_100000709892 [1,1,0,0,0,0|2,0,0]=4 4948 B10R0.4 CC(C)OCOCCCCN 34a_100000750430_100000709892 [1,1,0,0,0,0|2,0,0]=4 4949 B10R0.4 CC(C)SCCOCCCBr 34a_100011217188_100000730970 [1,1,0,0,0,0|1,1,0]=4 4950 B10R0.4 CC(C)SCCOCCCCl 34a_100000230001_100000730970 [1,1,0,0,0,0|1,1,0]=4 4951 B10R0.4 CC(C)SCCOCCCF 34a_100000759539_100000730970 [1,1,0,0,0,0|1,1,0]=4 4952 B10R0.4 CC(C)SCCOCCCF 34a_200011212901_100011934791 [1,1,0,0,0,0|1,1,0]=4 4953 B10R0.4 CC(C)SCCOCCCF 7a_200011212901_100011934791 [1,1,0,0,0,0|1,1,0]=4 4954 B10R0.4 CC(C)SCCOCCCN 34a_100000182051_100000730970 [1,1,0,0,0,0|1,1,0]=4 4955 B10R0.4 CC(C)SCCOCCCO 34a_200011212901_100000230001 [1,1,0,0,0,0|1,1,0]=4 4956 B10R0.4 CC(C)SCCOCCCO 7a_200011212901_100011215043 [1,1,0,0,0,0|1,1,0]=4 4957 B10R0.4 CC(C)SCCOCCON 34a_100000700252_100000730970 [1,1,0,0,0,0|1,1,0]=4 4958 B10R0.4 CC(O)CCCOCCCBr 34a_100011217188_200000718107 [1,1,0,0,0,0|2,0,0]=4 4959 B10R0.4 CC(O)CCCOCCCCl 34a_100000230001_200000718107 [1,1,0,0,0,0|2,0,0]=4 4960 B10R0.4 CC(O)CCCOCCCF 34a_100000759539_200000718107 [1,1,0,0,0,0|2,0,0]=4 4961 B10R0.4 CC(O)CCCOCCCN 34a_100000182051_200000718107 [1,1,0,0,0,0|2,0,0]=4 4962 B10R0.4 CC(O)CCCOCCON 34a_100000700252_200000718107 [1,1,0,0,0,0|2,0,0]=4 4963 B10R0.4 CC(O)CCOCCCCBr 34a_100011216708_100012276601 [1,1,0,0,0,0|2,0,0]=4 4964 B10R0.4 CC(O)CCOCCCCCl 34a_100000210776_100012276601 [1,1,0,0,0,0|2,0,0]=4 4965 B10R0.4 CC(O)CCOCCCCCl 7a_100000210776_100012276601 [1,1,0,0,0,0|2,0,0]=4 4966 B10R0.4 CC(O)CCOCCCCF 34a_100011995726_100012276601 [1,1,0,0,0,0|2,0,0]=4 4967 B10R0.4 CC(O)CCOCCCCF 7a_100011995726_100012276601 [1,1,0,0,0,0|2,0,0]=4 4968 B10R0.4 CC(O)CCOCCCCI 34a_200012148704_100012276601 [1,1,0,0,0,0|2,0,0]=4 4969 B10R0.4 CC(O)CCOCCCCN 34a_100000750430_100012276601 [1,1,0,0,0,0|2,0,0]=4 4970 B10R0.4 CC/C=C/CCCOC(C)C 34a_100016287902_100000210206 [1,1,0,0,0,0|1,0,1]=4 4971 B10R0.4 CC/C=C/CCCOC(C)C 7a_100016287902_100000210206 [1,1,0,0,0,0|1,0,1]=4 4972 B10R0.4 CC/C=C\COCCC(C)Br 34a_100009893172_100103147603 [1,1,0,0,0,0|1,0,1]=4 4973 B10R0.4 CC/C=C\COCCC(C)C 34a_100000210254_100103147603 [1,1,0,0,0,0|1,0,1]=4 4974 B10R0.4 CC/C=C\COCCC(C)C 34a_100016268518_100000210312 [1,1,0,0,0,0|1,0,1]=4 4975 B10R0.4 CC/C=C\COCCC(C)C 7a_100000210254_100103147603 [1,1,0,0,0,0|1,0,1]=4 4976 B10R0.4 CC/C=C\COCCC(C)O 34a_100016268518_100012276601 [1,1,0,0,0,0|1,0,1]=4 4977 B10R0.4 CC/C=C\COCC[C@@H](C)N 34a_100000706166_100103147603 [1,1,0,0,0,0|1,0,1]=4 4978 B10R0.4 CC/C=C\COCOC(C)C 34a_100016268518_100000709892 [1,1,0,0,0,0|1,0,1]=4 4979 B10R0.4 CC=CCOCCOC(C)C 34a_100000211219_100000070051 [1,1,0,0,0,0|0,0,2]=4 4980 B10R0.4 CC=CCOCCOC(C)C 7a_100000211219_100000070051 [1,1,0,0,0,0|0,0,2]=4 4981 B10R0.4 CCC#CCOCCC(C)Br 34a_100009893172_100009813939 [1,1,0,0,0,0|1,0,1]=4 4982 B10R0.4 CCC#CCOCCC(C)C 34a_100000032950_100000210312 [1,1,0,0,0,0|1,0,1]=4 4983 B10R0.4 CCC#CCOCCC(C)C 34a_100000210254_100009813939 [1,1,0,0,0,0|1,0,1]=4 4984 B10R0.4 CCC#CCOCCC(C)C 7a_100000210254_100009813939 [1,1,0,0,0,0|1,0,1]=4 4985 B10R0.4 CCC#CCOCCC(C)O 34a_100000032950_100012276601 [1,1,0,0,0,0|1,0,1]=4 4986 B10R0.4 CCC#CCOCC[C@@H](C)N 34a_100000706166_100009813939 [1,1,0,0,0,0|1,0,1]=4 4987 B10R0.4 CCC#CCOCOC(C)C 34a_100000032950_100000709892 [1,1,0,0,0,0|1,0,1]=4 4988 B10R0.4 CCCC#CCCOC(C)C 34a_100000042726_100000210206 [1,1,0,0,0,0|1,0,1]=4 4989 B10R0.4 CCCC#CCCOC(C)C 7a_100000042726_100000210206 [1,1,0,0,0,0|1,0,1]=4 4990 B10R0.4 CCCC/C=C/COC(C)C 34a_200016272032_100000210206 [1,1,0,0,0,0|1,0,1]=4 4991 B10R0.4 CCCC/C=C/COC(C)C 7a_200016272032_100000210206 [1,1,0,0,0,0|1,0,1]=4 4992 B10R0.4 CCCCC#CCOC(C)C 34a_200000034558_100000210206 [1,1,0,0,0,0|1,0,1]=4 4993 B10R0.4 CCCCC#CCOC(C)C 7a_200000034558_100000210206 [1,1,0,0,0,0|1,0,1]=4 4994 B10R0.4 CCCCCCCNC(C)C 2230a_100000229938_100000210206 [1,1,0,0,0,0|2,0,0]=4 4995 B10R0.4 CCCCCCCNC(C)C 2230a_100138425928_100000210681 [1,1,0,0,0,0|2,0,0]=4 4996 B10R0.4 CCCCCCCNC(C)C 34a_100138425928_100000210614 [1,1,0,0,0,0|2,0,0]=4 4997 B10R0.4 CCCCCCCOC(C)C 34a_100000210272_100000210206 [1,1,0,0,0,0|1,0,0]=3 4998 B10R0.4 CCCCCCCOC(C)C 34a_100000212225_100000210614 [1,1,0,0,0,0|1,0,0]=3 4999 B10R0.4 CCCCCCCOC(C)C 7a_100000210272_100000210206 [1,1,0,0,0,0|1,0,0]=3 5000 B10R0.4 CCCCCCCSC(C)C 62a_100000210206_100000210316 [1,1,0,0,0,0|1,1,0]=4 5001 B10R0.4 CCCCCCCSC(C)C 62a_100000210614_100000210206 [1,1,0,0,0,0|1,1,0]=4 5002 B10R0.4 CCCCCNCCC(C)C 2230a_100000209983_100000210312 [1,1,0,0,0,0|2,0,0]=4 5003 B10R0.4 CCCCCNCCC(C)C 269862a_100000209983_100000185833 [1,1,0,0,0,0|2,0,0]=4 5004 B10R0.4 CCCCCNCCC(C)O 2230a_100000209983_100012276601 [1,1,0,0,0,0|2,0,0]=4 5005 B10R0.4 CCCCCNCCC(C)O 2230a_200000755665_100000210326 [1,1,0,0,0,0|2,0,0]=4 5006 B10R0.4 CCCCCNCOC(C)C 2230a_100000209983_100000709892 [1,1,0,0,0,0|2,0,0]=4 5007 B10R0.4 CCCCCOCCC(=O)C 34a_100000759926_100000718602 [1,1,0,0,0,0|1,0,1]=4 5008 B10R0.4 CCCCCOCCC(=O)C 7a_100000210253_100000053229 [1,1,0,0,0,0|1,0,1]=4 5009 B10R0.4 CCCCCOCCC(=O)C 7a_100000759926_100000210326 [1,1,0,0,0,0|1,0,1]=4 5010 B10R0.4 CCCCCOCCC(C)Br 34a_100009893172_100000718602 [1,1,0,0,0,0|1,0,0]=3 5011 B10R0.4 CCCCCOCCC(C)C 34a_100000210253_100000210312 [1,1,0,0,0,0|1,0,0]=3 5012 B10R0.4 CCCCCOCCC(C)C 34a_100000210254_100000718602 [1,1,0,0,0,0|1,0,0]=3 5013 B10R0.4 CCCCCOCCC(C)C 7a_100000210253_100000210626 [1,1,0,0,0,0|1,0,0]=3 5014 B10R0.4 CCCCCOCCC(C)C 7a_100000210254_100000210326 [1,1,0,0,0,0|1,0,0]=3 5015 B10R0.4 CCCCCOCCC(C)O 34a_100000210253_100012276601 [1,1,0,0,0,0|1,0,0]=3 5016 B10R0.4 CCCCCOCCC(C)O 7a_100000210253_100012276601 [1,1,0,0,0,0|1,0,0]=3 5017 B10R0.4 CCCCCOCCC(F)F 34a_100103093639_100000718602 [1,1,0,0,0,0|2,0,0]=4 5018 B10R0.4 CCCCCOCCN(C)C 7a_100000210253_100000755713 [1,1,0,0,0,0|2,0,0]=4 5019 B10R0.4 CCCCCOCC[C@@H](C)N 34a_100000706166_100000718602 [1,1,0,0,0,0|1,0,0]=3 5020 B10R0.4 CCCCCOCOC(=O)C 34a_100000210253_100009813279 [1,1,0,0,0,0|1,0,1]=4 5021 B10R0.4 CCCCCOCOC(C)C 34a_100000210253_100000709892 [1,1,0,0,0,0|1,0,0]=3 5022 B10R0.4 CCCCCSCCC(C)C 62a_100000210312_100000210326 [1,1,0,0,0,0|1,1,0]=4 5023 B10R0.4 CCCCCSCCC(C)C 62a_100000210326_100000210312 [1,1,0,0,0,0|1,1,0]=4 5024 B10R0.4 CCCCCSCCC(C)O 62a_100000210326_100012276601 [1,1,0,0,0,0|1,1,0]=4 5025 B10R0.4 CCCCCSCCC(C)O 62a_100012276601_100000210326 [1,1,0,0,0,0|1,1,0]=4 5026 B10R0.4 CCCCCSCOC(C)C 62a_100000210326_100000709892 [1,1,0,0,0,0|1,1,0]=4 5027 B10R0.4 CCCCCSCOC(C)C 62a_100000709892_100000210326 [1,1,0,0,0,0|1,1,0]=4 5028 B10R0.4 CCCCNCCCC(C)C 2230a_100000102301_100011214892 [1,1,0,0,0,0|2,0,0]=4 5029 B10R0.4 CCCCNCCCC(C)C 2230a_200000737386_100000210211 [1,1,0,0,0,0|2,0,0]=4 5030 B10R0.4 CCCCNCCCC(C)C 34a_200000737386_100000210210 [1,1,0,0,0,0|2,0,0]=4 5031 B10R0.4 CCCCNCCCC(C)C 7a_106832991798_100011214892 [1,1,0,0,0,0|2,0,0]=4 5032 B10R0.4 CCCCNCCCC(C)O 2230a_100000102301_200000718107 [1,1,0,0,0,0|2,0,0]=4 5033 B10R0.4 CCCCNCCCC(C)O 7a_106832991798_200000718107 [1,1,0,0,0,0|2,0,0]=4 5034 B10R0.4 CCCCNCCOC(=O)C 7a_106832991798_100009814007 [1,1,0,0,0,0|1,0,1]=4 5035 B10R0.4 CCCCNCCOC(C)C 2230a_100000102301_100000211751 [1,1,0,0,0,0|1,0,0]=3 5036 B10R0.4 CCCCNCCOC(C)C 2230a_100000701111_100000210211 [1,1,0,0,0,0|1,0,0]=3 5037 B10R0.4 CCCCNCCOC(C)C 34a_100000701111_100000210210 [1,1,0,0,0,0|1,0,0]=3 5038 B10R0.4 CCCCNCCOC(C)C 7a_106832991798_100000211751 [1,1,0,0,0,0|1,0,0]=3 5039 B10R0.4 CCCCNCCSC(C)C 2230a_100000102301_100000730970 [1,1,0,0,0,0|1,1,0]=4 5040 B10R0.4 CCCCNCCSC(C)C 2230a_100000731138_100000210211 [1,1,0,0,0,0|1,1,0]=4 5041 B10R0.4 CCCCNCCSC(C)C 34a_100000731138_100000210210 [1,1,0,0,0,0|1,1,0]=4 5042 B10R0.4 CCCCNCCSC(C)C 7a_106832991798_100000730970 [1,1,0,0,0,0|1,1,0]=4 5043 B10R0.4 CCCCOCCC=C(C)C 34a_100000210227_100011217483 [1,1,0,0,0,0|1,0,1]=4 5044 B10R0.4 CCCCOCCC=C(C)C 7a_100000210227_100011217483 [1,1,0,0,0,0|1,0,1]=4 5045 B10R0.4 CCCCOCCCC(=O)C 34a_100000210227_100000685027 [1,1,0,0,0,0|1,0,1]=4 5046 B10R0.4 CCCCOCCCC(=O)C 34a_100000759063_100000210210 [1,1,0,0,0,0|1,0,1]=4 5047 B10R0.4 CCCCOCCCC(=O)C 7a_100000210227_100011215641 [1,1,0,0,0,0|1,0,1]=4 5048 B10R0.4 CCCCOCCCC(=O)C 7a_100000759063_100000210211 [1,1,0,0,0,0|1,0,1]=4 5049 B10R0.4 CCCCOCCCC(C)C 34a_100000210227_100011214892 [1,1,0,0,0,0|1,0,0]=3 5050 B10R0.4 CCCCOCCCC(C)C 34a_100000210774_100000210210 [1,1,0,0,0,0|1,0,0]=3 5051 B10R0.4 CCCCOCCCC(C)C 7a_100000210227_100011214892 [1,1,0,0,0,0|1,0,0]=3 5052 B10R0.4 CCCCOCCCC(C)C 7a_100000210774_100000210211 [1,1,0,0,0,0|1,0,0]=3 5053 B10R0.4 CCCCOCCCC(C)O 34a_100000210227_200000718107 [1,1,0,0,0,0|1,0,0]=3 5054 B10R0.4 CCCCOCCCC(C)O 7a_100000210227_200000718107 [1,1,0,0,0,0|1,0,0]=3 5055 B10R0.4 CCCCOCCCN(C)C 7a_100000210227_100000757444 [1,1,0,0,0,0|2,0,0]=4 5056 B10R0.4 CCCCOCCNC(=O)C 34a_100000158858_100000210210 [1,1,0,0,0,0|1,0,1]=4 5057 B10R0.4 CCCCOCCNC(=O)C 7a_100000210227_100000189650 [1,1,0,0,0,0|1,0,1]=4 5058 B10R0.4 CCCCOCCNC(C)C 2230a_100138425928_100000743108 [1,1,0,0,0,0|1,0,0]=3 5059 B10R0.4 CCCCOCCNC(C)C 34a_100000224655_100000210210 [1,1,0,0,0,0|1,0,0]=3 5060 B10R0.4 CCCCOCCNC(C)C 34a_100138425928_100000743108 [1,1,0,0,0,0|1,0,0]=3 5061 B10R0.4 CCCCOCCOC(=O)C 34a_100000210227_100009814007 [1,1,0,0,0,0|0,0,1]=3 5062 B10R0.4 CCCCOCCOC(=O)C 7a_100000210227_100009814007 [1,1,0,0,0,0|0,0,1]=3 5063 B10R0.4 CCCCOCCOC(=O)N 34a_100000210227_200011214921 [1,1,0,0,0,0|1,0,1]=4 5064 B10R0.4 CCCCOCCOC(=O)N 7a_100000210227_200011214921 [1,1,0,0,0,0|1,0,1]=4 5065 B10R0.4 CCCCOCCOC(=O)N 7a_100000766696_100000210211 [1,1,0,0,0,0|1,0,1]=4 5066 B10R0.4 CCCCOCCOC(C)C 34a_100000210227_100000211751 [1,1,0,0,0,0|0,0,0]=2 5067 B10R0.4 CCCCOCCOC(C)C 34a_100000210238_100000210206 [1,1,0,0,0,0|0,0,0]=2 5068 B10R0.4 CCCCOCCOC(C)C 34a_100000211219_100000210210 [1,1,0,0,0,0|0,0,0]=2 5069 B10R0.4 CCCCOCCOC(C)C 34a_100000212225_100000743108 [1,1,0,0,0,0|0,0,0]=2 5070 B10R0.4 CCCCOCCOC(C)C 7a_100000210227_100000211751 [1,1,0,0,0,0|0,0,0]=2 5071 B10R0.4 CCCCOCCOC(C)C 7a_100000210238_100000210206 [1,1,0,0,0,0|0,0,0]=2 5072 B10R0.4 CCCCOCCOC(C)C 7a_100000211219_100000210211 [1,1,0,0,0,0|0,0,0]=2 5073 B10R0.4 CCCCOCCSC(C)C 34a_100000210227_100000730970 [1,1,0,0,0,0|0,1,0]=3 5074 B10R0.4 CCCCOCCSC(C)C 34a_200011212901_100000210210 [1,1,0,0,0,0|0,1,0]=3 5075 B10R0.4 CCCCOCCSC(C)C 62a_100000210206_100000743108 [1,1,0,0,0,0|0,1,0]=3 5076 B10R0.4 CCCCOCCSC(C)C 62a_100000743108_100000210206 [1,1,0,0,0,0|0,1,0]=3 5077 B10R0.4 CCCCOCCSC(C)C 7a_100000210227_100000730970 [1,1,0,0,0,0|0,1,0]=3 5078 B10R0.4 CCCCOCCSC(C)C 7a_200011212901_100000210211 [1,1,0,0,0,0|0,1,0]=3 5079 B10R0.4 CCCCOCNCC(C)C 2230a_100000210953_100011995733 [1,1,0,0,0,0|2,0,0]=4 5080 B10R0.4 CCCCOCNCC(C)C 34a_100000210953_100011995733 [1,1,0,0,0,0|2,0,0]=4 5081 B10R0.4 CCCCOCNCC(C)O 2230a_100000210904_100011995733 [1,1,0,0,0,0|2,0,0]=4 5082 B10R0.4 CCCCOCNCC(C)O 34a_100000210904_100011995733 [1,1,0,0,0,0|2,0,0]=4 5083 B10R0.4 CCCCOCOCC(C)Br 34a_100012180447_100011995733 [1,1,0,0,0,0|2,0,0]=4 5084 B10R0.4 CCCCOCOCC(C)C 34a_100000210257_100011995733 [1,1,0,0,0,0|2,0,0]=4 5085 B10R0.4 CCCCOCOCC(C)F 34a_100015925927_100011995733 [1,1,0,0,0,0|2,0,0]=4 5086 B10R0.4 CCCCOCOC[C@@H](C)Cl 34a_100016084084_100011995733 [1,1,0,0,0,0|2,0,0]=4 5087 B10R0.4 CCCCOCOC[C@@H](C)N 34a_100000737577_100011995733 [1,1,0,0,0,0|2,0,0]=4 5088 B10R0.4 CCCCOCSCC(C)C 62a_100000210624_100011995733 [1,1,0,0,0,0|2,0,0]=4 5089 B10R0.4 CCCCOCSCC(C)C 62a_100011995733_100000210760 [1,1,0,0,0,0|2,0,0]=4 5090 B10R0.4 CCCCOCSCC(C)O 62a_100011218427_100011995733 [1,1,0,0,0,0|2,0,0]=4 5091 B10R0.4 CCCCOCSCC(C)O 62a_100011995733_100011218427 [1,1,0,0,0,0|2,0,0]=4 5092 B10R0.4 CCCCOCSC[C@@H](C)O 62a_100009817552_100011995733 [1,1,0,0,0,0|2,0,0]=4 5093 B10R0.4 CCCCOCSC[C@@H](C)O 62a_100011995733_100009817552 [1,1,0,0,0,0|2,0,0]=4 5094 B10R0.4 CCCCSCCCC(C)C 62a_100000210211_100011214892 [1,1,0,0,0,0|1,1,0]=4 5095 B10R0.4 CCCCSCCCC(C)C 62a_100011214892_100000210210 [1,1,0,0,0,0|1,1,0]=4 5096 B10R0.4 CCCCSCCCC(C)O 62a_100000210211_200000718107 [1,1,0,0,0,0|1,1,0]=4 5097 B10R0.4 CCCCSCCCC(C)O 62a_200000718107_100000210210 [1,1,0,0,0,0|1,1,0]=4 5098 B10R0.4 CCCCSCCNC(C)C 2230a_100025743550_100000210206 [1,1,0,0,0,0|1,1,0]=4 5099 B10R0.4 CCCCSCCOC(=O)C 62a_100000210211_100009814007 [1,1,0,0,0,0|0,1,1]=4 5100 B10R0.4 CCCCSCCOC(=O)C 62a_100009814007_100000210210 [1,1,0,0,0,0|0,1,1]=4 5101 B10R0.4 CCCCSCCOC(C)C 34a_200000230436_100000210206 [1,1,0,0,0,0|0,1,0]=3 5102 B10R0.4 CCCCSCCOC(C)C 62a_100000210211_100000211751 [1,1,0,0,0,0|0,1,0]=3 5103 B10R0.4 CCCCSCCOC(C)C 62a_100000211751_100000210210 [1,1,0,0,0,0|0,1,0]=3 5104 B10R0.4 CCCCSCCOC(C)C 7a_200000230436_100000210206 [1,1,0,0,0,0|0,1,0]=3 5105 B10R0.4 CCCCSCCSC(C)C 62a_100000210211_100000730970 [1,1,0,0,0,0|0,2,0]=4 5106 B10R0.4 CCCCSCCSC(C)C 62a_100000730970_100000210210 [1,1,0,0,0,0|0,2,0]=4 5107 B10R0.4 CCCNCCCOC(C)C 2230a_100000737246_100000210303 [1,1,0,0,0,0|2,0,0]=4 5108 B10R0.4 CCCNCCCOC(C)C 34a_100000737246_100000210303 [1,1,0,0,0,0|2,0,0]=4 5109 B10R0.4 CCNCCCCCC(C)C 2230a_100011290863_100000210202 [1,1,0,0,0,0|2,0,0]=4 5110 B10R0.4 CCNCCCCCC(C)C 2230a_100015525214_100000210682 [1,1,0,0,0,0|2,0,0]=4 5111 B10R0.4 CCNCCCCCC(C)C 34a_100011290863_100000210202 [1,1,0,0,0,0|2,0,0]=4 5112 B10R0.4 CCOCCCCCC(C)C 34a_100011995859_100000210202 [1,1,0,0,0,0|1,0,0]=3 5113 B10R0.4 CCOCCCCCC(C)C 34a_100121572206_100000210682 [1,1,0,0,0,0|1,0,0]=3 5114 B10R0.4 CCOCCCCCC(C)C 7a_100011995859_100000210202 [1,1,0,0,0,0|1,0,0]=3 5115 B10R0.4 CCOCCCCNC(C)C 34a_100011521146_100000210202 [1,1,0,0,0,0|1,0,0]=3 5116 B10R0.4 CCOCCCCOC(=O)C 34a_100000073216_100000210202 [1,1,0,0,0,0|0,0,1]=3 5117 B10R0.4 CCOCCCCOC(=O)C 34a_100121572206_100000033659 [1,1,0,0,0,0|0,0,1]=3 5118 B10R0.4 CCOCCCCOC(=O)C 7a_100000073216_100000210202 [1,1,0,0,0,0|0,0,1]=3 5119 B10R0.4 CCOCCCCO[N+](=O)[O-] 34a_100121572206_100015694321 [1,1,0,0,0,0|2,0,0]=4 5120 B10R0.4 CCOCCCCSC(=O)C 34a_100121572206_200010402107 [1,1,0,0,0,0|0,1,1]=4 5121 B10R0.4 CCOCCCNCC(C)C 2230a_100000210953_100012232248 [1,1,0,0,0,0|2,0,0]=4 5122 B10R0.4 CCOCCCNCC(C)C 2230a_100000210961_100000210760 [1,1,0,0,0,0|2,0,0]=4 5123 B10R0.4 CCOCCCNCC(C)C 270004a_100000210961_100000210432 [1,1,0,0,0,0|2,0,0]=4 5124 B10R0.4 CCOCCCNCC(C)C 34a_100000210953_100012232248 [1,1,0,0,0,0|2,0,0]=4 5125 B10R0.4 CCOCCCNCC(C)C 34a_100000210961_100000210624 [1,1,0,0,0,0|2,0,0]=4 5126 B10R0.4 CCOCCCNCC(C)O 2230a_100000210904_100012232248 [1,1,0,0,0,0|2,0,0]=4 5127 B10R0.4 CCOCCCNCC(C)O 2230a_100000210961_100011218427 [1,1,0,0,0,0|2,0,0]=4 5128 B10R0.4 CCOCCCNCC(C)O 34a_100000210904_100012232248 [1,1,0,0,0,0|2,0,0]=4 5129 B10R0.4 CCOCCCNCC(C)O 34a_100000210961_100011218427 [1,1,0,0,0,0|2,0,0]=4 5130 B10R0.4 CCOCCCNC[C@@H](C)O 2230a_100000210961_100009817552 [1,1,0,0,0,0|2,0,0]=4 5131 B10R0.4 CCOCCCNC[C@@H](C)O 34a_100000210961_100009817552 [1,1,0,0,0,0|2,0,0]=4 5132 B10R0.4 CCOCCCOCC(C)Br 34a_100012180447_100012232248 [1,1,0,0,0,0|2,0,0]=4 5133 B10R0.4 CCOCCCOCC(C)C 34a_100000210257_100012232248 [1,1,0,0,0,0|2,0,0]=4 5134 B10R0.4 CCOCCCOCC(C)C 34a_100000757476_100000210624 [1,1,0,0,0,0|2,0,0]=4 5135 B10R0.4 CCOCCCOCC(C)C 7a_100000757476_100000210760 [1,1,0,0,0,0|2,0,0]=4 5136 B10R0.4 CCOCCCOCC(C)F 34a_100015925927_100012232248 [1,1,0,0,0,0|2,0,0]=4 5137 B10R0.4 CCOCCCOCC(C)O 34a_100000757476_100011218427 [1,1,0,0,0,0|2,0,0]=4 5138 B10R0.4 CCOCCCOCC(C)O 7a_100000757476_100011218427 [1,1,0,0,0,0|2,0,0]=4 5139 B10R0.4 CCOCCCOC[C@@H](C)Cl 34a_100016084084_100012232248 [1,1,0,0,0,0|2,0,0]=4 5140 B10R0.4 CCOCCCOC[C@@H](C)N 34a_100000737577_100012232248 [1,1,0,0,0,0|2,0,0]=4 5141 B10R0.4 CCOCCCOC[C@@H](C)O 34a_100000757476_100009817552 [1,1,0,0,0,0|2,0,0]=4 5142 B10R0.4 CCOCCCOC[C@@H](C)O 7a_100000757476_100009817552 [1,1,0,0,0,0|2,0,0]=4 5143 B10R0.4 CCOCCCSCC(C)C 62a_100000210624_100012232248 [1,1,0,0,0,0|2,0,0]=4 5144 B10R0.4 CCOCCCSCC(C)C 62a_100012232248_100000210760 [1,1,0,0,0,0|2,0,0]=4 5145 B10R0.4 CCOCCCSCC(C)O 62a_100011218427_100012232248 [1,1,0,0,0,0|2,0,0]=4 5146 B10R0.4 CCOCCCSCC(C)O 62a_100012232248_100011218427 [1,1,0,0,0,0|2,0,0]=4 5147 B10R0.4 CCOCCCSC[C@@H](C)O 62a_100009817552_100012232248 [1,1,0,0,0,0|2,0,0]=4 5148 B10R0.4 CCOCCCSC[C@@H](C)O 62a_100012232248_100009817552 [1,1,0,0,0,0|2,0,0]=4 5149 B10R0.4 CCOCCNCCC(C)C 2230a_102516460346_100000210312 [1,1,0,0,0,0|1,0,0]=3 5150 B10R0.4 CCOCCNCCC(C)C 269862a_100011200944_100000185833 [1,1,0,0,0,0|1,0,0]=3 5151 B10R0.4 CCOCCNCCC(C)C 34a_102516460346_100000210312 [1,1,0,0,0,0|1,0,0]=3 5152 B10R0.4 CCOCCNCCC(C)O 2230a_102516460346_100012276601 [1,1,0,0,0,0|1,0,0]=3 5153 B10R0.4 CCOCCNCCC(C)O 2230a_200000755665_100011215890 [1,1,0,0,0,0|1,0,0]=3 5154 B10R0.4 CCOCCNCCC(C)O 34a_102516460346_100012276601 [1,1,0,0,0,0|1,0,0]=3 5155 B10R0.4 CCOCCNCOC(=O)C 34a_102516460346_100009813279 [1,1,0,0,0,0|1,0,1]=4 5156 B10R0.4 CCOCCNCOC(C)C 2230a_102516460346_100000709892 [1,1,0,0,0,0|1,0,0]=3 5157 B10R0.4 CCOCCNCOC(C)C 34a_102516460346_100000709892 [1,1,0,0,0,0|1,0,0]=3 5158 B10R0.4 CCOCCOCC=C(C)C 34a_100000210136_100000761012 [1,1,0,0,0,0|0,0,2]=4 5159 B10R0.4 CCOCCOCC=C(C)C 34a_100000753907_100000210147 [1,1,0,0,0,0|0,0,2]=4 5160 B10R0.4 CCOCCOCC=C(C)C 7a_100000210136_100000761012 [1,1,0,0,0,0|0,0,2]=4 5161 B10R0.4 CCOCCOCCC(=O)C 1458a_100000070787_100011211534 [1,1,0,0,0,0|0,0,1]=3 5162 B10R0.4 CCOCCOCCC(=O)C 34a_100000759926_100000210147 [1,1,0,0,0,0|0,0,1]=3 5163 B10R0.4 CCOCCOCCC(=O)C 7a_100000210136_100000053229 [1,1,0,0,0,0|0,0,1]=3 5164 B10R0.4 CCOCCOCCC(=O)C 7a_100000759926_100011215890 [1,1,0,0,0,0|0,0,1]=3 5165 B10R0.4 CCOCCOCCC(=O)N 34a_100000210136_100000731001 [1,1,0,0,0,0|1,0,1]=4 5166 B10R0.4 CCOCCOCCC(=O)N 34a_100000757172_100000210147 [1,1,0,0,0,0|1,0,1]=4 5167 B10R0.4 CCOCCOCCC(=O)N 7a_100000210136_100000744528 [1,1,0,0,0,0|1,0,1]=4 5168 B10R0.4 CCOCCOCCC(=O)N 7a_100000757172_100011215890 [1,1,0,0,0,0|1,0,1]=4 5169 B10R0.4 CCOCCOCCC(C)Br 34a_100009893172_100000210147 [1,1,0,0,0,0|0,0,0]=2 5170 B10R0.4 CCOCCOCCC(C)C 34a_100000210136_100000210312 [1,1,0,0,0,0|0,0,0]=2 5171 B10R0.4 CCOCCOCCC(C)C 34a_100000210254_100000210147 [1,1,0,0,0,0|0,0,0]=2 5172 B10R0.4 CCOCCOCCC(C)C 7a_100000210136_100000210626 [1,1,0,0,0,0|0,0,0]=2 5173 B10R0.4 CCOCCOCCC(C)C 7a_100000210254_100011215890 [1,1,0,0,0,0|0,0,0]=2 5174 B10R0.4 CCOCCOCCC(C)O 34a_100000210136_100012276601 [1,1,0,0,0,0|0,0,0]=2 5175 B10R0.4 CCOCCOCCC(C)O 7a_100000210136_100012276601 [1,1,0,0,0,0|0,0,0]=2 5176 B10R0.4 CCOCCOCCC(F)F 34a_100103093639_100000210147 [1,1,0,0,0,0|1,0,0]=3 5177 B10R0.4 CCOCCOCCN(C)C 2230a_100102631434_100011211534 [1,1,0,0,0,0|1,0,0]=3 5178 B10R0.4 CCOCCOCCN(C)C 269982a_100102631434_100011211534 [1,1,0,0,0,0|1,0,0]=3 5179 B10R0.4 CCOCCOCCN(C)C 7a_100000210136_100000755713 [1,1,0,0,0,0|1,0,0]=3 5180 B10R0.4 CCOCCOCC[C@@H](C)N 34a_100000706166_100000210147 [1,1,0,0,0,0|0,0,0]=2 5181 B10R0.4 CCOCCOCOC(=O)C 34a_100000210136_100009813279 [1,1,0,0,0,0|0,0,1]=3 5182 B10R0.4 CCOCCOCOC(C)C 34a_100000210136_100000709892 [1,1,0,0,0,0|0,0,0]=2 5183 B10R0.4 CCOCCSCCC(=O)C 62a_100000053229_100011215890 [1,1,0,0,0,0|0,1,1]=4 5184 B10R0.4 CCOCCSCCC(=O)C 62a_100000210147_100000053229 [1,1,0,0,0,0|0,1,1]=4 5185 B10R0.4 CCOCCSCCC(C)C 62a_100000210147_100000210312 [1,1,0,0,0,0|0,1,0]=3 5186 B10R0.4 CCOCCSCCC(C)C 62a_100000210312_100011215890 [1,1,0,0,0,0|0,1,0]=3 5187 B10R0.4 CCOCCSCCC(C)O 62a_100000210147_100012276601 [1,1,0,0,0,0|0,1,0]=3 5188 B10R0.4 CCOCCSCCC(C)O 62a_100012276601_100011215890 [1,1,0,0,0,0|0,1,0]=3 5189 B10R0.4 CCOCCSCCN(C)C 62a_100000210147_100000755713 [1,1,0,0,0,0|1,1,0]=4 5190 B10R0.4 CCOCCSCOC(=O)C 62a_100000076356_100011215890 [1,1,0,0,0,0|0,1,1]=4 5191 B10R0.4 CCOCCSCOC(=O)C 62a_100000210147_100000076356 [1,1,0,0,0,0|0,1,1]=4 5192 B10R0.4 CCOCCSCOC(C)C 62a_100000210147_100000709892 [1,1,0,0,0,0|0,1,0]=3 5193 B10R0.4 CCOCCSCOC(C)C 62a_100000709892_100011215890 [1,1,0,0,0,0|0,1,0]=3 5194 B10R0.4 CCOCOCCOC(=O)C 34a_100121572206_100000076355 [1,1,0,0,0,0|0,0,1]=3 5195 B10R0.4 CCOCSCCCC(C)C 62a_100000739092_100011214892 [1,1,0,0,0,0|1,1,0]=4 5196 B10R0.4 CCOCSCCCC(C)C 62a_100011214892_100000739092 [1,1,0,0,0,0|1,1,0]=4 5197 B10R0.4 CCOCSCCCC(C)O 62a_100000739092_200000718107 [1,1,0,0,0,0|1,1,0]=4 5198 B10R0.4 CCOCSCCCC(C)O 62a_200000718107_100000739092 [1,1,0,0,0,0|1,1,0]=4 5199 B10R0.4 CCOCSCCOC(=O)C 62a_100000739092_100009814007 [1,1,0,0,0,0|0,1,1]=4 5200 B10R0.4 CCOCSCCOC(=O)C 62a_100009814007_100000739092 [1,1,0,0,0,0|0,1,1]=4 5201 B10R0.4 CCOCSCCOC(C)C 62a_100000211751_100000739092 [1,1,0,0,0,0|0,1,0]=3 5202 B10R0.4 CCOCSCCOC(C)C 62a_100000739092_100000211751 [1,1,0,0,0,0|0,1,0]=3 5203 B10R0.4 CCOCSCCSC(C)C 62a_100000730970_100000739092 [1,1,0,0,0,0|0,2,0]=4 5204 B10R0.4 CCOCSCCSC(C)C 62a_100000739092_100000730970 [1,1,0,0,0,0|0,2,0]=4 5205 B10R0.4 CCSCCCCCC(C)C 62a_100000210202_100000210682 [1,1,0,0,0,0|1,1,0]=4 5206 B10R0.4 CCSCCCCCC(C)C 62a_100000210682_100000210202 [1,1,0,0,0,0|1,1,0]=4 5207 B10R0.4 CCSCCCCOC(=O)C 62a_100000033659_100000210202 [1,1,0,0,0,0|0,1,1]=4 5208 B10R0.4 CCSCCCCOC(=O)C 62a_100000210202_100000033659 [1,1,0,0,0,0|0,1,1]=4 5209 B10R0.4 CCSCCNCCC(C)C 2230a_100000106463_100000210312 [1,1,0,0,0,0|1,1,0]=4 5210 B10R0.4 CCSCCNCCC(C)C 269862a_100000106463_100000185833 [1,1,0,0,0,0|1,1,0]=4 5211 B10R0.4 CCSCCNCCC(C)O 2230a_100000106463_100012276601 [1,1,0,0,0,0|1,1,0]=4 5212 B10R0.4 CCSCCNCCC(C)O 2230a_200000755665_100000757381 [1,1,0,0,0,0|1,1,0]=4 5213 B10R0.4 CCSCCNCOC(C)C 2230a_100000106463_100000709892 [1,1,0,0,0,0|1,1,0]=4 5214 B10R0.4 CCSCCOCCC(=O)C 34a_100000759926_100000757381 [1,1,0,0,0,0|0,1,1]=4 5215 B10R0.4 CCSCCOCCC(=O)C 7a_100000212035_100000053229 [1,1,0,0,0,0|0,1,1]=4 5216 B10R0.4 CCSCCOCCC(=O)C 7a_100000759926_100000757381 [1,1,0,0,0,0|0,1,1]=4 5217 B10R0.4 CCSCCOCCC(C)Br 34a_100009893172_100000757381 [1,1,0,0,0,0|0,1,0]=3 5218 B10R0.4 CCSCCOCCC(C)C 34a_100000210254_100000757381 [1,1,0,0,0,0|0,1,0]=3 5219 B10R0.4 CCSCCOCCC(C)C 34a_100000212035_100000210312 [1,1,0,0,0,0|0,1,0]=3 5220 B10R0.4 CCSCCOCCC(C)C 7a_100000210254_100000757381 [1,1,0,0,0,0|0,1,0]=3 5221 B10R0.4 CCSCCOCCC(C)C 7a_100000212035_100000210626 [1,1,0,0,0,0|0,1,0]=3 5222 B10R0.4 CCSCCOCCC(C)O 34a_100000212035_100012276601 [1,1,0,0,0,0|0,1,0]=3 5223 B10R0.4 CCSCCOCCC(C)O 7a_100000212035_100012276601 [1,1,0,0,0,0|0,1,0]=3 5224 B10R0.4 CCSCCOCCC(F)F 34a_100103093639_100000757381 [1,1,0,0,0,0|1,1,0]=4 5225 B10R0.4 CCSCCOCCN(C)C 7a_100000212035_100000755713 [1,1,0,0,0,0|1,1,0]=4 5226 B10R0.4 CCSCCOCC[C@@H](C)N 34a_100000706166_100000757381 [1,1,0,0,0,0|0,1,0]=3 5227 B10R0.4 CCSCCOCOC(=O)C 34a_100000212035_100009813279 [1,1,0,0,0,0|0,1,1]=4 5228 B10R0.4 CCSCCOCOC(C)C 34a_100000212035_100000709892 [1,1,0,0,0,0|0,1,0]=3 5229 B10R0.4 CCSCCSCCC(C)C 62a_100000210312_100000757381 [1,1,0,0,0,0|0,2,0]=4 5230 B10R0.4 CCSCCSCCC(C)C 62a_100000757381_100000210312 [1,1,0,0,0,0|0,2,0]=4 5231 B10R0.4 CCSCCSCCC(C)O 62a_100000757381_100012276601 [1,1,0,0,0,0|0,2,0]=4 5232 B10R0.4 CCSCCSCCC(C)O 62a_100012276601_100000757381 [1,1,0,0,0,0|0,2,0]=4 5233 B10R0.4 CCSCCSCOC(C)C 62a_100000709892_100000757381 [1,1,0,0,0,0|0,2,0]=4 5234 B10R0.4 CCSCCSCOC(C)C 62a_100000757381_100000709892 [1,1,0,0,0,0|0,2,0]=4 5235 B10R0.4 CCSCOCCOC(=O)C 62a_100000076355_100000210202 [1,1,0,0,0,0|0,1,1]=4 5236 B10R0.4 CCSCOCCOC(=O)C 62a_100000210202_100000076355 [1,1,0,0,0,0|0,1,1]=4 5237 B10R0.4 CNCCCCCOC(C)C 34a_100000722520_100000210206 [1,1,0,0,0,0|2,0,0]=4 5238 B10R0.4 CNCCCOCCC(C)C 34a_100000213112_100000210312 [1,1,0,0,0,0|2,0,0]=4 5239 B10R0.4 CNCCCOCCC(C)O 34a_100000213112_100012276601 [1,1,0,0,0,0|2,0,0]=4 5240 B10R0.4 CNCCCOCOC(C)C 34a_100000213112_100000709892 [1,1,0,0,0,0|2,0,0]=4 5241 B10R0.4 CNCCOCCOC(=O)C 2230a_106832991635_200000083610 [1,1,0,0,0,0|1,0,1]=4 5242 B10R0.4 CNCCOCCOC(=O)C 34a_100102657272_200000083610 [1,1,0,0,0,0|1,0,1]=4 5243 B10R0.4 CNCCOCCOC(=O)C 7a_106832991635_200000083610 [1,1,0,0,0,0|1,0,1]=4 5244 B10R0.4 CNCCOCCOC(C)C 34a_100000228057_100000210206 [1,1,0,0,0,0|1,0,0]=3 5245 B10R0.4 COCCCCCNC(C)C 2230a_100000747528_100000210206 [1,1,0,0,0,0|2,0,0]=4 5246 B10R0.4 COCCCCCNC(C)C 34a_100000747528_100000210206 [1,1,0,0,0,0|2,0,0]=4 5247 B10R0.4 COCCCCCNC(C)C 34a_100011629493_200000210301 [1,1,0,0,0,0|2,0,0]=4 5248 B10R0.4 COCCCCCOC(=O)C 34a_100138415774_100000033007 [1,1,0,0,0,0|1,0,1]=4 5249 B10R0.4 COCCCNCOC(C)C 34a_100150723488_100000709892 [1,1,0,0,0,0|2,0,0]=4 5250 B10R0.4 COCCCOCCC(C)Br 34a_100009893172_100000740836 [1,1,0,0,0,0|2,0,0]=4 5251 B10R0.4 COCCCOCCC(C)C 34a_100000210254_100000740836 [1,1,0,0,0,0|2,0,0]=4 5252 B10R0.4 COCCCOCCC(C)C 34a_100000740835_100000210312 [1,1,0,0,0,0|2,0,0]=4 5253 B10R0.4 COCCCOCCC(C)C 7a_100000210254_100000740836 [1,1,0,0,0,0|2,0,0]=4 5254 B10R0.4 COCCCOCCC(C)O 34a_100000740835_100012276601 [1,1,0,0,0,0|2,0,0]=4 5255 B10R0.4 COCCCOCC[C@@H](C)N 34a_100000706166_100000740836 [1,1,0,0,0,0|2,0,0]=4 5256 B10R0.4 COCCCOCOC(C)C 34a_100000740835_100000709892 [1,1,0,0,0,0|2,0,0]=4 5257 B10R0.4 COCCCSCOC(C)C 62a_100000709357_100000709892 [1,1,0,0,0,0|2,0,0]=4 5258 B10R0.4 COCCCSCOC(C)C 62a_100000709892_100000709357 [1,1,0,0,0,0|2,0,0]=4 5259 B10R0.4 COCCNCCCC(C)C 2230a_100000209980_100011214892 [1,1,0,0,0,0|2,0,0]=4 5260 B10R0.4 COCCNCCCC(C)C 2230a_200000737386_100011201679 [1,1,0,0,0,0|2,0,0]=4 5261 B10R0.4 COCCNCCCC(C)C 34a_200000737386_100011201679 [1,1,0,0,0,0|2,0,0]=4 5262 B10R0.4 COCCNCCCC(C)O 2230a_100000209980_200000718107 [1,1,0,0,0,0|2,0,0]=4 5263 B10R0.4 COCCNCCOC(C)C 2230a_100000209980_100000211751 [1,1,0,0,0,0|1,0,0]=3 5264 B10R0.4 COCCNCCOC(C)C 2230a_100000701111_100011201679 [1,1,0,0,0,0|1,0,0]=3 5265 B10R0.4 COCCNCCOC(C)C 34a_100000701111_100011201679 [1,1,0,0,0,0|1,0,0]=3 5266 B10R0.4 COCCNCCSC(C)C 2230a_100000209980_100000730970 [1,1,0,0,0,0|1,1,0]=4 5267 B10R0.4 COCCNCCSC(C)C 2230a_100000731138_100011201679 [1,1,0,0,0,0|1,1,0]=4 5268 B10R0.4 COCCNCCSC(C)C 34a_100000731138_100011201679 [1,1,0,0,0,0|1,1,0]=4 5269 B10R0.4 COCCOCCC=C(C)C 34a_100000210237_100011217483 [1,1,0,0,0,0|1,0,1]=4 5270 B10R0.4 COCCOCCCC(=O)C 1458a_100000070787_100011216529 [1,1,0,0,0,0|1,0,1]=4 5271 B10R0.4 COCCOCCCC(=O)C 34a_100000210237_100000685027 [1,1,0,0,0,0|1,0,1]=4 5272 B10R0.4 COCCOCCCC(=O)C 34a_100000759063_100011201679 [1,1,0,0,0,0|1,0,1]=4 5273 B10R0.4 COCCOCCCC(=O)C 7a_100000759063_100000233755 [1,1,0,0,0,0|1,0,1]=4 5274 B10R0.4 COCCOCCCC(C)C 34a_100000210237_100011214892 [1,1,0,0,0,0|1,0,0]=3 5275 B10R0.4 COCCOCCCC(C)C 34a_100000210774_100011201679 [1,1,0,0,0,0|1,0,0]=3 5276 B10R0.4 COCCOCCCC(C)C 7a_100000210774_100000233755 [1,1,0,0,0,0|1,0,0]=3 5277 B10R0.4 COCCOCCCC(C)O 34a_100000210237_200000718107 [1,1,0,0,0,0|1,0,0]=3 5278 B10R0.4 COCCOCCCN(C)C 2230a_100102631434_100011216529 [1,1,0,0,0,0|2,0,0]=4 5279 B10R0.4 COCCOCCCN(C)C 269982a_100102631434_100011216529 [1,1,0,0,0,0|2,0,0]=4 5280 B10R0.4 COCCOCCNC(=O)C 11a_100000745349_100015343762 [1,1,0,0,0,0|1,0,1]=4 5281 B10R0.4 COCCOCCNC(=O)C 1626a_100000745349_100015343762 [1,1,0,0,0,0|1,0,1]=4 5282 B10R0.4 COCCOCCNC(=O)C 240690a_100000745349_100015343762 [1,1,0,0,0,0|1,0,1]=4 5283 B10R0.4 COCCOCCNC(=O)C 34a_100000158858_100011201679 [1,1,0,0,0,0|1,0,1]=4 5284 B10R0.4 COCCOCCNC(=O)C 527a_100000745349_100103153847 [1,1,0,0,0,0|1,0,1]=4 5285 B10R0.4 COCCOCCNC(C)C 2230a_100000745349_100000210206 [1,1,0,0,0,0|1,0,0]=3 5286 B10R0.4 COCCOCCNC(C)C 2230a_100138425928_100000695917 [1,1,0,0,0,0|1,0,0]=3 5287 B10R0.4 COCCOCCNC(C)C 34a_100000224655_100011201679 [1,1,0,0,0,0|1,0,0]=3 5288 B10R0.4 COCCOCCNC(C)C 34a_100000745349_100000210206 [1,1,0,0,0,0|1,0,0]=3 5289 B10R0.4 COCCOCCNC(C)C 34a_100138425928_100000695917 [1,1,0,0,0,0|1,0,0]=3 5290 B10R0.4 COCCOCCOC(=O)C 34a_100000210237_100009814007 [1,1,0,0,0,0|0,0,1]=3 5291 B10R0.4 COCCOCCOC(=O)C 34a_100138415774_200000083610 [1,1,0,0,0,0|0,0,1]=3 5292 B10R0.4 COCCOCCOC(=O)N 34a_100000210237_200011214921 [1,1,0,0,0,0|1,0,1]=4 5293 B10R0.4 COCCOCCOC(=O)N 7a_100000766696_100000233755 [1,1,0,0,0,0|1,0,1]=4 5294 B10R0.4 COCCOCCOC(C)C 34a_100000210237_100000211751 [1,1,0,0,0,0|0,0,0]=2 5295 B10R0.4 COCCOCCOC(C)C 34a_100000211219_100011201679 [1,1,0,0,0,0|0,0,0]=2 5296 B10R0.4 COCCOCCOC(C)C 34a_100000212225_100000695917 [1,1,0,0,0,0|0,0,0]=2 5297 B10R0.4 COCCOCCOC(C)C 34a_100011215163_100000210206 [1,1,0,0,0,0|0,0,0]=2 5298 B10R0.4 COCCOCCOC(C)C 7a_100000211219_100000233755 [1,1,0,0,0,0|0,0,0]=2 5299 B10R0.4 COCCOCCOC(C)C 7a_100011215163_100000210206 [1,1,0,0,0,0|0,0,0]=2 5300 B10R0.4 COCCOCCSC(C)C 34a_100000210237_100000730970 [1,1,0,0,0,0|0,1,0]=3 5301 B10R0.4 COCCOCCSC(C)C 34a_200011212901_100011201679 [1,1,0,0,0,0|0,1,0]=3 5302 B10R0.4 COCCOCCSC(C)C 62a_100000210206_100000695917 [1,1,0,0,0,0|0,1,0]=3 5303 B10R0.4 COCCOCCSC(C)C 62a_100000695917_100000210206 [1,1,0,0,0,0|0,1,0]=3 5304 B10R0.4 COCCOCCSC(C)C 7a_200011212901_100000233755 [1,1,0,0,0,0|0,1,0]=3 5305 B10R0.4 COCCOCNCC(C)C 2230a_100000210953_100000231047 [1,1,0,0,0,0|2,0,0]=4 5306 B10R0.4 COCCOCNCC(C)O 2230a_100000210904_100000231047 [1,1,0,0,0,0|2,0,0]=4 5307 B10R0.4 COCCOCSCC(C)C 62a_100000210624_100000231047 [1,1,0,0,0,0|2,0,0]=4 5308 B10R0.4 COCCOCSCC(C)C 62a_100000231047_100000210760 [1,1,0,0,0,0|2,0,0]=4 5309 B10R0.4 COCCOCSCC(C)O 62a_100000231047_100011218427 [1,1,0,0,0,0|2,0,0]=4 5310 B10R0.4 COCCOCSCC(C)O 62a_100011218427_100000231047 [1,1,0,0,0,0|2,0,0]=4 5311 B10R0.4 COCCOCSC[C@@H](C)O 62a_100000231047_100009817552 [1,1,0,0,0,0|2,0,0]=4 5312 B10R0.4 COCCOCSC[C@@H](C)O 62a_100009817552_100000231047 [1,1,0,0,0,0|2,0,0]=4 5313 B10R0.4 COCCSCCCC(C)C 62a_100000233755_100011214892 [1,1,0,0,0,0|1,1,0]=4 5314 B10R0.4 COCCSCCCC(C)C 62a_100011214892_100000233755 [1,1,0,0,0,0|1,1,0]=4 5315 B10R0.4 COCCSCCCC(C)O 62a_100000233755_200000718107 [1,1,0,0,0,0|1,1,0]=4 5316 B10R0.4 COCCSCCCC(C)O 62a_200000718107_100000233755 [1,1,0,0,0,0|1,1,0]=4 5317 B10R0.4 COCCSCCOC(=O)C 62a_100000233755_100009814007 [1,1,0,0,0,0|0,1,1]=4 5318 B10R0.4 COCCSCCOC(=O)C 62a_100009814007_100000233755 [1,1,0,0,0,0|0,1,1]=4 5319 B10R0.4 COCCSCCOC(C)C 62a_100000211751_100000233755 [1,1,0,0,0,0|0,1,0]=3 5320 B10R0.4 COCCSCCOC(C)C 62a_100000233755_100000211751 [1,1,0,0,0,0|0,1,0]=3 5321 B10R0.4 COCCSCCSC(C)C 62a_100000233755_100000730970 [1,1,0,0,0,0|0,2,0]=4 5322 B10R0.4 COCCSCCSC(C)C 62a_100000730970_100000233755 [1,1,0,0,0,0|0,2,0]=4 5323 B10R0.4 COCNCCCOC(C)C 2230a_100000737246_100000766300 [1,1,0,0,0,0|2,0,0]=4 5324 B10R0.4 CSCCCOCCC(C)C 34a_100000690336_100000210312 [1,1,0,0,0,0|2,0,0]=4 5325 B10R0.4 CSCCCOCCC(C)C 7a_100000690336_100000210626 [1,1,0,0,0,0|2,0,0]=4 5326 B10R0.4 CSCCCOCCC(C)O 34a_100000690336_100012276601 [1,1,0,0,0,0|2,0,0]=4 5327 B10R0.4 CSCCCOCCC(C)O 7a_100000690336_100012276601 [1,1,0,0,0,0|2,0,0]=4 5328 B10R0.4 CSCCCOCOC(C)C 34a_100000690336_100000709892 [1,1,0,0,0,0|2,0,0]=4 5329 B10R0.4 CSCCNCCOC(C)C 2230a_100000701111_100000751147 [1,1,0,0,0,0|1,1,0]=4 5330 B10R0.4 CSCCNCCOC(C)C 2230a_100020590264_100000211751 [1,1,0,0,0,0|1,1,0]=4 5331 B10R0.4 CSCCNCCOC(C)C 34a_100000701111_100000212216 [1,1,0,0,0,0|1,1,0]=4 5332 B10R0.4 CSCCOCCCC(C)C 34a_100000210774_100000212216 [1,1,0,0,0,0|1,1,0]=4 5333 B10R0.4 CSCCOCCCC(C)C 34a_100000230434_100011214892 [1,1,0,0,0,0|1,1,0]=4 5334 B10R0.4 CSCCOCCCC(C)C 7a_100000210774_100000212216 [1,1,0,0,0,0|1,1,0]=4 5335 B10R0.4 CSCCOCCCC(C)C 7a_100000230434_100011214892 [1,1,0,0,0,0|1,1,0]=4 5336 B10R0.4 CSCCOCCCC(C)O 34a_100000230434_200000718107 [1,1,0,0,0,0|1,1,0]=4 5337 B10R0.4 CSCCOCCCC(C)O 7a_100000230434_200000718107 [1,1,0,0,0,0|1,1,0]=4 5338 B10R0.4 CSCCOCCNC(C)C 34a_100000224655_100000212216 [1,1,0,0,0,0|1,1,0]=4 5339 B10R0.4 CSCCOCCOC(=O)C 34a_100000230434_100009814007 [1,1,0,0,0,0|0,1,1]=4 5340 B10R0.4 CSCCOCCOC(=O)C 62a_200000083610_200000210301 [1,1,0,0,0,0|0,1,1]=4 5341 B10R0.4 CSCCOCCOC(=O)C 62a_200000210301_200000083610 [1,1,0,0,0,0|0,1,1]=4 5342 B10R0.4 CSCCOCCOC(=O)C 7a_100000230434_100009814007 [1,1,0,0,0,0|0,1,1]=4 5343 B10R0.4 CSCCOCCOC(C)C 34a_100000211219_100000212216 [1,1,0,0,0,0|0,1,0]=3 5344 B10R0.4 CSCCOCCOC(C)C 34a_100000230434_100000211751 [1,1,0,0,0,0|0,1,0]=3 5345 B10R0.4 CSCCOCCOC(C)C 7a_100000211219_100000212216 [1,1,0,0,0,0|0,1,0]=3 5346 B10R0.4 CSCCOCCOC(C)C 7a_100000230434_100000211751 [1,1,0,0,0,0|0,1,0]=3 5347 B10R0.4 CSCCOCCSC(C)C 34a_100000230434_100000730970 [1,1,0,0,0,0|0,2,0]=4 5348 B10R0.4 CSCCOCCSC(C)C 34a_200011212901_100000212216 [1,1,0,0,0,0|0,2,0]=4 5349 B10R0.4 CSCCOCCSC(C)C 7a_100000230434_100000730970 [1,1,0,0,0,0|0,2,0]=4 5350 B10R0.4 CSCCOCCSC(C)C 7a_200011212901_100000212216 [1,1,0,0,0,0|0,2,0]=4 5351 B10R0.4 CSCCSCCOC(C)C 62a_100000211751_100000751147 [1,1,0,0,0,0|0,2,0]=4 5352 B10R0.4 CSCCSCCOC(C)C 62a_100000212216_100000211751 [1,1,0,0,0,0|0,2,0]=4 5353 B10R0.4 C[C@@H](N)CCOCCCCF 34a_100000706166_100000729493 [1,1,0,0,0,0|2,0,0]=4 5354 B10R0.4 C[C@@H](N)CCOCCCCO 34a_100000706166_100011216708 [1,1,0,0,0,0|2,0,0]=4 5355 B10R0.74 C/C=C/CCOCC(C)CC 34a_100016278192_100000748023 [1,1,0,0,0,0|1,0,1]=4 5356 B10R0.74 C/C=C/CCOCC(O)CC 34a_100016278192_100011218378 [1,1,0,0,0,0|1,0,1]=4 5357 B10R0.74 C/C=C/CCOC[C@@H](C)CC 34a_100016278192_100009816398 [1,1,0,0,0,0|1,0,1]=4 5358 B10R0.74 C=CC(C)COCCOCC 34a_100011215527_100000210147 [1,1,0,0,0,0|0,0,2]=4 5359 B10R0.74 C=CC(C)COCCOCC 7a_100011215527_100011215890 [1,1,0,0,0,0|0,0,2]=4 5360 B10R0.74 C=CC(O)COCCOCC 34a_100000210136_100000730141 [1,1,0,0,0,0|0,0,2]=4 5361 B10R0.74 C=CC(O)COCCOCC 7a_100000210136_100000730141 [1,1,0,0,0,0|0,0,2]=4 5362 B10R0.74 C=COCCOCC(C)CC 34a_100000033082_100000748023 [1,1,0,0,0,0|0,0,2]=4 5363 B10R0.74 C=COCCOCC(C)OC 34a_100000690652_100000039644 [1,1,0,0,0,0|0,0,2]=4 5364 B10R0.74 C=COCCOCC(O)CC 34a_100000033082_100011218378 [1,1,0,0,0,0|0,0,2]=4 5365 B10R0.74 C=COCCOC[C@@H](C)CC 34a_100000033082_100009816398 [1,1,0,0,0,0|0,0,2]=4 5366 B10R0.74 C=COCCOC[C@@H](C)CC 7a_100009816381_100000039644 [1,1,0,0,0,0|0,0,2]=4 5367 B10R0.74 C=C[C@H](N)COCCOCC 34a_100016989147_100000210147 [1,1,0,0,0,0|0,0,2]=4 5368 B10R0.74 CC#CCCOCC(C)CC 34a_100000750427_100000748023 [1,1,0,0,0,0|1,0,1]=4 5369 B10R0.74 CC#CCCOCC(O)CC 34a_100000750427_100011218378 [1,1,0,0,0,0|1,0,1]=4 5370 B10R0.74 CC#CCCOC[C@@H](C)CC 34a_100000750427_100009816398 [1,1,0,0,0,0|1,0,1]=4 5371 B10R0.74 CC/C=C\COCC(C)CC 34a_100016268518_100000748023 [1,1,0,0,0,0|1,0,1]=4 5372 B10R0.74 CC/C=C\COCC(C)OC 34a_100000690652_100103147603 [1,1,0,0,0,0|1,0,1]=4 5373 B10R0.74 CC/C=C\COCC(O)CC 34a_100016268518_100011218378 [1,1,0,0,0,0|1,0,1]=4 5374 B10R0.74 CC/C=C\COC[C@@H](C)CC 34a_100016268518_100009816398 [1,1,0,0,0,0|1,0,1]=4 5375 B10R0.74 CC/C=C\COC[C@@H](C)CC 7a_100009816381_100103147603 [1,1,0,0,0,0|1,0,1]=4 5376 B10R0.74 CCC#CCOCC(C)CC 34a_100000032950_100000748023 [1,1,0,0,0,0|1,0,1]=4 5377 B10R0.74 CCC#CCOCC(C)OC 34a_100000690652_100009813939 [1,1,0,0,0,0|1,0,1]=4 5378 B10R0.74 CCC#CCOCC(O)CC 34a_100000032950_100011218378 [1,1,0,0,0,0|1,0,1]=4 5379 B10R0.74 CCC#CCOC[C@@H](C)CC 34a_100000032950_100009816398 [1,1,0,0,0,0|1,0,1]=4 5380 B10R0.74 CCC#CCOC[C@@H](C)CC 7a_100009816381_100009813939 [1,1,0,0,0,0|1,0,1]=4 5381 B10R0.74 CCC(=O)CCCCCOC 1458a_100011935119_100000210202 [1,1,0,0,0,0|2,0,0]=4 5382 B10R0.74 CCC(=O)CCOCCOC 1458a_100000210414_100000695917 [1,1,0,0,0,0|1,0,0]=3 5383 B10R0.74 CCC(=O)CCOCCOC 1458a_100000745395_100000210202 [1,1,0,0,0,0|1,0,0]=3 5384 B10R0.74 CCC(C)CCCCCOC 7a_200000035636_200000210301 [1,1,0,0,0,0|2,0,0]=4 5385 B10R0.74 CCC(C)CCCCCO[13CH3] 7a_200000035636_200025704644 [1,1,0,0,0,0|2,0,0]=4 5386 B10R0.74 CCC(C)CCNCCOC 2230a_100020591266_100011201679 [1,1,0,0,0,0|2,0,0]=4 5387 B10R0.74 CCC(C)CCOCCCF 7a_100011215188_100011934791 [1,1,0,0,0,0|2,0,0]=4 5388 B10R0.74 CCC(C)CCOCCCO 7a_100011215188_100011215043 [1,1,0,0,0,0|2,0,0]=4 5389 B10R0.74 CCC(C)CCOCCOC 7a_100011215188_100000233755 [1,1,0,0,0,0|1,0,0]=3 5390 B10R0.74 CCC(C)CCOCCSC 7a_100011215188_100000212216 [1,1,0,0,0,0|1,1,0]=4 5391 B10R0.74 CCC(C)COCCCCBr 34a_100011216708_100000748023 [1,1,0,0,0,0|2,0,0]=4 5392 B10R0.74 CCC(C)COCCCCCl 34a_100000210776_100000748023 [1,1,0,0,0,0|2,0,0]=4 5393 B10R0.74 CCC(C)COCCCCCl 7a_100000210776_100000748023 [1,1,0,0,0,0|2,0,0]=4 5394 B10R0.74 CCC(C)COCCCCF 34a_100011995726_100000748023 [1,1,0,0,0,0|2,0,0]=4 5395 B10R0.74 CCC(C)COCCCCF 7a_100011995726_100000748023 [1,1,0,0,0,0|2,0,0]=4 5396 B10R0.74 CCC(C)COCCCCI 34a_200012148704_100000748023 [1,1,0,0,0,0|2,0,0]=4 5397 B10R0.74 CCC(C)COCCCCN 34a_100000750430_100000748023 [1,1,0,0,0,0|2,0,0]=4 5398 B10R0.74 CCC(C)COCCCNC 34a_100000213112_100000748023 [1,1,0,0,0,0|2,0,0]=4 5399 B10R0.74 CCC(C)COCCCOC 34a_100000740835_100000748023 [1,1,0,0,0,0|2,0,0]=4 5400 B10R0.74 CCC(C)COCCCSC 34a_100000690336_100000748023 [1,1,0,0,0,0|2,0,0]=4 5401 B10R0.74 CCC(C)COCCCSC 7a_100000690336_100000748023 [1,1,0,0,0,0|2,0,0]=4 5402 B10R0.74 CCC(C)NCOCCOC 2230a_100000209981_100000231047 [1,1,0,0,0,0|2,0,0]=4 5403 B10R0.74 CCC(C)SCOCCOC 62a_100000231047_100000758301 [1,1,0,0,0,0|2,0,0]=4 5404 B10R0.74 CCC(C)SCOCCOC 62a_100000758301_100000231047 [1,1,0,0,0,0|2,0,0]=4 5405 B10R0.74 CCC(O)COCCCCBr 34a_100011216708_100011218378 [1,1,0,0,0,0|2,0,0]=4 5406 B10R0.74 CCC(O)COCCCCCl 34a_100000210776_100011218378 [1,1,0,0,0,0|2,0,0]=4 5407 B10R0.74 CCC(O)COCCCCCl 7a_100000210776_100011218378 [1,1,0,0,0,0|2,0,0]=4 5408 B10R0.74 CCC(O)COCCCCF 34a_100011995726_100011218378 [1,1,0,0,0,0|2,0,0]=4 5409 B10R0.74 CCC(O)COCCCCF 7a_100011995726_100011218378 [1,1,0,0,0,0|2,0,0]=4 5410 B10R0.74 CCC(O)COCCCCI 34a_200012148704_100011218378 [1,1,0,0,0,0|2,0,0]=4 5411 B10R0.74 CCC(O)COCCCCN 34a_100000750430_100011218378 [1,1,0,0,0,0|2,0,0]=4 5412 B10R0.74 CCC(O)COCCCNC 34a_100000213112_100011218378 [1,1,0,0,0,0|2,0,0]=4 5413 B10R0.74 CCC(O)COCCCOC 34a_100000740835_100011218378 [1,1,0,0,0,0|2,0,0]=4 5414 B10R0.74 CCC(O)COCCCSC 34a_100000690336_100011218378 [1,1,0,0,0,0|2,0,0]=4 5415 B10R0.74 CCC(O)COCCCSC 7a_100000690336_100011218378 [1,1,0,0,0,0|2,0,0]=4 5416 B10R0.74 CCCCCCCC(=O)CC 1458a_100000210414_100000210614 [1,1,0,0,0,0|2,0,0]=4 5417 B10R0.74 CCCCCCCC(=O)CC 1458a_100000211969_100000210202 [1,1,0,0,0,0|2,0,0]=4 5418 B10R0.74 CCCCCCCC(C)OC 34a_100138415774_200011218727 [1,1,0,0,0,0|2,0,0]=4 5419 B10R0.74 CCCCCCCC(C)OC 34a_200011215852_200000210301 [1,1,0,0,0,0|2,0,0]=4 5420 B10R0.74 CCCCCCCC(C)OC 7a_200011215852_200000210301 [1,1,0,0,0,0|2,0,0]=4 5421 B10R0.74 CCCCCCCC(C)O[13CH3] 34a_200011215852_200025704644 [1,1,0,0,0,0|2,0,0]=4 5422 B10R0.74 CCCCCCCC(C)O[13CH3] 7a_200011215852_200025704644 [1,1,0,0,0,0|2,0,0]=4 5423 B10R0.74 CCCCCCCN(C)CC 2230a_100000225621_100000210681 [1,1,0,0,0,0|2,0,0]=4 5424 B10R0.74 CCCCCCCN(C)CC 2230a_100000228206_100000210202 [1,1,0,0,0,0|2,0,0]=4 5425 B10R0.74 CCCCCCCN(C)CC 2230a_100000228213_200000210301 [1,1,0,0,0,0|2,0,0]=4 5426 B10R0.74 CCCCCCCN(C)CC 269982a_100000225621_100000210681 [1,1,0,0,0,0|2,0,0]=4 5427 B10R0.74 CCCCCCCN(C)CC 269982a_100000228206_100000204670 [1,1,0,0,0,0|2,0,0]=4 5428 B10R0.74 CCCCCCCN(C)CC 269982a_100000228213_200000210301 [1,1,0,0,0,0|2,0,0]=4 5429 B10R0.74 CCCCCCCN([13CH3])CC 2230a_100000228213_200025704644 [1,1,0,0,0,0|2,0,0]=4 5430 B10R0.74 CCCCCCCN([13CH3])CC 269982a_100000228213_200025704644 [1,1,0,0,0,0|2,0,0]=4 5431 B10R0.74 CCCCCNCC(C)CC 2230a_100000209983_100000748023 [1,1,0,0,0,0|2,0,0]=4 5432 B10R0.74 CCCCCNCC(C)CC 2230a_100020588543_100000210326 [1,1,0,0,0,0|2,0,0]=4 5433 B10R0.74 CCCCCNCC(C)CC 270004a_100000209983_100000243153 [1,1,0,0,0,0|2,0,0]=4 5434 B10R0.74 CCCCCNCC(O)CC 2230a_100000209983_100011218378 [1,1,0,0,0,0|2,0,0]=4 5435 B10R0.74 CCCCCNCC(O)CC 2230a_100011218483_100000210326 [1,1,0,0,0,0|2,0,0]=4 5436 B10R0.74 CCCCCNC[C@@H](C)CC 2230a_100000209983_100009816398 [1,1,0,0,0,0|2,0,0]=4 5437 B10R0.74 CCCCCNC[C@@H](C)OC 2230a_100020591295_100000210326 [1,1,0,0,0,0|2,0,0]=4 5438 B10R0.74 CCCCCOCC(=O)CC 34a_100000725409_100000718602 [1,1,0,0,0,0|1,0,1]=4 5439 B10R0.74 CCCCCOCC(=O)CC 7a_100000210253_100000747405 [1,1,0,0,0,0|1,0,1]=4 5440 B10R0.74 CCCCCOCC(=O)OC 34a_100000210253_100000747449 [1,1,0,0,0,0|1,0,1]=4 5441 B10R0.74 CCCCCOCC(=O)OC 7a_100000210253_100000747449 [1,1,0,0,0,0|1,0,1]=4 5442 B10R0.74 CCCCCOCC(C)CC 34a_100000210253_100000748023 [1,1,0,0,0,0|1,0,0]=3 5443 B10R0.74 CCCCCOCC(C)CC 7a_100000210253_100000748023 [1,1,0,0,0,0|1,0,0]=3 5444 B10R0.74 CCCCCOCC(C)CN 34a_100000744482_100000718602 [1,1,0,0,0,0|2,0,0]=4 5445 B10R0.74 CCCCCOCC(C)OC 34a_100000690652_100000718602 [1,1,0,0,0,0|1,0,0]=3 5446 B10R0.74 CCCCCOCC(Cl)CCl 34a_100000033668_100000718602 [1,1,0,0,0,0|2,0,0]=4 5447 B10R0.74 CCCCCOCC(O)CC 34a_100000210253_100011218378 [1,1,0,0,0,0|1,0,0]=3 5448 B10R0.74 CCCCCOCC(O)CC 7a_100000210253_100011218378 [1,1,0,0,0,0|1,0,0]=3 5449 B10R0.74 CCCCCOCC(O)CO 34a_100000210253_100011219619 [1,1,0,0,0,0|2,0,0]=4 5450 B10R0.74 CCCCCOCC(O)CO 7a_100000210253_100011219619 [1,1,0,0,0,0|2,0,0]=4 5451 B10R0.74 CCCCCOC[C@@H](C)CC 34a_100000210253_100009816398 [1,1,0,0,0,0|1,0,0]=3 5452 B10R0.74 CCCCCOC[C@@H](C)CC 7a_100000210253_100009816398 [1,1,0,0,0,0|1,0,0]=3 5453 B10R0.74 CCCCCOC[C@@H](C)CC 7a_100009816381_100000210326 [1,1,0,0,0,0|1,0,0]=3 5454 B10R0.74 CCCCCOC[C@@H](C)CO 34a_100000210253_100000059175 [1,1,0,0,0,0|2,0,0]=4 5455 B10R0.74 CCCCCOC[C@@H](C)CO 7a_100000210253_100000059175 [1,1,0,0,0,0|2,0,0]=4 5456 B10R0.74 CCCCCOC[C@@H](O)CF 34a_100000210253_100015614560 [1,1,0,0,0,0|2,0,0]=4 5457 B10R0.74 CCCCCOC[C@@H](O)CF 7a_100000210253_100015614560 [1,1,0,0,0,0|2,0,0]=4 5458 B10R0.74 CCCCCOC[C@@H](O)CO 34a_100000210253_100009815848 [1,1,0,0,0,0|2,0,0]=4 5459 B10R0.74 CCCCCOC[C@@H](O)CO 7a_100000210253_100009815848 [1,1,0,0,0,0|2,0,0]=4 5460 B10R0.74 CCCCCOC[C@H](F)CN 34a_100015665980_100000718602 [1,1,0,0,0,0|2,0,0]=4 5461 B10R0.74 CCCCCSCC(C)CC 62a_100000210326_100000748023 [1,1,0,0,0,0|1,1,0]=4 5462 B10R0.74 CCCCCSCC(C)CC 62a_100000748023_100000210326 [1,1,0,0,0,0|1,1,0]=4 5463 B10R0.74 CCCCCSCC(O)CC 62a_100000210326_100011218378 [1,1,0,0,0,0|1,1,0]=4 5464 B10R0.74 CCCCCSCC(O)CC 62a_100011218378_100000210326 [1,1,0,0,0,0|1,1,0]=4 5465 B10R0.74 CCCCCSC[C@@H](C)CC 62a_100000210326_100009816398 [1,1,0,0,0,0|1,1,0]=4 5466 B10R0.74 CCCCCSC[C@@H](C)CC 62a_100009816398_100000210326 [1,1,0,0,0,0|1,1,0]=4 5467 B10R0.74 CCCCNCCC(C)CC 2230a_100020591266_100000210211 [1,1,0,0,0,0|2,0,0]=4 5468 B10R0.74 CCCCOCCC(=O)CC 1458a_100000210414_100000743108 [1,1,0,0,0,0|1,0,0]=3 5469 B10R0.74 CCCCOCCC(=O)CO 1458a_100000210174_100000743108 [1,1,0,0,0,0|2,0,0]=4 5470 B10R0.74 CCCCOCCC(=O)NC 34a_100000210227_100012179268 [1,1,0,0,0,0|2,0,0]=4 5471 B10R0.74 CCCCOCCC(=O)NC 34a_100000754576_100000210210 [1,1,0,0,0,0|2,0,0]=4 5472 B10R0.74 CCCCOCCC(=O)NC 7a_100000210227_100000737683 [1,1,0,0,0,0|2,0,0]=4 5473 B10R0.74 CCCCOCCC(=O)OC 34a_100000210227_100000742370 [1,1,0,0,0,0|2,0,0]=4 5474 B10R0.74 CCCCOCCC(=O)OC 7a_100000210227_100000204255 [1,1,0,0,0,0|2,0,0]=4 5475 B10R0.74 CCCCOCCC(C)CC 7a_100011215188_100000210211 [1,1,0,0,0,0|1,0,0]=3 5476 B10R0.74 CCCCOCCC(C)OC 7a_100000764861_100000210211 [1,1,0,0,0,0|2,0,0]=4 5477 B10R0.74 CCCCOCCN(C)CC 2230a_100000225621_100000743108 [1,1,0,0,0,0|1,0,0]=3 5478 B10R0.74 CCCCOCCN(C)CC 269982a_100000225621_100000743108 [1,1,0,0,0,0|1,0,0]=3 5479 B10R0.74 CCCCOCNC(C)CC 2230a_100000209981_100011995733 [1,1,0,0,0,0|2,0,0]=4 5480 B10R0.74 CCCCOCSC(C)CC 62a_100000758301_100011995733 [1,1,0,0,0,0|2,0,0]=4 5481 B10R0.74 CCCCOCSC(C)CC 62a_100011995733_100000758301 [1,1,0,0,0,0|2,0,0]=4 5482 B10R0.74 CCN(C)CCOCCOC 2230a_100000225621_100000695917 [1,1,0,0,0,0|1,0,0]=3 5483 B10R0.74 CCN(C)CCOCCOC 269982a_100000225621_100000695917 [1,1,0,0,0,0|1,0,0]=3 5484 B10R0.74 CCNCCOCC(=O)OC 2230a_100015525214_100000090808 [1,1,0,0,0,0|1,0,1]=4 5485 B10R0.74 CCOCCCCC(=O)OC 34a_100000059025_100000210202 [1,1,0,0,0,0|1,0,1]=4 5486 B10R0.74 CCOCCCCC(=O)OC 34a_100121572206_100000204269 [1,1,0,0,0,0|1,0,1]=4 5487 B10R0.74 CCOCCCCC(=O)OC 7a_100000059025_100000210202 [1,1,0,0,0,0|1,0,1]=4 5488 B10R0.74 CCOCCCNC(=O)CC 11a_100000210961_100000210414 [1,1,0,0,0,0|2,0,0]=4 5489 B10R0.74 CCOCCCNC(=O)CC 1626a_100000210961_100000210414 [1,1,0,0,0,0|2,0,0]=4 5490 B10R0.74 CCOCCCNC(=O)CC 240690a_100000210961_100000210414 [1,1,0,0,0,0|2,0,0]=4 5491 B10R0.74 CCOCCCNC(=O)CC 527a_100000210961_100000210414 [1,1,0,0,0,0|2,0,0]=4 5492 B10R0.74 CCOCCCNC(C)CC 2230a_100000209981_100012232248 [1,1,0,0,0,0|2,0,0]=4 5493 B10R0.74 CCOCCCNC(C)CC 2230a_100000210961_100000758301 [1,1,0,0,0,0|2,0,0]=4 5494 B10R0.74 CCOCCCNC(C)CC 34a_100000210961_100011215416 [1,1,0,0,0,0|2,0,0]=4 5495 B10R0.74 CCOCCCOC(C)CC 34a_100000757476_100011215416 [1,1,0,0,0,0|2,0,0]=4 5496 B10R0.74 CCOCCCOC(C)CC 7a_100000210228_100012232248 [1,1,0,0,0,0|2,0,0]=4 5497 B10R0.74 CCOCCCOC(C)CC 7a_100000757476_100000758301 [1,1,0,0,0,0|2,0,0]=4 5498 B10R0.74 CCOCCCSC(C)CC 62a_100000758301_100012232248 [1,1,0,0,0,0|2,0,0]=4 5499 B10R0.74 CCOCCCSC(C)CC 62a_100012232248_100000758301 [1,1,0,0,0,0|2,0,0]=4 5500 B10R0.74 CCOCCCSC(C)OC 62a_100009879195_100012232248 [1,1,0,0,0,0|2,0,0]=4 5501 B10R0.74 CCOCCCSC(C)OC 62a_100012232248_100009879195 [1,1,0,0,0,0|2,0,0]=4 5502 B10R0.74 CCOCCNCC(=O)OC 2230a_102516460346_100000747449 [1,1,0,0,0,0|1,0,1]=4 5503 B10R0.74 CCOCCNCC(=O)OC 34a_102516460346_100000747449 [1,1,0,0,0,0|1,0,1]=4 5504 B10R0.74 CCOCCNCC(C)CC 2230a_100020588543_100011215890 [1,1,0,0,0,0|1,0,0]=3 5505 B10R0.74 CCOCCNCC(C)CC 2230a_102516460346_100000748023 [1,1,0,0,0,0|1,0,0]=3 5506 B10R0.74 CCOCCNCC(C)CC 270004a_102516460346_100000243153 [1,1,0,0,0,0|1,0,0]=3 5507 B10R0.74 CCOCCNCC(C)CC 34a_102516460346_100000748023 [1,1,0,0,0,0|1,0,0]=3 5508 B10R0.74 CCOCCNCC(C)CO 34a_100000744482_100000210147 [1,1,0,0,0,0|2,0,0]=4 5509 B10R0.74 CCOCCNCC(O)CC 2230a_100011218483_100011215890 [1,1,0,0,0,0|1,0,0]=3 5510 B10R0.74 CCOCCNCC(O)CC 2230a_102516460346_100011218378 [1,1,0,0,0,0|1,0,0]=3 5511 B10R0.74 CCOCCNCC(O)CC 34a_102516460346_100011218378 [1,1,0,0,0,0|1,0,0]=3 5512 B10R0.74 CCOCCNCC(O)CO 2230a_102516460346_100011219619 [1,1,0,0,0,0|2,0,0]=4 5513 B10R0.74 CCOCCNCC(O)CO 34a_102516460346_100011219619 [1,1,0,0,0,0|2,0,0]=4 5514 B10R0.74 CCOCCNC[C@@H](C)CC 2230a_102516460346_100009816398 [1,1,0,0,0,0|1,0,0]=3 5515 B10R0.74 CCOCCNC[C@@H](C)CC 34a_102516460346_100009816398 [1,1,0,0,0,0|1,0,0]=3 5516 B10R0.74 CCOCCNC[C@@H](C)CO 2230a_102516460346_100000059175 [1,1,0,0,0,0|2,0,0]=4 5517 B10R0.74 CCOCCNC[C@@H](C)CO 34a_102516460346_100000059175 [1,1,0,0,0,0|2,0,0]=4 5518 B10R0.74 CCOCCNC[C@@H](C)OC 2230a_100020591295_100011215890 [1,1,0,0,0,0|1,0,0]=3 5519 B10R0.74 CCOCCNC[C@@H](F)CO 34a_100015665980_100000210147 [1,1,0,0,0,0|2,0,0]=4 5520 B10R0.74 CCOCCNC[C@@H](O)CF 2230a_102516460346_100015614560 [1,1,0,0,0,0|2,0,0]=4 5521 B10R0.74 CCOCCNC[C@@H](O)CF 34a_102516460346_100015614560 [1,1,0,0,0,0|2,0,0]=4 5522 B10R0.74 CCOCCNC[C@@H](O)CO 2230a_102516460346_100009815848 [1,1,0,0,0,0|2,0,0]=4 5523 B10R0.74 CCOCCNC[C@@H](O)CO 34a_102516460346_100009815848 [1,1,0,0,0,0|2,0,0]=4 5524 B10R0.74 CCOCCNC[C@H](O)CO 2230a_100020644852_100011215890 [1,1,0,0,0,0|2,0,0]=4 5525 B10R0.74 CCOCCOCC(=O)CC 34a_100000725409_100000210147 [1,1,0,0,0,0|0,0,1]=3 5526 B10R0.74 CCOCCOCC(=O)CC 7a_100000210136_100000747405 [1,1,0,0,0,0|0,0,1]=3 5527 B10R0.74 CCOCCOCC(=O)NC 34a_100000210136_100000183359 [1,1,0,0,0,0|1,0,1]=4 5528 B10R0.74 CCOCCOCC(=O)NC 34a_100000750040_100000210147 [1,1,0,0,0,0|1,0,1]=4 5529 B10R0.74 CCOCCOCC(=O)NC 7a_100000210136_100000183359 [1,1,0,0,0,0|1,0,1]=4 5530 B10R0.74 CCOCCOCC(=O)OC 34a_100000210136_100000747449 [1,1,0,0,0,0|0,0,1]=3 5531 B10R0.74 CCOCCOCC(=O)OC 34a_100121572206_100000090808 [1,1,0,0,0,0|0,0,1]=3 5532 B10R0.74 CCOCCOCC(=O)OC 7a_100000210136_100000747449 [1,1,0,0,0,0|0,0,1]=3 5533 B10R0.74 CCOCCOCC(C)CC 34a_100000210136_100000748023 [1,1,0,0,0,0|0,0,0]=2 5534 B10R0.74 CCOCCOCC(C)CC 7a_100000210136_100000748023 [1,1,0,0,0,0|0,0,0]=2 5535 B10R0.74 CCOCCOCC(C)CN 34a_100000744482_100000210147 [1,1,0,0,0,0|1,0,0]=3 5536 B10R0.74 CCOCCOCC(C)OC 34a_100000690652_100000210147 [1,1,0,0,0,0|0,0,0]=2 5537 B10R0.74 CCOCCOCC(Cl)CCl 34a_100000033668_100000210147 [1,1,0,0,0,0|1,0,0]=3 5538 B10R0.74 CCOCCOCC(O)CC 34a_100000210136_100011218378 [1,1,0,0,0,0|0,0,0]=2 5539 B10R0.74 CCOCCOCC(O)CC 7a_100000210136_100011218378 [1,1,0,0,0,0|0,0,0]=2 5540 B10R0.74 CCOCCOCC(O)CO 34a_100000210136_100011219619 [1,1,0,0,0,0|1,0,0]=3 5541 B10R0.74 CCOCCOCC(O)CO 7a_100000210136_100011219619 [1,1,0,0,0,0|1,0,0]=3 5542 B10R0.74 CCOCCOC[C@@H](C)CC 34a_100000210136_100009816398 [1,1,0,0,0,0|0,0,0]=2 5543 B10R0.74 CCOCCOC[C@@H](C)CC 7a_100000210136_100009816398 [1,1,0,0,0,0|0,0,0]=2 5544 B10R0.74 CCOCCOC[C@@H](C)CC 7a_100009816381_100011215890 [1,1,0,0,0,0|0,0,0]=2 5545 B10R0.74 CCOCCOC[C@@H](C)CO 34a_100000210136_100000059175 [1,1,0,0,0,0|1,0,0]=3 5546 B10R0.74 CCOCCOC[C@@H](C)CO 7a_100000210136_100000059175 [1,1,0,0,0,0|1,0,0]=3 5547 B10R0.74 CCOCCOC[C@@H](O)CF 34a_100000210136_100015614560 [1,1,0,0,0,0|1,0,0]=3 5548 B10R0.74 CCOCCOC[C@@H](O)CF 7a_100000210136_100015614560 [1,1,0,0,0,0|1,0,0]=3 5549 B10R0.74 CCOCCOC[C@@H](O)CO 34a_100000210136_100009815848 [1,1,0,0,0,0|1,0,0]=3 5550 B10R0.74 CCOCCOC[C@@H](O)CO 7a_100000210136_100009815848 [1,1,0,0,0,0|1,0,0]=3 5551 B10R0.74 CCOCCOC[C@H](F)CN 34a_100015665980_100000210147 [1,1,0,0,0,0|1,0,0]=3 5552 B10R0.74 CCOCCSCC(=O)CC 62a_100000210147_100000747405 [1,1,0,0,0,0|0,1,1]=4 5553 B10R0.74 CCOCCSCC(=O)CC 62a_100000747405_100011215890 [1,1,0,0,0,0|0,1,1]=4 5554 B10R0.74 CCOCCSCC(=O)OC 62a_100000210147_100000747449 [1,1,0,0,0,0|0,1,1]=4 5555 B10R0.74 CCOCCSCC(=O)OC 62a_100000747449_100011215890 [1,1,0,0,0,0|0,1,1]=4 5556 B10R0.74 CCOCCSCC(C)CC 62a_100000210147_100000748023 [1,1,0,0,0,0|0,1,0]=3 5557 B10R0.74 CCOCCSCC(C)CC 62a_100000748023_100011215890 [1,1,0,0,0,0|0,1,0]=3 5558 B10R0.74 CCOCCSCC(O)CC 62a_100000210147_100011218378 [1,1,0,0,0,0|0,1,0]=3 5559 B10R0.74 CCOCCSCC(O)CC 62a_100011218378_100011215890 [1,1,0,0,0,0|0,1,0]=3 5560 B10R0.74 CCOCCSCC(O)CO 62a_100000210147_100011219619 [1,1,0,0,0,0|1,1,0]=4 5561 B10R0.74 CCOCCSCC(O)CO 62a_100011219619_100011215890 [1,1,0,0,0,0|1,1,0]=4 5562 B10R0.74 CCOCCSC[C@@H](C)CC 62a_100000210147_100009816398 [1,1,0,0,0,0|0,1,0]=3 5563 B10R0.74 CCOCCSC[C@@H](C)CC 62a_100009816398_100011215890 [1,1,0,0,0,0|0,1,0]=3 5564 B10R0.74 CCOCCSC[C@@H](C)CO 62a_100000059175_100011215890 [1,1,0,0,0,0|1,1,0]=4 5565 B10R0.74 CCOCCSC[C@@H](C)CO 62a_100000210147_100000059175 [1,1,0,0,0,0|1,1,0]=4 5566 B10R0.74 CCOCCSC[C@@H](O)CF 62a_100000210147_100015614560 [1,1,0,0,0,0|1,1,0]=4 5567 B10R0.74 CCOCCSC[C@@H](O)CF 62a_100015614560_100011215890 [1,1,0,0,0,0|1,1,0]=4 5568 B10R0.74 CCOCCSC[C@@H](O)CO 62a_100000210147_100009815848 [1,1,0,0,0,0|1,1,0]=4 5569 B10R0.74 CCOCCSC[C@@H](O)CO 62a_100009815848_100011215890 [1,1,0,0,0,0|1,1,0]=4 5570 B10R0.74 CCSCCNCC(C)CC 2230a_100000106463_100000748023 [1,1,0,0,0,0|1,1,0]=4 5571 B10R0.74 CCSCCNCC(C)CC 2230a_100020588543_100000757381 [1,1,0,0,0,0|1,1,0]=4 5572 B10R0.74 CCSCCNCC(C)CC 270004a_100000106463_100000243153 [1,1,0,0,0,0|1,1,0]=4 5573 B10R0.74 CCSCCNCC(O)CC 2230a_100000106463_100011218378 [1,1,0,0,0,0|1,1,0]=4 5574 B10R0.74 CCSCCNCC(O)CC 2230a_100011218483_100000757381 [1,1,0,0,0,0|1,1,0]=4 5575 B10R0.74 CCSCCNC[C@@H](C)CC 2230a_100000106463_100009816398 [1,1,0,0,0,0|1,1,0]=4 5576 B10R0.74 CCSCCNC[C@@H](C)OC 2230a_100020591295_100000757381 [1,1,0,0,0,0|1,1,0]=4 5577 B10R0.74 CCSCCOCC(=O)CC 34a_100000725409_100000757381 [1,1,0,0,0,0|0,1,1]=4 5578 B10R0.74 CCSCCOCC(=O)CC 7a_100000212035_100000747405 [1,1,0,0,0,0|0,1,1]=4 5579 B10R0.74 CCSCCOCC(=O)OC 34a_100000212035_100000747449 [1,1,0,0,0,0|0,1,1]=4 5580 B10R0.74 CCSCCOCC(=O)OC 62a_100000090808_100000210202 [1,1,0,0,0,0|0,1,1]=4 5581 B10R0.74 CCSCCOCC(=O)OC 62a_100000210202_100000090808 [1,1,0,0,0,0|0,1,1]=4 5582 B10R0.74 CCSCCOCC(=O)OC 7a_100000212035_100000747449 [1,1,0,0,0,0|0,1,1]=4 5583 B10R0.74 CCSCCOCC(C)CC 34a_100000212035_100000748023 [1,1,0,0,0,0|0,1,0]=3 5584 B10R0.74 CCSCCOCC(C)CC 7a_100000212035_100000748023 [1,1,0,0,0,0|0,1,0]=3 5585 B10R0.74 CCSCCOCC(C)CN 34a_100000744482_100000757381 [1,1,0,0,0,0|1,1,0]=4 5586 B10R0.74 CCSCCOCC(C)OC 34a_100000690652_100000757381 [1,1,0,0,0,0|0,1,0]=3 5587 B10R0.74 CCSCCOCC(Cl)CCl 34a_100000033668_100000757381 [1,1,0,0,0,0|1,1,0]=4 5588 B10R0.74 CCSCCOCC(O)CC 34a_100000212035_100011218378 [1,1,0,0,0,0|0,1,0]=3 5589 B10R0.74 CCSCCOCC(O)CC 7a_100000212035_100011218378 [1,1,0,0,0,0|0,1,0]=3 5590 B10R0.74 CCSCCOCC(O)CO 34a_100000212035_100011219619 [1,1,0,0,0,0|1,1,0]=4 5591 B10R0.74 CCSCCOCC(O)CO 7a_100000212035_100011219619 [1,1,0,0,0,0|1,1,0]=4 5592 B10R0.74 CCSCCOC[C@@H](C)CC 34a_100000212035_100009816398 [1,1,0,0,0,0|0,1,0]=3 5593 B10R0.74 CCSCCOC[C@@H](C)CC 7a_100000212035_100009816398 [1,1,0,0,0,0|0,1,0]=3 5594 B10R0.74 CCSCCOC[C@@H](C)CC 7a_100009816381_100000757381 [1,1,0,0,0,0|0,1,0]=3 5595 B10R0.74 CCSCCOC[C@@H](C)CO 34a_100000212035_100000059175 [1,1,0,0,0,0|1,1,0]=4 5596 B10R0.74 CCSCCOC[C@@H](C)CO 7a_100000212035_100000059175 [1,1,0,0,0,0|1,1,0]=4 5597 B10R0.74 CCSCCOC[C@@H](O)CF 34a_100000212035_100015614560 [1,1,0,0,0,0|1,1,0]=4 5598 B10R0.74 CCSCCOC[C@@H](O)CF 7a_100000212035_100015614560 [1,1,0,0,0,0|1,1,0]=4 5599 B10R0.74 CCSCCOC[C@@H](O)CO 34a_100000212035_100009815848 [1,1,0,0,0,0|1,1,0]=4 5600 B10R0.74 CCSCCOC[C@@H](O)CO 7a_100000212035_100009815848 [1,1,0,0,0,0|1,1,0]=4 5601 B10R0.74 CCSCCOC[C@H](F)CN 34a_100015665980_100000757381 [1,1,0,0,0,0|1,1,0]=4 5602 B10R0.74 CCSCCSCC(C)CC 62a_100000748023_100000757381 [1,1,0,0,0,0|0,2,0]=4 5603 B10R0.74 CCSCCSCC(C)CC 62a_100000757381_100000748023 [1,1,0,0,0,0|0,2,0]=4 5604 B10R0.74 CCSCCSCC(O)CC 62a_100000757381_100011218378 [1,1,0,0,0,0|0,2,0]=4 5605 B10R0.74 CCSCCSCC(O)CC 62a_100011218378_100000757381 [1,1,0,0,0,0|0,2,0]=4 5606 B10R0.74 CCSCCSC[C@@H](C)CC 62a_100000757381_100009816398 [1,1,0,0,0,0|0,2,0]=4 5607 B10R0.74 CCSCCSC[C@@H](C)CC 62a_100009816398_100000757381 [1,1,0,0,0,0|0,2,0]=4 5608 B10R0.74 CC[C@H](C)COCCCCBr 34a_100011216708_100009816398 [1,1,0,0,0,0|2,0,0]=4 5609 B10R0.74 CC[C@H](C)COCCCCCl 34a_100000210776_100009816398 [1,1,0,0,0,0|2,0,0]=4 5610 B10R0.74 CC[C@H](C)COCCCCCl 7a_100000210776_100009816398 [1,1,0,0,0,0|2,0,0]=4 5611 B10R0.74 CC[C@H](C)COCCCCF 34a_100011995726_100009816398 [1,1,0,0,0,0|2,0,0]=4 5612 B10R0.74 CC[C@H](C)COCCCCF 7a_100009816381_100000729493 [1,1,0,0,0,0|2,0,0]=4 5613 B10R0.74 CC[C@H](C)COCCCCF 7a_100011995726_100009816398 [1,1,0,0,0,0|2,0,0]=4 5614 B10R0.74 CC[C@H](C)COCCCCI 34a_200012148704_100009816398 [1,1,0,0,0,0|2,0,0]=4 5615 B10R0.74 CC[C@H](C)COCCCCN 34a_100000750430_100009816398 [1,1,0,0,0,0|2,0,0]=4 5616 B10R0.74 CC[C@H](C)COCCCCO 7a_100009816381_100000210776 [1,1,0,0,0,0|2,0,0]=4 5617 B10R0.74 CC[C@H](C)COCCCNC 34a_100000213112_100009816398 [1,1,0,0,0,0|2,0,0]=4 5618 B10R0.74 CC[C@H](C)COCCCOC 34a_100000740835_100009816398 [1,1,0,0,0,0|2,0,0]=4 5619 B10R0.74 CC[C@H](C)COCCCOC 7a_100009816381_100000740836 [1,1,0,0,0,0|2,0,0]=4 5620 B10R0.74 CC[C@H](C)COCCCSC 34a_100000690336_100009816398 [1,1,0,0,0,0|2,0,0]=4 5621 B10R0.74 CC[C@H](C)COCCCSC 7a_100000690336_100009816398 [1,1,0,0,0,0|2,0,0]=4 5622 B10R0.74 CNC(=O)CCOCCOC 11a_106832991635_100000745395 [1,1,0,0,0,0|2,0,0]=4 5623 B10R0.74 CNC(=O)CCOCCOC 1626a_100102657272_100000745395 [1,1,0,0,0,0|2,0,0]=4 5624 B10R0.74 CNC(=O)CCOCCOC 240690a_100102657272_100000745395 [1,1,0,0,0,0|2,0,0]=4 5625 B10R0.74 CNC(=O)CCOCCOC 34a_100000210237_100012179268 [1,1,0,0,0,0|2,0,0]=4 5626 B10R0.74 CNC(=O)CCOCCOC 34a_100000754576_100011201679 [1,1,0,0,0,0|2,0,0]=4 5627 B10R0.74 CNC(=O)CCOCCOC 527a_100102657272_100000745395 [1,1,0,0,0,0|2,0,0]=4 5628 B10R0.74 COC(C)COCCCCF 34a_100000690652_100000729493 [1,1,0,0,0,0|2,0,0]=4 5629 B10R0.74 COC(C)COCCCCO 34a_100000690652_100011216708 [1,1,0,0,0,0|2,0,0]=4 5630 B10R0.74 COCCCOCC(C)OC 34a_100000690652_100000740836 [1,1,0,0,0,0|2,0,0]=4 5631 B10R0.74 COCCOCCC(=O)CF 1458a_100000745395_100015361967 [1,1,0,0,0,0|2,0,0]=4 5632 B10R0.74 COCCOCCC(=O)CO 1458a_100000210174_100000695917 [1,1,0,0,0,0|2,0,0]=4 5633 B10R0.74 COCCOCCC(=O)OC 34a_100000210237_100000742370 [1,1,0,0,0,0|2,0,0]=4 5634 B10R0.74 COCCOCCC(C)OC 7a_100000764861_100000233755 [1,1,0,0,0,0|2,0,0]=4 5635 B10R0.91 C#CCCOC(C)COCC 34a_100000718985_100000688953 [1,1,0,0,0,0|0,0,2]=4 5636 B10R0.91 C#CCCOC(C)COCC 7a_100000718985_100000688953 [1,1,0,0,0,0|0,0,2]=4 5637 B10R0.91 C/C=C/COC(C)COCC 34a_100000718985_100102629194 [1,1,0,0,0,0|0,0,2]=4 5638 B10R0.91 C/C=C/COC(C)COCC 7a_100000718985_100102629194 [1,1,0,0,0,0|0,0,2]=4 5639 B10R0.91 C=CCCOC(C)COCC 34a_100000718985_100000754431 [1,1,0,0,0,0|0,0,2]=4 5640 B10R0.91 C=CCCOC(C)COCC 7a_100000718985_100000754431 [1,1,0,0,0,0|0,0,2]=4 5641 B10R0.91 CC#CCOC(C)COCC 34a_100000718985_100000748600 [1,1,0,0,0,0|0,0,2]=4 5642 B10R0.91 CC#CCOC(C)COCC 7a_100000718985_100000748600 [1,1,0,0,0,0|0,0,2]=4 5643 B10R0.91 CC=CCOC(C)COCC 34a_100000718985_100000070051 [1,1,0,0,0,0|0,0,2]=4 5644 B10R0.91 CC=CCOC(C)COCC 7a_100000718985_100000070051 [1,1,0,0,0,0|0,0,2]=4 5645 B10R0.91 CCC#CC(C)OCCCC 34a_100000033903_100000210210 [1,1,0,0,0,0|1,0,1]=4 5646 B10R0.91 CCC#CC(C)OCCCC 7a_100000033903_100000210211 [1,1,0,0,0,0|1,0,1]=4 5647 B10R0.91 CCC#CC(C)OCCOC 34a_100000033903_100011201679 [1,1,0,0,0,0|1,0,1]=4 5648 B10R0.91 CCC#CC(C)OCCOC 7a_100000033903_100000233755 [1,1,0,0,0,0|1,0,1]=4 5649 B10R0.91 CCCCC(=O)CCOCC 1458a_100000210183_100011215890 [1,1,0,0,0,0|1,0,0]=3 5650 B10R0.91 CCCCC(=O)CCOCC 1458a_100000749530_100000210211 [1,1,0,0,0,0|1,0,0]=3 5651 B10R0.91 CCCCC(=O)CCSCC 1458a_100000210183_100000757381 [1,1,0,0,0,0|1,1,0]=4 5652 B10R0.91 CCCCC(=O)CCSCC 1458a_100000230768_100000210211 [1,1,0,0,0,0|1,1,0]=4 5653 B10R0.91 CCCCC(C)NCCOC 2230a_100000126638_100011201679 [1,1,0,0,0,0|2,0,0]=4 5654 B10R0.91 CCCCC(C)NCCOC 2230a_100000209980_200011215066 [1,1,0,0,0,0|2,0,0]=4 5655 B10R0.91 CCCCC(C)NCCOC 270004a_100000209980_100000210087 [1,1,0,0,0,0|2,0,0]=4 5656 B10R0.91 CCCCC(C)OCCCBr 34a_100011217188_200011215066 [1,1,0,0,0,0|2,0,0]=4 5657 B10R0.91 CCCCC(C)OCCCCl 34a_100000230001_200011215066 [1,1,0,0,0,0|2,0,0]=4 5658 B10R0.91 CCCCC(C)OCCCF 34a_100000687866_100011934791 [1,1,0,0,0,0|2,0,0]=4 5659 B10R0.91 CCCCC(C)OCCCF 34a_100000759539_200011215066 [1,1,0,0,0,0|2,0,0]=4 5660 B10R0.91 CCCCC(C)OCCCF 7a_100000687866_100011934791 [1,1,0,0,0,0|2,0,0]=4 5661 B10R0.91 CCCCC(C)OCCCN 34a_100000182051_200011215066 [1,1,0,0,0,0|2,0,0]=4 5662 B10R0.91 CCCCC(C)OCCCO 34a_100000687866_100000230001 [1,1,0,0,0,0|2,0,0]=4 5663 B10R0.91 CCCCC(C)OCCCO 7a_100000687866_100011215043 [1,1,0,0,0,0|2,0,0]=4 5664 B10R0.91 CCCCC(C)OCCOC 34a_100000210237_200011215066 [1,1,0,0,0,0|1,0,0]=3 5665 B10R0.91 CCCCC(C)OCCOC 34a_100000687866_100011201679 [1,1,0,0,0,0|1,0,0]=3 5666 B10R0.91 CCCCC(C)OCCOC 7a_100000687866_100000233755 [1,1,0,0,0,0|1,0,0]=3 5667 B10R0.91 CCCCC(C)OCCON 34a_100000700252_200011215066 [1,1,0,0,0,0|2,0,0]=4 5668 B10R0.91 CCCCC(C)OCCSC 34a_100000230434_200011215066 [1,1,0,0,0,0|1,1,0]=4 5669 B10R0.91 CCCCC(C)OCCSC 34a_100000687866_100000212216 [1,1,0,0,0,0|1,1,0]=4 5670 B10R0.91 CCCCC(C)OCCSC 7a_100000230434_200011215066 [1,1,0,0,0,0|1,1,0]=4 5671 B10R0.91 CCCCC(C)OCCSC 7a_100000687866_100000212216 [1,1,0,0,0,0|1,1,0]=4 5672 B10R0.91 CCCCC(C)SCCOC 62a_100000233755_200011215066 [1,1,0,0,0,0|1,1,0]=4 5673 B10R0.91 CCCCC(C)SCCOC 62a_200011215066_100000233755 [1,1,0,0,0,0|1,1,0]=4 5674 B10R0.91 CCCCC(C)SCOCC 62a_100000739092_200011215066 [1,1,0,0,0,0|1,1,0]=4 5675 B10R0.91 CCCCC(C)SCOCC 62a_200011215066_100000739092 [1,1,0,0,0,0|1,1,0]=4 5676 B10R0.91 CCCCCC(=O)CCCC 1458a_100000210183_100000210326 [1,1,0,0,0,0|2,0,0]=4 5677 B10R0.91 CCCCCC(=O)CCCC 1458a_100000212188_100000210211 [1,1,0,0,0,0|2,0,0]=4 5678 B10R0.91 CCCCCC(=O)CCOC 1458a_100000212188_100000233755 [1,1,0,0,0,0|2,0,0]=4 5679 B10R0.91 CCCCCC(=O)CCOC 1458a_100000749529_100000210326 [1,1,0,0,0,0|2,0,0]=4 5680 B10R0.91 CCCCCC(=O)COCC 1458a_100000211967_100000210326 [1,1,0,0,0,0|1,0,1]=4 5681 B10R0.91 CCCCCC(=O)COCC 34a_100121572206_200012276598 [1,1,0,0,0,0|1,0,1]=4 5682 B10R0.91 CCCCCN(C)CCCC 2230a_100000207549_100000210326 [1,1,0,0,0,0|2,0,0]=4 5683 B10R0.91 CCCCCN(C)CCCC 2230a_100000223495_100000210211 [1,1,0,0,0,0|2,0,0]=4 5684 B10R0.91 CCCCCN(C)CCCC 269982a_100000207549_100000210215 [1,1,0,0,0,0|2,0,0]=4 5685 B10R0.91 CCCCCN(C)CCCC 269982a_100000223495_100000210211 [1,1,0,0,0,0|2,0,0]=4 5686 B10R0.91 CCCCCN(C)CCOC 2230a_100000223495_100011201679 [1,1,0,0,0,0|2,0,0]=4 5687 B10R0.91 CCCCCN(C)CCOC 2230a_100000743101_100000210326 [1,1,0,0,0,0|2,0,0]=4 5688 B10R0.91 CCCCCN(C)CCOC 269982a_100000223495_100000233755 [1,1,0,0,0,0|2,0,0]=4 5689 B10R0.91 CCCCCN(C)CCOC 269982a_100000743101_100000210215 [1,1,0,0,0,0|2,0,0]=4 5690 B10R0.91 CCCCCN(C)COCC 269982a_100000223495_100000739092 [1,1,0,0,0,0|2,0,0]=4 5691 B10R0.91 CCCCN(C)CCOCC 2230a_100000207549_100011215890 [1,1,0,0,0,0|1,0,0]=3 5692 B10R0.91 CCCCN(C)CCOCC 269982a_100000207549_100011215890 [1,1,0,0,0,0|1,0,0]=3 5693 B10R0.91 CCCCN(C)CCSCC 2230a_100000207549_100000757381 [1,1,0,0,0,0|1,1,0]=4 5694 B10R0.91 CCCCN(C)CCSCC 269982a_100000207549_100000757381 [1,1,0,0,0,0|1,1,0]=4 5695 B10R0.91 CCCCNC(=O)COCC 11a_100000102301_100000211967 [1,1,0,0,0,0|1,0,1]=4 5696 B10R0.91 CCCCNC(=O)COCC 1626a_100000102301_100000211967 [1,1,0,0,0,0|1,0,1]=4 5697 B10R0.91 CCCCNC(=O)COCC 240690a_100000102301_100000211967 [1,1,0,0,0,0|1,0,1]=4 5698 B10R0.91 CCCCNC(=O)COCC 34a_100121572206_100000182744 [1,1,0,0,0,0|1,0,1]=4 5699 B10R0.91 CCCCNC(=O)COCC 527a_100000102301_100000211967 [1,1,0,0,0,0|1,0,1]=4 5700 B10R0.91 CCCCNC(C)CCCC 2230a_100000102301_200011215066 [1,1,0,0,0,0|2,0,0]=4 5701 B10R0.91 CCCCNC(C)CCCC 2230a_100000126638_100000210211 [1,1,0,0,0,0|2,0,0]=4 5702 B10R0.91 CCCCNC(C)CCCC 270004a_100000102301_100000210087 [1,1,0,0,0,0|2,0,0]=4 5703 B10R0.91 CCCCNC(C)CCCC 7a_106832991798_200011215066 [1,1,0,0,0,0|2,0,0]=4 5704 B10R0.91 CCCCNC(C)CSCC 270004a_100000102301_200011216171 [1,1,0,0,0,0|1,1,0]=4 5705 B10R0.91 CCCCOC(=O)CNCC 2230a_100015525214_100000211628 [1,1,0,0,0,0|1,0,1]=4 5706 B10R0.91 CCCCOC(=O)COCC 34a_100121572206_100000211628 [1,1,0,0,0,0|0,0,1]=3 5707 B10R0.91 CCCCOC(=O)CSCC 62a_100000210202_100000211628 [1,1,0,0,0,0|0,1,1]=4 5708 B10R0.91 CCCCOC(=O)CSCC 62a_100000211628_100000210202 [1,1,0,0,0,0|0,1,1]=4 5709 B10R0.91 CCCCOC(C)CCCC 34a_100000210227_200011215066 [1,1,0,0,0,0|1,0,0]=3 5710 B10R0.91 CCCCOC(C)CCCC 34a_100000687866_100000210210 [1,1,0,0,0,0|1,0,0]=3 5711 B10R0.91 CCCCOC(C)CCCC 7a_100000210227_200011215066 [1,1,0,0,0,0|1,0,0]=3 5712 B10R0.91 CCCCOC(C)CCCC 7a_100000687866_100000210211 [1,1,0,0,0,0|1,0,0]=3 5713 B10R0.91 CCCCOC(C)CCCCl 34a_200000718107_100000210210 [1,1,0,0,0,0|2,0,0]=4 5714 B10R0.91 CCCCOC(C)CCCCl 7a_200000718107_100000210211 [1,1,0,0,0,0|2,0,0]=4 5715 B10R0.91 CCCCOC(C)COCC 34a_100000718985_100000210210 [1,1,0,0,0,0|0,0,0]=2 5716 B10R0.91 CCCCOC(C)COCC 7a_100000718985_100000210211 [1,1,0,0,0,0|0,0,0]=2 5717 B10R0.91 CCCCSC(C)CCCC 62a_100000210211_200011215066 [1,1,0,0,0,0|1,1,0]=4 5718 B10R0.91 CCCCSC(C)CCCC 62a_200011215066_100000210210 [1,1,0,0,0,0|1,1,0]=4 5719 B10R0.91 CCCNC(=O)CCOCC 11a_100020643023_100000749530 [1,1,0,0,0,0|2,0,0]=4 5720 B10R0.91 CCCNC(=O)CCOCC 1626a_100020643023_100000749530 [1,1,0,0,0,0|2,0,0]=4 5721 B10R0.91 CCCNC(=O)CCOCC 240690a_100020643023_100000749530 [1,1,0,0,0,0|2,0,0]=4 5722 B10R0.91 CCCNC(=O)CCOCC 527a_100020643023_100000749530 [1,1,0,0,0,0|2,0,0]=4 5723 B10R0.91 CCCNC(C)CCOCC 270004a_100020643023_200011216536 [1,1,0,0,0,0|2,0,0]=4 5724 B10R0.91 CCCNCC(O)COCC 2230a_102515437182_100000210303 [1,1,0,0,0,0|2,0,0]=4 5725 B10R0.91 CCCNCC(O)COCC 34a_102515437182_100000210303 [1,1,0,0,0,0|2,0,0]=4 5726 B10R0.91 CCNCC(=O)OCCOC 2230a_100015525214_200000040189 [1,1,0,0,0,0|1,0,1]=4 5727 B10R0.91 CCOCC(=O)CCCOC 1458a_100000211967_100000740836 [1,1,0,0,0,0|1,0,1]=4 5728 B10R0.91 CCOCC(=O)CCSCC 1458a_100000211967_100000757381 [1,1,0,0,0,0|0,1,1]=4 5729 B10R0.91 CCOCC(=O)NCCOC 1626a_100000209980_100000211967 [1,1,0,0,0,0|1,0,1]=4 5730 B10R0.91 CCOCC(=O)NCCOC 240690a_100000209980_100000211967 [1,1,0,0,0,0|1,0,1]=4 5731 B10R0.91 CCOCC(=O)NCCOC 34a_100121572206_100000183275 [1,1,0,0,0,0|1,0,1]=4 5732 B10R0.91 CCOCC(=O)NCCOC 527a_100000209980_100000211967 [1,1,0,0,0,0|1,0,1]=4 5733 B10R0.91 CCOCC(=O)OCCOC 34a_100121572206_200000040189 [1,1,0,0,0,0|0,0,1]=3 5734 B10R0.91 CCOCC(C)OCCC#N 7a_100000718985_100000184422 [1,1,0,0,0,0|1,0,1]=4 5735 B10R0.91 CCOCC(C)OCCCF 34a_100000718985_100011934791 [1,1,0,0,0,0|1,0,0]=3 5736 B10R0.91 CCOCC(C)OCCCF 7a_100000718985_100011934791 [1,1,0,0,0,0|1,0,0]=3 5737 B10R0.91 CCOCC(C)OCCCO 34a_100000718985_100000230001 [1,1,0,0,0,0|1,0,0]=3 5738 B10R0.91 CCOCC(C)OCCCO 7a_100000718985_100011215043 [1,1,0,0,0,0|1,0,0]=3 5739 B10R0.91 CCOCC(C)OCCOC 34a_100000718985_100011201679 [1,1,0,0,0,0|0,0,0]=2 5740 B10R0.91 CCOCC(C)OCCOC 7a_100000718985_100000233755 [1,1,0,0,0,0|0,0,0]=2 5741 B10R0.91 CCOCC(C)OCCSC 34a_100000718985_100000212216 [1,1,0,0,0,0|0,1,0]=3 5742 B10R0.91 CCOCC(C)OCCSC 7a_100000718985_100000212216 [1,1,0,0,0,0|0,1,0]=3 5743 B10R0.91 CCOCC(O)CNCOC 2230a_102515437182_100000766300 [1,1,0,0,0,0|2,0,0]=4 5744 B10R0.91 CCOCCC(=O)CCCF 1458a_100000749530_100011934791 [1,1,0,0,0,0|2,0,0]=4 5745 B10R0.91 CCOCCC(=O)CCCO 1458a_100000749530_100011215043 [1,1,0,0,0,0|2,0,0]=4 5746 B10R0.91 CCOCCC(=O)CCOC 1458a_100000749529_100011215890 [1,1,0,0,0,0|1,0,0]=3 5747 B10R0.91 CCOCCC(=O)CCOC 1458a_100000749530_100000233755 [1,1,0,0,0,0|1,0,0]=3 5748 B10R0.91 CCOCCC(=O)CCSC 1458a_100000174002_100011215890 [1,1,0,0,0,0|1,1,0]=4 5749 B10R0.91 CCOCCC(=O)CCSC 1458a_100000749530_100000751147 [1,1,0,0,0,0|1,1,0]=4 5750 B10R0.91 CCOCCC(=O)COCC 1458a_100000211967_100011215890 [1,1,0,0,0,0|0,0,1]=3 5751 B10R0.91 CCOCCC(=O)CSCC 1458a_100000230394_100011215890 [1,1,0,0,0,0|0,1,1]=4 5752 B10R0.91 CCOCCN(C)CCCO 2230a_100000213112_100011215890 [1,1,0,0,0,0|2,0,0]=4 5753 B10R0.91 CCOCCN(C)CCCO 269982a_100000213112_100011215890 [1,1,0,0,0,0|2,0,0]=4 5754 B10R0.91 CCOCCN(C)CCOC 2230a_100000743101_100011215890 [1,1,0,0,0,0|1,0,0]=3 5755 B10R0.91 CCOCCN(C)CCOC 269982a_100000743101_100011215890 [1,1,0,0,0,0|1,0,0]=3 5756 B10R0.91 CCOCCN(C)CCSC 2230a_100000686725_100011215890 [1,1,0,0,0,0|1,1,0]=4 5757 B10R0.91 CCOCCN(C)CCSC 269982a_100000686725_100011215890 [1,1,0,0,0,0|1,1,0]=4 5758 B10R0.91 CCOCN(C)CCCOC 269982a_100000224831_100000739092 [1,1,0,0,0,0|2,0,0]=4 5759 B10R0.91 CCOC[C@@H](N)CCCCN 34a_100016993712_100000210202 [1,1,0,0,0,0|2,0,0]=4 5760 B10R0.91 CCSCC(=O)OCCOC 62a_100000210202_200000040189 [1,1,0,0,0,0|0,1,1]=4 5761 B10R0.91 CCSCC(=O)OCCOC 62a_200000040189_100000210202 [1,1,0,0,0,0|0,1,1]=4 5762 B10R0.91 CCSCC(C)NCCOC 270004a_100000209980_200011216171 [1,1,0,0,0,0|1,1,0]=4 5763 B10R0.91 CCSCCC(=O)CCOC 1458a_100000230768_100000233755 [1,1,0,0,0,0|1,1,0]=4 5764 B10R0.91 CCSCCC(=O)CCOC 1458a_100000749529_100000757381 [1,1,0,0,0,0|1,1,0]=4 5765 B10R0.91 CCSCCN(C)CCOC 2230a_100000743101_100000757381 [1,1,0,0,0,0|1,1,0]=4 5766 B10R0.91 CCSCCN(C)CCOC 269982a_100000743101_100000757381 [1,1,0,0,0,0|1,1,0]=4 5767 B10R0.91 COCCOC(C)CCCCl 34a_200000718107_100011201679 [1,1,0,0,0,0|2,0,0]=4 5768 B10R0.91 COCCOC(C)CCCCl 7a_200000718107_100000233755 [1,1,0,0,0,0|2,0,0]=4 5769 B12R0.1 C#CCC(=O)CCOCCOCC 1458a_100011220946_100011211534 [0,2,0,0,0,0|1,0,1]=4 5770 B12R0.1 C#CCN(C)CCOCCOCC 2230a_100000225692_100011211534 [0,2,0,0,0,0|1,0,1]=4 5771 B12R0.1 C#CCN(C)CCOCCOCC 34a_100000225692_100011211534 [0,2,0,0,0,0|1,0,1]=4 5772 B12R0.1 C#CCOCCOCC(=O)OCC 34a_100000054580_100000188475 [0,2,0,0,0,0|0,0,2]=4 5773 B12R0.1 C#CCOCCOCC(=O)OCC 34a_100000210247_100000088970 [0,2,0,0,0,0|0,0,2]=4 5774 B12R0.1 C#CCOCCOCC(=O)OCC 7a_100000054580_100000188475 [0,2,0,0,0,0|0,0,2]=4 5775 B12R0.1 C#CCOCCOCC(C)CCC 34a_100000054580_100011216630 [0,2,0,0,0,0|1,0,1]=4 5776 B12R0.1 C#CCOCCOCC(C)CCC 34a_100000688023_100010402529 [0,2,0,0,0,0|1,0,1]=4 5777 B12R0.1 C#CCOCCOCC(C)CCC 7a_100000054580_100011216630 [0,2,0,0,0,0|1,0,1]=4 5778 B12R0.1 C#CCOCCOCC(C)CCC 7a_100000688023_100010402529 [0,2,0,0,0,0|1,0,1]=4 5779 B12R0.1 C#CCOCCOC[C@@H](N)CCC 34a_100000732646_100010402529 [0,2,0,0,0,0|1,0,1]=4 5780 B12R0.1 C/C=C/CCOCCC(=O)OCC 34a_100016278192_100000765890 [0,2,0,0,0,0|1,0,1]=4 5781 B12R0.1 C=CCC(=O)CCOCCOCC 1458a_100000210193_100011211534 [0,2,0,0,0,0|1,0,1]=4 5782 B12R0.1 C=CCN(C)CCOCCOCC 2230a_100000225617_100011211534 [0,2,0,0,0,0|1,0,1]=4 5783 B12R0.1 C=CCN(C)CCOCCOCC 269982a_100000225617_100011211534 [0,2,0,0,0,0|1,0,1]=4 5784 B12R0.1 C=CCOCCOCC(=O)OCC 34a_100000037705_100000188475 [0,2,0,0,0,0|0,0,2]=4 5785 B12R0.1 C=CCOCCOCC(=O)OCC 34a_200000210373_100000088970 [0,2,0,0,0,0|0,0,2]=4 5786 B12R0.1 C=CCOCCOCC(=O)OCC 7a_100000037705_100000188475 [0,2,0,0,0,0|0,0,2]=4 5787 B12R0.1 C=CCOCCOCC(C)CCC 34a_100000037705_100011216630 [0,2,0,0,0,0|1,0,1]=4 5788 B12R0.1 C=CCOCCOCC(C)CCC 7a_100000037705_100011216630 [0,2,0,0,0,0|1,0,1]=4 5789 B12R0.1 C=COCCOCCC(=O)OCC 34a_100000033082_100000765890 [0,2,0,0,0,0|0,0,2]=4 5790 B12R0.1 CC#CC(=O)CCOCCOCC 1458a_100000763181_100011211534 [0,2,0,0,0,0|1,0,1]=4 5791 B12R0.1 CC#CCCOCCC(=O)OCC 34a_100000750427_100000765890 [0,2,0,0,0,0|1,0,1]=4 5792 B12R0.1 CC(CCN)COCCOCCO 34a_106354213184_100000692535 [0,2,0,0,0,0|2,0,0]=4 5793 B12R0.1 CC/C=C\CCOCC(=O)OCC 34a_100016288707_100000188475 [0,2,0,0,0,0|1,0,1]=4 5794 B12R0.1 CC/C=C\CCOCC(=O)OCC 7a_100016288707_100000188475 [0,2,0,0,0,0|1,0,1]=4 5795 B12R0.1 CC/C=C\CCOCC(C)CCC 34a_100000688023_100015370543 [0,2,0,0,0,0|2,0,0]=4 5796 B12R0.1 CC/C=C\CCOCC(C)CCC 34a_100016288707_100011216630 [0,2,0,0,0,0|2,0,0]=4 5797 B12R0.1 CC/C=C\CCOCC(C)CCC 7a_100000688023_100015370543 [0,2,0,0,0,0|2,0,0]=4 5798 B12R0.1 CC/C=C\CCOCC(C)CCC 7a_100016288707_100011216630 [0,2,0,0,0,0|2,0,0]=4 5799 B12R0.1 CC/C=C\CCOC[C@@H](N)CCC 34a_100000732646_100015370543 [0,2,0,0,0,0|2,0,0]=4 5800 B12R0.1 CC/C=C\COCCC(=O)OCC 34a_100016268518_100000765890 [0,2,0,0,0,0|1,0,1]=4 5801 B12R0.1 CC=CC(=O)CCOCCOCC 1458a_100000210699_100011211534 [0,2,0,0,0,0|1,0,1]=4 5802 B12R0.1 CCC#CCCOCC(=O)OCC 34a_100000036655_100000188475 [0,2,0,0,0,0|1,0,1]=4 5803 B12R0.1 CCC#CCCOCC(=O)OCC 7a_100000036655_100000188475 [0,2,0,0,0,0|1,0,1]=4 5804 B12R0.1 CCC#CCCOCC(C)CCC 34a_100000036655_100011216630 [0,2,0,0,0,0|2,0,0]=4 5805 B12R0.1 CCC#CCCOCC(C)CCC 7a_100000036655_100011216630 [0,2,0,0,0,0|2,0,0]=4 5806 B12R0.1 CCC#CCOCCC(=O)OCC 34a_100000032950_100000765890 [0,2,0,0,0,0|1,0,1]=4 5807 B12R0.1 CCCC(=O)CCOCCOCC 1458a_100000211992_100011211534 [0,2,0,0,0,0|1,0,0]=3 5808 B12R0.1 CCCC(=O)COCCCOCC 7a_100000757476_100000747444 [0,2,0,0,0,0|1,0,1]=4 5809 B12R0.1 CCCC(=O)COCCOCCBr 7a_100000692535_100000747444 [0,2,0,0,0,0|1,0,1]=4 5810 B12R0.1 CCCC(=O)COCCOCCCl 7a_100011215305_100000747444 [0,2,0,0,0,0|1,0,1]=4 5811 B12R0.1 CCCC(=O)COCCOCCF 7a_200015357709_100000747444 [0,2,0,0,0,0|1,0,1]=4 5812 B12R0.1 CCCC(=O)COCCOCCI 7a_100012149058_100000747444 [0,2,0,0,0,0|1,0,1]=4 5813 B12R0.1 CCCC(=O)COCCOCCO 1458a_106645077154_100000210303 [0,2,0,0,0,0|1,0,1]=4 5814 B12R0.1 CCCC(=O)OCOCCOCC 34a_100000210136_100000034017 [0,2,0,0,0,0|1,0,1]=4 5815 B12R0.1 CCCC(C)CCOCCOCC 34a_100011217855_100000210147 [0,2,0,0,0,0|1,0,0]=3 5816 B12R0.1 CCCC(C)CCOCCOCC 7a_100011217855_100011215890 [0,2,0,0,0,0|1,0,0]=3 5817 B12R0.1 CCCC(C)CCOCCSCC 34a_100011217855_100000757381 [0,2,0,0,0,0|1,1,0]=4 5818 B12R0.1 CCCC(C)CCOCCSCC 7a_100011217855_100000757381 [0,2,0,0,0,0|1,1,0]=4 5819 B12R0.1 CCCC(C)CNCCCOCC 2230a_100000210961_100011216630 [0,2,0,0,0,0|2,0,0]=4 5820 B12R0.1 CCCC(C)CNCCCOCC 270004a_100000210961_100000243154 [0,2,0,0,0,0|2,0,0]=4 5821 B12R0.1 CCCC(C)CNCCCOCC 34a_100000210961_100011216630 [0,2,0,0,0,0|2,0,0]=4 5822 B12R0.1 CCCC(C)CNCCOCCO 2230a_100000211614_100011216630 [0,2,0,0,0,0|2,0,0]=4 5823 B12R0.1 CCCC(C)CNCCOCCO 270004a_100000211614_100000243154 [0,2,0,0,0,0|2,0,0]=4 5824 B12R0.1 CCCC(C)CNCCOCCO 34a_100000211614_100011216630 [0,2,0,0,0,0|2,0,0]=4 5825 B12R0.1 CCCC(C)COCCCCCBr 34a_100000746331_100011216630 [0,2,0,0,0,0|2,0,0]=4 5826 B12R0.1 CCCC(C)COCCCCCBr 7a_100000746331_100011216630 [0,2,0,0,0,0|2,0,0]=4 5827 B12R0.1 CCCC(C)COCCCCCCl 34a_100000746330_100011216630 [0,2,0,0,0,0|2,0,0]=4 5828 B12R0.1 CCCC(C)COCCCCCCl 7a_100000746330_100011216630 [0,2,0,0,0,0|2,0,0]=4 5829 B12R0.1 CCCC(C)COCCCCCF 34a_100000688023_100000729378 [0,2,0,0,0,0|2,0,0]=4 5830 B12R0.1 CCCC(C)COCCCCCF 7a_100000688023_100000729378 [0,2,0,0,0,0|2,0,0]=4 5831 B12R0.1 CCCC(C)COCCCCCI 34a_200012148887_100011216630 [0,2,0,0,0,0|2,0,0]=4 5832 B12R0.1 CCCC(C)COCCCCCI 7a_200012148887_100011216630 [0,2,0,0,0,0|2,0,0]=4 5833 B12R0.1 CCCC(C)COCCCCCN 34a_100000762737_100011216630 [0,2,0,0,0,0|2,0,0]=4 5834 B12R0.1 CCCC(C)COCCCCCO 34a_100000688023_100000746330 [0,2,0,0,0,0|2,0,0]=4 5835 B12R0.1 CCCC(C)COCCCCCO 7a_100000688023_100000746330 [0,2,0,0,0,0|2,0,0]=4 5836 B12R0.1 CCCC(C)COCCCCOC 34a_100000688023_100000755781 [0,2,0,0,0,0|2,0,0]=4 5837 B12R0.1 CCCC(C)COCCCCOC 34a_100000740925_100011216630 [0,2,0,0,0,0|2,0,0]=4 5838 B12R0.1 CCCC(C)COCCCCOC 7a_100000688023_100000730899 [0,2,0,0,0,0|2,0,0]=4 5839 B12R0.1 CCCC(C)COCCCCSC 34a_100011217163_100011216630 [0,2,0,0,0,0|2,0,0]=4 5840 B12R0.1 CCCC(C)COCCCCSC 7a_100011217163_100011216630 [0,2,0,0,0,0|2,0,0]=4 5841 B12R0.1 CCCC(C)COCCCOCC 34a_100000688023_100012232248 [0,2,0,0,0,0|1,0,0]=3 5842 B12R0.1 CCCC(C)COCCCOCC 34a_100000757476_100011216630 [0,2,0,0,0,0|1,0,0]=3 5843 B12R0.1 CCCC(C)COCCCOCC 7a_100000688023_100012232248 [0,2,0,0,0,0|1,0,0]=3 5844 B12R0.1 CCCC(C)COCCCOCC 7a_100000757476_100011216630 [0,2,0,0,0,0|1,0,0]=3 5845 B12R0.1 CCCC(C)COCCCSCC 34a_100011216438_100011216630 [0,2,0,0,0,0|1,1,0]=4 5846 B12R0.1 CCCC(C)COCCCSCC 7a_100011216438_100011216630 [0,2,0,0,0,0|1,1,0]=4 5847 B12R0.1 CCCC(C)COCCOCC#N 7a_100000688023_200000047693 [0,2,0,0,0,0|1,0,1]=4 5848 B12R0.1 CCCC(C)COCCOCCBr 34a_100000692535_100011216630 [0,2,0,0,0,0|1,0,0]=3 5849 B12R0.1 CCCC(C)COCCOCCBr 7a_100000692535_100011216630 [0,2,0,0,0,0|1,0,0]=3 5850 B12R0.1 CCCC(C)COCCOCCCl 34a_100011215305_100011216630 [0,2,0,0,0,0|1,0,0]=3 5851 B12R0.1 CCCC(C)COCCOCCCl 7a_100011215305_100011216630 [0,2,0,0,0,0|1,0,0]=3 5852 B12R0.1 CCCC(C)COCCOCCF 34a_200015357709_100011216630 [0,2,0,0,0,0|1,0,0]=3 5853 B12R0.1 CCCC(C)COCCOCCF 7a_200015357709_100011216630 [0,2,0,0,0,0|1,0,0]=3 5854 B12R0.1 CCCC(C)COCCOCCI 34a_100012149058_100011216630 [0,2,0,0,0,0|1,0,0]=3 5855 B12R0.1 CCCC(C)COCCOCCI 7a_100012149058_100011216630 [0,2,0,0,0,0|1,0,0]=3 5856 B12R0.1 CCCC(C)COCCOCCN 34a_100000211614_100011216630 [0,2,0,0,0,0|1,0,0]=3 5857 B12R0.1 CCCC(C)COCCOCCO 34a_100000688023_100000692535 [0,2,0,0,0,0|1,0,0]=3 5858 B12R0.1 CCCC(C)COCCOCCO 7a_100000688023_100011215305 [0,2,0,0,0,0|1,0,0]=3 5859 B12R0.1 CCCC(C)CSCCCOCC 62a_100011216630_100012232248 [0,2,0,0,0,0|1,1,0]=4 5860 B12R0.1 CCCC(C)CSCCCOCC 62a_100012232248_100011216630 [0,2,0,0,0,0|1,1,0]=4 5861 B12R0.1 CCCC(C)CSCCOCCO 62a_100011215305_100011216630 [0,2,0,0,0,0|1,1,0]=4 5862 B12R0.1 CCCC(C)CSCCOCCO 62a_100011216630_100011215305 [0,2,0,0,0,0|1,1,0]=4 5863 B12R0.1 CCCCCCCCC(C)OCC 34a_100000210740_100000210202 [0,2,0,0,0,0|2,0,0]=4 5864 B12R0.1 CCCCCCCCC(C)OCC 7a_100000210740_100000210202 [0,2,0,0,0,0|2,0,0]=4 5865 B12R0.1 CCCCCCOCC(=O)OCC 34a_100000210259_100000188475 [0,2,0,0,0,0|1,0,1]=4 5866 B12R0.1 CCCCCCOCC(=O)OCC 7a_100000210259_100000188475 [0,2,0,0,0,0|1,0,1]=4 5867 B12R0.1 CCCCCCOCC(C)CCC 34a_100000210259_100011216630 [0,2,0,0,0,0|2,0,0]=4 5868 B12R0.1 CCCCCCOCC(C)CCC 34a_100000688023_100000210314 [0,2,0,0,0,0|2,0,0]=4 5869 B12R0.1 CCCCCCOCC(C)CCC 7a_100000210259_100011216630 [0,2,0,0,0,0|2,0,0]=4 5870 B12R0.1 CCCCCCOCC(C)CCC 7a_100000688023_100000210314 [0,2,0,0,0,0|2,0,0]=4 5871 B12R0.1 CCCCCCOC[C@@H](N)CCC 34a_100000732646_100000210314 [0,2,0,0,0,0|2,0,0]=4 5872 B12R0.1 CCCCCNCCC(=O)OCC 2230a_100000209983_100011206558 [0,2,0,0,0,0|2,0,0]=4 5873 B12R0.1 CCCCCOCCC(=O)NCC 7a_100000210253_100000737597 [0,2,0,0,0,0|2,0,0]=4 5874 B12R0.1 CCCCCOCCC(=O)OCC 34a_100000210253_100000765890 [0,2,0,0,0,0|1,0,0]=3 5875 B12R0.1 CCCCCOCCC(=O)OCC 7a_100000210253_100011206558 [0,2,0,0,0,0|1,0,0]=3 5876 B12R0.1 CCCCCOCCC(C)CCC 34a_100011217855_100000718602 [0,2,0,0,0,0|2,0,0]=4 5877 B12R0.1 CCCCCOCCC(C)CCC 7a_100011217855_100000210326 [0,2,0,0,0,0|2,0,0]=4 5878 B12R0.1 CCCCCOCC[C@@H](N)CCC 34a_100015193777_100000718602 [0,2,0,0,0,0|2,0,0]=4 5879 B12R0.1 CCCCCSCCC(=O)OCC 62a_100000210326_100000765890 [0,2,0,0,0,0|1,1,0]=4 5880 B12R0.1 CCCCCSCCC(=O)OCC 62a_100000765890_100000210326 [0,2,0,0,0,0|1,1,0]=4 5881 B12R0.1 CCCCOCOCC(C)CCC 34a_100000688023_100011995733 [0,2,0,0,0,0|2,0,0]=4 5882 B12R0.1 CCCCOCOC[C@@H](N)CCC 34a_100000732646_100011995733 [0,2,0,0,0,0|2,0,0]=4 5883 B12R0.1 CCCN(C)CCOCCOCC 2230a_100000747261_100011211534 [0,2,0,0,0,0|1,0,0]=3 5884 B12R0.1 CCCN(C)CCOCCOCC 269982a_100000747261_100011211534 [0,2,0,0,0,0|1,0,0]=3 5885 B12R0.1 CCCOCCCCC(=O)OCC 34a_100000210258_100000750268 [0,2,0,0,0,0|1,0,1]=4 5886 B12R0.1 CCCOCCNCC(=O)OCC 2230a_100161115042_100000188475 [0,2,0,0,0,0|1,0,1]=4 5887 B12R0.1 CCCOCCNCC(=O)OCC 34a_100161115042_100000188475 [0,2,0,0,0,0|1,0,1]=4 5888 B12R0.1 CCCOCCNCC(C)CCC 2230a_100161115042_100011216630 [0,2,0,0,0,0|2,0,0]=4 5889 B12R0.1 CCCOCCNCC(C)CCC 270004a_100161115042_100000243154 [0,2,0,0,0,0|2,0,0]=4 5890 B12R0.1 CCCOCCNCC(C)CCC 34a_100161115042_100011216630 [0,2,0,0,0,0|2,0,0]=4 5891 B12R0.1 CCCOCCOCC(=O)CCC 7a_100000752267_100000747444 [0,2,0,0,0,0|1,0,1]=4 5892 B12R0.1 CCCOCCOCC(=O)NCC 34a_100000752267_100000183381 [0,2,0,0,0,0|1,0,1]=4 5893 B12R0.1 CCCOCCOCC(=O)NCC 7a_100000752267_100000183381 [0,2,0,0,0,0|1,0,1]=4 5894 B12R0.1 CCCOCCOCC(=O)OCC 34a_100000210258_100000088970 [0,2,0,0,0,0|0,0,1]=3 5895 B12R0.1 CCCOCCOCC(=O)OCC 34a_100000752267_100000188475 [0,2,0,0,0,0|0,0,1]=3 5896 B12R0.1 CCCOCCOCC(=O)OCC 7a_100000752267_100000188475 [0,2,0,0,0,0|0,0,1]=3 5897 B12R0.1 CCCOCCOCC(C)CCC 34a_100000688023_100011215938 [0,2,0,0,0,0|1,0,0]=3 5898 B12R0.1 CCCOCCOCC(C)CCC 34a_100000752267_100011216630 [0,2,0,0,0,0|1,0,0]=3 5899 B12R0.1 CCCOCCOCC(C)CCC 7a_100000688023_100011215938 [0,2,0,0,0,0|1,0,0]=3 5900 B12R0.1 CCCOCCOCC(C)CCC 7a_100000752267_100011216630 [0,2,0,0,0,0|1,0,0]=3 5901 B12R0.1 CCCOCCOCC(C)CCN 34a_106354213184_100011215938 [0,2,0,0,0,0|2,0,0]=4 5902 B12R0.1 CCCOCCOCC(N)COC 34a_100000724102_100011215938 [0,2,0,0,0,0|2,0,0]=4 5903 B12R0.1 CCCOCCOCC(O)COC 34a_100000752267_100011215053 [0,2,0,0,0,0|2,0,0]=4 5904 B12R0.1 CCCOCCOCC(O)COC 7a_100000752267_100011215053 [0,2,0,0,0,0|2,0,0]=4 5905 B12R0.1 CCCOCCOC[C@@H](N)CCC 34a_100000732646_100011215938 [0,2,0,0,0,0|1,0,0]=3 5906 B12R0.1 CCCOCCSCC(=O)OCC 62a_100000188475_100011215938 [0,2,0,0,0,0|0,1,1]=4 5907 B12R0.1 CCCOCCSCC(=O)OCC 62a_100011215938_100000188475 [0,2,0,0,0,0|0,1,1]=4 5908 B12R0.1 CCCOCCSCC(=O)OCC 7a_200000230590_100000210303 [0,2,0,0,0,0|0,1,1]=4 5909 B12R0.1 CCCOCCSCC(C)CCC 62a_100011215938_100011216630 [0,2,0,0,0,0|1,1,0]=4 5910 B12R0.1 CCCOCCSCC(C)CCC 62a_100011216630_100011215938 [0,2,0,0,0,0|1,1,0]=4 5911 B12R0.1 CCCSCCOCC(=O)OCC 34a_200000230433_100000188475 [0,2,0,0,0,0|0,1,1]=4 5912 B12R0.1 CCCSCCOCC(=O)OCC 62a_100000088970_100000210303 [0,2,0,0,0,0|0,1,1]=4 5913 B12R0.1 CCCSCCOCC(=O)OCC 62a_100000210303_100000088970 [0,2,0,0,0,0|0,1,1]=4 5914 B12R0.1 CCCSCCOCC(=O)OCC 7a_200000230433_100000188475 [0,2,0,0,0,0|0,1,1]=4 5915 B12R0.1 CCCSCCOCC(C)CCC 34a_200000230433_100011216630 [0,2,0,0,0,0|1,1,0]=4 5916 B12R0.1 CCCSCCOCC(C)CCC 7a_200000230433_100011216630 [0,2,0,0,0,0|1,1,0]=4 5917 B12R0.1 CCC[C@H](N)CCOCCOCC 34a_100015193777_100000210147 [0,2,0,0,0,0|1,0,0]=3 5918 B12R0.1 CCC[C@H](N)CCOCCSCC 34a_100015193777_100000757381 [0,2,0,0,0,0|1,1,0]=4 5919 B12R0.1 CCC[C@H](N)COCCCCCF 34a_100000732646_100000729378 [0,2,0,0,0,0|2,0,0]=4 5920 B12R0.1 CCC[C@H](N)COCCCCCO 34a_100000732646_100000746330 [0,2,0,0,0,0|2,0,0]=4 5921 B12R0.1 CCC[C@H](N)COCCCCOC 34a_100000732646_100000755781 [0,2,0,0,0,0|2,0,0]=4 5922 B12R0.1 CCC[C@H](N)COCCCOCC 34a_100000732646_100012232248 [0,2,0,0,0,0|1,0,0]=3 5923 B12R0.1 CCC[C@H](N)COCCOCCO 34a_100000732646_100000692535 [0,2,0,0,0,0|1,0,0]=3 5924 B12R0.1 CCNC(=O)CCNCCOCC 2230a_102516460346_100000737597 [0,2,0,0,0,0|2,0,0]=4 5925 B12R0.1 CCNC(=O)CCNCCOCC 34a_100025743525_100000210147 [0,2,0,0,0,0|2,0,0]=4 5926 B12R0.1 CCNC(=O)CCOCCOCC 7a_100000210136_100000737597 [0,2,0,0,0,0|1,0,0]=3 5927 B12R0.1 CCNC(=O)CCOCCSCC 7a_100000212035_100000737597 [0,2,0,0,0,0|1,1,0]=4 5928 B12R0.1 CCNC(=O)CCSCCOCC 62a_100000210147_100000737597 [0,2,0,0,0,0|1,1,0]=4 5929 B12R0.1 CCNC(=O)CCSCCOCC 62a_100000737597_100011215890 [0,2,0,0,0,0|1,1,0]=4 5930 B12R0.1 CCNC(=O)COCCCOCC 34a_100000757476_100000183381 [0,2,0,0,0,0|1,0,1]=4 5931 B12R0.1 CCNC(=O)COCCCOCC 7a_100000757476_100000183381 [0,2,0,0,0,0|1,0,1]=4 5932 B12R0.1 CCNC(=O)COCCOCCBr 34a_100000692535_100000183381 [0,2,0,0,0,0|1,0,1]=4 5933 B12R0.1 CCNC(=O)COCCOCCBr 7a_100000692535_100000183381 [0,2,0,0,0,0|1,0,1]=4 5934 B12R0.1 CCNC(=O)COCCOCCCl 34a_100011215305_100000183381 [0,2,0,0,0,0|1,0,1]=4 5935 B12R0.1 CCNC(=O)COCCOCCCl 7a_100011215305_100000183381 [0,2,0,0,0,0|1,0,1]=4 5936 B12R0.1 CCNC(=O)COCCOCCF 34a_200015357709_100000183381 [0,2,0,0,0,0|1,0,1]=4 5937 B12R0.1 CCNC(=O)COCCOCCF 7a_200015357709_100000183381 [0,2,0,0,0,0|1,0,1]=4 5938 B12R0.1 CCNC(=O)COCCOCCI 34a_100012149058_100000183381 [0,2,0,0,0,0|1,0,1]=4 5939 B12R0.1 CCNC(=O)COCCOCCI 7a_100012149058_100000183381 [0,2,0,0,0,0|1,0,1]=4 5940 B12R0.1 CCNC(=O)COCCOCCN 34a_100000211614_100000183381 [0,2,0,0,0,0|1,0,1]=4 5941 B12R0.1 CCNC(=O)COCCOCCO 240690a_100015525214_106645077154 [0,2,0,0,0,0|1,0,1]=4 5942 B12R0.1 CCNCCCCCC(=O)OCC 2230a_100015525214_100000755133 [0,2,0,0,0,0|2,0,0]=4 5943 B12R0.1 CCNCCCOCC(=O)OCC 2230a_100015525214_100009893628 [0,2,0,0,0,0|1,0,1]=4 5944 B12R0.1 CCOC(=O)CCCCCOCF 7a_100011214988_100015361967 [0,2,0,0,0,0|2,0,0]=4 5945 B12R0.1 CCOC(=O)CCCCCSCC 62a_100000210202_100000755133 [0,2,0,0,0,0|1,1,0]=4 5946 B12R0.1 CCOC(=O)CCCCCSCC 62a_100000755133_100000210202 [0,2,0,0,0,0|1,1,0]=4 5947 B12R0.1 CCOC(=O)CCCCOCCBr 34a_100000211926_100000750268 [0,2,0,0,0,0|1,0,1]=4 5948 B12R0.1 CCOC(=O)CCCCOCCN 34a_100000210304_100000750268 [0,2,0,0,0,0|1,0,1]=4 5949 B12R0.1 CCOC(=O)CCNCCSCC 2230a_100000106463_100011206558 [0,2,0,0,0,0|1,1,0]=4 5950 B12R0.1 CCOC(=O)CCOCCCCBr 34a_100011216708_100000765890 [0,2,0,0,0,0|2,0,0]=4 5951 B12R0.1 CCOC(=O)CCOCCCCCl 34a_100000210776_100000765890 [0,2,0,0,0,0|2,0,0]=4 5952 B12R0.1 CCOC(=O)CCOCCCCCl 7a_100000210776_100011206558 [0,2,0,0,0,0|2,0,0]=4 5953 B12R0.1 CCOC(=O)CCOCCCCF 34a_100011995726_100000765890 [0,2,0,0,0,0|2,0,0]=4 5954 B12R0.1 CCOC(=O)CCOCCCCF 7a_100011995726_100011206558 [0,2,0,0,0,0|2,0,0]=4 5955 B12R0.1 CCOC(=O)CCOCCCCI 34a_200012148704_100000765890 [0,2,0,0,0,0|2,0,0]=4 5956 B12R0.1 CCOC(=O)CCOCCCCN 34a_100000750430_100000765890 [0,2,0,0,0,0|2,0,0]=4 5957 B12R0.1 CCOC(=O)CCOCCCNC 34a_100000213112_100000765890 [0,2,0,0,0,0|2,0,0]=4 5958 B12R0.1 CCOC(=O)CCOCCCOC 34a_100000740835_100000765890 [0,2,0,0,0,0|2,0,0]=4 5959 B12R0.1 CCOC(=O)CCOCCCSC 34a_100000690336_100000765890 [0,2,0,0,0,0|2,0,0]=4 5960 B12R0.1 CCOC(=O)CCOCCCSC 7a_100000690336_100011206558 [0,2,0,0,0,0|2,0,0]=4 5961 B12R0.1 CCOC(=O)CCOCCSCC 34a_100000212035_100000765890 [0,2,0,0,0,0|0,1,0]=3 5962 B12R0.1 CCOC(=O)CCOCCSCC 7a_100000212035_100011206558 [0,2,0,0,0,0|0,1,0]=3 5963 B12R0.1 CCOC(=O)CCSCCSCC 62a_100000757381_100000765890 [0,2,0,0,0,0|0,2,0]=4 5964 B12R0.1 CCOC(=O)CCSCCSCC 62a_100000765890_100000757381 [0,2,0,0,0,0|0,2,0]=4 5965 B12R0.1 CCOC(=O)CNCCOCCO 2230a_100000211614_100000188475 [0,2,0,0,0,0|1,0,1]=4 5966 B12R0.1 CCOC(=O)CNCCOCCO 34a_100000211614_100000188475 [0,2,0,0,0,0|1,0,1]=4 5967 B12R0.1 CCOC(=O)COCCCCCBr 34a_100000746331_100000188475 [0,2,0,0,0,0|1,0,1]=4 5968 B12R0.1 CCOC(=O)COCCCCCBr 7a_100000746331_100000188475 [0,2,0,0,0,0|1,0,1]=4 5969 B12R0.1 CCOC(=O)COCCCCCCl 34a_100000746330_100000188475 [0,2,0,0,0,0|1,0,1]=4 5970 B12R0.1 CCOC(=O)COCCCCCCl 7a_100000746330_100000188475 [0,2,0,0,0,0|1,0,1]=4 5971 B12R0.1 CCOC(=O)COCCCCCI 34a_200012148887_100000188475 [0,2,0,0,0,0|1,0,1]=4 5972 B12R0.1 CCOC(=O)COCCCCCI 7a_200012148887_100000188475 [0,2,0,0,0,0|1,0,1]=4 5973 B12R0.1 CCOC(=O)COCCCCCN 34a_100000762737_100000188475 [0,2,0,0,0,0|1,0,1]=4 5974 B12R0.1 CCOC(=O)COCCCCOC 34a_100000740925_100000188475 [0,2,0,0,0,0|1,0,1]=4 5975 B12R0.1 CCOC(=O)COCCCCSC 34a_100011217163_100000188475 [0,2,0,0,0,0|1,0,1]=4 5976 B12R0.1 CCOC(=O)COCCCCSC 7a_100011217163_100000188475 [0,2,0,0,0,0|1,0,1]=4 5977 B12R0.1 CCOC(=O)COCCCSCC 34a_100011216438_100000188475 [0,2,0,0,0,0|0,1,1]=4 5978 B12R0.1 CCOC(=O)COCCCSCC 62a_100000210202_100009893628 [0,2,0,0,0,0|0,1,1]=4 5979 B12R0.1 CCOC(=O)COCCCSCC 62a_100009893628_100000210202 [0,2,0,0,0,0|0,1,1]=4 5980 B12R0.1 CCOC(=O)COCCCSCC 7a_100011216438_100000188475 [0,2,0,0,0,0|0,1,1]=4 5981 B12R0.1 CCOC(=O)COCCNCCF 34a_100000724931_100000088970 [0,2,0,0,0,0|1,0,1]=4 5982 B12R0.1 CCOC(=O)COCCNCCO 2230a_100016997473_100000088970 [0,2,0,0,0,0|1,0,1]=4 5983 B12R0.1 CCOC(=O)COCCNCCO 34a_100016990907_100000088970 [0,2,0,0,0,0|1,0,1]=4 5984 B12R0.1 CCOC(=O)COCCOCCBr 34a_100000211926_100000088970 [0,2,0,0,0,0|0,0,1]=3 5985 B12R0.1 CCOC(=O)COCCOCCBr 34a_100000692535_100000188475 [0,2,0,0,0,0|0,0,1]=3 5986 B12R0.1 CCOC(=O)COCCOCCBr 7a_100000692535_100000188475 [0,2,0,0,0,0|0,0,1]=3 5987 B12R0.1 CCOC(=O)COCCOCCCl 34a_100011215305_100000188475 [0,2,0,0,0,0|0,0,1]=3 5988 B12R0.1 CCOC(=O)COCCOCCCl 7a_100011215305_100000188475 [0,2,0,0,0,0|0,0,1]=3 5989 B12R0.1 CCOC(=O)COCCOCCF 34a_200015357709_100000188475 [0,2,0,0,0,0|0,0,1]=3 5990 B12R0.1 CCOC(=O)COCCOCCF 7a_200015357709_100000188475 [0,2,0,0,0,0|0,0,1]=3 5991 B12R0.1 CCOC(=O)COCCOCCI 34a_100012149058_100000188475 [0,2,0,0,0,0|0,0,1]=3 5992 B12R0.1 CCOC(=O)COCCOCCI 7a_100012149058_100000188475 [0,2,0,0,0,0|0,0,1]=3 5993 B12R0.1 CCOC(=O)COCCOCCN 34a_100000210304_100000088970 [0,2,0,0,0,0|0,0,1]=3 5994 B12R0.1 CCOC(=O)COCCOCCN 34a_100000211614_100000188475 [0,2,0,0,0,0|0,0,1]=3 5995 B12R0.1 CCOC(=O)COCCSCCF 62a_100000088970_100011217306 [0,2,0,0,0,0|0,1,1]=4 5996 B12R0.1 CCOC(=O)COCCSCCF 62a_100011217306_100000088970 [0,2,0,0,0,0|0,1,1]=4 5997 B12R0.1 CCOC(=O)COCCSCCO 62a_100000088970_100000211926 [0,2,0,0,0,0|0,1,1]=4 5998 B12R0.1 CCOC(=O)COCCSCCO 62a_100000211926_100000088970 [0,2,0,0,0,0|0,1,1]=4 5999 B12R0.1 CCOC(=O)COCCSCOC 62a_100000088970_100000766300 [0,2,0,0,0,0|0,1,1]=4 6000 B12R0.1 CCOC(=O)COCCSCOC 62a_100000766300_100000088970 [0,2,0,0,0,0|0,1,1]=4 6001 B12R0.1 CCOC(=O)COCCSCSC 62a_100000088970_100011218213 [0,2,0,0,0,0|0,1,1]=4 6002 B12R0.1 CCOC(=O)COCCSCSC 62a_100011218213_100000088970 [0,2,0,0,0,0|0,1,1]=4 6003 B12R0.1 CCOC(=O)CSCCOCCF 7a_200000230590_100011217306 [0,2,0,0,0,0|0,1,1]=4 6004 B12R0.1 CCOC(=O)CSCCOCCO 62a_100000188475_100011215305 [0,2,0,0,0,0|0,1,1]=4 6005 B12R0.1 CCOC(=O)CSCCOCCO 62a_100011215305_100000188475 [0,2,0,0,0,0|0,1,1]=4 6006 B12R0.1 CCOC(=O)CSCCOCCO 7a_200000230590_100000211926 [0,2,0,0,0,0|0,1,1]=4 6007 B12R0.1 CCOCCCCCC(=O)OCC 34a_100121572206_100000755133 [0,2,0,0,0,0|1,0,0]=3 6008 B12R0.1 CCOCCCCCC(=O)OCC 7a_100011214988_100000210202 [0,2,0,0,0,0|1,0,0]=3 6009 B12R0.1 CCOCCCNCC(=O)OCC 2230a_100000210961_100000188475 [0,2,0,0,0,0|1,0,1]=4 6010 B12R0.1 CCOCCCNCC(=O)OCC 34a_100000210961_100000188475 [0,2,0,0,0,0|1,0,1]=4 6011 B12R0.1 CCOCCCOCC(=O)OCC 34a_100000757476_100000188475 [0,2,0,0,0,0|0,0,1]=3 6012 B12R0.1 CCOCCCOCC(=O)OCC 34a_100121572206_100009893628 [0,2,0,0,0,0|0,0,1]=3 6013 B12R0.1 CCOCCCOCC(=O)OCC 7a_100000757476_100000188475 [0,2,0,0,0,0|0,0,1]=3 6014 B12R0.1 CCOCCCOCC(C)CCN 34a_106354213184_100012232248 [0,2,0,0,0,0|2,0,0]=4 6015 B12R0.1 CCOCCCOCC(N)COC 34a_100000724102_100012232248 [0,2,0,0,0,0|2,0,0]=4 6016 B12R0.1 CCOCCCOCC(O)COC 34a_100000757476_100011215053 [0,2,0,0,0,0|2,0,0]=4 6017 B12R0.1 CCOCCCOCC(O)COC 7a_100000757476_100011215053 [0,2,0,0,0,0|2,0,0]=4 6018 B12R0.1 CCOCCCSCC(=O)OCC 62a_100000188475_100012232248 [0,2,0,0,0,0|0,1,1]=4 6019 B12R0.1 CCOCCCSCC(=O)OCC 62a_100012232248_100000188475 [0,2,0,0,0,0|0,1,1]=4 6020 B12R0.1 CCOCCNCCC(=O)OCC 2230a_102516460346_100011206558 [0,2,0,0,0,0|1,0,0]=3 6021 B12R0.1 CCOCCNCCC(=O)OCC 34a_102516460346_100000765890 [0,2,0,0,0,0|1,0,0]=3 6022 B12R0.1 CCOCCOCCC(=O)CC#N 1458a_100051588842_100011211534 [0,2,0,0,0,0|1,0,1]=4 6023 B12R0.1 CCOCCOCCC(=O)CCO 1458a_100011216618_100011211534 [0,2,0,0,0,0|1,0,0]=3 6024 B12R0.1 CCOCCOCCC(=O)COC 1458a_100000210968_100011211534 [0,2,0,0,0,0|1,0,0]=3 6025 B12R0.1 CCOCCOCCC(=O)CSC 1458a_100000184570_100011211534 [0,2,0,0,0,0|1,0,0]=3 6026 B12R0.1 CCOCCOCCC(=O)OCC 34a_100000210136_100000765890 [0,2,0,0,0,0|0,0,0]=2 6027 B12R0.1 CCOCCOCCC(=O)OCC 7a_100000210136_100011206558 [0,2,0,0,0,0|0,0,0]=2 6028 B12R0.1 CCOCCOCCN(C)CC#N 2230a_100000748184_100011211534 [0,2,0,0,0,0|1,0,1]=4 6029 B12R0.1 CCOCCOCCN(C)CCO 2230a_100000210263_100011211534 [0,2,0,0,0,0|1,0,0]=3 6030 B12R0.1 CCOCCOCCN(C)CCO 269982a_100000210263_100011211534 [0,2,0,0,0,0|1,0,0]=3 6031 B12R0.1 CCOCCSCCC(=O)OCC 62a_100000210147_100000765890 [0,2,0,0,0,0|0,1,0]=3 6032 B12R0.1 CCOCCSCCC(=O)OCC 62a_100000765890_100011215890 [0,2,0,0,0,0|0,1,0]=3 6033 B12R0.1 CCOCCSCOC(=O)OCC 62a_100000210147_100000075025 [0,2,0,0,0,0|0,1,1]=4 6034 B12R0.1 CCOCSCCCC(=O)OCC 62a_100000739092_100009991533 [0,2,0,0,0,0|1,0,1]=4 6035 B12R0.1 CCOCSCCCC(=O)OCC 62a_100009991533_100000739092 [0,2,0,0,0,0|1,0,1]=4 6036 B12R0.1 COCC(N)COCCOCCO 34a_100000724102_100000692535 [0,2,0,0,0,0|2,0,0]=4 6037 B12R0.1 COCC(O)COCCOCCBr 34a_100000692535_100011215053 [0,2,0,0,0,0|2,0,0]=4 6038 B12R0.1 COCC(O)COCCOCCBr 7a_100000692535_100011215053 [0,2,0,0,0,0|2,0,0]=4 6039 B12R0.1 COCC(O)COCCOCCCl 34a_100011215305_100011215053 [0,2,0,0,0,0|2,0,0]=4 6040 B12R0.1 COCC(O)COCCOCCCl 7a_100011215305_100011215053 [0,2,0,0,0,0|2,0,0]=4 6041 B12R0.1 COCC(O)COCCOCCF 34a_200015357709_100011215053 [0,2,0,0,0,0|2,0,0]=4 6042 B12R0.1 COCC(O)COCCOCCF 7a_200015357709_100011215053 [0,2,0,0,0,0|2,0,0]=4 6043 B12R0.1 COCC(O)COCCOCCI 34a_100012149058_100011215053 [0,2,0,0,0,0|2,0,0]=4 6044 B12R0.1 COCC(O)COCCOCCI 7a_100012149058_100011215053 [0,2,0,0,0,0|2,0,0]=4 6045 B12R0.1 COCC(O)COCCOCCN 34a_100000211614_100011215053 [0,2,0,0,0,0|2,0,0]=4 6046 B12R0.5 C#CCCCCCCCCOCC 34a_100000065265_100000210202 [0,2,0,0,0,0|2,0,0]=4 6047 B12R0.5 C#CCCCCCCCCOCC 7a_100000065265_100000210202 [0,2,0,0,0,0|2,0,0]=4 6048 B12R0.5 C#CCCCCCNCCOCC 2230a_102516460346_100012094781 [0,2,0,0,0,0|2,0,0]=4 6049 B12R0.5 C#CCCCCCNCCOCC 34a_102516460346_100012094781 [0,2,0,0,0,0|2,0,0]=4 6050 B12R0.5 C#CCCCCCOCCCCC 34a_100000210253_100012094781 [0,2,0,0,0,0|2,0,0]=4 6051 B12R0.5 C#CCCCCCOCCCCC 34a_100000766912_100000718602 [0,2,0,0,0,0|2,0,0]=4 6052 B12R0.5 C#CCCCCCOCCCCC 7a_100000210253_100012094781 [0,2,0,0,0,0|2,0,0]=4 6053 B12R0.5 C#CCCCCCOCCCCC 7a_100000766912_100000210326 [0,2,0,0,0,0|2,0,0]=4 6054 B12R0.5 C#CCCCCCOCCOCC 34a_100000210136_100012094781 [0,2,0,0,0,0|1,0,0]=3 6055 B12R0.5 C#CCCCCCOCCOCC 34a_100000766912_100000210147 [0,2,0,0,0,0|1,0,0]=3 6056 B12R0.5 C#CCCCCCOCCOCC 7a_100000210136_100012094781 [0,2,0,0,0,0|1,0,0]=3 6057 B12R0.5 C#CCCCCCOCCOCC 7a_100000766912_100011215890 [0,2,0,0,0,0|1,0,0]=3 6058 B12R0.5 C#CCCCCCOCCSCC 34a_100000212035_100012094781 [0,2,0,0,0,0|1,1,0]=4 6059 B12R0.5 C#CCCCCCOCCSCC 34a_100000766912_100000757381 [0,2,0,0,0,0|1,1,0]=4 6060 B12R0.5 C#CCCCCCOCCSCC 7a_100000212035_100012094781 [0,2,0,0,0,0|1,1,0]=4 6061 B12R0.5 C#CCCCCCOCCSCC 7a_100000766912_100000757381 [0,2,0,0,0,0|1,1,0]=4 6062 B12R0.5 C#CCCCCCSCCOCC 62a_100000210147_100012094781 [0,2,0,0,0,0|1,1,0]=4 6063 B12R0.5 C#CCCCCCSCCOCC 62a_100012094781_100011215890 [0,2,0,0,0,0|1,1,0]=4 6064 B12R0.5 C#CCCCCOCCCOCC 34a_100000757476_100010269958 [0,2,0,0,0,0|1,0,1]=4 6065 B12R0.5 C#CCCCCOCCCOCC 34a_100000766709_100012232248 [0,2,0,0,0,0|1,0,1]=4 6066 B12R0.5 C#CCCCCOCCCOCC 7a_100000757476_100010269958 [0,2,0,0,0,0|1,0,1]=4 6067 B12R0.5 C#CCCCCOCCCOCC 7a_100000766709_100012232248 [0,2,0,0,0,0|1,0,1]=4 6068 B12R0.5 C#CCCCCOCCOCCBr 34a_100000692535_100010269958 [0,2,0,0,0,0|1,0,1]=4 6069 B12R0.5 C#CCCCCOCCOCCBr 7a_100000692535_100010269958 [0,2,0,0,0,0|1,0,1]=4 6070 B12R0.5 C#CCCCCOCCOCCC 34a_100000752267_100010269958 [0,2,0,0,0,0|1,0,1]=4 6071 B12R0.5 C#CCCCCOCCOCCC 34a_100000766709_100011215938 [0,2,0,0,0,0|1,0,1]=4 6072 B12R0.5 C#CCCCCOCCOCCC 7a_100000752267_100010269958 [0,2,0,0,0,0|1,0,1]=4 6073 B12R0.5 C#CCCCCOCCOCCC 7a_100000766709_100011215938 [0,2,0,0,0,0|1,0,1]=4 6074 B12R0.5 C#CCCCCOCCOCCCl 34a_100011215305_100010269958 [0,2,0,0,0,0|1,0,1]=4 6075 B12R0.5 C#CCCCCOCCOCCCl 7a_100011215305_100010269958 [0,2,0,0,0,0|1,0,1]=4 6076 B12R0.5 C#CCCCCOCCOCCF 34a_200015357709_100010269958 [0,2,0,0,0,0|1,0,1]=4 6077 B12R0.5 C#CCCCCOCCOCCF 7a_200015357709_100010269958 [0,2,0,0,0,0|1,0,1]=4 6078 B12R0.5 C#CCCCCOCCOCCI 34a_100012149058_100010269958 [0,2,0,0,0,0|1,0,1]=4 6079 B12R0.5 C#CCCCCOCCOCCI 7a_100012149058_100010269958 [0,2,0,0,0,0|1,0,1]=4 6080 B12R0.5 C#CCCCCOCCOCCN 34a_100000211614_100010269958 [0,2,0,0,0,0|1,0,1]=4 6081 B12R0.5 C#CCCCCOCCOCCO 34a_100000766709_100000692535 [0,2,0,0,0,0|1,0,1]=4 6082 B12R0.5 C#CCCCCOCCOCCO 7a_100000766709_100011215305 [0,2,0,0,0,0|1,0,1]=4 6083 B12R0.5 C#CCCNCCOCCOCC 2230a_100102712874_100000688953 [0,2,0,0,0,0|1,0,0]=3 6084 B12R0.5 C#CCCNCCOCCOCC 34a_100000755551_100011211534 [0,2,0,0,0,0|1,0,0]=3 6085 B12R0.5 C#CCCNCCOCCOCC 34a_100102712874_100000688953 [0,2,0,0,0,0|1,0,0]=3 6086 B12R0.5 C#CCCOCCCCCCCC 34a_100000210232_100000688953 [0,2,0,0,0,0|2,0,0]=4 6087 B12R0.5 C#CCCOCCCCCCCC 34a_100011215631_100000210759 [0,2,0,0,0,0|2,0,0]=4 6088 B12R0.5 C#CCCOCCCCCCCC 7a_100000210232_100000688953 [0,2,0,0,0,0|2,0,0]=4 6089 B12R0.5 C#CCCOCCNCCCCC 34a_100000224656_100000688953 [0,2,0,0,0,0|2,0,0]=4 6090 B12R0.5 C#CCCOCCOCCCCC 34a_100011215259_100000688953 [0,2,0,0,0,0|1,0,0]=3 6091 B12R0.5 C#CCCOCCOCCCCC 7a_100011215259_100000688953 [0,2,0,0,0,0|1,0,0]=3 6092 B12R0.5 C#CCCOCCOCCOC=C 34a_100000039918_100000688953 [0,2,0,0,0,0|0,0,2]=4 6093 B12R0.5 C#CCCOCCOCCOC=C 7a_100000039918_100000688953 [0,2,0,0,0,0|0,0,2]=4 6094 B12R0.5 C#CCCOCCOCCOCC 34a_100000210240_100000688953 [0,2,0,0,0,0|0,0,0]=2 6095 B12R0.5 C#CCCOCCOCCOCC 34a_100011215631_100011211534 [0,2,0,0,0,0|0,0,0]=2 6096 B12R0.5 C#CCCOCCOCCOCC 7a_100000210240_100000688953 [0,2,0,0,0,0|0,0,0]=2 6097 B12R0.5 C#CCCSCCOCCOCC 62a_100000688953_100011211534 [0,2,0,0,0,0|0,1,0]=3 6098 B12R0.5 C#CCCSCCOCCOCC 62a_100011211534_100000688953 [0,2,0,0,0,0|0,1,0]=3 6099 B12R0.5 C#CCNCCOCCOCCC 2230a_200011904461_100000038162 [0,2,0,0,0,0|1,0,1]=4 6100 B12R0.5 C#CCNCCOCCOCCC 34a_200011904461_100000184674 [0,2,0,0,0,0|1,0,1]=4 6101 B12R0.5 C#CCNCCOCCOCCO 2230a_100011998139_100000038162 [0,2,0,0,0,0|1,0,1]=4 6102 B12R0.5 C#CCNCCOCCOCCO 34a_100000212058_100000032323 [0,2,0,0,0,0|1,0,1]=4 6103 B12R0.5 C#CCNCCOCCOCCO 34a_100011998139_100000184674 [0,2,0,0,0,0|1,0,1]=4 6104 B12R0.5 C#CCOCCCCCCOCC 34a_200011021349_100000210202 [0,2,0,0,0,0|1,0,1]=4 6105 B12R0.5 C#CCOCCCCCCOCC 7a_200011021349_100000210202 [0,2,0,0,0,0|1,0,1]=4 6106 B12R0.5 C#CCOCCNCCCOCC 2230a_100000210961_100010402529 [0,2,0,0,0,0|1,0,1]=4 6107 B12R0.5 C#CCOCCNCCCOCC 2230a_100000700922_100012232248 [0,2,0,0,0,0|1,0,1]=4 6108 B12R0.5 C#CCOCCNCCCOCC 34a_100000210961_100010402529 [0,2,0,0,0,0|1,0,1]=4 6109 B12R0.5 C#CCOCCNCCCOCC 34a_100000700922_100012232248 [0,2,0,0,0,0|1,0,1]=4 6110 B12R0.5 C#CCOCCNCCOCCC 2230a_100000700922_100011215938 [0,2,0,0,0,0|1,0,1]=4 6111 B12R0.5 C#CCOCCNCCOCCC 2230a_100161115042_100010402529 [0,2,0,0,0,0|1,0,1]=4 6112 B12R0.5 C#CCOCCNCCOCCC 34a_100000700922_100011215938 [0,2,0,0,0,0|1,0,1]=4 6113 B12R0.5 C#CCOCCNCCOCCC 34a_100161115042_100010402529 [0,2,0,0,0,0|1,0,1]=4 6114 B12R0.5 C#CCOCCNCCOCCO 2230a_100000211614_100010402529 [0,2,0,0,0,0|1,0,1]=4 6115 B12R0.5 C#CCOCCNCCOCCO 2230a_100000700922_100011215305 [0,2,0,0,0,0|1,0,1]=4 6116 B12R0.5 C#CCOCCNCCOCCO 34a_100000211614_100010402529 [0,2,0,0,0,0|1,0,1]=4 6117 B12R0.5 C#CCOCCNCCOCCO 34a_100000700922_100000692535 [0,2,0,0,0,0|1,0,1]=4 6118 B12R0.5 C#CCOCCOCC/C=C\CC 34a_100000054580_100015370543 [0,2,0,0,0,0|1,0,1]=4 6119 B12R0.5 C#CCOCCOCC/C=C\CC 34a_100016288707_100010402529 [0,2,0,0,0,0|1,0,1]=4 6120 B12R0.5 C#CCOCCOCC/C=C\CC 7a_100000054580_100015370543 [0,2,0,0,0,0|1,0,1]=4 6121 B12R0.5 C#CCOCCOCC/C=C\CC 7a_100016288707_100010402529 [0,2,0,0,0,0|1,0,1]=4 6122 B12R0.5 C#CCOCCOCCC#CCC 34a_100000036655_100010402529 [0,2,0,0,0,0|1,0,1]=4 6123 B12R0.5 C#CCOCCOCCC#CCC 7a_100000036655_100010402529 [0,2,0,0,0,0|1,0,1]=4 6124 B12R0.5 C#CCOCCOCCCCCBr 34a_100000746331_100010402529 [0,2,0,0,0,0|1,0,1]=4 6125 B12R0.5 C#CCOCCOCCCCCBr 7a_100000746331_100010402529 [0,2,0,0,0,0|1,0,1]=4 6126 B12R0.5 C#CCOCCOCCCCCC 34a_100000054580_100000210314 [0,2,0,0,0,0|1,0,1]=4 6127 B12R0.5 C#CCOCCOCCCCCC 34a_100000210259_100010402529 [0,2,0,0,0,0|1,0,1]=4 6128 B12R0.5 C#CCOCCOCCCCCC 34a_100000691444_100000184674 [0,2,0,0,0,0|1,0,1]=4 6129 B12R0.5 C#CCOCCOCCCCCC 7a_100000054580_100000210314 [0,2,0,0,0,0|1,0,1]=4 6130 B12R0.5 C#CCOCCOCCCCCC 7a_100000210259_100010402529 [0,2,0,0,0,0|1,0,1]=4 6131 B12R0.5 C#CCOCCOCCCCCC 7a_100000691444_100000038162 [0,2,0,0,0,0|1,0,1]=4 6132 B12R0.5 C#CCOCCOCCCCCCl 34a_100000746330_100010402529 [0,2,0,0,0,0|1,0,1]=4 6133 B12R0.5 C#CCOCCOCCCCCCl 7a_100000746330_100010402529 [0,2,0,0,0,0|1,0,1]=4 6134 B12R0.5 C#CCOCCOCCCCCF 34a_100000054580_100000729378 [0,2,0,0,0,0|1,0,1]=4 6135 B12R0.5 C#CCOCCOCCCCCF 7a_100000054580_100000729378 [0,2,0,0,0,0|1,0,1]=4 6136 B12R0.5 C#CCOCCOCCCCCI 34a_200012148887_100010402529 [0,2,0,0,0,0|1,0,1]=4 6137 B12R0.5 C#CCOCCOCCCCCI 7a_200012148887_100010402529 [0,2,0,0,0,0|1,0,1]=4 6138 B12R0.5 C#CCOCCOCCCCCN 34a_100000762737_100010402529 [0,2,0,0,0,0|1,0,1]=4 6139 B12R0.5 C#CCOCCOCCCCCO 34a_100000054580_100000746330 [0,2,0,0,0,0|1,0,1]=4 6140 B12R0.5 C#CCOCCOCCCCCO 7a_100000054580_100000746330 [0,2,0,0,0,0|1,0,1]=4 6141 B12R0.5 C#CCOCCOCCCCOC 34a_100000054580_100000755781 [0,2,0,0,0,0|1,0,1]=4 6142 B12R0.5 C#CCOCCOCCCCOC 34a_100000740925_100010402529 [0,2,0,0,0,0|1,0,1]=4 6143 B12R0.5 C#CCOCCOCCCCOC 7a_100000054580_100000730899 [0,2,0,0,0,0|1,0,1]=4 6144 B12R0.5 C#CCOCCOCCCCSC 34a_100011217163_100010402529 [0,2,0,0,0,0|1,0,1]=4 6145 B12R0.5 C#CCOCCOCCCCSC 7a_100011217163_100010402529 [0,2,0,0,0,0|1,0,1]=4 6146 B12R0.5 C#CCOCCOCCCOCC 34a_100000054580_100012232248 [0,2,0,0,0,0|0,0,1]=3 6147 B12R0.5 C#CCOCCOCCCOCC 34a_100000757476_100010402529 [0,2,0,0,0,0|0,0,1]=3 6148 B12R0.5 C#CCOCCOCCCOCC 7a_100000054580_100012232248 [0,2,0,0,0,0|0,0,1]=3 6149 B12R0.5 C#CCOCCOCCCOCC 7a_100000757476_100010402529 [0,2,0,0,0,0|0,0,1]=3 6150 B12R0.5 C#CCOCCOCCCSCC 34a_100011216438_100010402529 [0,2,0,0,0,0|0,1,1]=4 6151 B12R0.5 C#CCOCCOCCCSCC 7a_100011216438_100010402529 [0,2,0,0,0,0|0,1,1]=4 6152 B12R0.5 C#CCOCCOCCNCCC 2230a_100000056377_100000210303 [0,2,0,0,0,0|1,0,1]=4 6153 B12R0.5 C#CCOCCOCCNCCC 34a_100000056377_100000210303 [0,2,0,0,0,0|1,0,1]=4 6154 B12R0.5 C#CCOCCOCCNCCF 2230a_100000056377_100011217306 [0,2,0,0,0,0|1,0,1]=4 6155 B12R0.5 C#CCOCCOCCNCCF 34a_100000056377_100011217306 [0,2,0,0,0,0|1,0,1]=4 6156 B12R0.5 C#CCOCCOCCNCCF 34a_100000724931_100010408581 [0,2,0,0,0,0|1,0,1]=4 6157 B12R0.5 C#CCOCCOCCNCCO 2230a_100000056377_100000211926 [0,2,0,0,0,0|1,0,1]=4 6158 B12R0.5 C#CCOCCOCCNCCO 2230a_100016997473_100010408581 [0,2,0,0,0,0|1,0,1]=4 6159 B12R0.5 C#CCOCCOCCNCCO 34a_100000056377_100000211926 [0,2,0,0,0,0|1,0,1]=4 6160 B12R0.5 C#CCOCCOCCNCCO 34a_100016990907_100010408581 [0,2,0,0,0,0|1,0,1]=4 6161 B12R0.5 C#CCOCCOCCNCOC 2230a_100000056377_100000766300 [0,2,0,0,0,0|1,0,1]=4 6162 B12R0.5 C#CCOCCOCCNCSC 2230a_100000056377_100011218213 [0,2,0,0,0,0|1,0,1]=4 6163 B12R0.5 C#CCOCCOCCNCSC 34a_100000056377_100011218213 [0,2,0,0,0,0|1,0,1]=4 6164 B12R0.5 C#CCOCCOCCOCC#C 34a_100000041007_100000184674 [0,2,0,0,0,0|0,0,2]=4 6165 B12R0.5 C#CCOCCOCCOCC#C 34a_100000054580_100010402529 [0,2,0,0,0,0|0,0,2]=4 6166 B12R0.5 C#CCOCCOCCOCC#C 34a_100000210247_100010408581 [0,2,0,0,0,0|0,0,2]=4 6167 B12R0.5 C#CCOCCOCCOCC#C 7a_100000041007_100000038162 [0,2,0,0,0,0|0,0,2]=4 6168 B12R0.5 C#CCOCCOCCOCC#C 7a_100000054580_100010402529 [0,2,0,0,0,0|0,0,2]=4 6169 B12R0.5 C#CCOCCOCCOCC#N 7a_100000041007_100011215382 [0,2,0,0,0,0|0,0,2]=4 6170 B12R0.5 C#CCOCCOCCOCC#N 7a_100000054580_200000047693 [0,2,0,0,0,0|0,0,2]=4 6171 B12R0.5 C#CCOCCOCCOCC=C 34a_100000037705_100010402529 [0,2,0,0,0,0|0,0,2]=4 6172 B12R0.5 C#CCOCCOCCOCC=C 34a_100000041007_100015514636 [0,2,0,0,0,0|0,0,2]=4 6173 B12R0.5 C#CCOCCOCCOCC=C 34a_100000065479_100000184674 [0,2,0,0,0,0|0,0,2]=4 6174 B12R0.5 C#CCOCCOCCOCC=C 34a_200000210373_100010408581 [0,2,0,0,0,0|0,0,2]=4 6175 B12R0.5 C#CCOCCOCCOCC=C 7a_100000037705_100010402529 [0,2,0,0,0,0|0,0,2]=4 6176 B12R0.5 C#CCOCCOCCOCC=C 7a_100000041007_100015514636 [0,2,0,0,0,0|0,0,2]=4 6177 B12R0.5 C#CCOCCOCCOCC=C 7a_100000065479_100000038162 [0,2,0,0,0,0|0,0,2]=4 6178 B12R0.5 C#CCOCCOCCOCC=O 34a_100000041007_200009817547 [0,2,0,0,0,0|0,0,2]=4 6179 B12R0.5 C#CCOCCOCCOCC=O 7a_100000041007_200015260668 [0,2,0,0,0,0|0,0,2]=4 6180 B12R0.5 C#CCOCCOCCOCCBr 34a_100000211926_100010408581 [0,2,0,0,0,0|0,0,1]=3 6181 B12R0.5 C#CCOCCOCCOCCBr 34a_100000692535_100010402529 [0,2,0,0,0,0|0,0,1]=3 6182 B12R0.5 C#CCOCCOCCOCCBr 34a_100010132937_100000184674 [0,2,0,0,0,0|0,0,1]=3 6183 B12R0.5 C#CCOCCOCCOCCBr 7a_100000692535_100010402529 [0,2,0,0,0,0|0,0,1]=3 6184 B12R0.5 C#CCOCCOCCOCCBr 7a_100010132937_100000038162 [0,2,0,0,0,0|0,0,1]=3 6185 B12R0.5 C#CCOCCOCCOCCC 34a_100000041007_100000210303 [0,2,0,0,0,0|0,0,1]=3 6186 B12R0.5 C#CCOCCOCCOCCC 34a_100000054580_100011215938 [0,2,0,0,0,0|0,0,1]=3 6187 B12R0.5 C#CCOCCOCCOCCC 34a_100000210258_100010408581 [0,2,0,0,0,0|0,0,1]=3 6188 B12R0.5 C#CCOCCOCCOCCC 34a_100000752267_100010402529 [0,2,0,0,0,0|0,0,1]=3 6189 B12R0.5 C#CCOCCOCCOCCC 7a_100000041007_100000210303 [0,2,0,0,0,0|0,0,1]=3 6190 B12R0.5 C#CCOCCOCCOCCC 7a_100000054580_100011215938 [0,2,0,0,0,0|0,0,1]=3 6191 B12R0.5 C#CCOCCOCCOCCC 7a_100000752267_100010402529 [0,2,0,0,0,0|0,0,1]=3 6192 B12R0.5 C#CCOCCOCCOCCCl 34a_100000032323_100000184674 [0,2,0,0,0,0|0,0,1]=3 6193 B12R0.5 C#CCOCCOCCOCCCl 34a_100011215305_100010402529 [0,2,0,0,0,0|0,0,1]=3 6194 B12R0.5 C#CCOCCOCCOCCCl 7a_100000032323_100000038162 [0,2,0,0,0,0|0,0,1]=3 6195 B12R0.5 C#CCOCCOCCOCCCl 7a_100011215305_100010402529 [0,2,0,0,0,0|0,0,1]=3 6196 B12R0.5 C#CCOCCOCCOCCF 34a_100000041007_100011217306 [0,2,0,0,0,0|0,0,1]=3 6197 B12R0.5 C#CCOCCOCCOCCF 34a_200015357709_100010402529 [0,2,0,0,0,0|0,0,1]=3 6198 B12R0.5 C#CCOCCOCCOCCF 7a_100000041007_100011217306 [0,2,0,0,0,0|0,0,1]=3 6199 B12R0.5 C#CCOCCOCCOCCF 7a_200015357709_100010402529 [0,2,0,0,0,0|0,0,1]=3 6200 B12R0.5 C#CCOCCOCCOCCI 34a_100012149058_100010402529 [0,2,0,0,0,0|0,0,1]=3 6201 B12R0.5 C#CCOCCOCCOCCI 7a_100012149058_100010402529 [0,2,0,0,0,0|0,0,1]=3 6202 B12R0.5 C#CCOCCOCCOCCN 34a_100000210304_100010408581 [0,2,0,0,0,0|0,0,1]=3 6203 B12R0.5 C#CCOCCOCCOCCN 34a_100000211614_100010402529 [0,2,0,0,0,0|0,0,1]=3 6204 B12R0.5 C#CCOCCOCCOCCN 34a_100011998139_100000184674 [0,2,0,0,0,0|0,0,1]=3 6205 B12R0.5 C#CCOCCOCCOCCO 34a_100000041007_100000211926 [0,2,0,0,0,0|0,0,1]=3 6206 B12R0.5 C#CCOCCOCCOCCO 34a_100000054580_100000692535 [0,2,0,0,0,0|0,0,1]=3 6207 B12R0.5 C#CCOCCOCCOCCO 34a_100000210247_100000032323 [0,2,0,0,0,0|0,0,1]=3 6208 B12R0.5 C#CCOCCOCCOCCO 7a_100000041007_100000211926 [0,2,0,0,0,0|0,0,1]=3 6209 B12R0.5 C#CCOCCOCCOCCO 7a_100000054580_100011215305 [0,2,0,0,0,0|0,0,1]=3 6210 B12R0.5 C#CCOCCOCCOCSC 34a_100000041007_100011218213 [0,2,0,0,0,0|0,0,1]=3 6211 B12R0.5 C#CCOCCOCCSCCC 34a_200000230433_100010402529 [0,2,0,0,0,0|0,1,1]=4 6212 B12R0.5 C#CCOCCOCCSCCC 62a_100000210303_100010408581 [0,2,0,0,0,0|0,1,1]=4 6213 B12R0.5 C#CCOCCOCCSCCC 62a_100010408581_100000210303 [0,2,0,0,0,0|0,1,1]=4 6214 B12R0.5 C#CCOCCOCCSCCC 7a_200000230433_100010402529 [0,2,0,0,0,0|0,1,1]=4 6215 B12R0.5 C#CCOCCOCCSCCF 62a_100010408581_100011217306 [0,2,0,0,0,0|0,1,1]=4 6216 B12R0.5 C#CCOCCOCCSCCF 62a_100011217306_100010408581 [0,2,0,0,0,0|0,1,1]=4 6217 B12R0.5 C#CCOCCOCCSCCO 62a_100000211926_100010408581 [0,2,0,0,0,0|0,1,1]=4 6218 B12R0.5 C#CCOCCOCCSCCO 62a_100010408581_100000211926 [0,2,0,0,0,0|0,1,1]=4 6219 B12R0.5 C#CCOCCOCCSCOC 62a_100000766300_100010408581 [0,2,0,0,0,0|0,1,1]=4 6220 B12R0.5 C#CCOCCOCCSCOC 62a_100010408581_100000766300 [0,2,0,0,0,0|0,1,1]=4 6221 B12R0.5 C#CCOCCOCCSCSC 62a_100010408581_100011218213 [0,2,0,0,0,0|0,1,1]=4 6222 B12R0.5 C#CCOCCOCCSCSC 62a_100011218213_100010408581 [0,2,0,0,0,0|0,1,1]=4 6223 B12R0.5 C#CCOCCOCOCCCC 34a_100000054580_100011995733 [0,2,0,0,0,0|1,0,1]=4 6224 B12R0.5 C#CCOCCSCCCOCC 62a_100010402529_100012232248 [0,2,0,0,0,0|0,1,1]=4 6225 B12R0.5 C#CCOCCSCCCOCC 62a_100012232248_100010402529 [0,2,0,0,0,0|0,1,1]=4 6226 B12R0.5 C#CCOCCSCCOCCC 62a_100010402529_100011215938 [0,2,0,0,0,0|0,1,1]=4 6227 B12R0.5 C#CCOCCSCCOCCC 62a_100011215938_100010402529 [0,2,0,0,0,0|0,1,1]=4 6228 B12R0.5 C#CCOCCSCCOCCO 62a_100010402529_100011215305 [0,2,0,0,0,0|0,1,1]=4 6229 B12R0.5 C#CCOCCSCCOCCO 62a_100011215305_100010402529 [0,2,0,0,0,0|0,1,1]=4 6230 B12R0.5 C#CCSCCOCCOCCO 62a_100000038162_100000032323 [0,2,0,0,0,0|0,1,1]=4 6231 B12R0.5 C/C=C/CCOCCOCCCC 34a_100016278192_100000743108 [0,2,0,0,0,0|1,0,1]=4 6232 B12R0.5 C/C=C/CCOCCOCCOC 34a_100016278192_100000695917 [0,2,0,0,0,0|1,0,1]=4 6233 B12R0.5 C/C=C/CNCCOCCOCC 34a_100102712874_100102629194 [0,2,0,0,0,0|1,0,0]=3 6234 B12R0.5 C/C=C/COCCCCCCCC 34a_100000210232_100102629194 [0,2,0,0,0,0|2,0,0]=4 6235 B12R0.5 C/C=C/COCCCCCCCC 34a_100016270725_100000210759 [0,2,0,0,0,0|2,0,0]=4 6236 B12R0.5 C/C=C/COCCCCCCCC 7a_100000210232_100102629194 [0,2,0,0,0,0|2,0,0]=4 6237 B12R0.5 C/C=C/COCCNCCCCC 34a_100000224656_100102629194 [0,2,0,0,0,0|2,0,0]=4 6238 B12R0.5 C/C=C/COCCOCCCCC 34a_100011215259_100102629194 [0,2,0,0,0,0|1,0,0]=3 6239 B12R0.5 C/C=C/COCCOCCCCC 7a_100011215259_100102629194 [0,2,0,0,0,0|1,0,0]=3 6240 B12R0.5 C/C=C/COCCOCCOCC 34a_100000210240_100102629194 [0,2,0,0,0,0|0,0,0]=2 6241 B12R0.5 C/C=C/COCCOCCOCC 34a_100016270725_100011211534 [0,2,0,0,0,0|0,0,0]=2 6242 B12R0.5 C/C=C/COCCOCCOCC 7a_100000210240_100102629194 [0,2,0,0,0,0|0,0,0]=2 6243 B12R0.5 C/C=C/CSCCOCCOCC 62a_100011211534_100102629194 [0,2,0,0,0,0|0,1,0]=3 6244 B12R0.5 C/C=C/CSCCOCCOCC 62a_100102629194_100011211534 [0,2,0,0,0,0|0,1,0]=3 6245 B12R0.5 C=CCCCCCCCCOCC 34a_100011215194_100000210202 [0,2,0,0,0,0|2,0,0]=4 6246 B12R0.5 C=CCCCCCCCCOCC 34a_100121572206_100011933949 [0,2,0,0,0,0|2,0,0]=4 6247 B12R0.5 C=CCCCCCCCCOCC 7a_100011215194_100000210202 [0,2,0,0,0,0|2,0,0]=4 6248 B12R0.5 C=CCCCCCNCCOCC 2230a_102516460346_100000700193 [0,2,0,0,0,0|2,0,0]=4 6249 B12R0.5 C=CCCCCCNCCOCC 34a_102516460346_100000700193 [0,2,0,0,0,0|2,0,0]=4 6250 B12R0.5 C=CCCCCCOCCCCC 34a_100000210253_100000700193 [0,2,0,0,0,0|2,0,0]=4 6251 B12R0.5 C=CCCCCCOCCCCC 34a_100011216702_100000718602 [0,2,0,0,0,0|2,0,0]=4 6252 B12R0.5 C=CCCCCCOCCCCC 7a_100000210253_100000700193 [0,2,0,0,0,0|2,0,0]=4 6253 B12R0.5 C=CCCCCCOCCCCC 7a_100011216702_100000210326 [0,2,0,0,0,0|2,0,0]=4 6254 B12R0.5 C=CCCCCCOCCOCC 34a_100000210136_100000700193 [0,2,0,0,0,0|1,0,0]=3 6255 B12R0.5 C=CCCCCCOCCOCC 34a_100011216702_100000210147 [0,2,0,0,0,0|1,0,0]=3 6256 B12R0.5 C=CCCCCCOCCOCC 7a_100000210136_100000700193 [0,2,0,0,0,0|1,0,0]=3 6257 B12R0.5 C=CCCCCCOCCOCC 7a_100011216702_100011215890 [0,2,0,0,0,0|1,0,0]=3 6258 B12R0.5 C=CCCCCCOCCSCC 34a_100000212035_100000700193 [0,2,0,0,0,0|1,1,0]=4 6259 B12R0.5 C=CCCCCCOCCSCC 34a_100011216702_100000757381 [0,2,0,0,0,0|1,1,0]=4 6260 B12R0.5 C=CCCCCCOCCSCC 7a_100000212035_100000700193 [0,2,0,0,0,0|1,1,0]=4 6261 B12R0.5 C=CCCCCCOCCSCC 7a_100011216702_100000757381 [0,2,0,0,0,0|1,1,0]=4 6262 B12R0.5 C=CCCCCCSCCOCC 62a_100000210147_100000700193 [0,2,0,0,0,0|1,1,0]=4 6263 B12R0.5 C=CCCCCCSCCOCC 62a_100000700193_100011215890 [0,2,0,0,0,0|1,1,0]=4 6264 B12R0.5 C=CCCCCOCCCOCC 34a_100000757476_100011215482 [0,2,0,0,0,0|1,0,1]=4 6265 B12R0.5 C=CCCCCOCCCOCC 34a_100000766645_100012232248 [0,2,0,0,0,0|1,0,1]=4 6266 B12R0.5 C=CCCCCOCCCOCC 7a_100000757476_100011215482 [0,2,0,0,0,0|1,0,1]=4 6267 B12R0.5 C=CCCCCOCCCOCC 7a_100000766645_100012232248 [0,2,0,0,0,0|1,0,1]=4 6268 B12R0.5 C=CCCCCOCCOCCBr 34a_100000692535_100011215482 [0,2,0,0,0,0|1,0,1]=4 6269 B12R0.5 C=CCCCCOCCOCCBr 7a_100000692535_100011215482 [0,2,0,0,0,0|1,0,1]=4 6270 B12R0.5 C=CCCCCOCCOCCC 34a_100000752267_100011215482 [0,2,0,0,0,0|1,0,1]=4 6271 B12R0.5 C=CCCCCOCCOCCC 34a_100000766645_100011215938 [0,2,0,0,0,0|1,0,1]=4 6272 B12R0.5 C=CCCCCOCCOCCC 7a_100000752267_100011215482 [0,2,0,0,0,0|1,0,1]=4 6273 B12R0.5 C=CCCCCOCCOCCC 7a_100000766645_100011215938 [0,2,0,0,0,0|1,0,1]=4 6274 B12R0.5 C=CCCCCOCCOCCCl 34a_100011215305_100011215482 [0,2,0,0,0,0|1,0,1]=4 6275 B12R0.5 C=CCCCCOCCOCCCl 7a_100011215305_100011215482 [0,2,0,0,0,0|1,0,1]=4 6276 B12R0.5 C=CCCCCOCCOCCF 34a_200015357709_100011215482 [0,2,0,0,0,0|1,0,1]=4 6277 B12R0.5 C=CCCCCOCCOCCF 7a_200015357709_100011215482 [0,2,0,0,0,0|1,0,1]=4 6278 B12R0.5 C=CCCCCOCCOCCI 34a_100012149058_100011215482 [0,2,0,0,0,0|1,0,1]=4 6279 B12R0.5 C=CCCCCOCCOCCI 7a_100012149058_100011215482 [0,2,0,0,0,0|1,0,1]=4 6280 B12R0.5 C=CCCCCOCCOCCN 34a_100000211614_100011215482 [0,2,0,0,0,0|1,0,1]=4 6281 B12R0.5 C=CCCCCOCCOCCO 34a_100000766645_100000692535 [0,2,0,0,0,0|1,0,1]=4 6282 B12R0.5 C=CCCCCOCCOCCO 7a_100000766645_100011215305 [0,2,0,0,0,0|1,0,1]=4 6283 B12R0.5 C=CCCNCCOCCOCC 2230a_100015191253_100011211534 [0,2,0,0,0,0|1,0,0]=3 6284 B12R0.5 C=CCCNCCOCCOCC 2230a_100102712874_100000754431 [0,2,0,0,0,0|1,0,0]=3 6285 B12R0.5 C=CCCNCCOCCOCC 34a_100102712874_100000754431 [0,2,0,0,0,0|1,0,0]=3 6286 B12R0.5 C=CCCOCCCCCCCC 34a_100000210232_100000754431 [0,2,0,0,0,0|2,0,0]=4 6287 B12R0.5 C=CCCOCCCCCCCC 34a_100011205117_100000210759 [0,2,0,0,0,0|2,0,0]=4 6288 B12R0.5 C=CCCOCCCCCCCC 7a_100000210232_100000754431 [0,2,0,0,0,0|2,0,0]=4 6289 B12R0.5 C=CCCOCCNCCCCC 34a_100000224656_100000754431 [0,2,0,0,0,0|2,0,0]=4 6290 B12R0.5 C=CCCOCCOCCCCC 34a_100011215259_100000754431 [0,2,0,0,0,0|1,0,0]=3 6291 B12R0.5 C=CCCOCCOCCCCC 7a_100011215259_100000754431 [0,2,0,0,0,0|1,0,0]=3 6292 B12R0.5 C=CCCOCCOCCOC=C 34a_100000039918_100000754431 [0,2,0,0,0,0|0,0,2]=4 6293 B12R0.5 C=CCCOCCOCCOC=C 7a_100000039918_100000754431 [0,2,0,0,0,0|0,0,2]=4 6294 B12R0.5 C=CCCOCCOCCOCC 34a_100000210240_100000754431 [0,2,0,0,0,0|0,0,0]=2 6295 B12R0.5 C=CCCOCCOCCOCC 34a_100011205117_100011211534 [0,2,0,0,0,0|0,0,0]=2 6296 B12R0.5 C=CCCOCCOCCOCC 7a_100000210240_100000754431 [0,2,0,0,0,0|0,0,0]=2 6297 B12R0.5 C=CCCSCCOCCOCC 62a_100000754431_100011211534 [0,2,0,0,0,0|0,1,0]=3 6298 B12R0.5 C=CCCSCCOCCOCC 62a_100011211534_100000754431 [0,2,0,0,0,0|0,1,0]=3 6299 B12R0.5 C=CCNCCOCCOCCC 2230a_200011904461_100000210623 [0,2,0,0,0,0|1,0,1]=4 6300 B12R0.5 C=CCNCCOCCOCCC 34a_200011904461_100015514636 [0,2,0,0,0,0|1,0,1]=4 6301 B12R0.5 C=CCNCCOCCOCCO 2230a_100011998139_100000210623 [0,2,0,0,0,0|1,0,1]=4 6302 B12R0.5 C=CCNCCOCCOCCO 2230a_100020586998_100000032323 [0,2,0,0,0,0|1,0,1]=4 6303 B12R0.5 C=CCNCCOCCOCCO 34a_100011998139_100015514636 [0,2,0,0,0,0|1,0,1]=4 6304 B12R0.5 C=CCOCCOCC/C=C\CC 34a_100000037705_100015370543 [0,2,0,0,0,0|1,0,1]=4 6305 B12R0.5 C=CCOCCOCC/C=C\CC 7a_100000037705_100015370543 [0,2,0,0,0,0|1,0,1]=4 6306 B12R0.5 C=CCOCCOCCCCCC 34a_100000037705_100000210314 [0,2,0,0,0,0|1,0,1]=4 6307 B12R0.5 C=CCOCCOCCCCCC 34a_100000691444_100015514636 [0,2,0,0,0,0|1,0,1]=4 6308 B12R0.5 C=CCOCCOCCCCCC 7a_100000037705_100000210314 [0,2,0,0,0,0|1,0,1]=4 6309 B12R0.5 C=CCOCCOCCCCCC 7a_100000691444_100015514636 [0,2,0,0,0,0|1,0,1]=4 6310 B12R0.5 C=CCOCCOCCCCCF 34a_100000037705_100000729378 [0,2,0,0,0,0|1,0,1]=4 6311 B12R0.5 C=CCOCCOCCCCCF 7a_100000037705_100000729378 [0,2,0,0,0,0|1,0,1]=4 6312 B12R0.5 C=CCOCCOCCCCCO 34a_100000037705_100000746330 [0,2,0,0,0,0|1,0,1]=4 6313 B12R0.5 C=CCOCCOCCCCCO 7a_100000037705_100000746330 [0,2,0,0,0,0|1,0,1]=4 6314 B12R0.5 C=CCOCCOCCCCOC 34a_100000037705_100000755781 [0,2,0,0,0,0|1,0,1]=4 6315 B12R0.5 C=CCOCCOCCCCOC 7a_100000037705_100000730899 [0,2,0,0,0,0|1,0,1]=4 6316 B12R0.5 C=CCOCCOCCCOCC 34a_100000037705_100012232248 [0,2,0,0,0,0|0,0,1]=3 6317 B12R0.5 C=CCOCCOCCCOCC 7a_100000037705_100012232248 [0,2,0,0,0,0|0,0,1]=3 6318 B12R0.5 C=CCOCCOCCOCC#N 7a_100000037705_200000047693 [0,2,0,0,0,0|0,0,2]=4 6319 B12R0.5 C=CCOCCOCCOCC#N 7a_100000065479_100011215382 [0,2,0,0,0,0|0,0,2]=4 6320 B12R0.5 C=CCOCCOCCOCC=C 34a_100000065479_100015514636 [0,2,0,0,0,0|0,0,2]=4 6321 B12R0.5 C=CCOCCOCCOCC=C 7a_100000065479_100015514636 [0,2,0,0,0,0|0,0,2]=4 6322 B12R0.5 C=CCOCCOCCOCC=O 34a_100000065479_200009817547 [0,2,0,0,0,0|0,0,2]=4 6323 B12R0.5 C=CCOCCOCCOCC=O 7a_100000065479_200015260668 [0,2,0,0,0,0|0,0,2]=4 6324 B12R0.5 C=CCOCCOCCOCCBr 34a_100010132937_100015514636 [0,2,0,0,0,0|0,0,1]=3 6325 B12R0.5 C=CCOCCOCCOCCBr 7a_100010132937_100015514636 [0,2,0,0,0,0|0,0,1]=3 6326 B12R0.5 C=CCOCCOCCOCCC 34a_100000037705_100011215938 [0,2,0,0,0,0|0,0,1]=3 6327 B12R0.5 C=CCOCCOCCOCCC 34a_100000065479_100000210303 [0,2,0,0,0,0|0,0,1]=3 6328 B12R0.5 C=CCOCCOCCOCCC 7a_100000037705_100011215938 [0,2,0,0,0,0|0,0,1]=3 6329 B12R0.5 C=CCOCCOCCOCCC 7a_100000065479_100000210303 [0,2,0,0,0,0|0,0,1]=3 6330 B12R0.5 C=CCOCCOCCOCCCl 34a_100000032323_100015514636 [0,2,0,0,0,0|0,0,1]=3 6331 B12R0.5 C=CCOCCOCCOCCCl 7a_100000032323_100015514636 [0,2,0,0,0,0|0,0,1]=3 6332 B12R0.5 C=CCOCCOCCOCCF 34a_100000065479_100011217306 [0,2,0,0,0,0|0,0,1]=3 6333 B12R0.5 C=CCOCCOCCOCCF 7a_100000065479_100011217306 [0,2,0,0,0,0|0,0,1]=3 6334 B12R0.5 C=CCOCCOCCOCCN 34a_100011998139_100015514636 [0,2,0,0,0,0|0,0,1]=3 6335 B12R0.5 C=CCOCCOCCOCCO 34a_100000037705_100000692535 [0,2,0,0,0,0|0,0,1]=3 6336 B12R0.5 C=CCOCCOCCOCCO 34a_100000065479_100000211926 [0,2,0,0,0,0|0,0,1]=3 6337 B12R0.5 C=CCOCCOCCOCCO 34a_200000210373_100000032323 [0,2,0,0,0,0|0,0,1]=3 6338 B12R0.5 C=CCOCCOCCOCCO 7a_100000037705_100011215305 [0,2,0,0,0,0|0,0,1]=3 6339 B12R0.5 C=CCOCCOCCOCCO 7a_100000065479_100000211926 [0,2,0,0,0,0|0,0,1]=3 6340 B12R0.5 C=CCOCCOCCOCSC 34a_100000065479_100011218213 [0,2,0,0,0,0|0,0,1]=3 6341 B12R0.5 C=CCOCCOCOCCCC 34a_100000037705_100011995733 [0,2,0,0,0,0|1,0,1]=4 6342 B12R0.5 C=CCSCCOCCOCCO 62a_100000032323_100000210623 [0,2,0,0,0,0|0,1,1]=4 6343 B12R0.5 C=CCSCCOCCOCCO 62a_100000210623_100000032323 [0,2,0,0,0,0|0,1,1]=4 6344 B12R0.5 C=COCCCCOCCOCC 34a_100000031558_100000210147 [0,2,0,0,0,0|0,0,2]=4 6345 B12R0.5 C=COCCCCOCCOCC 7a_100000031558_100011215890 [0,2,0,0,0,0|0,0,2]=4 6346 B12R0.5 C=COCCOCCOC/C=C/C 34a_100000039918_100102629194 [0,2,0,0,0,0|0,0,2]=4 6347 B12R0.5 C=COCCOCCOC/C=C/C 7a_100000039918_100102629194 [0,2,0,0,0,0|0,0,2]=4 6348 B12R0.5 C=COCCOCCOCC#CC 34a_100000039918_100000748600 [0,2,0,0,0,0|0,0,2]=4 6349 B12R0.5 C=COCCOCCOCC#CC 7a_100000039918_100000748600 [0,2,0,0,0,0|0,0,2]=4 6350 B12R0.5 C=COCCOCCOCC=CC 34a_100000039918_100000070051 [0,2,0,0,0,0|0,0,2]=4 6351 B12R0.5 C=COCCOCCOCC=CC 7a_100000039918_100000070051 [0,2,0,0,0,0|0,0,2]=4 6352 B12R0.5 C=COCCOCCOCCC#N 7a_100000039918_100000184422 [0,2,0,0,0,0|0,0,2]=4 6353 B12R0.5 C=COCCOCCOCCCC 34a_100000033082_100000743108 [0,2,0,0,0,0|0,0,2]=4 6354 B12R0.5 C=COCCOCCOCCCC 34a_100000039918_100000210210 [0,2,0,0,0,0|0,0,2]=4 6355 B12R0.5 C=COCCOCCOCCCC 34a_100000210238_100000039644 [0,2,0,0,0,0|0,0,2]=4 6356 B12R0.5 C=COCCOCCOCCCC 7a_100000039918_100000210211 [0,2,0,0,0,0|0,0,2]=4 6357 B12R0.5 C=COCCOCCOCCCC 7a_100000210238_100000039644 [0,2,0,0,0,0|0,0,2]=4 6358 B12R0.5 C=COCCOCCOCCCF 34a_100000039918_100011934791 [0,2,0,0,0,0|0,0,2]=4 6359 B12R0.5 C=COCCOCCOCCCF 7a_100000039918_100011934791 [0,2,0,0,0,0|0,0,2]=4 6360 B12R0.5 C=COCCOCCOCCCO 34a_100000039918_100000230001 [0,2,0,0,0,0|0,0,2]=4 6361 B12R0.5 C=COCCOCCOCCCO 7a_100000039918_100011215043 [0,2,0,0,0,0|0,0,2]=4 6362 B12R0.5 C=COCCOCCOCCNC 34a_100000228057_100000039644 [0,2,0,0,0,0|0,0,2]=4 6363 B12R0.5 C=COCCOCCOCCOC 34a_100000033082_100000695917 [0,2,0,0,0,0|0,0,2]=4 6364 B12R0.5 C=COCCOCCOCCOC 34a_100000039918_100011201679 [0,2,0,0,0,0|0,0,2]=4 6365 B12R0.5 C=COCCOCCOCCOC 34a_100011215163_100000039644 [0,2,0,0,0,0|0,0,2]=4 6366 B12R0.5 C=COCCOCCOCCOC 7a_100000039918_100000233755 [0,2,0,0,0,0|0,0,2]=4 6367 B12R0.5 C=COCCOCCOCCOC 7a_100011215163_100000039644 [0,2,0,0,0,0|0,0,2]=4 6368 B12R0.5 C=COCCOCCOCCSC 34a_100000039918_100000212216 [0,2,0,0,0,0|0,0,2]=4 6369 B12R0.5 C=COCCOCCOCCSC 7a_100000039918_100000212216 [0,2,0,0,0,0|0,0,2]=4 6370 B12R0.5 CC#CCCOCCOCCCC 34a_100000750427_100000743108 [0,2,0,0,0,0|1,0,1]=4 6371 B12R0.5 CC#CCCOCCOCCOC 34a_100000750427_100000695917 [0,2,0,0,0,0|1,0,1]=4 6372 B12R0.5 CC#CCNCCOCCOCC 2230a_100000685387_100011211534 [0,2,0,0,0,0|1,0,0]=3 6373 B12R0.5 CC#CCNCCOCCOCC 2230a_100102712874_100000748600 [0,2,0,0,0,0|1,0,0]=3 6374 B12R0.5 CC#CCNCCOCCOCC 34a_100000685387_100011211534 [0,2,0,0,0,0|1,0,0]=3 6375 B12R0.5 CC#CCNCCOCCOCC 34a_100102712874_100000748600 [0,2,0,0,0,0|1,0,0]=3 6376 B12R0.5 CC#CCOCCCCCCCC 34a_100000210232_100000748600 [0,2,0,0,0,0|2,0,0]=4 6377 B12R0.5 CC#CCOCCCCCCCC 34a_100000761923_100000210759 [0,2,0,0,0,0|2,0,0]=4 6378 B12R0.5 CC#CCOCCCCCCCC 7a_100000210232_100000748600 [0,2,0,0,0,0|2,0,0]=4 6379 B12R0.5 CC#CCOCCNCCCCC 34a_100000224656_100000748600 [0,2,0,0,0,0|2,0,0]=4 6380 B12R0.5 CC#CCOCCOCCCCC 34a_100011215259_100000748600 [0,2,0,0,0,0|1,0,0]=3 6381 B12R0.5 CC#CCOCCOCCCCC 7a_100011215259_100000748600 [0,2,0,0,0,0|1,0,0]=3 6382 B12R0.5 CC#CCOCCOCCOCC 34a_100000210240_100000748600 [0,2,0,0,0,0|0,0,0]=2 6383 B12R0.5 CC#CCOCCOCCOCC 34a_100000761923_100011211534 [0,2,0,0,0,0|0,0,0]=2 6384 B12R0.5 CC#CCOCCOCCOCC 7a_100000210240_100000748600 [0,2,0,0,0,0|0,0,0]=2 6385 B12R0.5 CC#CCSCCOCCOCC 62a_100000748600_100011211534 [0,2,0,0,0,0|0,1,0]=3 6386 B12R0.5 CC#CCSCCOCCOCC 62a_100011211534_100000748600 [0,2,0,0,0,0|0,1,0]=3 6387 B12R0.5 CC/C=C/CCCOCCCCC 34a_100016287902_100000718602 [0,2,0,0,0,0|2,0,0]=4 6388 B12R0.5 CC/C=C/CCCOCCCCC 7a_100016287902_100000210326 [0,2,0,0,0,0|2,0,0]=4 6389 B12R0.5 CC/C=C/CCCOCCOCC 34a_100016287902_100000210147 [0,2,0,0,0,0|1,0,0]=3 6390 B12R0.5 CC/C=C/CCCOCCOCC 7a_100016287902_100011215890 [0,2,0,0,0,0|1,0,0]=3 6391 B12R0.5 CC/C=C/CCCOCCSCC 34a_100016287902_100000757381 [0,2,0,0,0,0|1,1,0]=4 6392 B12R0.5 CC/C=C/CCCOCCSCC 7a_100016287902_100000757381 [0,2,0,0,0,0|1,1,0]=4 6393 B12R0.5 CC/C=C\CCCCCOCCC 34a_100016268722_100000210303 [0,2,0,0,0,0|2,0,0]=4 6394 B12R0.5 CC/C=C\CCCCCOCCC 7a_100016268722_100000210303 [0,2,0,0,0,0|2,0,0]=4 6395 B12R0.5 CC/C=C\CCCCCOCCF 34a_100016268722_100011217306 [0,2,0,0,0,0|2,0,0]=4 6396 B12R0.5 CC/C=C\CCCCCOCCF 7a_100016268722_100011217306 [0,2,0,0,0,0|2,0,0]=4 6397 B12R0.5 CC/C=C\CCCCCOCCO 34a_100016268722_100000211926 [0,2,0,0,0,0|2,0,0]=4 6398 B12R0.5 CC/C=C\CCCCCOCCO 7a_100016268722_100000211926 [0,2,0,0,0,0|2,0,0]=4 6399 B12R0.5 CC/C=C\CCCCCOCSC 34a_100016268722_100011218213 [0,2,0,0,0,0|2,0,0]=4 6400 B12R0.5 CC/C=C\CCNCCCOCC 2230a_100000210961_100015370543 [0,2,0,0,0,0|2,0,0]=4 6401 B12R0.5 CC/C=C\CCNCCCOCC 34a_100000210961_100015370543 [0,2,0,0,0,0|2,0,0]=4 6402 B12R0.5 CC/C=C\CCNCCOCCC 2230a_100161115042_100015370543 [0,2,0,0,0,0|2,0,0]=4 6403 B12R0.5 CC/C=C\CCNCCOCCC 34a_100161115042_100015370543 [0,2,0,0,0,0|2,0,0]=4 6404 B12R0.5 CC/C=C\CCNCCOCCO 2230a_100000211614_100015370543 [0,2,0,0,0,0|2,0,0]=4 6405 B12R0.5 CC/C=C\CCNCCOCCO 34a_100000211614_100015370543 [0,2,0,0,0,0|2,0,0]=4 6406 B12R0.5 CC/C=C\CCOCC/C=C\CC 34a_100016288707_100015370543 [0,2,0,0,0,0|2,0,0]=4 6407 B12R0.5 CC/C=C\CCOCC/C=C\CC 7a_100016288707_100015370543 [0,2,0,0,0,0|2,0,0]=4 6408 B12R0.5 CC/C=C\CCOCCCCCBr 34a_100000746331_100015370543 [0,2,0,0,0,0|2,0,0]=4 6409 B12R0.5 CC/C=C\CCOCCCCCBr 7a_100000746331_100015370543 [0,2,0,0,0,0|2,0,0]=4 6410 B12R0.5 CC/C=C\CCOCCCCCC 34a_100000210259_100015370543 [0,2,0,0,0,0|2,0,0]=4 6411 B12R0.5 CC/C=C\CCOCCCCCC 34a_100016288707_100000210314 [0,2,0,0,0,0|2,0,0]=4 6412 B12R0.5 CC/C=C\CCOCCCCCC 7a_100000210259_100015370543 [0,2,0,0,0,0|2,0,0]=4 6413 B12R0.5 CC/C=C\CCOCCCCCC 7a_100016288707_100000210314 [0,2,0,0,0,0|2,0,0]=4 6414 B12R0.5 CC/C=C\CCOCCCCCCl 34a_100000746330_100015370543 [0,2,0,0,0,0|2,0,0]=4 6415 B12R0.5 CC/C=C\CCOCCCCCCl 7a_100000746330_100015370543 [0,2,0,0,0,0|2,0,0]=4 6416 B12R0.5 CC/C=C\CCOCCCCCF 34a_100016288707_100000729378 [0,2,0,0,0,0|2,0,0]=4 6417 B12R0.5 CC/C=C\CCOCCCCCF 7a_100016288707_100000729378 [0,2,0,0,0,0|2,0,0]=4 6418 B12R0.5 CC/C=C\CCOCCCCCI 34a_200012148887_100015370543 [0,2,0,0,0,0|2,0,0]=4 6419 B12R0.5 CC/C=C\CCOCCCCCI 7a_200012148887_100015370543 [0,2,0,0,0,0|2,0,0]=4 6420 B12R0.5 CC/C=C\CCOCCCCCN 34a_100000762737_100015370543 [0,2,0,0,0,0|2,0,0]=4 6421 B12R0.5 CC/C=C\CCOCCCCCO 34a_100016288707_100000746330 [0,2,0,0,0,0|2,0,0]=4 6422 B12R0.5 CC/C=C\CCOCCCCCO 7a_100016288707_100000746330 [0,2,0,0,0,0|2,0,0]=4 6423 B12R0.5 CC/C=C\CCOCCCCOC 34a_100000740925_100015370543 [0,2,0,0,0,0|2,0,0]=4 6424 B12R0.5 CC/C=C\CCOCCCCOC 34a_100016288707_100000755781 [0,2,0,0,0,0|2,0,0]=4 6425 B12R0.5 CC/C=C\CCOCCCCOC 7a_100016288707_100000730899 [0,2,0,0,0,0|2,0,0]=4 6426 B12R0.5 CC/C=C\CCOCCCCSC 34a_100011217163_100015370543 [0,2,0,0,0,0|2,0,0]=4 6427 B12R0.5 CC/C=C\CCOCCCCSC 7a_100011217163_100015370543 [0,2,0,0,0,0|2,0,0]=4 6428 B12R0.5 CC/C=C\CCOCCCOCC 34a_100000757476_100015370543 [0,2,0,0,0,0|1,0,0]=3 6429 B12R0.5 CC/C=C\CCOCCCOCC 34a_100016288707_100012232248 [0,2,0,0,0,0|1,0,0]=3 6430 B12R0.5 CC/C=C\CCOCCCOCC 7a_100000757476_100015370543 [0,2,0,0,0,0|1,0,0]=3 6431 B12R0.5 CC/C=C\CCOCCCOCC 7a_100016288707_100012232248 [0,2,0,0,0,0|1,0,0]=3 6432 B12R0.5 CC/C=C\CCOCCCSCC 34a_100011216438_100015370543 [0,2,0,0,0,0|1,1,0]=4 6433 B12R0.5 CC/C=C\CCOCCCSCC 7a_100011216438_100015370543 [0,2,0,0,0,0|1,1,0]=4 6434 B12R0.5 CC/C=C\CCOCCOCC#N 7a_100016288707_200000047693 [0,2,0,0,0,0|1,0,1]=4 6435 B12R0.5 CC/C=C\CCOCCOCCBr 34a_100000692535_100015370543 [0,2,0,0,0,0|1,0,0]=3 6436 B12R0.5 CC/C=C\CCOCCOCCBr 7a_100000692535_100015370543 [0,2,0,0,0,0|1,0,0]=3 6437 B12R0.5 CC/C=C\CCOCCOCCC 34a_100000752267_100015370543 [0,2,0,0,0,0|1,0,0]=3 6438 B12R0.5 CC/C=C\CCOCCOCCC 34a_100016288707_100011215938 [0,2,0,0,0,0|1,0,0]=3 6439 B12R0.5 CC/C=C\CCOCCOCCC 7a_100000752267_100015370543 [0,2,0,0,0,0|1,0,0]=3 6440 B12R0.5 CC/C=C\CCOCCOCCC 7a_100016288707_100011215938 [0,2,0,0,0,0|1,0,0]=3 6441 B12R0.5 CC/C=C\CCOCCOCCCl 34a_100011215305_100015370543 [0,2,0,0,0,0|1,0,0]=3 6442 B12R0.5 CC/C=C\CCOCCOCCCl 7a_100011215305_100015370543 [0,2,0,0,0,0|1,0,0]=3 6443 B12R0.5 CC/C=C\CCOCCOCCF 34a_200015357709_100015370543 [0,2,0,0,0,0|1,0,0]=3 6444 B12R0.5 CC/C=C\CCOCCOCCF 7a_200015357709_100015370543 [0,2,0,0,0,0|1,0,0]=3 6445 B12R0.5 CC/C=C\CCOCCOCCI 34a_100012149058_100015370543 [0,2,0,0,0,0|1,0,0]=3 6446 B12R0.5 CC/C=C\CCOCCOCCI 7a_100012149058_100015370543 [0,2,0,0,0,0|1,0,0]=3 6447 B12R0.5 CC/C=C\CCOCCOCCN 34a_100000211614_100015370543 [0,2,0,0,0,0|1,0,0]=3 6448 B12R0.5 CC/C=C\CCOCCOCCO 34a_100016288707_100000692535 [0,2,0,0,0,0|1,0,0]=3 6449 B12R0.5 CC/C=C\CCOCCOCCO 7a_100016288707_100011215305 [0,2,0,0,0,0|1,0,0]=3 6450 B12R0.5 CC/C=C\CCOCCSCCC 34a_200000230433_100015370543 [0,2,0,0,0,0|1,1,0]=4 6451 B12R0.5 CC/C=C\CCOCCSCCC 7a_200000230433_100015370543 [0,2,0,0,0,0|1,1,0]=4 6452 B12R0.5 CC/C=C\CCOCOCCCC 34a_100016288707_100011995733 [0,2,0,0,0,0|2,0,0]=4 6453 B12R0.5 CC/C=C\CCSCCCOCC 62a_100012232248_100015370543 [0,2,0,0,0,0|1,1,0]=4 6454 B12R0.5 CC/C=C\CCSCCCOCC 62a_100015370543_100012232248 [0,2,0,0,0,0|1,1,0]=4 6455 B12R0.5 CC/C=C\CCSCCOCCC 62a_100011215938_100015370543 [0,2,0,0,0,0|1,1,0]=4 6456 B12R0.5 CC/C=C\CCSCCOCCC 62a_100015370543_100011215938 [0,2,0,0,0,0|1,1,0]=4 6457 B12R0.5 CC/C=C\CCSCCOCCO 62a_100011215305_100015370543 [0,2,0,0,0,0|1,1,0]=4 6458 B12R0.5 CC/C=C\CCSCCOCCO 62a_100015370543_100011215305 [0,2,0,0,0,0|1,1,0]=4 6459 B12R0.5 CC/C=C\COCCOCCCC 34a_100000210238_100103147603 [0,2,0,0,0,0|1,0,1]=4 6460 B12R0.5 CC/C=C\COCCOCCCC 34a_100016268518_100000743108 [0,2,0,0,0,0|1,0,1]=4 6461 B12R0.5 CC/C=C\COCCOCCCC 7a_100000210238_100103147603 [0,2,0,0,0,0|1,0,1]=4 6462 B12R0.5 CC/C=C\COCCOCCNC 34a_100000228057_100103147603 [0,2,0,0,0,0|1,0,1]=4 6463 B12R0.5 CC/C=C\COCCOCCOC 34a_100011215163_100103147603 [0,2,0,0,0,0|1,0,1]=4 6464 B12R0.5 CC/C=C\COCCOCCOC 34a_100016268518_100000695917 [0,2,0,0,0,0|1,0,1]=4 6465 B12R0.5 CC/C=C\COCCOCCOC 7a_100011215163_100103147603 [0,2,0,0,0,0|1,0,1]=4 6466 B12R0.5 CC=C=CCCOCCCOCC 34a_100011020354_100012232248 [0,2,0,0,0,0|1,0,1]=4 6467 B12R0.5 CC=C=CCCOCCOCCC 34a_100011020354_100011215938 [0,2,0,0,0,0|1,0,1]=4 6468 B12R0.5 CC=C=CCCOCCOCCO 34a_100011020354_100000692535 [0,2,0,0,0,0|1,0,1]=4 6469 B12R0.5 CC=CCCCOCCCOCC 34a_100020645299_100012232248 [0,2,0,0,0,0|1,0,1]=4 6470 B12R0.5 CC=CCCCOCCOCCC 34a_100020645299_100011215938 [0,2,0,0,0,0|1,0,1]=4 6471 B12R0.5 CC=CCCCOCCOCCO 34a_100020645299_100000692535 [0,2,0,0,0,0|1,0,1]=4 6472 B12R0.5 CC=CCNCCOCCOCC 2230a_100102712874_100000070051 [0,2,0,0,0,0|1,0,0]=3 6473 B12R0.5 CC=CCNCCOCCOCC 34a_100102712874_100000070051 [0,2,0,0,0,0|1,0,0]=3 6474 B12R0.5 CC=CCOCCCCCCCC 34a_100000210232_100000070051 [0,2,0,0,0,0|2,0,0]=4 6475 B12R0.5 CC=CCOCCCCCCCC 7a_100000210232_100000070051 [0,2,0,0,0,0|2,0,0]=4 6476 B12R0.5 CC=CCOCCNCCCCC 34a_100000224656_100000070051 [0,2,0,0,0,0|2,0,0]=4 6477 B12R0.5 CC=CCOCCOCCCCC 34a_100011215259_100000070051 [0,2,0,0,0,0|1,0,0]=3 6478 B12R0.5 CC=CCOCCOCCCCC 7a_100011215259_100000070051 [0,2,0,0,0,0|1,0,0]=3 6479 B12R0.5 CC=CCOCCOCCOCC 34a_100000210240_100000070051 [0,2,0,0,0,0|0,0,0]=2 6480 B12R0.5 CC=CCOCCOCCOCC 7a_100000210240_100000070051 [0,2,0,0,0,0|0,0,0]=2 6481 B12R0.5 CC=CCSCCOCCOCC 62a_100000070051_100011211534 [0,2,0,0,0,0|0,1,0]=3 6482 B12R0.5 CC=CCSCCOCCOCC 62a_100011211534_100000070051 [0,2,0,0,0,0|0,1,0]=3 6483 B12R0.5 CCC#CCCCCCCOCC 34a_100121572206_200000036426 [0,2,0,0,0,0|2,0,0]=4 6484 B12R0.5 CCC#CCCOCC/C=C\CC 34a_100000036655_100015370543 [0,2,0,0,0,0|2,0,0]=4 6485 B12R0.5 CCC#CCCOCC/C=C\CC 7a_100000036655_100015370543 [0,2,0,0,0,0|2,0,0]=4 6486 B12R0.5 CCC#CCCOCCCCCC 34a_100000036655_100000210314 [0,2,0,0,0,0|2,0,0]=4 6487 B12R0.5 CCC#CCCOCCCCCC 7a_100000036655_100000210314 [0,2,0,0,0,0|2,0,0]=4 6488 B12R0.5 CCC#CCCOCCCCCF 34a_100000036655_100000729378 [0,2,0,0,0,0|2,0,0]=4 6489 B12R0.5 CCC#CCCOCCCCCF 7a_100000036655_100000729378 [0,2,0,0,0,0|2,0,0]=4 6490 B12R0.5 CCC#CCCOCCCCCO 34a_100000036655_100000746330 [0,2,0,0,0,0|2,0,0]=4 6491 B12R0.5 CCC#CCCOCCCCCO 7a_100000036655_100000746330 [0,2,0,0,0,0|2,0,0]=4 6492 B12R0.5 CCC#CCCOCCCCOC 34a_100000036655_100000755781 [0,2,0,0,0,0|2,0,0]=4 6493 B12R0.5 CCC#CCCOCCCCOC 7a_100000036655_100000730899 [0,2,0,0,0,0|2,0,0]=4 6494 B12R0.5 CCC#CCCOCCCOCC 34a_100000036655_100012232248 [0,2,0,0,0,0|1,0,0]=3 6495 B12R0.5 CCC#CCCOCCCOCC 7a_100000036655_100012232248 [0,2,0,0,0,0|1,0,0]=3 6496 B12R0.5 CCC#CCCOCCOCC#N 7a_100000036655_200000047693 [0,2,0,0,0,0|1,0,1]=4 6497 B12R0.5 CCC#CCCOCCOCCC 34a_100000036655_100011215938 [0,2,0,0,0,0|1,0,0]=3 6498 B12R0.5 CCC#CCCOCCOCCC 7a_100000036655_100011215938 [0,2,0,0,0,0|1,0,0]=3 6499 B12R0.5 CCC#CCCOCCOCCO 34a_100000036655_100000692535 [0,2,0,0,0,0|1,0,0]=3 6500 B12R0.5 CCC#CCCOCCOCCO 7a_100000036655_100011215305 [0,2,0,0,0,0|1,0,0]=3 6501 B12R0.5 CCC#CCCOCOCCCC 34a_100000036655_100011995733 [0,2,0,0,0,0|2,0,0]=4 6502 B12R0.5 CCC#CCOCCOCCCC 34a_100000032950_100000743108 [0,2,0,0,0,0|1,0,1]=4 6503 B12R0.5 CCC#CCOCCOCCCC 34a_100000210238_100009813939 [0,2,0,0,0,0|1,0,1]=4 6504 B12R0.5 CCC#CCOCCOCCCC 7a_100000210238_100009813939 [0,2,0,0,0,0|1,0,1]=4 6505 B12R0.5 CCC#CCOCCOCCNC 34a_100000228057_100009813939 [0,2,0,0,0,0|1,0,1]=4 6506 B12R0.5 CCC#CCOCCOCCOC 34a_100000032950_100000695917 [0,2,0,0,0,0|1,0,1]=4 6507 B12R0.5 CCC#CCOCCOCCOC 34a_100011215163_100009813939 [0,2,0,0,0,0|1,0,1]=4 6508 B12R0.5 CCC#CCOCCOCCOC 7a_100011215163_100009813939 [0,2,0,0,0,0|1,0,1]=4 6509 B12R0.5 CCC/C=C/COCCCOCC 34a_100016278788_100012232248 [0,2,0,0,0,0|1,0,1]=4 6510 B12R0.5 CCC/C=C/COCCCOCC 7a_100016278788_100012232248 [0,2,0,0,0,0|1,0,1]=4 6511 B12R0.5 CCC/C=C/COCCOCCC 34a_100016278788_100011215938 [0,2,0,0,0,0|1,0,1]=4 6512 B12R0.5 CCC/C=C/COCCOCCC 7a_100016278788_100011215938 [0,2,0,0,0,0|1,0,1]=4 6513 B12R0.5 CCC/C=C/COCCOCCO 34a_100016278788_100000692535 [0,2,0,0,0,0|1,0,1]=4 6514 B12R0.5 CCC/C=C/COCCOCCO 7a_100016278788_100011215305 [0,2,0,0,0,0|1,0,1]=4 6515 B12R0.5 CCCC#CCCOCCCCC 34a_100000042726_100000718602 [0,2,0,0,0,0|2,0,0]=4 6516 B12R0.5 CCCC#CCCOCCCCC 7a_100000042726_100000210326 [0,2,0,0,0,0|2,0,0]=4 6517 B12R0.5 CCCC#CCCOCCOCC 34a_100000042726_100000210147 [0,2,0,0,0,0|1,0,0]=3 6518 B12R0.5 CCCC#CCCOCCOCC 7a_100000042726_100011215890 [0,2,0,0,0,0|1,0,0]=3 6519 B12R0.5 CCCC#CCCOCCSCC 34a_100000042726_100000757381 [0,2,0,0,0,0|1,1,0]=4 6520 B12R0.5 CCCC#CCCOCCSCC 7a_100000042726_100000757381 [0,2,0,0,0,0|1,1,0]=4 6521 B12R0.5 CCCC#CCOCCCOCC 34a_100000034806_100012232248 [0,2,0,0,0,0|1,0,1]=4 6522 B12R0.5 CCCC#CCOCCCOCC 7a_100000034806_100012232248 [0,2,0,0,0,0|1,0,1]=4 6523 B12R0.5 CCCC#CCOCCOCCC 34a_100000034806_100011215938 [0,2,0,0,0,0|1,0,1]=4 6524 B12R0.5 CCCC#CCOCCOCCC 7a_100000034806_100011215938 [0,2,0,0,0,0|1,0,1]=4 6525 B12R0.5 CCCC#CCOCCOCCO 34a_100000034806_100000692535 [0,2,0,0,0,0|1,0,1]=4 6526 B12R0.5 CCCC#CCOCCOCCO 7a_100000034806_100011215305 [0,2,0,0,0,0|1,0,1]=4 6527 B12R0.5 CCCC/C=C/CCCCOCC 34a_200020645093_100000210202 [0,2,0,0,0,0|2,0,0]=4 6528 B12R0.5 CCCC/C=C/CCCCOCC 7a_200020645093_100000210202 [0,2,0,0,0,0|2,0,0]=4 6529 B12R0.5 CCCC/C=C/COCCCCC 34a_200016272032_100000718602 [0,2,0,0,0,0|2,0,0]=4 6530 B12R0.5 CCCC/C=C/COCCCCC 7a_200016272032_100000210326 [0,2,0,0,0,0|2,0,0]=4 6531 B12R0.5 CCCC/C=C/COCCOCC 34a_200016272032_100000210147 [0,2,0,0,0,0|1,0,0]=3 6532 B12R0.5 CCCC/C=C/COCCOCC 7a_200016272032_100011215890 [0,2,0,0,0,0|1,0,0]=3 6533 B12R0.5 CCCC/C=C/COCCSCC 34a_200016272032_100000757381 [0,2,0,0,0,0|1,1,0]=4 6534 B12R0.5 CCCC/C=C/COCCSCC 7a_200016272032_100000757381 [0,2,0,0,0,0|1,1,0]=4 6535 B12R0.5 CCCCC#CCCCCOCC 34a_200000066234_100000210202 [0,2,0,0,0,0|2,0,0]=4 6536 B12R0.5 CCCCC#CCCCCOCC 7a_200000066234_100000210202 [0,2,0,0,0,0|2,0,0]=4 6537 B12R0.5 CCCCC#CCOCCCCC 34a_200000034558_100000718602 [0,2,0,0,0,0|2,0,0]=4 6538 B12R0.5 CCCCC#CCOCCCCC 7a_200000034558_100000210326 [0,2,0,0,0,0|2,0,0]=4 6539 B12R0.5 CCCCC#CCOCCOCC 34a_200000034558_100000210147 [0,2,0,0,0,0|1,0,0]=3 6540 B12R0.5 CCCCC#CCOCCOCC 7a_200000034558_100011215890 [0,2,0,0,0,0|1,0,0]=3 6541 B12R0.5 CCCCC#CCOCCSCC 34a_200000034558_100000757381 [0,2,0,0,0,0|1,1,0]=4 6542 B12R0.5 CCCCC#CCOCCSCC 7a_200000034558_100000757381 [0,2,0,0,0,0|1,1,0]=4 6543 B12R0.5 CCCCC/C=C\CCCOCC 34a_100020655193_100000210202 [0,2,0,0,0,0|2,0,0]=4 6544 B12R0.5 CCCCC/C=C\CCCOCC 7a_100020655193_100000210202 [0,2,0,0,0,0|2,0,0]=4 6545 B12R0.5 CCCCC/C=C\CCOCCC 34a_100016277358_100000210303 [0,2,0,0,0,0|2,0,0]=4 6546 B12R0.5 CCCCC/C=C\CCOCCC 7a_100016277358_100000210303 [0,2,0,0,0,0|2,0,0]=4 6547 B12R0.5 CCCCC/C=C\CCOCCF 34a_100016277358_100011217306 [0,2,0,0,0,0|2,0,0]=4 6548 B12R0.5 CCCCC/C=C\CCOCCF 7a_100016277358_100011217306 [0,2,0,0,0,0|2,0,0]=4 6549 B12R0.5 CCCCC/C=C\CCOCCO 34a_100016277358_100000211926 [0,2,0,0,0,0|2,0,0]=4 6550 B12R0.5 CCCCC/C=C\CCOCCO 7a_100016277358_100000211926 [0,2,0,0,0,0|2,0,0]=4 6551 B12R0.5 CCCCC/C=C\CCOCSC 34a_100016277358_100011218213 [0,2,0,0,0,0|2,0,0]=4 6552 B12R0.5 CCCCCC#CCCOCCC 34a_200000042877_100000210303 [0,2,0,0,0,0|2,0,0]=4 6553 B12R0.5 CCCCCC#CCCOCCC 7a_200000042877_100000210303 [0,2,0,0,0,0|2,0,0]=4 6554 B12R0.5 CCCCCC#CCCOCCF 34a_200000042877_100011217306 [0,2,0,0,0,0|2,0,0]=4 6555 B12R0.5 CCCCCC#CCCOCCF 7a_200000042877_100011217306 [0,2,0,0,0,0|2,0,0]=4 6556 B12R0.5 CCCCCC#CCCOCCO 34a_200000042877_100000211926 [0,2,0,0,0,0|2,0,0]=4 6557 B12R0.5 CCCCCC#CCCOCCO 7a_200000042877_100000211926 [0,2,0,0,0,0|2,0,0]=4 6558 B12R0.5 CCCCCC#CCCOCSC 34a_200000042877_100011218213 [0,2,0,0,0,0|2,0,0]=4 6559 B12R0.5 CCCCCC#CCSCOCC 62a_100000739092_100009816472 [0,2,0,0,0,0|2,0,0]=4 6560 B12R0.5 CCCCCC#CCSCOCC 62a_100009816472_100000739092 [0,2,0,0,0,0|2,0,0]=4 6561 B12R0.5 CCCCCC=NNCCOCC 4a_100000732670_100000737632 [0,2,0,0,0,0|2,0,0]=4 6562 B12R0.5 CCCCCCC#CCCOCC 34a_200000033163_100000210202 [0,2,0,0,0,0|2,0,0]=4 6563 B12R0.5 CCCCCCC#CCCOCC 7a_200000033163_100000210202 [0,2,0,0,0,0|2,0,0]=4 6564 B12R0.5 CCCCCCCC#CCOCC 34a_200000061759_100000210202 [0,2,0,0,0,0|2,0,0]=4 6565 B12R0.5 CCCCCCCC#CCOCC 7a_200000061759_100000210202 [0,2,0,0,0,0|2,0,0]=4 6566 B12R0.5 CCCCCCCCCCOCC 34a_100000210711_100000210202 [0,2,0,0,0,0|2,0,0]=4 6567 B12R0.5 CCCCCCCCCCOCC 34a_100121572206_100000210320 [0,2,0,0,0,0|2,0,0]=4 6568 B12R0.5 CCCCCCCCCCOCC 7a_100000210711_100000210202 [0,2,0,0,0,0|2,0,0]=4 6569 B12R0.5 CCCCCCCCCOCCBr 34a_100000211926_100011214924 [0,2,0,0,0,0|2,0,0]=4 6570 B12R0.5 CCCCCCCCCOCCC 34a_100000210258_100011214924 [0,2,0,0,0,0|2,0,0]=4 6571 B12R0.5 CCCCCCCCCOCCC 34a_100000210712_100000210303 [0,2,0,0,0,0|2,0,0]=4 6572 B12R0.5 CCCCCCCCCOCCC 7a_100000210712_100000210303 [0,2,0,0,0,0|2,0,0]=4 6573 B12R0.5 CCCCCCCCCOCCF 34a_100000210712_100011217306 [0,2,0,0,0,0|2,0,0]=4 6574 B12R0.5 CCCCCCCCCOCCF 7a_100000210712_100011217306 [0,2,0,0,0,0|2,0,0]=4 6575 B12R0.5 CCCCCCCCCOCCN 34a_100000210304_100011214924 [0,2,0,0,0,0|2,0,0]=4 6576 B12R0.5 CCCCCCCCCOCCO 34a_100000210712_100000211926 [0,2,0,0,0,0|2,0,0]=4 6577 B12R0.5 CCCCCCCCCOCCO 7a_100000210712_100000211926 [0,2,0,0,0,0|2,0,0]=4 6578 B12R0.5 CCCCCCCCCOCSC 34a_100000210712_100011218213 [0,2,0,0,0,0|2,0,0]=4 6579 B12R0.5 CCCCCCCCOCCC#N 7a_100000210232_100000184422 [0,2,0,0,0,0|2,0,0]=4 6580 B12R0.5 CCCCCCCCOCCCBr 34a_100011217188_100000210759 [0,2,0,0,0,0|2,0,0]=4 6581 B12R0.5 CCCCCCCCOCCCC 34a_100000210227_100000210759 [0,2,0,0,0,0|2,0,0]=4 6582 B12R0.5 CCCCCCCCOCCCC 34a_100000210232_100000210210 [0,2,0,0,0,0|2,0,0]=4 6583 B12R0.5 CCCCCCCCOCCCC 7a_100000210227_100000210759 [0,2,0,0,0,0|2,0,0]=4 6584 B12R0.5 CCCCCCCCOCCCC 7a_100000210232_100000210211 [0,2,0,0,0,0|2,0,0]=4 6585 B12R0.5 CCCCCCCCOCCCCl 34a_100000230001_100000210759 [0,2,0,0,0,0|2,0,0]=4 6586 B12R0.5 CCCCCCCCOCCCF 34a_100000210232_100011934791 [0,2,0,0,0,0|2,0,0]=4 6587 B12R0.5 CCCCCCCCOCCCF 34a_100000759539_100000210759 [0,2,0,0,0,0|2,0,0]=4 6588 B12R0.5 CCCCCCCCOCCCF 7a_100000210232_100011934791 [0,2,0,0,0,0|2,0,0]=4 6589 B12R0.5 CCCCCCCCOCCCN 34a_100000182051_100000210759 [0,2,0,0,0,0|2,0,0]=4 6590 B12R0.5 CCCCCCCCOCCCO 34a_100000210232_100000230001 [0,2,0,0,0,0|2,0,0]=4 6591 B12R0.5 CCCCCCCCOCCCO 7a_100000210232_100011215043 [0,2,0,0,0,0|2,0,0]=4 6592 B12R0.5 CCCCCCCCOCCOC 34a_100000210232_100011201679 [0,2,0,0,0,0|2,0,0]=4 6593 B12R0.5 CCCCCCCCOCCOC 34a_100000210237_100000210759 [0,2,0,0,0,0|2,0,0]=4 6594 B12R0.5 CCCCCCCCOCCOC 7a_100000210232_100000233755 [0,2,0,0,0,0|2,0,0]=4 6595 B12R0.5 CCCCCCCCOCCON 34a_100000700252_100000210759 [0,2,0,0,0,0|2,0,0]=4 6596 B12R0.5 CCCCCCCCOCCSC 34a_100000210232_100000212216 [0,2,0,0,0,0|2,0,0]=4 6597 B12R0.5 CCCCCCCCOCCSC 34a_100000230434_100000210759 [0,2,0,0,0,0|2,0,0]=4 6598 B12R0.5 CCCCCCCCOCCSC 7a_100000210232_100000212216 [0,2,0,0,0,0|2,0,0]=4 6599 B12R0.5 CCCCCCCCOCCSC 7a_100000230434_100000210759 [0,2,0,0,0,0|2,0,0]=4 6600 B12R0.5 CCCCCCCCSCOCC 62a_100000210759_100000739092 [0,2,0,0,0,0|2,0,0]=4 6601 B12R0.5 CCCCCCCCSCOCC 62a_100000739092_100000210317 [0,2,0,0,0,0|2,0,0]=4 6602 B12R0.5 CCCCCCCNCCOCC 2230a_100000229938_100011215890 [0,2,0,0,0,0|2,0,0]=4 6603 B12R0.5 CCCCCCCNCCOCC 2230a_102516460346_100000210681 [0,2,0,0,0,0|2,0,0]=4 6604 B12R0.5 CCCCCCCNCCOCC 34a_102516460346_100000210614 [0,2,0,0,0,0|2,0,0]=4 6605 B12R0.5 CCCCCCCOCCCCC 34a_100000210253_100000210614 [0,2,0,0,0,0|2,0,0]=4 6606 B12R0.5 CCCCCCCOCCCCC 34a_100000210272_100000718602 [0,2,0,0,0,0|2,0,0]=4 6607 B12R0.5 CCCCCCCOCCCCC 7a_100000210253_100000210614 [0,2,0,0,0,0|2,0,0]=4 6608 B12R0.5 CCCCCCCOCCCCC 7a_100000210272_100000210326 [0,2,0,0,0,0|2,0,0]=4 6609 B12R0.5 CCCCCCCOCCOCC 34a_100000210136_100000210614 [0,2,0,0,0,0|1,0,0]=3 6610 B12R0.5 CCCCCCCOCCOCC 34a_100000210272_100000210147 [0,2,0,0,0,0|1,0,0]=3 6611 B12R0.5 CCCCCCCOCCOCC 7a_100000210136_100000210614 [0,2,0,0,0,0|1,0,0]=3 6612 B12R0.5 CCCCCCCOCCOCC 7a_100000210272_100011215890 [0,2,0,0,0,0|1,0,0]=3 6613 B12R0.5 CCCCCCCOCCSCC 34a_100000210272_100000757381 [0,2,0,0,0,0|1,1,0]=4 6614 B12R0.5 CCCCCCCOCCSCC 34a_100000212035_100000210614 [0,2,0,0,0,0|1,1,0]=4 6615 B12R0.5 CCCCCCCOCCSCC 7a_100000210272_100000757381 [0,2,0,0,0,0|1,1,0]=4 6616 B12R0.5 CCCCCCCOCCSCC 7a_100000212035_100000210614 [0,2,0,0,0,0|1,1,0]=4 6617 B12R0.5 CCCCCCCSCCOCC 62a_100000210147_100000210316 [0,2,0,0,0,0|1,1,0]=4 6618 B12R0.5 CCCCCCCSCCOCC 62a_100000210614_100011215890 [0,2,0,0,0,0|1,1,0]=4 6619 B12R0.5 CCCCCCNCCCOCC 2230a_100000210581_100012232248 [0,2,0,0,0,0|2,0,0]=4 6620 B12R0.5 CCCCCCNCCCOCC 2230a_100000210961_100000210314 [0,2,0,0,0,0|2,0,0]=4 6621 B12R0.5 CCCCCCNCCCOCC 34a_100000210961_100000210314 [0,2,0,0,0,0|2,0,0]=4 6622 B12R0.5 CCCCCCNCCOCCC 2230a_100000210581_100011215938 [0,2,0,0,0,0|2,0,0]=4 6623 B12R0.5 CCCCCCNCCOCCC 2230a_100161115042_100000210314 [0,2,0,0,0,0|2,0,0]=4 6624 B12R0.5 CCCCCCNCCOCCC 34a_100161115042_100000210314 [0,2,0,0,0,0|2,0,0]=4 6625 B12R0.5 CCCCCCNCCOCCO 2230a_100000210581_100011215305 [0,2,0,0,0,0|2,0,0]=4 6626 B12R0.5 CCCCCCNCCOCCO 2230a_100000211614_100000210314 [0,2,0,0,0,0|2,0,0]=4 6627 B12R0.5 CCCCCCNCCOCCO 34a_100000211614_100000210314 [0,2,0,0,0,0|2,0,0]=4 6628 B12R0.5 CCCCCCOCCCCCBr 34a_100000746331_100000210314 [0,2,0,0,0,0|2,0,0]=4 6629 B12R0.5 CCCCCCOCCCCCBr 7a_100000746331_100000210314 [0,2,0,0,0,0|2,0,0]=4 6630 B12R0.5 CCCCCCOCCCCCC 34a_100000210259_100000210314 [0,2,0,0,0,0|2,0,0]=4 6631 B12R0.5 CCCCCCOCCCCCC 7a_100000210259_100000210314 [0,2,0,0,0,0|2,0,0]=4 6632 B12R0.5 CCCCCCOCCCCCCl 34a_100000746330_100000210314 [0,2,0,0,0,0|2,0,0]=4 6633 B12R0.5 CCCCCCOCCCCCCl 7a_100000746330_100000210314 [0,2,0,0,0,0|2,0,0]=4 6634 B12R0.5 CCCCCCOCCCCCF 34a_100000210259_100000729378 [0,2,0,0,0,0|2,0,0]=4 6635 B12R0.5 CCCCCCOCCCCCF 7a_100000210259_100000729378 [0,2,0,0,0,0|2,0,0]=4 6636 B12R0.5 CCCCCCOCCCCCI 34a_200012148887_100000210314 [0,2,0,0,0,0|2,0,0]=4 6637 B12R0.5 CCCCCCOCCCCCI 7a_200012148887_100000210314 [0,2,0,0,0,0|2,0,0]=4 6638 B12R0.5 CCCCCCOCCCCCN 34a_100000762737_100000210314 [0,2,0,0,0,0|2,0,0]=4 6639 B12R0.5 CCCCCCOCCCCCO 34a_100000210259_100000746330 [0,2,0,0,0,0|2,0,0]=4 6640 B12R0.5 CCCCCCOCCCCCO 7a_100000210259_100000746330 [0,2,0,0,0,0|2,0,0]=4 6641 B12R0.5 CCCCCCOCCCCOC 34a_100000210259_100000755781 [0,2,0,0,0,0|2,0,0]=4 6642 B12R0.5 CCCCCCOCCCCOC 34a_100000740925_100000210314 [0,2,0,0,0,0|2,0,0]=4 6643 B12R0.5 CCCCCCOCCCCOC 7a_100000210259_100000730899 [0,2,0,0,0,0|2,0,0]=4 6644 B12R0.5 CCCCCCOCCCCSC 34a_100011217163_100000210314 [0,2,0,0,0,0|2,0,0]=4 6645 B12R0.5 CCCCCCOCCCCSC 7a_100011217163_100000210314 [0,2,0,0,0,0|2,0,0]=4 6646 B12R0.5 CCCCCCOCCCOCC 34a_100000210259_100012232248 [0,2,0,0,0,0|1,0,0]=3 6647 B12R0.5 CCCCCCOCCCOCC 34a_100000757476_100000210314 [0,2,0,0,0,0|1,0,0]=3 6648 B12R0.5 CCCCCCOCCCOCC 7a_100000210259_100012232248 [0,2,0,0,0,0|1,0,0]=3 6649 B12R0.5 CCCCCCOCCCOCC 7a_100000757476_100000210314 [0,2,0,0,0,0|1,0,0]=3 6650 B12R0.5 CCCCCCOCCCSCC 34a_100011216438_100000210314 [0,2,0,0,0,0|1,1,0]=4 6651 B12R0.5 CCCCCCOCCCSCC 7a_100011216438_100000210314 [0,2,0,0,0,0|1,1,0]=4 6652 B12R0.5 CCCCCCOCCOCC#N 7a_100000210259_200000047693 [0,2,0,0,0,0|1,0,1]=4 6653 B12R0.5 CCCCCCOCCOCC#N 7a_100000691444_100011215382 [0,2,0,0,0,0|1,0,1]=4 6654 B12R0.5 CCCCCCOCCOCC=O 34a_100000691444_200009817547 [0,2,0,0,0,0|1,0,1]=4 6655 B12R0.5 CCCCCCOCCOCC=O 7a_100000691444_200015260668 [0,2,0,0,0,0|1,0,1]=4 6656 B12R0.5 CCCCCCOCCOCCBr 34a_100000692535_100000210314 [0,2,0,0,0,0|1,0,0]=3 6657 B12R0.5 CCCCCCOCCOCCBr 7a_100000692535_100000210314 [0,2,0,0,0,0|1,0,0]=3 6658 B12R0.5 CCCCCCOCCOCCC 34a_100000210259_100011215938 [0,2,0,0,0,0|1,0,0]=3 6659 B12R0.5 CCCCCCOCCOCCC 34a_100000691444_100000210303 [0,2,0,0,0,0|1,0,0]=3 6660 B12R0.5 CCCCCCOCCOCCC 34a_100000752267_100000210314 [0,2,0,0,0,0|1,0,0]=3 6661 B12R0.5 CCCCCCOCCOCCC 7a_100000210259_100011215938 [0,2,0,0,0,0|1,0,0]=3 6662 B12R0.5 CCCCCCOCCOCCC 7a_100000691444_100000210303 [0,2,0,0,0,0|1,0,0]=3 6663 B12R0.5 CCCCCCOCCOCCC 7a_100000752267_100000210314 [0,2,0,0,0,0|1,0,0]=3 6664 B12R0.5 CCCCCCOCCOCCCl 34a_100011215305_100000210314 [0,2,0,0,0,0|1,0,0]=3 6665 B12R0.5 CCCCCCOCCOCCCl 7a_100011215305_100000210314 [0,2,0,0,0,0|1,0,0]=3 6666 B12R0.5 CCCCCCOCCOCCF 34a_100000691444_100011217306 [0,2,0,0,0,0|1,0,0]=3 6667 B12R0.5 CCCCCCOCCOCCF 34a_200015357709_100000210314 [0,2,0,0,0,0|1,0,0]=3 6668 B12R0.5 CCCCCCOCCOCCF 7a_100000691444_100011217306 [0,2,0,0,0,0|1,0,0]=3 6669 B12R0.5 CCCCCCOCCOCCF 7a_200015357709_100000210314 [0,2,0,0,0,0|1,0,0]=3 6670 B12R0.5 CCCCCCOCCOCCI 34a_100012149058_100000210314 [0,2,0,0,0,0|1,0,0]=3 6671 B12R0.5 CCCCCCOCCOCCI 7a_100012149058_100000210314 [0,2,0,0,0,0|1,0,0]=3 6672 B12R0.5 CCCCCCOCCOCCN 34a_100000211614_100000210314 [0,2,0,0,0,0|1,0,0]=3 6673 B12R0.5 CCCCCCOCCOCCO 34a_100000210259_100000692535 [0,2,0,0,0,0|1,0,0]=3 6674 B12R0.5 CCCCCCOCCOCCO 34a_100000691444_100000211926 [0,2,0,0,0,0|1,0,0]=3 6675 B12R0.5 CCCCCCOCCOCCO 7a_100000210259_100011215305 [0,2,0,0,0,0|1,0,0]=3 6676 B12R0.5 CCCCCCOCCOCCO 7a_100000691444_100000211926 [0,2,0,0,0,0|1,0,0]=3 6677 B12R0.5 CCCCCCOCCOCSC 34a_100000691444_100011218213 [0,2,0,0,0,0|1,0,0]=3 6678 B12R0.5 CCCCCCOCCSCCC 34a_200000230433_100000210314 [0,2,0,0,0,0|1,1,0]=4 6679 B12R0.5 CCCCCCOCCSCCC 7a_200000230433_100000210314 [0,2,0,0,0,0|1,1,0]=4 6680 B12R0.5 CCCCCCOCOCCCC 34a_100000210259_100011995733 [0,2,0,0,0,0|2,0,0]=4 6681 B12R0.5 CCCCCCSCCCOCC 62a_100000210314_100012232248 [0,2,0,0,0,0|1,1,0]=4 6682 B12R0.5 CCCCCCSCCCOCC 62a_100012232248_100000210757 [0,2,0,0,0,0|1,1,0]=4 6683 B12R0.5 CCCCCCSCCOCCC 62a_100000210314_100011215938 [0,2,0,0,0,0|1,1,0]=4 6684 B12R0.5 CCCCCCSCCOCCC 62a_100011215938_100000210757 [0,2,0,0,0,0|1,1,0]=4 6685 B12R0.5 CCCCCCSCCOCCO 62a_100000210314_100011215305 [0,2,0,0,0,0|1,1,0]=4 6686 B12R0.5 CCCCCCSCCOCCO 62a_100011215305_100000210757 [0,2,0,0,0,0|1,1,0]=4 6687 B12R0.5 CCCCCNCCCOCCC 2230a_100011217757_100000210326 [0,2,0,0,0,0|2,0,0]=4 6688 B12R0.5 CCCCCNCCCOCCC 34a_100011217757_100000718602 [0,2,0,0,0,0|2,0,0]=4 6689 B12R0.5 CCCCCNCCOCCCC 2230a_100000209983_100000743108 [0,2,0,0,0,0|2,0,0]=4 6690 B12R0.5 CCCCCNCCOCCCC 34a_100000224656_100000210210 [0,2,0,0,0,0|2,0,0]=4 6691 B12R0.5 CCCCCNCCOCCCF 34a_100000224656_100011934791 [0,2,0,0,0,0|2,0,0]=4 6692 B12R0.5 CCCCCNCCOCCCO 34a_100000224656_100000230001 [0,2,0,0,0,0|2,0,0]=4 6693 B12R0.5 CCCCCNCCOCCOC 2230a_100000209983_100000695917 [0,2,0,0,0,0|2,0,0]=4 6694 B12R0.5 CCCCCNCCOCCOC 2230a_100000745349_100000210326 [0,2,0,0,0,0|2,0,0]=4 6695 B12R0.5 CCCCCNCCOCCOC 34a_100000224656_100011201679 [0,2,0,0,0,0|2,0,0]=4 6696 B12R0.5 CCCCCNCCOCCOC 34a_100000745349_100000718602 [0,2,0,0,0,0|2,0,0]=4 6697 B12R0.5 CCCCCNCCOCCSC 34a_100000224656_100000212216 [0,2,0,0,0,0|2,0,0]=4 6698 B12R0.5 CCCCCOCCCCCC#N 7a_100000210253_100009813376 [0,2,0,0,0,0|2,0,0]=4 6699 B12R0.5 CCCCCOCCCCCC=O 7a_100000210253_100000139337 [0,2,0,0,0,0|2,0,0]=4 6700 B12R0.5 CCCCCOCCCCCCBr 34a_100011215345_100000718602 [0,2,0,0,0,0|2,0,0]=4 6701 B12R0.5 CCCCCOCCCCCCBr 7a_100011215345_100000210326 [0,2,0,0,0,0|2,0,0]=4 6702 B12R0.5 CCCCCOCCCCCCCl 34a_100000766143_100000718602 [0,2,0,0,0,0|2,0,0]=4 6703 B12R0.5 CCCCCOCCCCCCCl 7a_100000766143_100000210326 [0,2,0,0,0,0|2,0,0]=4 6704 B12R0.5 CCCCCOCCCCCCF 34a_100000210253_100015922095 [0,2,0,0,0,0|2,0,0]=4 6705 B12R0.5 CCCCCOCCCCCCF 34a_100000732779_100000718602 [0,2,0,0,0,0|2,0,0]=4 6706 B12R0.5 CCCCCOCCCCCCF 7a_100000210253_100015922095 [0,2,0,0,0,0|2,0,0]=4 6707 B12R0.5 CCCCCOCCCCCCF 7a_100000732779_100000210326 [0,2,0,0,0,0|2,0,0]=4 6708 B12R0.5 CCCCCOCCCCCCN 34a_100000686447_100000718602 [0,2,0,0,0,0|2,0,0]=4 6709 B12R0.5 CCCCCOCCCCCCO 34a_100000210253_100000766143 [0,2,0,0,0,0|2,0,0]=4 6710 B12R0.5 CCCCCOCCCCCCO 7a_100000210253_100000766143 [0,2,0,0,0,0|2,0,0]=4 6711 B12R0.5 CCCCCOCCCCCNC 34a_100000722520_100000718602 [0,2,0,0,0,0|2,0,0]=4 6712 B12R0.5 CCCCCOCCOCCC#N 7a_100011215259_100000184422 [0,2,0,0,0,0|1,0,0]=3 6713 B12R0.5 CCCCCOCCOCCCC 34a_100000210238_100000718602 [0,2,0,0,0,0|1,0,0]=3 6714 B12R0.5 CCCCCOCCOCCCC 34a_100000210253_100000743108 [0,2,0,0,0,0|1,0,0]=3 6715 B12R0.5 CCCCCOCCOCCCC 34a_100011215259_100000210210 [0,2,0,0,0,0|1,0,0]=3 6716 B12R0.5 CCCCCOCCOCCCC 7a_100000210238_100000210326 [0,2,0,0,0,0|1,0,0]=3 6717 B12R0.5 CCCCCOCCOCCCC 7a_100000210253_100000743108 [0,2,0,0,0,0|1,0,0]=3 6718 B12R0.5 CCCCCOCCOCCCC 7a_100011215259_100000210211 [0,2,0,0,0,0|1,0,0]=3 6719 B12R0.5 CCCCCOCCOCCCF 34a_100011215259_100011934791 [0,2,0,0,0,0|1,0,0]=3 6720 B12R0.5 CCCCCOCCOCCCF 7a_100011215259_100011934791 [0,2,0,0,0,0|1,0,0]=3 6721 B12R0.5 CCCCCOCCOCCCO 34a_100011215259_100000230001 [0,2,0,0,0,0|1,0,0]=3 6722 B12R0.5 CCCCCOCCOCCCO 7a_100011215259_100011215043 [0,2,0,0,0,0|1,0,0]=3 6723 B12R0.5 CCCCCOCCOCCNC 34a_100000228057_100000718602 [0,2,0,0,0,0|1,0,0]=3 6724 B12R0.5 CCCCCOCCOCCOC 34a_100000210253_100000695917 [0,2,0,0,0,0|1,0,0]=3 6725 B12R0.5 CCCCCOCCOCCOC 34a_100011215163_100000718602 [0,2,0,0,0,0|1,0,0]=3 6726 B12R0.5 CCCCCOCCOCCOC 34a_100011215259_100011201679 [0,2,0,0,0,0|1,0,0]=3 6727 B12R0.5 CCCCCOCCOCCOC 7a_100000210253_100000695917 [0,2,0,0,0,0|1,0,0]=3 6728 B12R0.5 CCCCCOCCOCCOC 7a_100011215163_100000210326 [0,2,0,0,0,0|1,0,0]=3 6729 B12R0.5 CCCCCOCCOCCOC 7a_100011215259_100000233755 [0,2,0,0,0,0|1,0,0]=3 6730 B12R0.5 CCCCCOCCOCCSC 34a_100011215259_100000212216 [0,2,0,0,0,0|1,0,0]=3 6731 B12R0.5 CCCCCOCCOCCSC 7a_100011215259_100000212216 [0,2,0,0,0,0|1,0,0]=3 6732 B12R0.5 CCCCCOCCSCCCC 34a_200000230436_100000718602 [0,2,0,0,0,0|1,1,0]=4 6733 B12R0.5 CCCCCOCCSCCCC 7a_200000230436_100000210326 [0,2,0,0,0,0|1,1,0]=4 6734 B12R0.5 CCCCCSCCOCCCC 62a_100000210326_100000743108 [0,2,0,0,0,0|1,1,0]=4 6735 B12R0.5 CCCCCSCCOCCCC 62a_100000743108_100000210326 [0,2,0,0,0,0|1,1,0]=4 6736 B12R0.5 CCCCCSCCOCCOC 62a_100000210326_100000695917 [0,2,0,0,0,0|1,1,0]=4 6737 B12R0.5 CCCCCSCCOCCOC 62a_100000695917_100000210326 [0,2,0,0,0,0|1,1,0]=4 6738 B12R0.5 CCCCNCCCCOCCC 34a_200011216965_100000210303 [0,2,0,0,0,0|2,0,0]=4 6739 B12R0.5 CCCCNCCCCOCCF 34a_200011216965_100011217306 [0,2,0,0,0,0|2,0,0]=4 6740 B12R0.5 CCCCNCCCCOCCO 34a_200011216965_100000211926 [0,2,0,0,0,0|2,0,0]=4 6741 B12R0.5 CCCCNCCCCOCSC 34a_200011216965_100011218213 [0,2,0,0,0,0|2,0,0]=4 6742 B12R0.5 CCCCNCCOCCOCC 2230a_100000102301_100011211534 [0,2,0,0,0,0|1,0,0]=3 6743 B12R0.5 CCCCNCCOCCOCC 2230a_100102712874_100000210211 [0,2,0,0,0,0|1,0,0]=3 6744 B12R0.5 CCCCNCCOCCOCC 34a_100102712874_100000210210 [0,2,0,0,0,0|1,0,0]=3 6745 B12R0.5 CCCCNCCOCCOCC 7a_106832991798_100011211534 [0,2,0,0,0,0|1,0,0]=3 6746 B12R0.5 CCCCOCCCCOCCC 34a_200000760531_100000210303 [0,2,0,0,0,0|2,0,0]=4 6747 B12R0.5 CCCCOCCCCOCCC 7a_200000760531_100000210303 [0,2,0,0,0,0|2,0,0]=4 6748 B12R0.5 CCCCOCCCCOCCF 34a_200000760531_100011217306 [0,2,0,0,0,0|2,0,0]=4 6749 B12R0.5 CCCCOCCCCOCCF 7a_200000760531_100011217306 [0,2,0,0,0,0|2,0,0]=4 6750 B12R0.5 CCCCOCCCCOCCO 34a_200000760531_100000211926 [0,2,0,0,0,0|2,0,0]=4 6751 B12R0.5 CCCCOCCCCOCCO 7a_200000760531_100000211926 [0,2,0,0,0,0|2,0,0]=4 6752 B12R0.5 CCCCOCCCCOCSC 34a_200000760531_100011218213 [0,2,0,0,0,0|2,0,0]=4 6753 B12R0.5 CCCCOCCNCCOCC 2230a_102516460346_100000743108 [0,2,0,0,0,0|1,0,0]=3 6754 B12R0.5 CCCCOCCNCCOCC 34a_102516460346_100000743108 [0,2,0,0,0,0|1,0,0]=3 6755 B12R0.5 CCCCOCCNCCSCC 2230a_100000106463_100000743108 [0,2,0,0,0,0|1,1,0]=4 6756 B12R0.5 CCCCOCCOCCCCBr 34a_100011216708_100000743108 [0,2,0,0,0,0|2,0,0]=4 6757 B12R0.5 CCCCOCCOCCCCCl 34a_100000210776_100000743108 [0,2,0,0,0,0|2,0,0]=4 6758 B12R0.5 CCCCOCCOCCCCCl 7a_100000210776_100000743108 [0,2,0,0,0,0|2,0,0]=4 6759 B12R0.5 CCCCOCCOCCCCF 34a_100000210238_100000729493 [0,2,0,0,0,0|2,0,0]=4 6760 B12R0.5 CCCCOCCOCCCCF 34a_100011995726_100000743108 [0,2,0,0,0,0|2,0,0]=4 6761 B12R0.5 CCCCOCCOCCCCF 7a_100000210238_100000729493 [0,2,0,0,0,0|2,0,0]=4 6762 B12R0.5 CCCCOCCOCCCCF 7a_100011995726_100000743108 [0,2,0,0,0,0|2,0,0]=4 6763 B12R0.5 CCCCOCCOCCCCI 34a_200012148704_100000743108 [0,2,0,0,0,0|2,0,0]=4 6764 B12R0.5 CCCCOCCOCCCCN 34a_100000750430_100000743108 [0,2,0,0,0,0|2,0,0]=4 6765 B12R0.5 CCCCOCCOCCCCO 34a_100000210238_100011216708 [0,2,0,0,0,0|2,0,0]=4 6766 B12R0.5 CCCCOCCOCCCCO 7a_100000210238_100000210776 [0,2,0,0,0,0|2,0,0]=4 6767 B12R0.5 CCCCOCCOCCCNC 34a_100000213112_100000743108 [0,2,0,0,0,0|2,0,0]=4 6768 B12R0.5 CCCCOCCOCCCOC 34a_100000210238_100000740836 [0,2,0,0,0,0|2,0,0]=4 6769 B12R0.5 CCCCOCCOCCCOC 34a_100000740835_100000743108 [0,2,0,0,0,0|2,0,0]=4 6770 B12R0.5 CCCCOCCOCCCOC 7a_100000210238_100000740836 [0,2,0,0,0,0|2,0,0]=4 6771 B12R0.5 CCCCOCCOCCCSC 34a_100000690336_100000743108 [0,2,0,0,0,0|2,0,0]=4 6772 B12R0.5 CCCCOCCOCCCSC 7a_100000690336_100000743108 [0,2,0,0,0,0|2,0,0]=4 6773 B12R0.5 CCCCOCCOCCOCC 34a_100000210136_100000743108 [0,2,0,0,0,0|0,0,0]=2 6774 B12R0.5 CCCCOCCOCCOCC 34a_100000210227_100011211534 [0,2,0,0,0,0|0,0,0]=2 6775 B12R0.5 CCCCOCCOCCOCC 34a_100000210238_100000210147 [0,2,0,0,0,0|0,0,0]=2 6776 B12R0.5 CCCCOCCOCCOCC 34a_100000210240_100000210210 [0,2,0,0,0,0|0,0,0]=2 6777 B12R0.5 CCCCOCCOCCOCC 34a_100011215186_100000210202 [0,2,0,0,0,0|0,0,0]=2 6778 B12R0.5 CCCCOCCOCCOCC 7a_100000210136_100000743108 [0,2,0,0,0,0|0,0,0]=2 6779 B12R0.5 CCCCOCCOCCOCC 7a_100000210227_100011211534 [0,2,0,0,0,0|0,0,0]=2 6780 B12R0.5 CCCCOCCOCCOCC 7a_100000210238_100011215890 [0,2,0,0,0,0|0,0,0]=2 6781 B12R0.5 CCCCOCCOCCOCC 7a_100000210240_100000210211 [0,2,0,0,0,0|0,0,0]=2 6782 B12R0.5 CCCCOCCOCCOCC 7a_100011215186_100000210202 [0,2,0,0,0,0|0,0,0]=2 6783 B12R0.5 CCCCOCCOCCOCF 34a_100011215186_100015361967 [0,2,0,0,0,0|1,0,0]=3 6784 B12R0.5 CCCCOCCOCCOCF 7a_100011215186_100015361967 [0,2,0,0,0,0|1,0,0]=3 6785 B12R0.5 CCCCOCCOCCSCC 34a_100000210238_100000757381 [0,2,0,0,0,0|0,1,0]=3 6786 B12R0.5 CCCCOCCOCCSCC 34a_100000212035_100000743108 [0,2,0,0,0,0|0,1,0]=3 6787 B12R0.5 CCCCOCCOCCSCC 7a_100000210238_100000757381 [0,2,0,0,0,0|0,1,0]=3 6788 B12R0.5 CCCCOCCOCCSCC 7a_100000212035_100000743108 [0,2,0,0,0,0|0,1,0]=3 6789 B12R0.5 CCCCOCCSCCOCC 62a_100000210147_100000743108 [0,2,0,0,0,0|0,1,0]=3 6790 B12R0.5 CCCCOCCSCCOCC 62a_100000743108_100011215890 [0,2,0,0,0,0|0,1,0]=3 6791 B12R0.5 CCCCOCCSCCSCC 62a_100000743108_100000757381 [0,2,0,0,0,0|0,2,0]=4 6792 B12R0.5 CCCCOCCSCCSCC 62a_100000757381_100000743108 [0,2,0,0,0,0|0,2,0]=4 6793 B12R0.5 CCCCOCNCCCOCC 2230a_100000210961_100011995733 [0,2,0,0,0,0|2,0,0]=4 6794 B12R0.5 CCCCOCNCCCOCC 34a_100000210961_100011995733 [0,2,0,0,0,0|2,0,0]=4 6795 B12R0.5 CCCCOCNCCOCCC 2230a_100161115042_100011995733 [0,2,0,0,0,0|2,0,0]=4 6796 B12R0.5 CCCCOCNCCOCCC 34a_100161115042_100011995733 [0,2,0,0,0,0|2,0,0]=4 6797 B12R0.5 CCCCOCNCCOCCO 2230a_100000211614_100011995733 [0,2,0,0,0,0|2,0,0]=4 6798 B12R0.5 CCCCOCNCCOCCO 34a_100000211614_100011995733 [0,2,0,0,0,0|2,0,0]=4 6799 B12R0.5 CCCCOCOCCCCCBr 34a_100000746331_100011995733 [0,2,0,0,0,0|2,0,0]=4 6800 B12R0.5 CCCCOCOCCCCCCl 34a_100000746330_100011995733 [0,2,0,0,0,0|2,0,0]=4 6801 B12R0.5 CCCCOCOCCCCCI 34a_200012148887_100011995733 [0,2,0,0,0,0|2,0,0]=4 6802 B12R0.5 CCCCOCOCCCCCN 34a_100000762737_100011995733 [0,2,0,0,0,0|2,0,0]=4 6803 B12R0.5 CCCCOCOCCCCOC 34a_100000740925_100011995733 [0,2,0,0,0,0|2,0,0]=4 6804 B12R0.5 CCCCOCOCCCCSC 34a_100011217163_100011995733 [0,2,0,0,0,0|2,0,0]=4 6805 B12R0.5 CCCCOCOCCCOCC 34a_100000757476_100011995733 [0,2,0,0,0,0|1,0,0]=3 6806 B12R0.5 CCCCOCOCCCSCC 34a_100011216438_100011995733 [0,2,0,0,0,0|1,1,0]=4 6807 B12R0.5 CCCCOCOCCOCCBr 34a_100000692535_100011995733 [0,2,0,0,0,0|1,0,0]=3 6808 B12R0.5 CCCCOCOCCOCCC 34a_100000752267_100011995733 [0,2,0,0,0,0|1,0,0]=3 6809 B12R0.5 CCCCOCOCCOCCCl 34a_100011215305_100011995733 [0,2,0,0,0,0|1,0,0]=3 6810 B12R0.5 CCCCOCOCCOCCF 34a_200015357709_100011995733 [0,2,0,0,0,0|1,0,0]=3 6811 B12R0.5 CCCCOCOCCOCCI 34a_100012149058_100011995733 [0,2,0,0,0,0|1,0,0]=3 6812 B12R0.5 CCCCOCOCCOCCN 34a_100000211614_100011995733 [0,2,0,0,0,0|1,0,0]=3 6813 B12R0.5 CCCCOCOCCSCCC 34a_200000230433_100011995733 [0,2,0,0,0,0|1,1,0]=4 6814 B12R0.5 CCCCOCSCCCOCC 62a_100011995733_100012232248 [0,2,0,0,0,0|1,1,0]=4 6815 B12R0.5 CCCCOCSCCCOCC 62a_100012232248_100011995733 [0,2,0,0,0,0|1,1,0]=4 6816 B12R0.5 CCCCOCSCCOCCC 62a_100011215938_100011995733 [0,2,0,0,0,0|1,1,0]=4 6817 B12R0.5 CCCCOCSCCOCCC 62a_100011995733_100011215938 [0,2,0,0,0,0|1,1,0]=4 6818 B12R0.5 CCCCOCSCCOCCO 62a_100011215305_100011995733 [0,2,0,0,0,0|1,1,0]=4 6819 B12R0.5 CCCCOCSCCOCCO 62a_100011995733_100011215305 [0,2,0,0,0,0|1,1,0]=4 6820 B12R0.5 CCCCSCCNCCOCC 2230a_100025743550_100011215890 [0,2,0,0,0,0|1,1,0]=4 6821 B12R0.5 CCCCSCCOCCOCC 34a_200000230436_100000210147 [0,2,0,0,0,0|0,1,0]=3 6822 B12R0.5 CCCCSCCOCCOCC 62a_100000210211_100011211534 [0,2,0,0,0,0|0,1,0]=3 6823 B12R0.5 CCCCSCCOCCOCC 62a_100011211534_100000210210 [0,2,0,0,0,0|0,1,0]=3 6824 B12R0.5 CCCCSCCOCCOCC 7a_200000230436_100011215890 [0,2,0,0,0,0|0,1,0]=3 6825 B12R0.5 CCCCSCCOCCSCC 34a_200000230436_100000757381 [0,2,0,0,0,0|0,2,0]=4 6826 B12R0.5 CCCCSCCOCCSCC 7a_200000230436_100000757381 [0,2,0,0,0,0|0,2,0]=4 6827 B12R0.5 CCCNCCOCCOCCC 2230a_200011904461_100000210303 [0,2,0,0,0,0|1,0,0]=3 6828 B12R0.5 CCCNCCOCCOCCC 34a_200011904461_100000210303 [0,2,0,0,0,0|1,0,0]=3 6829 B12R0.5 CCCNCCOCCOCCO 2230a_100011998139_100000210303 [0,2,0,0,0,0|1,0,0]=3 6830 B12R0.5 CCCNCCOCCOCCO 34a_100011998139_100000210303 [0,2,0,0,0,0|1,0,0]=3 6831 B12R0.5 CCCOCCCCCCCCBr 34a_100009813846_100000210303 [0,2,0,0,0,0|2,0,0]=4 6832 B12R0.5 CCCOCCCCCCCCBr 7a_100009813846_100000210303 [0,2,0,0,0,0|2,0,0]=4 6833 B12R0.5 CCCOCCCCCCCCCl 34a_100000033203_100000210303 [0,2,0,0,0,0|2,0,0]=4 6834 B12R0.5 CCCOCCCCCCCCCl 7a_100000033203_100000210303 [0,2,0,0,0,0|2,0,0]=4 6835 B12R0.5 CCCOCCCCCCCCN 34a_102515433106_100000210303 [0,2,0,0,0,0|2,0,0]=4 6836 B12R0.5 CCCOCCCCCCCCO 34a_100000210258_100000033203 [0,2,0,0,0,0|2,0,0]=4 6837 B12R0.5 CCCOCCCCCNCCN 34a_103619048469_100000210303 [0,2,0,0,0,0|2,0,0]=4 6838 B12R0.5 CCCOCCCNCCOCC 2230a_100011217757_100011215890 [0,2,0,0,0,0|1,0,0]=3 6839 B12R0.5 CCCOCCCNCCOCC 34a_100011217757_100000210147 [0,2,0,0,0,0|1,0,0]=3 6840 B12R0.5 CCCOCCCNCCSCC 2230a_100011217757_100000757381 [0,2,0,0,0,0|1,1,0]=4 6841 B12R0.5 CCCOCCCNCCSCC 34a_100011217757_100000757381 [0,2,0,0,0,0|1,1,0]=4 6842 B12R0.5 CCCOCCCOCCCOC 34a_200011215475_100000210303 [0,2,0,0,0,0|2,0,0]=4 6843 B12R0.5 CCCOCCCOCCCOC 7a_200011215475_100000210303 [0,2,0,0,0,0|2,0,0]=4 6844 B12R0.5 CCCOCCNCCCCCF 2230a_100161115042_100000729378 [0,2,0,0,0,0|2,0,0]=4 6845 B12R0.5 CCCOCCNCCCCCF 34a_100161115042_100000729378 [0,2,0,0,0,0|2,0,0]=4 6846 B12R0.5 CCCOCCNCCCCCO 2230a_100000762737_100011215938 [0,2,0,0,0,0|2,0,0]=4 6847 B12R0.5 CCCOCCNCCCCCO 2230a_100161115042_100000746330 [0,2,0,0,0,0|2,0,0]=4 6848 B12R0.5 CCCOCCNCCCCCO 34a_100000762737_100011215938 [0,2,0,0,0,0|2,0,0]=4 6849 B12R0.5 CCCOCCNCCCCCO 34a_100161115042_100000746330 [0,2,0,0,0,0|2,0,0]=4 6850 B12R0.5 CCCOCCNCCCCOC 2230a_100161115042_100000730899 [0,2,0,0,0,0|2,0,0]=4 6851 B12R0.5 CCCOCCNCCCCOC 34a_100161115042_100000755781 [0,2,0,0,0,0|2,0,0]=4 6852 B12R0.5 CCCOCCNCCCOCC 2230a_100000210961_100011215938 [0,2,0,0,0,0|1,0,0]=3 6853 B12R0.5 CCCOCCNCCCOCC 2230a_100161115042_100012232248 [0,2,0,0,0,0|1,0,0]=3 6854 B12R0.5 CCCOCCNCCCOCC 34a_100000210961_100011215938 [0,2,0,0,0,0|1,0,0]=3 6855 B12R0.5 CCCOCCNCCCOCC 34a_100161115042_100012232248 [0,2,0,0,0,0|1,0,0]=3 6856 B12R0.5 CCCOCCNCCOCC#N 2230a_100161115042_200000047693 [0,2,0,0,0,0|1,0,1]=4 6857 B12R0.5 CCCOCCNCCOCCC 2230a_100161115042_100011215938 [0,2,0,0,0,0|1,0,0]=3 6858 B12R0.5 CCCOCCNCCOCCC 34a_100161115042_100011215938 [0,2,0,0,0,0|1,0,0]=3 6859 B12R0.5 CCCOCCNCCOCCO 2230a_100000211614_100011215938 [0,2,0,0,0,0|1,0,0]=3 6860 B12R0.5 CCCOCCNCCOCCO 2230a_100161115042_100011215305 [0,2,0,0,0,0|1,0,0]=3 6861 B12R0.5 CCCOCCNCCOCCO 34a_100000211614_100011215938 [0,2,0,0,0,0|1,0,0]=3 6862 B12R0.5 CCCOCCNCCOCCO 34a_100161115042_100000692535 [0,2,0,0,0,0|1,0,0]=3 6863 B12R0.5 CCCOCCNCCSCCC 2230a_100020603323_100011215938 [0,2,0,0,0,0|1,1,0]=4 6864 B12R0.5 CCCOCCNCCSCCO 2230a_100011219999_100011215938 [0,2,0,0,0,0|1,1,0]=4 6865 B12R0.5 CCCOCCOCCCCC#N 7a_100000752267_100000211819 [0,2,0,0,0,0|1,0,1]=4 6866 B12R0.5 CCCOCCOCCCCC=O 7a_100000752267_100000139335 [0,2,0,0,0,0|1,0,1]=4 6867 B12R0.5 CCCOCCOCCCCCBr 34a_100000746331_100011215938 [0,2,0,0,0,0|1,0,0]=3 6868 B12R0.5 CCCOCCOCCCCCBr 7a_100000746331_100011215938 [0,2,0,0,0,0|1,0,0]=3 6869 B12R0.5 CCCOCCOCCCCCCl 34a_100000746330_100011215938 [0,2,0,0,0,0|1,0,0]=3 6870 B12R0.5 CCCOCCOCCCCCCl 7a_100000746330_100011215938 [0,2,0,0,0,0|1,0,0]=3 6871 B12R0.5 CCCOCCOCCCCCF 34a_100000752267_100000729378 [0,2,0,0,0,0|1,0,0]=3 6872 B12R0.5 CCCOCCOCCCCCF 7a_100000752267_100000729378 [0,2,0,0,0,0|1,0,0]=3 6873 B12R0.5 CCCOCCOCCCCCI 34a_200012148887_100011215938 [0,2,0,0,0,0|1,0,0]=3 6874 B12R0.5 CCCOCCOCCCCCI 7a_200012148887_100011215938 [0,2,0,0,0,0|1,0,0]=3 6875 B12R0.5 CCCOCCOCCCCCN 34a_100000762737_100011215938 [0,2,0,0,0,0|1,0,0]=3 6876 B12R0.5 CCCOCCOCCCCCO 34a_100000752267_100000746330 [0,2,0,0,0,0|1,0,0]=3 6877 B12R0.5 CCCOCCOCCCCCO 7a_100000752267_100000746330 [0,2,0,0,0,0|1,0,0]=3 6878 B12R0.5 CCCOCCOCCCCOC 34a_100000740925_100011215938 [0,2,0,0,0,0|1,0,0]=3 6879 B12R0.5 CCCOCCOCCCCOC 34a_100000752267_100000755781 [0,2,0,0,0,0|1,0,0]=3 6880 B12R0.5 CCCOCCOCCCCOC 7a_100000752267_100000730899 [0,2,0,0,0,0|1,0,0]=3 6881 B12R0.5 CCCOCCOCCCCSC 34a_100011217163_100011215938 [0,2,0,0,0,0|1,0,0]=3 6882 B12R0.5 CCCOCCOCCCCSC 7a_100011217163_100011215938 [0,2,0,0,0,0|1,0,0]=3 6883 B12R0.5 CCCOCCOCCCOCC 34a_100000752267_100012232248 [0,2,0,0,0,0|0,0,0]=2 6884 B12R0.5 CCCOCCOCCCOCC 34a_100000757476_100011215938 [0,2,0,0,0,0|0,0,0]=2 6885 B12R0.5 CCCOCCOCCCOCC 7a_100000752267_100012232248 [0,2,0,0,0,0|0,0,0]=2 6886 B12R0.5 CCCOCCOCCCOCC 7a_100000757476_100011215938 [0,2,0,0,0,0|0,0,0]=2 6887 B12R0.5 CCCOCCOCCCSCC 34a_100011216438_100011215938 [0,2,0,0,0,0|0,1,0]=3 6888 B12R0.5 CCCOCCOCCCSCC 7a_100011216438_100011215938 [0,2,0,0,0,0|0,1,0]=3 6889 B12R0.5 CCCOCCOCCNCC#N 2230a_200011904461_100011215382 [0,2,0,0,0,0|1,0,1]=4 6890 B12R0.5 CCCOCCOCCNCC=O 2230a_200011904461_200015260668 [0,2,0,0,0,0|1,0,1]=4 6891 B12R0.5 CCCOCCOCCNCC=O 34a_200011904461_200009817547 [0,2,0,0,0,0|1,0,1]=4 6892 B12R0.5 CCCOCCOCCNCCF 2230a_200011904461_100011217306 [0,2,0,0,0,0|1,0,0]=3 6893 B12R0.5 CCCOCCOCCNCCF 34a_200011904461_100011217306 [0,2,0,0,0,0|1,0,0]=3 6894 B12R0.5 CCCOCCOCCNCCO 2230a_200011904461_100000211926 [0,2,0,0,0,0|1,0,0]=3 6895 B12R0.5 CCCOCCOCCNCCO 34a_200011904461_100000211926 [0,2,0,0,0,0|1,0,0]=3 6896 B12R0.5 CCCOCCOCCNCOC 2230a_200011904461_100000766300 [0,2,0,0,0,0|1,0,0]=3 6897 B12R0.5 CCCOCCOCCNCSC 2230a_200011904461_100011218213 [0,2,0,0,0,0|1,0,0]=3 6898 B12R0.5 CCCOCCOCCNCSC 34a_200011904461_100011218213 [0,2,0,0,0,0|1,0,0]=3 6899 B12R0.5 CCCOCCOCCOCC#N 7a_100000752267_200000047693 [0,2,0,0,0,0|0,0,1]=3 6900 B12R0.5 CCCOCCOCCOCCBr 34a_100000692535_100011215938 [0,2,0,0,0,0|0,0,0]=2 6901 B12R0.5 CCCOCCOCCOCCBr 34a_100010132937_100000210303 [0,2,0,0,0,0|0,0,0]=2 6902 B12R0.5 CCCOCCOCCOCCBr 7a_100000692535_100011215938 [0,2,0,0,0,0|0,0,0]=2 6903 B12R0.5 CCCOCCOCCOCCBr 7a_100010132937_100000210303 [0,2,0,0,0,0|0,0,0]=2 6904 B12R0.5 CCCOCCOCCOCCC 34a_100000752267_100011215938 [0,2,0,0,0,0|0,0,0]=2 6905 B12R0.5 CCCOCCOCCOCCC 7a_100000752267_100011215938 [0,2,0,0,0,0|0,0,0]=2 6906 B12R0.5 CCCOCCOCCOCCCl 34a_100000032323_100000210303 [0,2,0,0,0,0|0,0,0]=2 6907 B12R0.5 CCCOCCOCCOCCCl 34a_100011215305_100011215938 [0,2,0,0,0,0|0,0,0]=2 6908 B12R0.5 CCCOCCOCCOCCCl 7a_100000032323_100000210303 [0,2,0,0,0,0|0,0,0]=2 6909 B12R0.5 CCCOCCOCCOCCCl 7a_100011215305_100011215938 [0,2,0,0,0,0|0,0,0]=2 6910 B12R0.5 CCCOCCOCCOCCF 34a_200015357709_100011215938 [0,2,0,0,0,0|0,0,0]=2 6911 B12R0.5 CCCOCCOCCOCCF 7a_200015357709_100011215938 [0,2,0,0,0,0|0,0,0]=2 6912 B12R0.5 CCCOCCOCCOCCI 34a_100012149058_100011215938 [0,2,0,0,0,0|0,0,0]=2 6913 B12R0.5 CCCOCCOCCOCCI 7a_100012149058_100011215938 [0,2,0,0,0,0|0,0,0]=2 6914 B12R0.5 CCCOCCOCCOCCN 34a_100000211614_100011215938 [0,2,0,0,0,0|0,0,0]=2 6915 B12R0.5 CCCOCCOCCOCCN 34a_100011998139_100000210303 [0,2,0,0,0,0|0,0,0]=2 6916 B12R0.5 CCCOCCOCCOCCO 34a_100000210258_100000032323 [0,2,0,0,0,0|0,0,0]=2 6917 B12R0.5 CCCOCCOCCOCCO 34a_100000752267_100000692535 [0,2,0,0,0,0|0,0,0]=2 6918 B12R0.5 CCCOCCOCCOCCO 7a_100000752267_100011215305 [0,2,0,0,0,0|0,0,0]=2 6919 B12R0.5 CCCOCCOCCSCCC 34a_200000230433_100011215938 [0,2,0,0,0,0|0,1,0]=3 6920 B12R0.5 CCCOCCOCCSCCC 7a_200000230433_100011215938 [0,2,0,0,0,0|0,1,0]=3 6921 B12R0.5 CCCOCCSCCCCCF 62a_100000729378_100011215938 [0,2,0,0,0,0|1,1,0]=4 6922 B12R0.5 CCCOCCSCCCCCF 62a_100011215938_100000729378 [0,2,0,0,0,0|1,1,0]=4 6923 B12R0.5 CCCOCCSCCCCCO 62a_100000746330_100011215938 [0,2,0,0,0,0|1,1,0]=4 6924 B12R0.5 CCCOCCSCCCCCO 62a_100011215938_100000746330 [0,2,0,0,0,0|1,1,0]=4 6925 B12R0.5 CCCOCCSCCCCOC 62a_100000730899_100011215938 [0,2,0,0,0,0|1,1,0]=4 6926 B12R0.5 CCCOCCSCCCCOC 62a_100011215938_100000730899 [0,2,0,0,0,0|1,1,0]=4 6927 B12R0.5 CCCOCCSCCCOCC 62a_100011215938_100012232248 [0,2,0,0,0,0|0,1,0]=3 6928 B12R0.5 CCCOCCSCCCOCC 62a_100012232248_100011215938 [0,2,0,0,0,0|0,1,0]=3 6929 B12R0.5 CCCOCCSCCOCC#N 62a_100011215938_200000047693 [0,2,0,0,0,0|0,1,1]=4 6930 B12R0.5 CCCOCCSCCOCC#N 62a_200000047693_100011215938 [0,2,0,0,0,0|0,1,1]=4 6931 B12R0.5 CCCOCCSCCOCCC 62a_100011215938_100011215938 [0,2,0,0,0,0|0,1,0]=3 6932 B12R0.5 CCCOCCSCCOCCO 62a_100011215305_100011215938 [0,2,0,0,0,0|0,1,0]=3 6933 B12R0.5 CCCOCCSCCOCCO 62a_100011215938_100011215305 [0,2,0,0,0,0|0,1,0]=3 6934 B12R0.5 CCCSCCNCCCOCC 2230a_100020603323_100012232248 [0,2,0,0,0,0|1,1,0]=4 6935 B12R0.5 CCCSCCNCCOCCO 2230a_100020603323_100011215305 [0,2,0,0,0,0|1,1,0]=4 6936 B12R0.5 CCCSCCOCCCCCF 34a_200000230433_100000729378 [0,2,0,0,0,0|1,1,0]=4 6937 B12R0.5 CCCSCCOCCCCCF 7a_200000230433_100000729378 [0,2,0,0,0,0|1,1,0]=4 6938 B12R0.5 CCCSCCOCCCCCO 34a_200000230433_100000746330 [0,2,0,0,0,0|1,1,0]=4 6939 B12R0.5 CCCSCCOCCCCCO 7a_200000230433_100000746330 [0,2,0,0,0,0|1,1,0]=4 6940 B12R0.5 CCCSCCOCCCCOC 34a_200000230433_100000755781 [0,2,0,0,0,0|1,1,0]=4 6941 B12R0.5 CCCSCCOCCCCOC 7a_200000230433_100000730899 [0,2,0,0,0,0|1,1,0]=4 6942 B12R0.5 CCCSCCOCCCOCC 34a_200000230433_100012232248 [0,2,0,0,0,0|0,1,0]=3 6943 B12R0.5 CCCSCCOCCCOCC 7a_200000230433_100012232248 [0,2,0,0,0,0|0,1,0]=3 6944 B12R0.5 CCCSCCOCCOCC#N 7a_200000230433_200000047693 [0,2,0,0,0,0|0,1,1]=4 6945 B12R0.5 CCCSCCOCCOCCO 34a_200000230433_100000692535 [0,2,0,0,0,0|0,1,0]=3 6946 B12R0.5 CCCSCCOCCOCCO 62a_100000032323_100000210303 [0,2,0,0,0,0|0,1,0]=3 6947 B12R0.5 CCCSCCOCCOCCO 62a_100000210303_100000032323 [0,2,0,0,0,0|0,1,0]=3 6948 B12R0.5 CCCSCCOCCOCCO 7a_200000230433_100011215305 [0,2,0,0,0,0|0,1,0]=3 6949 B12R0.5 CCNCCCOCCOCCO 2230a_100011996194_100000210202 [0,2,0,0,0,0|1,0,0]=3 6950 B12R0.5 CCNCCCOCCOCCO 34a_100011996194_100000210202 [0,2,0,0,0,0|1,0,0]=3 6951 B12R0.5 CCNCCOCCOCCOC 2230a_100012028300_100000210202 [0,2,0,0,0,0|1,0,0]=3 6952 B12R0.5 CCNCCOCCOCCOC 2230a_100015525214_100013367474 [0,2,0,0,0,0|1,0,0]=3 6953 B12R0.5 CCNCCOCCOCCOC 34a_100012028300_100000210202 [0,2,0,0,0,0|1,0,0]=3 6954 B12R0.5 CCOCCCCCCCCCBr 34a_100009813782_100000210202 [0,2,0,0,0,0|2,0,0]=4 6955 B12R0.5 CCOCCCCCCCCCBr 7a_100009813782_100000210202 [0,2,0,0,0,0|2,0,0]=4 6956 B12R0.5 CCOCCCCCCCCCCl 34a_100009868337_100000210202 [0,2,0,0,0,0|2,0,0]=4 6957 B12R0.5 CCOCCCCCCCCCCl 7a_100009868337_100000210202 [0,2,0,0,0,0|2,0,0]=4 6958 B12R0.5 CCOCCCCCCCCCN 34a_100000078944_100000210202 [0,2,0,0,0,0|2,0,0]=4 6959 B12R0.5 CCOCCCCCCCCCO 34a_100121572206_100009813782 [0,2,0,0,0,0|2,0,0]=4 6960 B12R0.5 CCOCCCNCCCCCF 2230a_100000210961_100000729378 [0,2,0,0,0,0|2,0,0]=4 6961 B12R0.5 CCOCCCNCCCCCF 34a_100000210961_100000729378 [0,2,0,0,0,0|2,0,0]=4 6962 B12R0.5 CCOCCCNCCCCCO 2230a_100000210961_100000746330 [0,2,0,0,0,0|2,0,0]=4 6963 B12R0.5 CCOCCCNCCCCCO 2230a_100000762737_100012232248 [0,2,0,0,0,0|2,0,0]=4 6964 B12R0.5 CCOCCCNCCCCCO 34a_100000210961_100000746330 [0,2,0,0,0,0|2,0,0]=4 6965 B12R0.5 CCOCCCNCCCCCO 34a_100000762737_100012232248 [0,2,0,0,0,0|2,0,0]=4 6966 B12R0.5 CCOCCCNCCCCOC 2230a_100000210961_100000730899 [0,2,0,0,0,0|2,0,0]=4 6967 B12R0.5 CCOCCCNCCCCOC 34a_100000210961_100000755781 [0,2,0,0,0,0|2,0,0]=4 6968 B12R0.5 CCOCCCNCCCOCC 2230a_100000210961_100012232248 [0,2,0,0,0,0|1,0,0]=3 6969 B12R0.5 CCOCCCNCCCOCC 34a_100000210961_100012232248 [0,2,0,0,0,0|1,0,0]=3 6970 B12R0.5 CCOCCCNCCOCC#N 2230a_100000210961_200000047693 [0,2,0,0,0,0|1,0,1]=4 6971 B12R0.5 CCOCCCNCCOCCO 2230a_100000210961_100011215305 [0,2,0,0,0,0|1,0,0]=3 6972 B12R0.5 CCOCCCNCCOCCO 2230a_100000211614_100012232248 [0,2,0,0,0,0|1,0,0]=3 6973 B12R0.5 CCOCCCNCCOCCO 34a_100000210961_100000692535 [0,2,0,0,0,0|1,0,0]=3 6974 B12R0.5 CCOCCCNCCOCCO 34a_100000211614_100012232248 [0,2,0,0,0,0|1,0,0]=3 6975 B12R0.5 CCOCCCNCCSCCO 2230a_100011219999_100012232248 [0,2,0,0,0,0|1,1,0]=4 6976 B12R0.5 CCOCCCNCOCCOC 2230a_100000210961_100000231047 [0,2,0,0,0,0|2,0,0]=4 6977 B12R0.5 CCOCCCOCCCCC#N 7a_100000757476_100000211819 [0,2,0,0,0,0|1,0,1]=4 6978 B12R0.5 CCOCCCOCCCCC=O 7a_100000757476_100000139335 [0,2,0,0,0,0|1,0,1]=4 6979 B12R0.5 CCOCCCOCCCCCBr 34a_100000746331_100012232248 [0,2,0,0,0,0|1,0,0]=3 6980 B12R0.5 CCOCCCOCCCCCBr 7a_100000746331_100012232248 [0,2,0,0,0,0|1,0,0]=3 6981 B12R0.5 CCOCCCOCCCCCCl 34a_100000746330_100012232248 [0,2,0,0,0,0|1,0,0]=3 6982 B12R0.5 CCOCCCOCCCCCCl 7a_100000746330_100012232248 [0,2,0,0,0,0|1,0,0]=3 6983 B12R0.5 CCOCCCOCCCCCF 34a_100000757476_100000729378 [0,2,0,0,0,0|1,0,0]=3 6984 B12R0.5 CCOCCCOCCCCCF 7a_100000757476_100000729378 [0,2,0,0,0,0|1,0,0]=3 6985 B12R0.5 CCOCCCOCCCCCI 34a_200012148887_100012232248 [0,2,0,0,0,0|1,0,0]=3 6986 B12R0.5 CCOCCCOCCCCCI 7a_200012148887_100012232248 [0,2,0,0,0,0|1,0,0]=3 6987 B12R0.5 CCOCCCOCCCCCN 34a_100000762737_100012232248 [0,2,0,0,0,0|1,0,0]=3 6988 B12R0.5 CCOCCCOCCCCCO 34a_100000757476_100000746330 [0,2,0,0,0,0|1,0,0]=3 6989 B12R0.5 CCOCCCOCCCCCO 7a_100000757476_100000746330 [0,2,0,0,0,0|1,0,0]=3 6990 B12R0.5 CCOCCCOCCCCOC 34a_100000740925_100012232248 [0,2,0,0,0,0|1,0,0]=3 6991 B12R0.5 CCOCCCOCCCCOC 34a_100000757476_100000755781 [0,2,0,0,0,0|1,0,0]=3 6992 B12R0.5 CCOCCCOCCCCOC 7a_100000757476_100000730899 [0,2,0,0,0,0|1,0,0]=3 6993 B12R0.5 CCOCCCOCCCCSC 34a_100011217163_100012232248 [0,2,0,0,0,0|1,0,0]=3 6994 B12R0.5 CCOCCCOCCCCSC 7a_100011217163_100012232248 [0,2,0,0,0,0|1,0,0]=3 6995 B12R0.5 CCOCCCOCCCOCC 34a_100000757476_100012232248 [0,2,0,0,0,0|0,0,0]=2 6996 B12R0.5 CCOCCCOCCCOCC 7a_100000757476_100012232248 [0,2,0,0,0,0|0,0,0]=2 6997 B12R0.5 CCOCCCOCCCSCC 34a_100011216438_100012232248 [0,2,0,0,0,0|0,1,0]=3 6998 B12R0.5 CCOCCCOCCCSCC 7a_100011216438_100012232248 [0,2,0,0,0,0|0,1,0]=3 6999 B12R0.5 CCOCCCOCCOCC#N 7a_100000757476_200000047693 [0,2,0,0,0,0|0,0,1]=3 7000 B12R0.5 CCOCCCOCCOCCBr 34a_100000692535_100012232248 [0,2,0,0,0,0|0,0,0]=2 7001 B12R0.5 CCOCCCOCCOCCBr 7a_100000692535_100012232248 [0,2,0,0,0,0|0,0,0]=2 7002 B12R0.5 CCOCCCOCCOCCCl 34a_100011215305_100012232248 [0,2,0,0,0,0|0,0,0]=2 7003 B12R0.5 CCOCCCOCCOCCCl 7a_100011215305_100012232248 [0,2,0,0,0,0|0,0,0]=2 7004 B12R0.5 CCOCCCOCCOCCF 34a_200015357709_100012232248 [0,2,0,0,0,0|0,0,0]=2 7005 B12R0.5 CCOCCCOCCOCCF 7a_200015357709_100012232248 [0,2,0,0,0,0|0,0,0]=2 7006 B12R0.5 CCOCCCOCCOCCI 34a_100012149058_100012232248 [0,2,0,0,0,0|0,0,0]=2 7007 B12R0.5 CCOCCCOCCOCCI 7a_100012149058_100012232248 [0,2,0,0,0,0|0,0,0]=2 7008 B12R0.5 CCOCCCOCCOCCN 34a_100000211614_100012232248 [0,2,0,0,0,0|0,0,0]=2 7009 B12R0.5 CCOCCCOCCOCCO 34a_100000757476_100000692535 [0,2,0,0,0,0|0,0,0]=2 7010 B12R0.5 CCOCCCOCCOCCO 7a_100000757476_100011215305 [0,2,0,0,0,0|0,0,0]=2 7011 B12R0.5 CCOCCCSCCCCCF 62a_100000729378_100012232248 [0,2,0,0,0,0|1,1,0]=4 7012 B12R0.5 CCOCCCSCCCCCF 62a_100012232248_100000729378 [0,2,0,0,0,0|1,1,0]=4 7013 B12R0.5 CCOCCCSCCCCCO 62a_100000746330_100012232248 [0,2,0,0,0,0|1,1,0]=4 7014 B12R0.5 CCOCCCSCCCCCO 62a_100012232248_100000746330 [0,2,0,0,0,0|1,1,0]=4 7015 B12R0.5 CCOCCCSCCCCOC 62a_100000730899_100012232248 [0,2,0,0,0,0|1,1,0]=4 7016 B12R0.5 CCOCCCSCCCCOC 62a_100012232248_100000730899 [0,2,0,0,0,0|1,1,0]=4 7017 B12R0.5 CCOCCCSCCCOCC 62a_100012232248_100012232248 [0,2,0,0,0,0|0,1,0]=3 7018 B12R0.5 CCOCCCSCCOCC#N 62a_100012232248_200000047693 [0,2,0,0,0,0|0,1,1]=4 7019 B12R0.5 CCOCCCSCCOCC#N 62a_200000047693_100012232248 [0,2,0,0,0,0|0,1,1]=4 7020 B12R0.5 CCOCCCSCCOCCO 62a_100011215305_100012232248 [0,2,0,0,0,0|0,1,0]=3 7021 B12R0.5 CCOCCCSCCOCCO 62a_100012232248_100011215305 [0,2,0,0,0,0|0,1,0]=3 7022 B12R0.5 CCOCCCSCOCCOC 62a_100000231047_100012232248 [0,2,0,0,0,0|2,0,0]=4 7023 B12R0.5 CCOCCCSCOCCOC 62a_100012232248_100000231047 [0,2,0,0,0,0|2,0,0]=4 7024 B12R0.5 CCOCCNCCCCCC#N 2230a_102516460346_100009813376 [0,2,0,0,0,0|2,0,0]=4 7025 B12R0.5 CCOCCNCCCCCC=O 2230a_102516460346_100000139337 [0,2,0,0,0,0|2,0,0]=4 7026 B12R0.5 CCOCCNCCCCCCF 2230a_102516460346_100015922095 [0,2,0,0,0,0|2,0,0]=4 7027 B12R0.5 CCOCCNCCCCCCF 34a_102516460346_100015922095 [0,2,0,0,0,0|2,0,0]=4 7028 B12R0.5 CCOCCNCCCCCCO 2230a_100000686447_100011215890 [0,2,0,0,0,0|2,0,0]=4 7029 B12R0.5 CCOCCNCCCCCCO 2230a_102516460346_100000766143 [0,2,0,0,0,0|2,0,0]=4 7030 B12R0.5 CCOCCNCCCCCCO 34a_100000686447_100000210147 [0,2,0,0,0,0|2,0,0]=4 7031 B12R0.5 CCOCCNCCCCCCO 34a_102516460346_100000766143 [0,2,0,0,0,0|2,0,0]=4 7032 B12R0.5 CCOCCNCCCCCOC 2230a_100000747528_100011215890 [0,2,0,0,0,0|2,0,0]=4 7033 B12R0.5 CCOCCNCCCCCOC 34a_100000747528_100000210147 [0,2,0,0,0,0|2,0,0]=4 7034 B12R0.5 CCOCCNCCOCCOC 2230a_100000745349_100011215890 [0,2,0,0,0,0|1,0,0]=3 7035 B12R0.5 CCOCCNCCOCCOC 2230a_102516460346_100000695917 [0,2,0,0,0,0|1,0,0]=3 7036 B12R0.5 CCOCCNCCOCCOC 34a_100000745349_100000210147 [0,2,0,0,0,0|1,0,0]=3 7037 B12R0.5 CCOCCNCCOCCOC 34a_102516460346_100000695917 [0,2,0,0,0,0|1,0,0]=3 7038 B12R0.5 CCOCCOCCCCCC#N 7a_100000210136_100009813376 [0,2,0,0,0,0|1,0,0]=3 7039 B12R0.5 CCOCCOCCCCCC=O 7a_100000210136_100000139337 [0,2,0,0,0,0|1,0,0]=3 7040 B12R0.5 CCOCCOCCCCCCBr 34a_100011215345_100000210147 [0,2,0,0,0,0|1,0,0]=3 7041 B12R0.5 CCOCCOCCCCCCBr 7a_100011215345_100011215890 [0,2,0,0,0,0|1,0,0]=3 7042 B12R0.5 CCOCCOCCCCCCCl 34a_100000766143_100000210147 [0,2,0,0,0,0|1,0,0]=3 7043 B12R0.5 CCOCCOCCCCCCCl 7a_100000766143_100011215890 [0,2,0,0,0,0|1,0,0]=3 7044 B12R0.5 CCOCCOCCCCCCF 34a_100000210136_100015922095 [0,2,0,0,0,0|1,0,0]=3 7045 B12R0.5 CCOCCOCCCCCCF 34a_100000732779_100000210147 [0,2,0,0,0,0|1,0,0]=3 7046 B12R0.5 CCOCCOCCCCCCF 7a_100000210136_100015922095 [0,2,0,0,0,0|1,0,0]=3 7047 B12R0.5 CCOCCOCCCCCCF 7a_100000732779_100011215890 [0,2,0,0,0,0|1,0,0]=3 7048 B12R0.5 CCOCCOCCCCCCN 34a_100000686447_100000210147 [0,2,0,0,0,0|1,0,0]=3 7049 B12R0.5 CCOCCOCCCCCCO 34a_100000210136_100000766143 [0,2,0,0,0,0|1,0,0]=3 7050 B12R0.5 CCOCCOCCCCCCO 7a_100000210136_100000766143 [0,2,0,0,0,0|1,0,0]=3 7051 B12R0.5 CCOCCOCCCCCNC 34a_100000722520_100000210147 [0,2,0,0,0,0|1,0,0]=3 7052 B12R0.5 CCOCCOCCNCCC#N 2230a_100102712874_100011215226 [0,2,0,0,0,0|1,0,0]=3 7053 B12R0.5 CCOCCOCCNCCCF 2230a_100015189416_100011211534 [0,2,0,0,0,0|1,0,0]=3 7054 B12R0.5 CCOCCOCCNCCCF 2230a_100102712874_100011934791 [0,2,0,0,0,0|1,0,0]=3 7055 B12R0.5 CCOCCOCCNCCCF 34a_100015189416_100011211534 [0,2,0,0,0,0|1,0,0]=3 7056 B12R0.5 CCOCCOCCNCCCF 34a_100102712874_100011934791 [0,2,0,0,0,0|1,0,0]=3 7057 B12R0.5 CCOCCOCCNCCCO 2230a_100102712874_100000230001 [0,2,0,0,0,0|1,0,0]=3 7058 B12R0.5 CCOCCOCCNCCCO 34a_100102712874_100000230001 [0,2,0,0,0,0|1,0,0]=3 7059 B12R0.5 CCOCCOCCNCCOC 2230a_100000209980_100011211534 [0,2,0,0,0,0|1,0,0]=3 7060 B12R0.5 CCOCCOCCNCCOC 2230a_100102712874_100011201679 [0,2,0,0,0,0|1,0,0]=3 7061 B12R0.5 CCOCCOCCNCCOC 34a_100102712874_100011201679 [0,2,0,0,0,0|1,0,0]=3 7062 B12R0.5 CCOCCOCCNCCSC 2230a_100020590264_100011211534 [0,2,0,0,0,0|1,0,0]=3 7063 B12R0.5 CCOCCOCCNCCSC 2230a_100102712874_100000751147 [0,2,0,0,0,0|1,0,0]=3 7064 B12R0.5 CCOCCOCCNCCSC 34a_100102712874_100000212216 [0,2,0,0,0,0|1,0,0]=3 7065 B12R0.5 CCOCCOCCOCCC#N 7a_100000210240_100000184422 [0,2,0,0,0,0|0,0,0]=2 7066 B12R0.5 CCOCCOCCOCCCBr 34a_100011217188_100011211534 [0,2,0,0,0,0|0,0,0]=2 7067 B12R0.5 CCOCCOCCOCCCCl 34a_100000230001_100011211534 [0,2,0,0,0,0|0,0,0]=2 7068 B12R0.5 CCOCCOCCOCCCF 34a_100000210240_100011934791 [0,2,0,0,0,0|0,0,0]=2 7069 B12R0.5 CCOCCOCCOCCCF 34a_100000759539_100011211534 [0,2,0,0,0,0|0,0,0]=2 7070 B12R0.5 CCOCCOCCOCCCF 7a_100000210240_100011934791 [0,2,0,0,0,0|0,0,0]=2 7071 B12R0.5 CCOCCOCCOCCCN 34a_100000182051_100011211534 [0,2,0,0,0,0|0,0,0]=2 7072 B12R0.5 CCOCCOCCOCCCN 34a_100011996194_100000210202 [0,2,0,0,0,0|0,0,0]=2 7073 B12R0.5 CCOCCOCCOCCCO 34a_100000210240_100000230001 [0,2,0,0,0,0|0,0,0]=2 7074 B12R0.5 CCOCCOCCOCCCO 7a_100000210240_100011215043 [0,2,0,0,0,0|0,0,0]=2 7075 B12R0.5 CCOCCOCCOCCNC 2230a_100012282185_200000210301 [0,2,0,0,0,0|0,0,0]=2 7076 B12R0.5 CCOCCOCCOCCNC 34a_100000228057_100000210147 [0,2,0,0,0,0|0,0,0]=2 7077 B12R0.5 CCOCCOCCOCCNC 34a_100012282185_200000210301 [0,2,0,0,0,0|0,0,0]=2 7078 B12R0.5 CCOCCOCCOCCNC 34a_200014138305_100000210202 [0,2,0,0,0,0|0,0,0]=2 7079 B12R0.5 CCOCCOCCOCCN[13CH3] 2230a_100012282185_200025704644 [0,2,0,0,0,0|0,0,0]=2 7080 B12R0.5 CCOCCOCCOCCN[13CH3] 34a_100012282185_200025704644 [0,2,0,0,0,0|0,0,0]=2 7081 B12R0.5 CCOCCOCCOCCOC 34a_100000033264_200000210301 [0,2,0,0,0,0|0,0,0]=2 7082 B12R0.5 CCOCCOCCOCCOC 34a_100000210136_100000695917 [0,2,0,0,0,0|0,0,0]=2 7083 B12R0.5 CCOCCOCCOCCOC 34a_100000210237_100011211534 [0,2,0,0,0,0|0,0,0]=2 7084 B12R0.5 CCOCCOCCOCCOC 34a_100000210240_100011201679 [0,2,0,0,0,0|0,0,0]=2 7085 B12R0.5 CCOCCOCCOCCOC 34a_100000688194_100000210202 [0,2,0,0,0,0|0,0,0]=2 7086 B12R0.5 CCOCCOCCOCCOC 34a_100011215163_100000210147 [0,2,0,0,0,0|0,0,0]=2 7087 B12R0.5 CCOCCOCCOCCOC 34a_100121572206_100013367474 [0,2,0,0,0,0|0,0,0]=2 7088 B12R0.5 CCOCCOCCOCCOC 7a_100000033264_200000210301 [0,2,0,0,0,0|0,0,0]=2 7089 B12R0.5 CCOCCOCCOCCOC 7a_100000210136_100000695917 [0,2,0,0,0,0|0,0,0]=2 7090 B12R0.5 CCOCCOCCOCCOC 7a_100000210240_100000233755 [0,2,0,0,0,0|0,0,0]=2 7091 B12R0.5 CCOCCOCCOCCOC 7a_100000688194_100000210202 [0,2,0,0,0,0|0,0,0]=2 7092 B12R0.5 CCOCCOCCOCCOC 7a_100011215163_100011215890 [0,2,0,0,0,0|0,0,0]=2 7093 B12R0.5 CCOCCOCCOCCON 34a_100000700252_100011211534 [0,2,0,0,0,0|0,0,0]=2 7094 B12R0.5 CCOCCOCCOCCO[13CH3] 34a_100000033264_200025704644 [0,2,0,0,0,0|0,0,0]=2 7095 B12R0.5 CCOCCOCCOCCO[13CH3] 7a_100000033264_200025704644 [0,2,0,0,0,0|0,0,0]=2 7096 B12R0.5 CCOCCOCCOCCSC 34a_100000210240_100000212216 [0,2,0,0,0,0|0,0,0]=2 7097 B12R0.5 CCOCCOCCOCCSC 34a_100000230434_100011211534 [0,2,0,0,0,0|0,0,0]=2 7098 B12R0.5 CCOCCOCCOCCSC 7a_100000210240_100000212216 [0,2,0,0,0,0|0,0,0]=2 7099 B12R0.5 CCOCCOCCOCCSC 7a_100000230434_100011211534 [0,2,0,0,0,0|0,0,0]=2 7100 B12R0.5 CCOCCOCCSCCC#N 62a_100011211534_100011215226 [0,2,0,0,0,0|0,1,0]=3 7101 B12R0.5 CCOCCOCCSCCC#N 62a_100011215226_100011211534 [0,2,0,0,0,0|0,1,0]=3 7102 B12R0.5 CCOCCOCCSCCCF 62a_100011211534_100011934791 [0,2,0,0,0,0|0,1,0]=3 7103 B12R0.5 CCOCCOCCSCCCF 62a_100011934791_100011211534 [0,2,0,0,0,0|0,1,0]=3 7104 B12R0.5 CCOCCOCCSCCCO 62a_100011211534_100011215043 [0,2,0,0,0,0|0,1,0]=3 7105 B12R0.5 CCOCCOCCSCCCO 62a_100011215043_100011211534 [0,2,0,0,0,0|0,1,0]=3 7106 B12R0.5 CCOCCOCCSCCOC 62a_100000233755_100011211534 [0,2,0,0,0,0|0,1,0]=3 7107 B12R0.5 CCOCCOCCSCCOC 62a_100011211534_100000233755 [0,2,0,0,0,0|0,1,0]=3 7108 B12R0.5 CCOCCOCCSCCSC 62a_100000212216_100011211534 [0,2,0,0,0,0|0,1,0]=3 7109 B12R0.5 CCOCCOCCSCCSC 62a_100011211534_100000751147 [0,2,0,0,0,0|0,1,0]=3 7110 B12R0.5 CCOCCOCCSCOCC 62a_100000739092_100011211534 [0,2,0,0,0,0|0,0,0]=2 7111 B12R0.5 CCOCCOCCSCOCC 62a_100011211534_100000739092 [0,2,0,0,0,0|0,0,0]=2 7112 B12R0.5 CCOCCOCCSCSC#N 62a_100000211825_100011211534 [0,2,0,0,0,0|0,1,1]=4 7113 B12R0.5 CCOCCOCCSCSC#N 62a_100011211534_100000211825 [0,2,0,0,0,0|0,1,1]=4 7114 B12R0.5 CCOCCSCCCCCC#N 62a_100000210147_100009813376 [0,2,0,0,0,0|1,1,0]=4 7115 B12R0.5 CCOCCSCCCCCC#N 62a_100009813376_100011215890 [0,2,0,0,0,0|1,1,0]=4 7116 B12R0.5 CCOCCSCCCCCC=O 62a_100000139337_100011215890 [0,2,0,0,0,0|1,1,0]=4 7117 B12R0.5 CCOCCSCCCCCC=O 62a_100000210147_100000139337 [0,2,0,0,0,0|1,1,0]=4 7118 B12R0.5 CCOCCSCCCCCCF 62a_100000210147_100015922095 [0,2,0,0,0,0|1,1,0]=4 7119 B12R0.5 CCOCCSCCCCCCF 62a_100015922095_100011215890 [0,2,0,0,0,0|1,1,0]=4 7120 B12R0.5 CCOCCSCCCCCCO 62a_100000210147_100000766143 [0,2,0,0,0,0|1,1,0]=4 7121 B12R0.5 CCOCCSCCCCCCO 62a_100000766143_100011215890 [0,2,0,0,0,0|1,1,0]=4 7122 B12R0.5 CCOCCSCCOCCOC 62a_100000210147_100000695917 [0,2,0,0,0,0|0,1,0]=3 7123 B12R0.5 CCOCCSCCOCCOC 62a_100000695917_100011215890 [0,2,0,0,0,0|0,1,0]=3 7124 B12R0.5 CCOCSCCCCCCCO 62a_100000739092_100000760002 [0,2,0,0,0,0|2,0,0]=4 7125 B12R0.5 CCOCSCCCCCCCO 62a_100000760002_100000739092 [0,2,0,0,0,0|2,0,0]=4 7126 B12R0.5 CCOCSCCCCCCOC 62a_100000739092_100011998445 [0,2,0,0,0,0|2,0,0]=4 7127 B12R0.5 CCOCSCCCCCCOC 62a_100011998445_100000739092 [0,2,0,0,0,0|2,0,0]=4 7128 B12R0.5 CCOCSCCCOCCOC 62a_100000739092_100011216529 [0,2,0,0,0,0|2,0,0]=4 7129 B12R0.5 CCOCSCCCOCCOC 62a_100011216529_100000739092 [0,2,0,0,0,0|2,0,0]=4 7130 B12R0.5 CCSCCCOCCCCCF 34a_100011216438_100000729378 [0,2,0,0,0,0|1,1,0]=4 7131 B12R0.5 CCSCCCOCCCCCF 7a_100011216438_100000729378 [0,2,0,0,0,0|1,1,0]=4 7132 B12R0.5 CCSCCCOCCCCCO 34a_100011216438_100000746330 [0,2,0,0,0,0|1,1,0]=4 7133 B12R0.5 CCSCCCOCCCCCO 7a_100011216438_100000746330 [0,2,0,0,0,0|1,1,0]=4 7134 B12R0.5 CCSCCCOCCCCOC 34a_100011216438_100000755781 [0,2,0,0,0,0|1,1,0]=4 7135 B12R0.5 CCSCCCOCCCCOC 7a_100011216438_100000730899 [0,2,0,0,0,0|1,1,0]=4 7136 B12R0.5 CCSCCCOCCOCC#N 7a_100011216438_200000047693 [0,2,0,0,0,0|0,1,1]=4 7137 B12R0.5 CCSCCCOCCOCCO 34a_100011216438_100000692535 [0,2,0,0,0,0|0,1,0]=3 7138 B12R0.5 CCSCCCOCCOCCO 7a_100011216438_100011215305 [0,2,0,0,0,0|0,1,0]=3 7139 B12R0.5 CCSCCNCCOCCOC 2230a_100000106463_100000695917 [0,2,0,0,0,0|1,1,0]=4 7140 B12R0.5 CCSCCNCCOCCOC 2230a_100000745349_100000757381 [0,2,0,0,0,0|1,1,0]=4 7141 B12R0.5 CCSCCNCCOCCOC 34a_100000745349_100000757381 [0,2,0,0,0,0|1,1,0]=4 7142 B12R0.5 CCSCCOCCCCCC#N 7a_100000212035_100009813376 [0,2,0,0,0,0|1,1,0]=4 7143 B12R0.5 CCSCCOCCCCCC=O 7a_100000212035_100000139337 [0,2,0,0,0,0|1,1,0]=4 7144 B12R0.5 CCSCCOCCCCCCBr 34a_100011215345_100000757381 [0,2,0,0,0,0|1,1,0]=4 7145 B12R0.5 CCSCCOCCCCCCBr 7a_100011215345_100000757381 [0,2,0,0,0,0|1,1,0]=4 7146 B12R0.5 CCSCCOCCCCCCCl 34a_100000766143_100000757381 [0,2,0,0,0,0|1,1,0]=4 7147 B12R0.5 CCSCCOCCCCCCCl 7a_100000766143_100000757381 [0,2,0,0,0,0|1,1,0]=4 7148 B12R0.5 CCSCCOCCCCCCF 34a_100000212035_100015922095 [0,2,0,0,0,0|1,1,0]=4 7149 B12R0.5 CCSCCOCCCCCCF 34a_100000732779_100000757381 [0,2,0,0,0,0|1,1,0]=4 7150 B12R0.5 CCSCCOCCCCCCF 7a_100000212035_100015922095 [0,2,0,0,0,0|1,1,0]=4 7151 B12R0.5 CCSCCOCCCCCCF 7a_100000732779_100000757381 [0,2,0,0,0,0|1,1,0]=4 7152 B12R0.5 CCSCCOCCCCCCN 34a_100000686447_100000757381 [0,2,0,0,0,0|1,1,0]=4 7153 B12R0.5 CCSCCOCCCCCCO 34a_100000212035_100000766143 [0,2,0,0,0,0|1,1,0]=4 7154 B12R0.5 CCSCCOCCCCCCO 7a_100000212035_100000766143 [0,2,0,0,0,0|1,1,0]=4 7155 B12R0.5 CCSCCOCCCCCNC 34a_100000722520_100000757381 [0,2,0,0,0,0|1,1,0]=4 7156 B12R0.5 CCSCCOCCOCCNC 34a_100000228057_100000757381 [0,2,0,0,0,0|0,1,0]=3 7157 B12R0.5 CCSCCOCCOCCOC 34a_100000212035_100000695917 [0,2,0,0,0,0|0,1,0]=3 7158 B12R0.5 CCSCCOCCOCCOC 34a_100011215163_100000757381 [0,2,0,0,0,0|0,1,0]=3 7159 B12R0.5 CCSCCOCCOCCOC 62a_100000210202_100013367474 [0,2,0,0,0,0|0,1,0]=3 7160 B12R0.5 CCSCCOCCOCCOC 62a_100013367474_100000210202 [0,2,0,0,0,0|0,1,0]=3 7161 B12R0.5 CCSCCOCCOCCOC 7a_100000212035_100000695917 [0,2,0,0,0,0|0,1,0]=3 7162 B12R0.5 CCSCCOCCOCCOC 7a_100011215163_100000757381 [0,2,0,0,0,0|0,1,0]=3 7163 B12R0.5 CCSCCSCCOCCOC 62a_100000695917_100000757381 [0,2,0,0,0,0|0,2,0]=4 7164 B12R0.5 CCSCCSCCOCCOC 62a_100000757381_100000695917 [0,2,0,0,0,0|0,2,0]=4 7165 B12R0.5 CNCCCOCCOCCOC 34a_100000213112_100000695917 [0,2,0,0,0,0|2,0,0]=4 7166 B12R0.5 CNCCOCCOCCCCF 34a_100000228057_100000729493 [0,2,0,0,0,0|2,0,0]=4 7167 B12R0.5 CNCCOCCOCCCCO 34a_100000228057_100011216708 [0,2,0,0,0,0|2,0,0]=4 7168 B12R0.5 CNCCOCCOCCCOC 34a_100000228057_100000740836 [0,2,0,0,0,0|2,0,0]=4 7169 B12R0.5 CNCCOCCOCCOCF 34a_200014138305_100015361967 [0,2,0,0,0,0|1,0,0]=3 7170 B12R0.5 COCCCCNCCOCCO 2230a_100000211614_100000730899 [0,2,0,0,0,0|2,0,0]=4 7171 B12R0.5 COCCCCNCCOCCO 34a_100000211614_100000755781 [0,2,0,0,0,0|2,0,0]=4 7172 B12R0.5 COCCCCOCCCCCBr 34a_100000746331_100000755781 [0,2,0,0,0,0|2,0,0]=4 7173 B12R0.5 COCCCCOCCCCCBr 7a_100000746331_100000730899 [0,2,0,0,0,0|2,0,0]=4 7174 B12R0.5 COCCCCOCCCCCCl 34a_100000746330_100000755781 [0,2,0,0,0,0|2,0,0]=4 7175 B12R0.5 COCCCCOCCCCCCl 7a_100000746330_100000730899 [0,2,0,0,0,0|2,0,0]=4 7176 B12R0.5 COCCCCOCCCCCF 34a_100000740925_100000729378 [0,2,0,0,0,0|2,0,0]=4 7177 B12R0.5 COCCCCOCCCCCI 34a_200012148887_100000755781 [0,2,0,0,0,0|2,0,0]=4 7178 B12R0.5 COCCCCOCCCCCI 7a_200012148887_100000730899 [0,2,0,0,0,0|2,0,0]=4 7179 B12R0.5 COCCCCOCCCCCN 34a_100000762737_100000755781 [0,2,0,0,0,0|2,0,0]=4 7180 B12R0.5 COCCCCOCCCCCO 34a_100000740925_100000746330 [0,2,0,0,0,0|2,0,0]=4 7181 B12R0.5 COCCCCOCCCCOC 34a_100000740925_100000755781 [0,2,0,0,0,0|2,0,0]=4 7182 B12R0.5 COCCCCOCCCCSC 34a_100011217163_100000755781 [0,2,0,0,0,0|2,0,0]=4 7183 B12R0.5 COCCCCOCCCCSC 7a_100011217163_100000730899 [0,2,0,0,0,0|2,0,0]=4 7184 B12R0.5 COCCCCOCCOCCBr 34a_100000692535_100000755781 [0,2,0,0,0,0|1,0,0]=3 7185 B12R0.5 COCCCCOCCOCCBr 7a_100000692535_100000730899 [0,2,0,0,0,0|1,0,0]=3 7186 B12R0.5 COCCCCOCCOCCCl 34a_100011215305_100000755781 [0,2,0,0,0,0|1,0,0]=3 7187 B12R0.5 COCCCCOCCOCCCl 7a_100011215305_100000730899 [0,2,0,0,0,0|1,0,0]=3 7188 B12R0.5 COCCCCOCCOCCF 34a_200015357709_100000755781 [0,2,0,0,0,0|1,0,0]=3 7189 B12R0.5 COCCCCOCCOCCF 7a_200015357709_100000730899 [0,2,0,0,0,0|1,0,0]=3 7190 B12R0.5 COCCCCOCCOCCI 34a_100012149058_100000755781 [0,2,0,0,0,0|1,0,0]=3 7191 B12R0.5 COCCCCOCCOCCI 7a_100012149058_100000730899 [0,2,0,0,0,0|1,0,0]=3 7192 B12R0.5 COCCCCOCCOCCN 34a_100000211614_100000755781 [0,2,0,0,0,0|1,0,0]=3 7193 B12R0.5 COCCCCOCCOCCO 34a_100000740925_100000692535 [0,2,0,0,0,0|1,0,0]=3 7194 B12R0.5 COCCCCSCCOCCO 62a_100000730899_100011215305 [0,2,0,0,0,0|1,1,0]=4 7195 B12R0.5 COCCCCSCCOCCO 62a_100011215305_100000730899 [0,2,0,0,0,0|1,1,0]=4 7196 B12R0.5 COCCCOCCCOCCF 34a_200011215475_100011217306 [0,2,0,0,0,0|2,0,0]=4 7197 B12R0.5 COCCCOCCCOCCF 7a_200011215475_100011217306 [0,2,0,0,0,0|2,0,0]=4 7198 B12R0.5 COCCCOCCCOCCO 34a_200011215475_100000211926 [0,2,0,0,0,0|2,0,0]=4 7199 B12R0.5 COCCCOCCCOCCO 7a_200011215475_100000211926 [0,2,0,0,0,0|2,0,0]=4 7200 B12R0.5 COCCCOCCCOCSC 34a_200011215475_100011218213 [0,2,0,0,0,0|2,0,0]=4 7201 B12R0.5 COCCCOCCOCCOC 34a_100000740835_100000695917 [0,2,0,0,0,0|2,0,0]=4 7202 B12R0.5 COCCCOCCOCCOC 34a_100011215163_100000740836 [0,2,0,0,0,0|2,0,0]=4 7203 B12R0.5 COCCCOCCOCCOC 7a_100011215163_100000740836 [0,2,0,0,0,0|2,0,0]=4 7204 B12R0.5 COCCOCCOCCCCBr 34a_100011216708_100000695917 [0,2,0,0,0,0|2,0,0]=4 7205 B12R0.5 COCCOCCOCCCCCl 34a_100000210776_100000695917 [0,2,0,0,0,0|2,0,0]=4 7206 B12R0.5 COCCOCCOCCCCCl 7a_100000210776_100000695917 [0,2,0,0,0,0|2,0,0]=4 7207 B12R0.5 COCCOCCOCCCCF 34a_100011215163_100000729493 [0,2,0,0,0,0|2,0,0]=4 7208 B12R0.5 COCCOCCOCCCCF 34a_100011995726_100000695917 [0,2,0,0,0,0|2,0,0]=4 7209 B12R0.5 COCCOCCOCCCCF 7a_100011215163_100000729493 [0,2,0,0,0,0|2,0,0]=4 7210 B12R0.5 COCCOCCOCCCCF 7a_100011995726_100000695917 [0,2,0,0,0,0|2,0,0]=4 7211 B12R0.5 COCCOCCOCCCCI 34a_200012148704_100000695917 [0,2,0,0,0,0|2,0,0]=4 7212 B12R0.5 COCCOCCOCCCCN 34a_100000750430_100000695917 [0,2,0,0,0,0|2,0,0]=4 7213 B12R0.5 COCCOCCOCCCCO 34a_100011215163_100011216708 [0,2,0,0,0,0|2,0,0]=4 7214 B12R0.5 COCCOCCOCCCCO 7a_100011215163_100000210776 [0,2,0,0,0,0|2,0,0]=4 7215 B12R0.5 COCCOCCOCCCSC 34a_100000690336_100000695917 [0,2,0,0,0,0|2,0,0]=4 7216 B12R0.5 COCCOCCOCCCSC 7a_100000690336_100000695917 [0,2,0,0,0,0|2,0,0]=4 7217 B12R0.5 COCCOCCOCCNCF 34a_100012028300_100015361967 [0,2,0,0,0,0|2,0,0]=4 7218 B12R0.5 COCCOCCOCCOCF 34a_100000688194_100015361967 [0,2,0,0,0,0|1,0,0]=3 7219 B12R0.5 COCCOCCOCCOCF 7a_100000688194_100015361967 [0,2,0,0,0,0|1,0,0]=3 7220 B12R0.5 COCCOCCOCCSCF 62a_100013367474_100015361967 [0,2,0,0,0,0|1,1,0]=4 7221 B12R0.5 COCCOCCOCCSCF 62a_100015361967_100013367474 [0,2,0,0,0,0|1,1,0]=4 7222 B12R0.5 COCNCCOCCOCCO 2230a_100011998139_100000766300 [0,2,0,0,0,0|1,0,0]=3 7223 B12R0.5 COCSCCOCCOCCO 62a_100000032323_100000766300 [0,2,0,0,0,0|0,1,0]=3 7224 B12R0.5 COCSCCOCCOCCO 62a_100000766300_100000032323 [0,2,0,0,0,0|0,1,0]=3 7225 B12R0.5 CSCCCCOCCCCCF 34a_100011217163_100000729378 [0,2,0,0,0,0|2,0,0]=4 7226 B12R0.5 CSCCCCOCCCCCF 7a_100011217163_100000729378 [0,2,0,0,0,0|2,0,0]=4 7227 B12R0.5 CSCCCCOCCCCCO 34a_100011217163_100000746330 [0,2,0,0,0,0|2,0,0]=4 7228 B12R0.5 CSCCCCOCCCCCO 7a_100011217163_100000746330 [0,2,0,0,0,0|2,0,0]=4 7229 B12R0.5 CSCCCCOCCOCC#N 7a_100011217163_200000047693 [0,2,0,0,0,0|1,0,1]=4 7230 B12R0.5 CSCCCCOCCOCCO 34a_100011217163_100000692535 [0,2,0,0,0,0|1,0,0]=3 7231 B12R0.5 CSCCCCOCCOCCO 7a_100011217163_100011215305 [0,2,0,0,0,0|1,0,0]=3 7232 B12R0.5 CSCNCCOCCOCCO 2230a_100011998139_100011218213 [0,2,0,0,0,0|1,0,0]=3 7233 B12R0.5 CSCNCCOCCOCCO 34a_100011998139_100011218213 [0,2,0,0,0,0|1,0,0]=3 7234 B12R0.5 CSCOCCCCCCCCBr 34a_100009813846_100011218213 [0,2,0,0,0,0|2,0,0]=4 7235 B12R0.5 CSCOCCCCCCCCCl 34a_100000033203_100011218213 [0,2,0,0,0,0|2,0,0]=4 7236 B12R0.5 CSCOCCCCCCCCN 34a_102515433106_100011218213 [0,2,0,0,0,0|2,0,0]=4 7237 B12R0.5 CSCOCCCCCNCCN 34a_103619048469_100011218213 [0,2,0,0,0,0|2,0,0]=4 7238 B12R0.5 CSCOCCOCCOCCBr 34a_100010132937_100011218213 [0,2,0,0,0,0|0,0,0]=2 7239 B12R0.5 CSCOCCOCCOCCCl 34a_100000032323_100011218213 [0,2,0,0,0,0|0,0,0]=2 7240 B12R0.5 CSCOCCOCCOCCN 34a_100011998139_100011218213 [0,2,0,0,0,0|0,0,0]=2 7241 B12R0.5 CSCSCCOCCOCCO 62a_100000032323_100011218213 [0,2,0,0,0,0|0,1,0]=3 7242 B12R0.5 CSCSCCOCCOCCO 62a_100011218213_100000032323 [0,2,0,0,0,0|0,1,0]=3 7243 B12R0.5 FCCCCCOCCCCCBr 34a_100000746331_100000729378 [0,2,0,0,0,0|2,0,0]=4 7244 B12R0.5 FCCCCCOCCCCCBr 7a_100000746331_100000729378 [0,2,0,0,0,0|2,0,0]=4 7245 B12R0.5 FCCCCCOCCCCCCl 34a_100000746330_100000729378 [0,2,0,0,0,0|2,0,0]=4 7246 B12R0.5 FCCCCCOCCCCCCl 7a_100000746330_100000729378 [0,2,0,0,0,0|2,0,0]=4 7247 B12R0.5 FCCCCCOCCCCCI 34a_200012148887_100000729378 [0,2,0,0,0,0|2,0,0]=4 7248 B12R0.5 FCCCCCOCCCCCI 7a_200012148887_100000729378 [0,2,0,0,0,0|2,0,0]=4 7249 B12R0.5 FCCCCCOCCOCCBr 34a_100000692535_100000729378 [0,2,0,0,0,0|1,0,0]=3 7250 B12R0.5 FCCCCCOCCOCCBr 7a_100000692535_100000729378 [0,2,0,0,0,0|1,0,0]=3 7251 B12R0.5 FCCCCCOCCOCCCl 34a_100011215305_100000729378 [0,2,0,0,0,0|1,0,0]=3 7252 B12R0.5 FCCCCCOCCOCCCl 7a_100011215305_100000729378 [0,2,0,0,0,0|1,0,0]=3 7253 B12R0.5 FCCCCCOCCOCCF 34a_200015357709_100000729378 [0,2,0,0,0,0|1,0,0]=3 7254 B12R0.5 FCCCCCOCCOCCF 7a_200015357709_100000729378 [0,2,0,0,0,0|1,0,0]=3 7255 B12R0.5 FCCCCCOCCOCCI 34a_100012149058_100000729378 [0,2,0,0,0,0|1,0,0]=3 7256 B12R0.5 FCCCCCOCCOCCI 7a_100012149058_100000729378 [0,2,0,0,0,0|1,0,0]=3 7257 B12R0.5 FCCOCCCCCCCCBr 34a_100009813846_100011217306 [0,2,0,0,0,0|2,0,0]=4 7258 B12R0.5 FCCOCCCCCCCCBr 7a_100009813846_100011217306 [0,2,0,0,0,0|2,0,0]=4 7259 B12R0.5 FCCOCCCCCCCCCl 34a_100000033203_100011217306 [0,2,0,0,0,0|2,0,0]=4 7260 B12R0.5 FCCOCCCCCCCCCl 7a_100000033203_100011217306 [0,2,0,0,0,0|2,0,0]=4 7261 B12R0.5 FCCOCCOCCOCCBr 34a_100010132937_100011217306 [0,2,0,0,0,0|0,0,0]=2 7262 B12R0.5 FCCOCCOCCOCCBr 7a_100010132937_100011217306 [0,2,0,0,0,0|0,0,0]=2 7263 B12R0.5 FCCOCCOCCOCCCl 34a_100000032323_100011217306 [0,2,0,0,0,0|0,0,0]=2 7264 B12R0.5 FCCOCCOCCOCCCl 7a_100000032323_100011217306 [0,2,0,0,0,0|0,0,0]=2 7265 B12R0.5 N#CCCCCOCCOCCBr 7a_100000692535_100000211819 [0,2,0,0,0,0|1,0,1]=4 7266 B12R0.5 N#CCCCCOCCOCCCl 7a_100011215305_100000211819 [0,2,0,0,0,0|1,0,1]=4 7267 B12R0.5 N#CCCCCOCCOCCF 7a_200015357709_100000211819 [0,2,0,0,0,0|1,0,1]=4 7268 B12R0.5 N#CCCCCOCCOCCI 7a_100012149058_100000211819 [0,2,0,0,0,0|1,0,1]=4 7269 B12R0.5 N#CCNCCOCCOCCO 2230a_100011998139_100011215382 [0,2,0,0,0,0|1,0,1]=4 7270 B12R0.5 N#CCOCCNCCOCCO 2230a_100000211614_200000047693 [0,2,0,0,0,0|1,0,1]=4 7271 B12R0.5 N#CCOCCOCCCCCBr 7a_100000746331_200000047693 [0,2,0,0,0,0|1,0,1]=4 7272 B12R0.5 N#CCOCCOCCCCCCl 7a_100000746330_200000047693 [0,2,0,0,0,0|1,0,1]=4 7273 B12R0.5 N#CCOCCOCCCCCI 7a_200012148887_200000047693 [0,2,0,0,0,0|1,0,1]=4 7274 B12R0.5 N#CCOCCOCCOCCBr 7a_100000692535_200000047693 [0,2,0,0,0,0|0,0,1]=3 7275 B12R0.5 N#CCOCCOCCOCCBr 7a_100010132937_100011215382 [0,2,0,0,0,0|0,0,1]=3 7276 B12R0.5 N#CCOCCOCCOCCCl 7a_100000032323_100011215382 [0,2,0,0,0,0|0,0,1]=3 7277 B12R0.5 N#CCOCCOCCOCCCl 7a_100011215305_200000047693 [0,2,0,0,0,0|0,0,1]=3 7278 B12R0.5 N#CCOCCOCCOCCF 7a_200015357709_200000047693 [0,2,0,0,0,0|0,0,1]=3 7279 B12R0.5 N#CCOCCOCCOCCI 7a_100012149058_200000047693 [0,2,0,0,0,0|0,0,1]=3 7280 B12R0.5 N#CCOCCSCCOCCO 62a_100011215305_200000047693 [0,2,0,0,0,0|0,1,1]=4 7281 B12R0.5 N#CCOCCSCCOCCO 62a_200000047693_100011215305 [0,2,0,0,0,0|0,1,1]=4 7282 B12R0.5 N#CCSCCOCCOCCO 62a_100000032323_100011215382 [0,2,0,0,0,0|0,1,1]=4 7283 B12R0.5 N#CCSCCOCCOCCO 62a_100011215382_100000032323 [0,2,0,0,0,0|0,1,1]=4 7284 B12R0.5 NCCCCCCCCOCCF 34a_102515433106_100011217306 [0,2,0,0,0,0|2,0,0]=4 7285 B12R0.5 NCCCCCCCCOCCO 34a_102515433106_100000211926 [0,2,0,0,0,0|2,0,0]=4 7286 B12R0.5 NCCCCCOCCCCCF 34a_100000762737_100000729378 [0,2,0,0,0,0|2,0,0]=4 7287 B12R0.5 NCCCCCOCCCCCO 34a_100000762737_100000746330 [0,2,0,0,0,0|2,0,0]=4 7288 B12R0.5 NCCCCCOCCOCCO 34a_100000762737_100000692535 [0,2,0,0,0,0|1,0,0]=3 7289 B12R0.5 NCCCOCCOCCOCF 34a_100011996194_100015361967 [0,2,0,0,0,0|1,0,0]=3 7290 B12R0.5 NCCNCCCCCOCCF 34a_103619048469_100011217306 [0,2,0,0,0,0|2,0,0]=4 7291 B12R0.5 NCCNCCCCCOCCO 34a_103619048469_100000211926 [0,2,0,0,0,0|2,0,0]=4 7292 B12R0.5 NCCOCCCCCCCCO 34a_100000210304_100000033203 [0,2,0,0,0,0|2,0,0]=4 7293 B12R0.5 NCCOCCOCCCCCF 34a_100000211614_100000729378 [0,2,0,0,0,0|1,0,0]=3 7294 B12R0.5 NCCOCCOCCCCCO 34a_100000211614_100000746330 [0,2,0,0,0,0|1,0,0]=3 7295 B12R0.5 NCCOCCOCCOCC=O 34a_100011998139_200009817547 [0,2,0,0,0,0|0,0,1]=3 7296 B12R0.5 NCCOCCOCCOCCF 34a_100011998139_100011217306 [0,2,0,0,0,0|0,0,0]=2 7297 B12R0.5 NCCOCCOCCOCCO 34a_100000210304_100000032323 [0,2,0,0,0,0|0,0,0]=2 7298 B12R0.5 NCCOCCOCCOCCO 34a_100000211614_100000692535 [0,2,0,0,0,0|0,0,0]=2 7299 B12R0.5 NCCOCCOCCOCCO 34a_100011998139_100000211926 [0,2,0,0,0,0|0,0,0]=2 7300 B12R0.5 O=CCCCCOCCOCCBr 7a_100000692535_100000139335 [0,2,0,0,0,0|1,0,1]=4 7301 B12R0.5 O=CCCCCOCCOCCCl 7a_100011215305_100000139335 [0,2,0,0,0,0|1,0,1]=4 7302 B12R0.5 O=CCCCCOCCOCCF 7a_200015357709_100000139335 [0,2,0,0,0,0|1,0,1]=4 7303 B12R0.5 O=CCCCCOCCOCCI 7a_100012149058_100000139335 [0,2,0,0,0,0|1,0,1]=4 7304 B12R0.5 O=CCNCCOCCOCCO 2230a_100011998139_200015260668 [0,2,0,0,0,0|1,0,1]=4 7305 B12R0.5 O=CCNCCOCCOCCO 34a_100011998139_200009817547 [0,2,0,0,0,0|1,0,1]=4 7306 B12R0.5 O=CCOCCOCCOCCBr 34a_100010132937_200009817547 [0,2,0,0,0,0|0,0,1]=3 7307 B12R0.5 O=CCOCCOCCOCCBr 7a_100010132937_200015260668 [0,2,0,0,0,0|0,0,1]=3 7308 B12R0.5 O=CCOCCOCCOCCCl 34a_100000032323_200009817547 [0,2,0,0,0,0|0,0,1]=3 7309 B12R0.5 O=CCOCCOCCOCCCl 7a_100000032323_200015260668 [0,2,0,0,0,0|0,0,1]=3 7310 B12R0.5 O=CCSCCOCCOCCO 62a_100000032323_200015260668 [0,2,0,0,0,0|0,1,1]=4 7311 B12R0.5 O=CCSCCOCCOCCO 62a_200015260668_100000032323 [0,2,0,0,0,0|0,1,1]=4 7312 B12R0.5 OCCCCCCCCOCCBr 34a_100000211926_100000033203 [0,2,0,0,0,0|2,0,0]=4 7313 B12R0.5 OCCCCCNCCOCCO 2230a_100000211614_100000746330 [0,2,0,0,0,0|2,0,0]=4 7314 B12R0.5 OCCCCCNCCOCCO 2230a_100000762737_100011215305 [0,2,0,0,0,0|2,0,0]=4 7315 B12R0.5 OCCCCCNCCOCCO 34a_100000211614_100000746330 [0,2,0,0,0,0|2,0,0]=4 7316 B12R0.5 OCCCCCNCCOCCO 34a_100000762737_100000692535 [0,2,0,0,0,0|2,0,0]=4 7317 B12R0.5 OCCCCCOCCCCCBr 34a_100000746331_100000746330 [0,2,0,0,0,0|2,0,0]=4 7318 B12R0.5 OCCCCCOCCCCCBr 7a_100000746331_100000746330 [0,2,0,0,0,0|2,0,0]=4 7319 B12R0.5 OCCCCCOCCCCCCl 34a_100000746330_100000746330 [0,2,0,0,0,0|2,0,0]=4 7320 B12R0.5 OCCCCCOCCCCCCl 7a_100000746330_100000746330 [0,2,0,0,0,0|2,0,0]=4 7321 B12R0.5 OCCCCCOCCCCCI 34a_200012148887_100000746330 [0,2,0,0,0,0|2,0,0]=4 7322 B12R0.5 OCCCCCOCCCCCI 7a_200012148887_100000746330 [0,2,0,0,0,0|2,0,0]=4 7323 B12R0.5 OCCCCCOCCOCCBr 34a_100000692535_100000746330 [0,2,0,0,0,0|1,0,0]=3 7324 B12R0.5 OCCCCCOCCOCCBr 7a_100000692535_100000746330 [0,2,0,0,0,0|1,0,0]=3 7325 B12R0.5 OCCCCCOCCOCCCl 34a_100011215305_100000746330 [0,2,0,0,0,0|1,0,0]=3 7326 B12R0.5 OCCCCCOCCOCCCl 7a_100011215305_100000746330 [0,2,0,0,0,0|1,0,0]=3 7327 B12R0.5 OCCCCCOCCOCCF 34a_200015357709_100000746330 [0,2,0,0,0,0|1,0,0]=3 7328 B12R0.5 OCCCCCOCCOCCF 7a_200015357709_100000746330 [0,2,0,0,0,0|1,0,0]=3 7329 B12R0.5 OCCCCCOCCOCCI 34a_100012149058_100000746330 [0,2,0,0,0,0|1,0,0]=3 7330 B12R0.5 OCCCCCOCCOCCI 7a_100012149058_100000746330 [0,2,0,0,0,0|1,0,0]=3 7331 B12R0.5 OCCCCCSCCOCCO 62a_100000746330_100011215305 [0,2,0,0,0,0|1,1,0]=4 7332 B12R0.5 OCCCCCSCCOCCO 62a_100011215305_100000746330 [0,2,0,0,0,0|1,1,0]=4 7333 B12R0.5 OCCNCCOCCOCCO 2230a_100011998139_100000211926 [0,2,0,0,0,0|1,0,0]=3 7334 B12R0.5 OCCNCCOCCOCCO 2230a_100016997473_100000032323 [0,2,0,0,0,0|1,0,0]=3 7335 B12R0.5 OCCNCCOCCOCCO 34a_100011998139_100000211926 [0,2,0,0,0,0|1,0,0]=3 7336 B12R0.5 OCCNCCOCCOCCO 34a_100016990907_100000032323 [0,2,0,0,0,0|1,0,0]=3 7337 B12R0.5 OCCOCCCCCCCCBr 34a_100009813846_100000211926 [0,2,0,0,0,0|2,0,0]=4 7338 B12R0.5 OCCOCCCCCCCCBr 7a_100009813846_100000211926 [0,2,0,0,0,0|2,0,0]=4 7339 B12R0.5 OCCOCCCCCCCCCl 34a_100000033203_100000211926 [0,2,0,0,0,0|2,0,0]=4 7340 B12R0.5 OCCOCCCCCCCCCl 7a_100000033203_100000211926 [0,2,0,0,0,0|2,0,0]=4 7341 B12R0.5 OCCOCCNCCCCCF 2230a_100000211614_100000729378 [0,2,0,0,0,0|2,0,0]=4 7342 B12R0.5 OCCOCCNCCCCCF 34a_100000211614_100000729378 [0,2,0,0,0,0|2,0,0]=4 7343 B12R0.5 OCCOCCNCCOCCO 2230a_100000211614_100011215305 [0,2,0,0,0,0|1,0,0]=3 7344 B12R0.5 OCCOCCNCCOCCO 34a_100000211614_100000692535 [0,2,0,0,0,0|1,0,0]=3 7345 B12R0.5 OCCOCCNCCSCCO 2230a_100011219999_100011215305 [0,2,0,0,0,0|1,1,0]=4 7346 B12R0.5 OCCOCCOCCCCCBr 34a_100000746331_100000692535 [0,2,0,0,0,0|1,0,0]=3 7347 B12R0.5 OCCOCCOCCCCCBr 7a_100000746331_100011215305 [0,2,0,0,0,0|1,0,0]=3 7348 B12R0.5 OCCOCCOCCCCCCl 34a_100000746330_100000692535 [0,2,0,0,0,0|1,0,0]=3 7349 B12R0.5 OCCOCCOCCCCCCl 7a_100000746330_100011215305 [0,2,0,0,0,0|1,0,0]=3 7350 B12R0.5 OCCOCCOCCCCCI 34a_200012148887_100000692535 [0,2,0,0,0,0|1,0,0]=3 7351 B12R0.5 OCCOCCOCCCCCI 7a_200012148887_100011215305 [0,2,0,0,0,0|1,0,0]=3 7352 B12R0.5 OCCOCCOCCCNCF 34a_100011996194_100015361967 [0,2,0,0,0,0|2,0,0]=4 7353 B12R0.5 OCCOCCOCCNCCF 2230a_100011998139_100011217306 [0,2,0,0,0,0|1,0,0]=3 7354 B12R0.5 OCCOCCOCCNCCF 34a_100000724931_100000032323 [0,2,0,0,0,0|1,0,0]=3 7355 B12R0.5 OCCOCCOCCNCCF 34a_100011998139_100011217306 [0,2,0,0,0,0|1,0,0]=3 7356 B12R0.5 OCCOCCOCCOCCBr 34a_100000211926_100000032323 [0,2,0,0,0,0|0,0,0]=2 7357 B12R0.5 OCCOCCOCCOCCBr 34a_100000692535_100000692535 [0,2,0,0,0,0|0,0,0]=2 7358 B12R0.5 OCCOCCOCCOCCBr 34a_100010132937_100000211926 [0,2,0,0,0,0|0,0,0]=2 7359 B12R0.5 OCCOCCOCCOCCBr 7a_100000692535_100011215305 [0,2,0,0,0,0|0,0,0]=2 7360 B12R0.5 OCCOCCOCCOCCBr 7a_100010132937_100000211926 [0,2,0,0,0,0|0,0,0]=2 7361 B12R0.5 OCCOCCOCCOCCCl 34a_100000032323_100000211926 [0,2,0,0,0,0|0,0,0]=2 7362 B12R0.5 OCCOCCOCCOCCCl 34a_100011215305_100000692535 [0,2,0,0,0,0|0,0,0]=2 7363 B12R0.5 OCCOCCOCCOCCCl 7a_100000032323_100000211926 [0,2,0,0,0,0|0,0,0]=2 7364 B12R0.5 OCCOCCOCCOCCCl 7a_100011215305_100011215305 [0,2,0,0,0,0|0,0,0]=2 7365 B12R0.5 OCCOCCOCCOCCF 34a_200015357709_100000692535 [0,2,0,0,0,0|0,0,0]=2 7366 B12R0.5 OCCOCCOCCOCCF 7a_200015357709_100011215305 [0,2,0,0,0,0|0,0,0]=2 7367 B12R0.5 OCCOCCOCCOCCI 34a_100012149058_100000692535 [0,2,0,0,0,0|0,0,0]=2 7368 B12R0.5 OCCOCCOCCOCCI 7a_100012149058_100011215305 [0,2,0,0,0,0|0,0,0]=2 7369 B12R0.5 OCCOCCOCCSCCF 62a_100000032323_100011217306 [0,2,0,0,0,0|0,1,0]=3 7370 B12R0.5 OCCOCCOCCSCCF 62a_100011217306_100000032323 [0,2,0,0,0,0|0,1,0]=3 7371 B12R0.5 OCCOCCOCCSCCO 62a_100000032323_100000211926 [0,2,0,0,0,0|0,1,0]=3 7372 B12R0.5 OCCOCCOCCSCCO 62a_100000211926_100000032323 [0,2,0,0,0,0|0,1,0]=3 7373 B12R0.5 OCCOCCSCCCCCF 62a_100000729378_100011215305 [0,2,0,0,0,0|1,1,0]=4 7374 B12R0.5 OCCOCCSCCCCCF 62a_100011215305_100000729378 [0,2,0,0,0,0|1,1,0]=4 7375 B12R0.5 OCCOCCSCCOCCO 62a_100011215305_100011215305 [0,2,0,0,0,0|0,1,0]=3 7376 B12R0.47 C#CCOCC(=O)OCCOCC 34a_100000210247_200000101388 [0,2,0,0,0,0|0,0,2]=4 7377 B12R0.47 C#CCOCC(C)OCCCCC 34a_100011025554_100000718602 [0,2,0,0,0,0|1,0,1]=4 7378 B12R0.47 C#CCOCC(C)OCCCCC 7a_100011025554_100000210326 [0,2,0,0,0,0|1,0,1]=4 7379 B12R0.47 C#CCOCC(C)OCCOCC 34a_100011025554_100000210147 [0,2,0,0,0,0|0,0,1]=3 7380 B12R0.47 C#CCOCC(C)OCCOCC 7a_100011025554_100011215890 [0,2,0,0,0,0|0,0,1]=3 7381 B12R0.47 C#CCOCC(C)OCCSCC 34a_100011025554_100000757381 [0,2,0,0,0,0|0,1,1]=4 7382 B12R0.47 C#CCOCC(C)OCCSCC 7a_100011025554_100000757381 [0,2,0,0,0,0|0,1,1]=4 7383 B12R0.47 C#CCOCCC(=O)CCOCC 1458a_100000693358_100011215890 [0,2,0,0,0,0|1,0,1]=4 7384 B12R0.47 C#CCOCCC(=O)CCOCC 1458a_100000749530_100010402529 [0,2,0,0,0,0|1,0,1]=4 7385 B12R0.47 C=CCOCC(=O)OCCOCC 34a_200000210373_200000101388 [0,2,0,0,0,0|0,0,2]=4 7386 B12R0.47 C=CCOCCC(=O)CCOCC 1458a_200011217002_100011215890 [0,2,0,0,0,0|1,0,1]=4 7387 B12R0.47 CC/C=C\CCC(=O)CCOCC 1458a_100000749530_100015370543 [0,2,0,0,0,0|2,0,0]=4 7388 B12R0.47 CCC#CCC(C)OCCCCC 34a_200000035118_100000718602 [0,2,0,0,0,0|2,0,0]=4 7389 B12R0.47 CCC#CCC(C)OCCCCC 7a_200000035118_100000210326 [0,2,0,0,0,0|2,0,0]=4 7390 B12R0.47 CCC#CCC(C)OCCOCC 34a_200000035118_100000210147 [0,2,0,0,0,0|1,0,0]=3 7391 B12R0.47 CCC#CCC(C)OCCOCC 7a_200000035118_100011215890 [0,2,0,0,0,0|1,0,0]=3 7392 B12R0.47 CCC#CCC(C)OCCSCC 34a_200000035118_100000757381 [0,2,0,0,0,0|1,1,0]=4 7393 B12R0.47 CCC#CCC(C)OCCSCC 7a_200000035118_100000757381 [0,2,0,0,0,0|1,1,0]=4 7394 B12R0.47 CCCCCC(=O)CCCOCC 1458a_100000212188_100012232248 [0,2,0,0,0,0|2,0,0]=4 7395 B12R0.47 CCCCCC(=O)CCOCCC 1458a_100000212188_100011215938 [0,2,0,0,0,0|2,0,0]=4 7396 B12R0.47 CCCCCC(=O)CCOCCO 1458a_100000212188_100011215305 [0,2,0,0,0,0|2,0,0]=4 7397 B12R0.47 CCCCCC(=O)CCOCCO 1458a_100011229844_100000210326 [0,2,0,0,0,0|2,0,0]=4 7398 B12R0.47 CCCCCC(=O)CSCOCC 62a_100000739092_200012276598 [0,2,0,0,0,0|2,0,0]=4 7399 B12R0.47 CCCCCC(=O)CSCOCC 62a_200012276598_100000739092 [0,2,0,0,0,0|2,0,0]=4 7400 B12R0.47 CCCCCC(=O)NCCOCC 11a_100011200944_100000212188 [0,2,0,0,0,0|2,0,0]=4 7401 B12R0.47 CCCCCC(=O)NCCOCC 1626a_102516460346_100000212188 [0,2,0,0,0,0|2,0,0]=4 7402 B12R0.47 CCCCCC(=O)NCCOCC 240690a_100011200944_100000212188 [0,2,0,0,0,0|2,0,0]=4 7403 B12R0.47 CCCCCC(=O)NCCOCC 527a_100011200944_100000212188 [0,2,0,0,0,0|2,0,0]=4 7404 B12R0.47 CCCCCC(C)NCCOCC 2230a_100000211957_100011215890 [0,2,0,0,0,0|2,0,0]=4 7405 B12R0.47 CCCCCC(C)NCCOCC 2230a_102516460346_200011218191 [0,2,0,0,0,0|2,0,0]=4 7406 B12R0.47 CCCCCC(C)NCCOCC 270004a_102516460346_100000211708 [0,2,0,0,0,0|2,0,0]=4 7407 B12R0.47 CCCCCC(C)NCCOCC 34a_102516460346_200011218191 [0,2,0,0,0,0|2,0,0]=4 7408 B12R0.47 CCCCCC(C)OCCOCC 34a_100000210136_200011218191 [0,2,0,0,0,0|1,0,0]=3 7409 B12R0.47 CCCCCC(C)OCCOCC 34a_100011215632_100000210147 [0,2,0,0,0,0|1,0,0]=3 7410 B12R0.47 CCCCCC(C)OCCOCC 7a_100000210136_200011218191 [0,2,0,0,0,0|1,0,0]=3 7411 B12R0.47 CCCCCC(C)OCCOCC 7a_100011215632_100011215890 [0,2,0,0,0,0|1,0,0]=3 7412 B12R0.47 CCCCCC(C)OCCSCC 34a_100000212035_200011218191 [0,2,0,0,0,0|1,1,0]=4 7413 B12R0.47 CCCCCC(C)OCCSCC 34a_100011215632_100000757381 [0,2,0,0,0,0|1,1,0]=4 7414 B12R0.47 CCCCCC(C)OCCSCC 7a_100000212035_200011218191 [0,2,0,0,0,0|1,1,0]=4 7415 B12R0.47 CCCCCC(C)OCCSCC 7a_100011215632_100000757381 [0,2,0,0,0,0|1,1,0]=4 7416 B12R0.47 CCCCCC(C)SCCOCC 62a_100000210147_200011218191 [0,2,0,0,0,0|1,1,0]=4 7417 B12R0.47 CCCCCC(C)SCCOCC 62a_200011218191_100011215890 [0,2,0,0,0,0|1,1,0]=4 7418 B12R0.47 CCCCCCC(=O)CCOCC 1458a_100000749530_100000210757 [0,2,0,0,0,0|2,0,0]=4 7419 B12R0.47 CCCCCCC(=O)CCOCC 1458a_100102632555_100011215890 [0,2,0,0,0,0|2,0,0]=4 7420 B12R0.47 CCCCCCC(C)CCOCC 34a_200011024964_100000210202 [0,2,0,0,0,0|2,0,0]=4 7421 B12R0.47 CCCCCCC(C)CCOCC 7a_200011024964_100000210202 [0,2,0,0,0,0|2,0,0]=4 7422 B12R0.47 CCCCCCC(C)SCOCC 62a_100000739092_100011215978 [0,2,0,0,0,0|2,0,0]=4 7423 B12R0.47 CCCCCCC(C)SCOCC 62a_100011215978_100000739092 [0,2,0,0,0,0|2,0,0]=4 7424 B12R0.47 CCCCCCN(C)CCOCC 2230a_106256046315_100011215890 [0,2,0,0,0,0|2,0,0]=4 7425 B12R0.47 CCCCCCN(C)CCOCC 269982a_106256046315_100011215890 [0,2,0,0,0,0|2,0,0]=4 7426 B12R0.47 CCCCCN(C)CCCOCC 2230a_100000223495_100012232248 [0,2,0,0,0,0|2,0,0]=4 7427 B12R0.47 CCCCCN(C)CCCOCC 269982a_100000223495_100012232248 [0,2,0,0,0,0|2,0,0]=4 7428 B12R0.47 CCCCCN(C)CCOCCC 2230a_100000223495_100011215938 [0,2,0,0,0,0|2,0,0]=4 7429 B12R0.47 CCCCCN(C)CCOCCC 269982a_100000223495_100011215938 [0,2,0,0,0,0|2,0,0]=4 7430 B12R0.47 CCCCCN(C)CCOCCO 2230a_100000223495_100011215305 [0,2,0,0,0,0|2,0,0]=4 7431 B12R0.47 CCCCCN(C)CCOCCO 2230a_100000228057_100000210326 [0,2,0,0,0,0|2,0,0]=4 7432 B12R0.47 CCCCCN(C)CCOCCO 269982a_100000223495_100011215305 [0,2,0,0,0,0|2,0,0]=4 7433 B12R0.47 CCCCCN(C)CCOCCO 269982a_100000228057_100000210215 [0,2,0,0,0,0|2,0,0]=4 7434 B12R0.47 CCCCCNC(=O)CCOCC 11a_100000209983_100000749530 [0,2,0,0,0,0|2,0,0]=4 7435 B12R0.47 CCCCCNC(=O)CCOCC 1626a_100000209983_100000749530 [0,2,0,0,0,0|2,0,0]=4 7436 B12R0.47 CCCCCNC(=O)CCOCC 240690a_100000209983_100000749530 [0,2,0,0,0,0|2,0,0]=4 7437 B12R0.47 CCCCCNC(=O)CCOCC 527a_100000209983_100000749530 [0,2,0,0,0,0|2,0,0]=4 7438 B12R0.47 CCCCCNC(C)CCOCC 270004a_100000209983_200011216536 [0,2,0,0,0,0|2,0,0]=4 7439 B12R0.47 CCCCCOC(C)CCCCC 34a_100000210253_200011218191 [0,2,0,0,0,0|2,0,0]=4 7440 B12R0.47 CCCCCOC(C)CCCCC 34a_100011215632_100000718602 [0,2,0,0,0,0|2,0,0]=4 7441 B12R0.47 CCCCCOC(C)CCCCC 7a_100000210253_200011218191 [0,2,0,0,0,0|2,0,0]=4 7442 B12R0.47 CCCCCOC(C)CCCCC 7a_100011215632_100000210326 [0,2,0,0,0,0|2,0,0]=4 7443 B12R0.47 CCCCCOC(C)CCCOC 34a_200011539412_100000718602 [0,2,0,0,0,0|2,0,0]=4 7444 B12R0.47 CCCCCOC(C)CCCOC 7a_200011539412_100000210326 [0,2,0,0,0,0|2,0,0]=4 7445 B12R0.47 CCCCOCC(=O)CCOCC 1458a_100000749530_100011995733 [0,2,0,0,0,0|2,0,0]=4 7446 B12R0.47 CCCCOCC(=O)CCOCC 1458a_100000757543_100011215890 [0,2,0,0,0,0|2,0,0]=4 7447 B12R0.47 CCCCSCC(=O)CCOCC 1458a_100000191162_100011215890 [0,2,0,0,0,0|2,0,0]=4 7448 B12R0.47 CCCOCC(=O)CCCOCC 1458a_100000745993_100012232248 [0,2,0,0,0,0|1,0,1]=4 7449 B12R0.47 CCCOCC(=O)NCCOCC 11a_100011200944_100000745993 [0,2,0,0,0,0|1,0,1]=4 7450 B12R0.47 CCCOCC(=O)NCCOCC 1626a_102516460346_100000745993 [0,2,0,0,0,0|1,0,1]=4 7451 B12R0.47 CCCOCC(=O)NCCOCC 240690a_100011200944_100000745993 [0,2,0,0,0,0|1,0,1]=4 7452 B12R0.47 CCCOCC(=O)NCCOCC 527a_100011200944_100000745993 [0,2,0,0,0,0|1,0,1]=4 7453 B12R0.47 CCCOCC(=O)OCCOCC 34a_100000210258_200000101388 [0,2,0,0,0,0|0,0,1]=3 7454 B12R0.47 CCCOCCC(=O)CCOCC 1458a_100000749530_100011215938 [0,2,0,0,0,0|1,0,0]=3 7455 B12R0.47 CCCOCCC(=O)CCSCC 1458a_100000230768_100011215938 [0,2,0,0,0,0|1,1,0]=4 7456 B12R0.47 CCCSCC(=O)OCCOCC 62a_100000210303_200000101388 [0,2,0,0,0,0|0,1,1]=4 7457 B12R0.47 CCCSCC(=O)OCCOCC 62a_200000101388_100000210303 [0,2,0,0,0,0|0,1,1]=4 7458 B12R0.47 CCCSCC(C)NCCOCC 270004a_102516460346_100011343953 [0,2,0,0,0,0|1,1,0]=4 7459 B12R0.47 CCOCCC(=O)CCCCCF 1458a_100000749530_100000729378 [0,2,0,0,0,0|2,0,0]=4 7460 B12R0.47 CCOCCC(=O)CCCCCO 1458a_100000749530_100000746330 [0,2,0,0,0,0|2,0,0]=4 7461 B12R0.47 CCOCCC(=O)CCCCCO 1458a_100102619762_100011215890 [0,2,0,0,0,0|2,0,0]=4 7462 B12R0.47 CCOCCC(=O)CCCCOC 1458a_100000749530_100000755781 [0,2,0,0,0,0|2,0,0]=4 7463 B12R0.47 CCOCCC(=O)CCOCC#N 1458a_100000749530_200000047693 [0,2,0,0,0,0|1,0,1]=4 7464 B12R0.47 CCOCCC(=O)CCOCCO 1458a_100000749530_100011215305 [0,2,0,0,0,0|1,0,0]=3 7465 B12R0.47 CCOCCC(=O)CCOCCO 1458a_100011229844_100011215890 [0,2,0,0,0,0|1,0,0]=3 7466 B12R0.47 CCOCCC(=O)NCCSCC 11a_100000106463_100000749530 [0,2,0,0,0,0|1,1,0]=4 7467 B12R0.47 CCOCCC(=O)NCCSCC 1626a_100000106463_100000749530 [0,2,0,0,0,0|1,1,0]=4 7468 B12R0.47 CCOCCC(=O)NCCSCC 240690a_100000106463_100000749530 [0,2,0,0,0,0|1,1,0]=4 7469 B12R0.47 CCOCCC(=O)NCCSCC 527a_100000106463_100000749530 [0,2,0,0,0,0|1,1,0]=4 7470 B12R0.47 CCOCCC(C)NCCSCC 270004a_100000106463_200011216536 [0,2,0,0,0,0|1,1,0]=4 7471 B12R0.47 CCOCCCC(=O)CCOCC 1458a_100000749530_100012232248 [0,2,0,0,0,0|1,0,0]=3 7472 B12R0.47 CCOCCCC(=O)CCSCC 1458a_100000230768_100012232248 [0,2,0,0,0,0|1,1,0]=4 7473 B12R0.47 CCOCCCC(=O)COCCO 1458a_100000708028_100012232248 [0,2,0,0,0,0|1,0,1]=4 7474 B12R0.47 CCOCCN(C)CCCCCO 2230a_100000722520_100011215890 [0,2,0,0,0,0|2,0,0]=4 7475 B12R0.47 CCOCCN(C)CCCCCO 269982a_100000722520_100011215890 [0,2,0,0,0,0|2,0,0]=4 7476 B12R0.47 CCOCCN(C)CCOCCO 2230a_100000228057_100011215890 [0,2,0,0,0,0|1,0,0]=3 7477 B12R0.47 CCOCCN(C)CCOCCO 269982a_100000228057_100011215890 [0,2,0,0,0,0|1,0,0]=3 7478 B12R0.47 CCOCCNC(=O)CCOCC 11a_100011200944_100000749530 [0,2,0,0,0,0|1,0,0]=3 7479 B12R0.47 CCOCCNC(=O)CCOCC 1626a_102516460346_100000749530 [0,2,0,0,0,0|1,0,0]=3 7480 B12R0.47 CCOCCNC(=O)CCOCC 240690a_100011200944_100000749530 [0,2,0,0,0,0|1,0,0]=3 7481 B12R0.47 CCOCCNC(=O)CCOCC 527a_100011200944_100000749530 [0,2,0,0,0,0|1,0,0]=3 7482 B12R0.47 CCOCCNC(=O)CCSCC 11a_100011200944_100000230768 [0,2,0,0,0,0|1,1,0]=4 7483 B12R0.47 CCOCCNC(=O)CCSCC 1626a_102516460346_100000230768 [0,2,0,0,0,0|1,1,0]=4 7484 B12R0.47 CCOCCNC(=O)CCSCC 240690a_100011200944_100000230768 [0,2,0,0,0,0|1,1,0]=4 7485 B12R0.47 CCOCCNC(=O)CCSCC 527a_100011200944_100000230768 [0,2,0,0,0,0|1,1,0]=4 7486 B12R0.47 CCOCCNC(=O)COCCO 1626a_102516460346_100000708028 [0,2,0,0,0,0|1,0,1]=4 7487 B12R0.47 CCOCCNC(=O)COCCO 240690a_100011200944_100000708028 [0,2,0,0,0,0|1,0,1]=4 7488 B12R0.47 CCOCCNC(C)CCCSC 270004a_102516460346_100011399439 [0,2,0,0,0,0|2,0,0]=4 7489 B12R0.47 CCOCCNC(C)CCOCC 270004a_102516460346_200011216536 [0,2,0,0,0,0|1,0,0]=3 7490 B12R0.47 CCOCCOC(=O)CNCCF 34a_100000724931_200000101388 [0,2,0,0,0,0|1,0,1]=4 7491 B12R0.47 CCOCCOC(=O)CNCCO 2230a_100016997473_200000101388 [0,2,0,0,0,0|1,0,1]=4 7492 B12R0.47 CCOCCOC(=O)CNCCO 34a_100016990907_200000101388 [0,2,0,0,0,0|1,0,1]=4 7493 B12R0.47 CCOCCOC(=O)COCCBr 34a_100000211926_200000101388 [0,2,0,0,0,0|0,0,1]=3 7494 B12R0.47 CCOCCOC(=O)COCCN 34a_100000210304_200000101388 [0,2,0,0,0,0|0,0,1]=3 7495 B12R0.47 CCOCCOC(=O)CSCCF 62a_100011217306_200000101388 [0,2,0,0,0,0|0,1,1]=4 7496 B12R0.47 CCOCCOC(=O)CSCCF 62a_200000101388_100011217306 [0,2,0,0,0,0|0,1,1]=4 7497 B12R0.47 CCOCCOC(=O)CSCCO 62a_100000211926_200000101388 [0,2,0,0,0,0|0,1,1]=4 7498 B12R0.47 CCOCCOC(=O)CSCCO 62a_200000101388_100000211926 [0,2,0,0,0,0|0,1,1]=4 7499 B12R0.47 CCOCCOC(=O)CSCOC 62a_100000766300_200000101388 [0,2,0,0,0,0|0,1,1]=4 7500 B12R0.47 CCOCCOC(=O)CSCOC 62a_200000101388_100000766300 [0,2,0,0,0,0|0,1,1]=4 7501 B12R0.47 CCOCCOC(=O)CSCSC 62a_100011218213_200000101388 [0,2,0,0,0,0|0,1,1]=4 7502 B12R0.47 CCOCCOC(=O)CSCSC 62a_200000101388_100011218213 [0,2,0,0,0,0|0,1,1]=4 7503 B12R0.47 CCOCCOC(C)CCCOC 34a_200011539412_100000210147 [0,2,0,0,0,0|1,0,0]=3 7504 B12R0.47 CCOCCOC(C)CCCOC 7a_200011539412_100011215890 [0,2,0,0,0,0|1,0,0]=3 7505 B12R0.47 CCSCCC(=O)CCOCCO 1458a_100000230768_100011215305 [0,2,0,0,0,0|1,1,0]=4 7506 B12R0.47 CCSCCC(=O)CCOCCO 1458a_100011229844_100000757381 [0,2,0,0,0,0|1,1,0]=4 7507 B12R0.47 CCSCCN(C)CCOCCO 2230a_100000228057_100000757381 [0,2,0,0,0,0|1,1,0]=4 7508 B12R0.47 CCSCCN(C)CCOCCO 269982a_100000228057_100000757381 [0,2,0,0,0,0|1,1,0]=4 7509 B12R0.47 CCSCCOC(C)CCCOC 34a_200011539412_100000757381 [0,2,0,0,0,0|1,1,0]=4 7510 B12R0.47 CCSCCOC(C)CCCOC 7a_200011539412_100000757381 [0,2,0,0,0,0|1,1,0]=4 7511 B12R0.206 C#CCCCCOC(C)COCC 34a_100000718985_100010269958 [0,2,0,0,0,0|1,0,1]=4 7512 B12R0.206 C#CCCCCOC(C)COCC 7a_100000718985_100010269958 [0,2,0,0,0,0|1,0,1]=4 7513 B12R0.206 C#CCOC(C)COCCCCC 34a_200000093152_100000718602 [0,2,0,0,0,0|1,0,1]=4 7514 B12R0.206 C#CCOC(C)COCCCCC 7a_200000093152_100000210326 [0,2,0,0,0,0|1,0,1]=4 7515 B12R0.206 C#CCOC(C)COCCOCC 34a_200000093152_100000210147 [0,2,0,0,0,0|0,0,1]=3 7516 B12R0.206 C#CCOC(C)COCCOCC 7a_200000093152_100011215890 [0,2,0,0,0,0|0,0,1]=3 7517 B12R0.206 C#CCOC(C)COCCSCC 34a_200000093152_100000757381 [0,2,0,0,0,0|0,1,1]=4 7518 B12R0.206 C#CCOC(C)COCCSCC 7a_200000093152_100000757381 [0,2,0,0,0,0|0,1,1]=4 7519 B12R0.206 C#CCOCCOC(C)CCCC 34a_100000054580_200011215066 [0,2,0,0,0,0|1,0,1]=4 7520 B12R0.206 C#CCOCCOC(C)CCCC 34a_100000687866_100010402529 [0,2,0,0,0,0|1,0,1]=4 7521 B12R0.206 C#CCOCCOC(C)CCCC 7a_100000054580_200011215066 [0,2,0,0,0,0|1,0,1]=4 7522 B12R0.206 C#CCOCCOC(C)CCCC 7a_100000687866_100010402529 [0,2,0,0,0,0|1,0,1]=4 7523 B12R0.206 C#CCOCCOC(C)COCC 34a_100000718985_100010402529 [0,2,0,0,0,0|0,0,1]=3 7524 B12R0.206 C#CCOCCOC(C)COCC 7a_100000718985_100010402529 [0,2,0,0,0,0|0,0,1]=3 7525 B12R0.206 C=C(CNCCOCC)OCOC 34a_102516460346_100000042856 [0,2,0,0,0,0|1,0,1]=4 7526 B12R0.206 C=C(COCCCCC)OCOC 34a_100000210253_100000042856 [0,2,0,0,0,0|1,0,1]=4 7527 B12R0.206 C=C(COCCOCC)OCOC 34a_100000210136_100000042856 [0,2,0,0,0,0|0,0,1]=3 7528 B12R0.206 C=C(COCCSCC)OCOC 34a_100000212035_100000042856 [0,2,0,0,0,0|0,1,1]=4 7529 B12R0.206 C=C(CSCCOCC)OCOC 62a_100000042856_100011215890 [0,2,0,0,0,0|0,1,1]=4 7530 B12R0.206 C=C(CSCCOCC)OCOC 62a_100000210147_100000042856 [0,2,0,0,0,0|0,1,1]=4 7531 B12R0.206 C=CCCCCOC(C)COCC 34a_100000718985_100011215482 [0,2,0,0,0,0|1,0,1]=4 7532 B12R0.206 C=CCCCCOC(C)COCC 7a_100000718985_100011215482 [0,2,0,0,0,0|1,0,1]=4 7533 B12R0.206 C=CCOC(=O)COCCOCC 34a_100000210136_100000033060 [0,2,0,0,0,0|0,0,2]=4 7534 B12R0.206 C=CCOC(=O)COCCOCC 7a_100000210136_100000033060 [0,2,0,0,0,0|0,0,2]=4 7535 B12R0.206 C=CCOCCOC(C)CCCC 34a_100000037705_200011215066 [0,2,0,0,0,0|1,0,1]=4 7536 B12R0.206 C=CCOCCOC(C)CCCC 7a_100000037705_200011215066 [0,2,0,0,0,0|1,0,1]=4 7537 B12R0.206 C=COCCOC[C@@H](C)OCOC 34a_100016172286_100000039644 [0,2,0,0,0,0|0,0,2]=4 7538 B12R0.206 C=COCCOC[C@@H](C)OCOC 7a_100016172286_100000039644 [0,2,0,0,0,0|0,0,2]=4 7539 B12R0.206 CC(CCCCl)OCCOCCO 34a_200000718107_100000692535 [0,2,0,0,0,0|2,0,0]=4 7540 B12R0.206 CC(CCCCl)OCCOCCO 7a_200000718107_100011215305 [0,2,0,0,0,0|2,0,0]=4 7541 B12R0.206 CC/C=C\CCOC(C)CCCC 34a_100000687866_100015370543 [0,2,0,0,0,0|2,0,0]=4 7542 B12R0.206 CC/C=C\CCOC(C)CCCC 34a_100016288707_200011215066 [0,2,0,0,0,0|2,0,0]=4 7543 B12R0.206 CC/C=C\CCOC(C)CCCC 7a_100000687866_100015370543 [0,2,0,0,0,0|2,0,0]=4 7544 B12R0.206 CC/C=C\CCOC(C)CCCC 7a_100016288707_200011215066 [0,2,0,0,0,0|2,0,0]=4 7545 B12R0.206 CC/C=C\CCOC(C)COCC 34a_100000718985_100015370543 [0,2,0,0,0,0|1,0,0]=3 7546 B12R0.206 CC/C=C\CCOC(C)COCC 7a_100000718985_100015370543 [0,2,0,0,0,0|1,0,0]=3 7547 B12R0.206 CC/C=C\COC[C@@H](C)OCOC 34a_100016172286_100103147603 [0,2,0,0,0,0|1,0,1]=4 7548 B12R0.206 CC/C=C\COC[C@@H](C)OCOC 7a_100016172286_100103147603 [0,2,0,0,0,0|1,0,1]=4 7549 B12R0.206 CCC#CC(C)OCCCOCC 34a_100000033903_100012232248 [0,2,0,0,0,0|1,0,1]=4 7550 B12R0.206 CCC#CC(C)OCCCOCC 7a_100000033903_100012232248 [0,2,0,0,0,0|1,0,1]=4 7551 B12R0.206 CCC#CC(C)OCCOCCC 34a_100000033903_100011215938 [0,2,0,0,0,0|1,0,1]=4 7552 B12R0.206 CCC#CC(C)OCCOCCC 7a_100000033903_100011215938 [0,2,0,0,0,0|1,0,1]=4 7553 B12R0.206 CCC#CC(C)OCCOCCO 34a_100000033903_100000692535 [0,2,0,0,0,0|1,0,1]=4 7554 B12R0.206 CCC#CC(C)OCCOCCO 7a_100000033903_100011215305 [0,2,0,0,0,0|1,0,1]=4 7555 B12R0.206 CCC#CCCOC(C)CCCC 34a_100000036655_200011215066 [0,2,0,0,0,0|2,0,0]=4 7556 B12R0.206 CCC#CCCOC(C)CCCC 7a_100000036655_200011215066 [0,2,0,0,0,0|2,0,0]=4 7557 B12R0.206 CCC#CCOC[C@@H](C)OCOC 34a_100016172286_100009813939 [0,2,0,0,0,0|1,0,1]=4 7558 B12R0.206 CCC#CCOC[C@@H](C)OCOC 7a_100016172286_100009813939 [0,2,0,0,0,0|1,0,1]=4 7559 B12R0.206 CCCCC(C)CCCCOCC 34a_200011021034_100000210202 [0,2,0,0,0,0|2,0,0]=4 7560 B12R0.206 CCCCC(C)CCCCOCC 7a_200011021034_100000210202 [0,2,0,0,0,0|2,0,0]=4 7561 B12R0.206 CCCCC(C)COCCOCC 34a_100011995851_100000210147 [0,2,0,0,0,0|1,0,0]=3 7562 B12R0.206 CCCCC(C)COCCOCC 7a_100011995851_100011215890 [0,2,0,0,0,0|1,0,0]=3 7563 B12R0.206 CCCCC(C)COCCSCC 34a_100011995851_100000757381 [0,2,0,0,0,0|1,1,0]=4 7564 B12R0.206 CCCCC(C)COCCSCC 7a_100011995851_100000757381 [0,2,0,0,0,0|1,1,0]=4 7565 B12R0.206 CCCCC(C)NCCCOCC 2230a_100000126638_100012232248 [0,2,0,0,0,0|2,0,0]=4 7566 B12R0.206 CCCCC(C)NCCCOCC 2230a_100000210961_200011215066 [0,2,0,0,0,0|2,0,0]=4 7567 B12R0.206 CCCCC(C)NCCCOCC 270004a_100000210961_100000210087 [0,2,0,0,0,0|2,0,0]=4 7568 B12R0.206 CCCCC(C)NCCCOCC 34a_100000210961_200011215066 [0,2,0,0,0,0|2,0,0]=4 7569 B12R0.206 CCCCC(C)NCCOCCC 2230a_100000126638_100011215938 [0,2,0,0,0,0|2,0,0]=4 7570 B12R0.206 CCCCC(C)NCCOCCC 2230a_100161115042_200011215066 [0,2,0,0,0,0|2,0,0]=4 7571 B12R0.206 CCCCC(C)NCCOCCC 270004a_100161115042_100000210087 [0,2,0,0,0,0|2,0,0]=4 7572 B12R0.206 CCCCC(C)NCCOCCC 34a_100161115042_200011215066 [0,2,0,0,0,0|2,0,0]=4 7573 B12R0.206 CCCCC(C)NCCOCCO 2230a_100000126638_100011215305 [0,2,0,0,0,0|2,0,0]=4 7574 B12R0.206 CCCCC(C)NCCOCCO 2230a_100000211614_200011215066 [0,2,0,0,0,0|2,0,0]=4 7575 B12R0.206 CCCCC(C)NCCOCCO 270004a_100000211614_100000210087 [0,2,0,0,0,0|2,0,0]=4 7576 B12R0.206 CCCCC(C)NCCOCCO 34a_100000211614_200011215066 [0,2,0,0,0,0|2,0,0]=4 7577 B12R0.206 CCCCC(C)OCCCCCBr 34a_100000746331_200011215066 [0,2,0,0,0,0|2,0,0]=4 7578 B12R0.206 CCCCC(C)OCCCCCBr 7a_100000746331_200011215066 [0,2,0,0,0,0|2,0,0]=4 7579 B12R0.206 CCCCC(C)OCCCCCCl 34a_100000746330_200011215066 [0,2,0,0,0,0|2,0,0]=4 7580 B12R0.206 CCCCC(C)OCCCCCCl 7a_100000746330_200011215066 [0,2,0,0,0,0|2,0,0]=4 7581 B12R0.206 CCCCC(C)OCCCCCF 34a_100000687866_100000729378 [0,2,0,0,0,0|2,0,0]=4 7582 B12R0.206 CCCCC(C)OCCCCCF 7a_100000687866_100000729378 [0,2,0,0,0,0|2,0,0]=4 7583 B12R0.206 CCCCC(C)OCCCCCI 34a_200012148887_200011215066 [0,2,0,0,0,0|2,0,0]=4 7584 B12R0.206 CCCCC(C)OCCCCCI 7a_200012148887_200011215066 [0,2,0,0,0,0|2,0,0]=4 7585 B12R0.206 CCCCC(C)OCCCCCN 34a_100000762737_200011215066 [0,2,0,0,0,0|2,0,0]=4 7586 B12R0.206 CCCCC(C)OCCCCCO 34a_100000687866_100000746330 [0,2,0,0,0,0|2,0,0]=4 7587 B12R0.206 CCCCC(C)OCCCCCO 7a_100000687866_100000746330 [0,2,0,0,0,0|2,0,0]=4 7588 B12R0.206 CCCCC(C)OCCCCOC 34a_100000687866_100000755781 [0,2,0,0,0,0|2,0,0]=4 7589 B12R0.206 CCCCC(C)OCCCCOC 34a_100000740925_200011215066 [0,2,0,0,0,0|2,0,0]=4 7590 B12R0.206 CCCCC(C)OCCCCOC 7a_100000687866_100000730899 [0,2,0,0,0,0|2,0,0]=4 7591 B12R0.206 CCCCC(C)OCCCCSC 34a_100011217163_200011215066 [0,2,0,0,0,0|2,0,0]=4 7592 B12R0.206 CCCCC(C)OCCCCSC 7a_100011217163_200011215066 [0,2,0,0,0,0|2,0,0]=4 7593 B12R0.206 CCCCC(C)OCCCOCC 34a_100000687866_100012232248 [0,2,0,0,0,0|1,0,0]=3 7594 B12R0.206 CCCCC(C)OCCCOCC 34a_100000757476_200011215066 [0,2,0,0,0,0|1,0,0]=3 7595 B12R0.206 CCCCC(C)OCCCOCC 7a_100000687866_100012232248 [0,2,0,0,0,0|1,0,0]=3 7596 B12R0.206 CCCCC(C)OCCCOCC 7a_100000757476_200011215066 [0,2,0,0,0,0|1,0,0]=3 7597 B12R0.206 CCCCC(C)OCCCSCC 34a_100011216438_200011215066 [0,2,0,0,0,0|1,1,0]=4 7598 B12R0.206 CCCCC(C)OCCCSCC 7a_100011216438_200011215066 [0,2,0,0,0,0|1,1,0]=4 7599 B12R0.206 CCCCC(C)OCCOCC#N 7a_100000687866_200000047693 [0,2,0,0,0,0|1,0,1]=4 7600 B12R0.206 CCCCC(C)OCCOCCBr 34a_100000692535_200011215066 [0,2,0,0,0,0|1,0,0]=3 7601 B12R0.206 CCCCC(C)OCCOCCBr 7a_100000692535_200011215066 [0,2,0,0,0,0|1,0,0]=3 7602 B12R0.206 CCCCC(C)OCCOCCC 34a_100000687866_100011215938 [0,2,0,0,0,0|1,0,0]=3 7603 B12R0.206 CCCCC(C)OCCOCCC 34a_100000752267_200011215066 [0,2,0,0,0,0|1,0,0]=3 7604 B12R0.206 CCCCC(C)OCCOCCC 7a_100000687866_100011215938 [0,2,0,0,0,0|1,0,0]=3 7605 B12R0.206 CCCCC(C)OCCOCCC 7a_100000752267_200011215066 [0,2,0,0,0,0|1,0,0]=3 7606 B12R0.206 CCCCC(C)OCCOCCCl 34a_100011215305_200011215066 [0,2,0,0,0,0|1,0,0]=3 7607 B12R0.206 CCCCC(C)OCCOCCCl 7a_100011215305_200011215066 [0,2,0,0,0,0|1,0,0]=3 7608 B12R0.206 CCCCC(C)OCCOCCF 34a_200015357709_200011215066 [0,2,0,0,0,0|1,0,0]=3 7609 B12R0.206 CCCCC(C)OCCOCCF 7a_200015357709_200011215066 [0,2,0,0,0,0|1,0,0]=3 7610 B12R0.206 CCCCC(C)OCCOCCI 34a_100012149058_200011215066 [0,2,0,0,0,0|1,0,0]=3 7611 B12R0.206 CCCCC(C)OCCOCCI 7a_100012149058_200011215066 [0,2,0,0,0,0|1,0,0]=3 7612 B12R0.206 CCCCC(C)OCCOCCN 34a_100000211614_200011215066 [0,2,0,0,0,0|1,0,0]=3 7613 B12R0.206 CCCCC(C)OCCOCCO 34a_100000687866_100000692535 [0,2,0,0,0,0|1,0,0]=3 7614 B12R0.206 CCCCC(C)OCCOCCO 7a_100000687866_100011215305 [0,2,0,0,0,0|1,0,0]=3 7615 B12R0.206 CCCCC(C)OCCSCCC 34a_200000230433_200011215066 [0,2,0,0,0,0|1,1,0]=4 7616 B12R0.206 CCCCC(C)OCCSCCC 7a_200000230433_200011215066 [0,2,0,0,0,0|1,1,0]=4 7617 B12R0.206 CCCCC(C)SCCCOCC 62a_100012232248_200011215066 [0,2,0,0,0,0|1,1,0]=4 7618 B12R0.206 CCCCC(C)SCCCOCC 62a_200011215066_100012232248 [0,2,0,0,0,0|1,1,0]=4 7619 B12R0.206 CCCCC(C)SCCOCCC 62a_100011215938_200011215066 [0,2,0,0,0,0|1,1,0]=4 7620 B12R0.206 CCCCC(C)SCCOCCC 62a_200011215066_100011215938 [0,2,0,0,0,0|1,1,0]=4 7621 B12R0.206 CCCCC(C)SCCOCCO 62a_100011215305_200011215066 [0,2,0,0,0,0|1,1,0]=4 7622 B12R0.206 CCCCC(C)SCCOCCO 62a_200011215066_100011215305 [0,2,0,0,0,0|1,1,0]=4 7623 B12R0.206 CCCCCCCC(=O)COCC 1458a_100000211967_100000210614 [0,2,0,0,0,0|2,0,0]=4 7624 B12R0.206 CCCCCCCC(C)OCCBr 34a_100000211926_200011218727 [0,2,0,0,0,0|2,0,0]=4 7625 B12R0.206 CCCCCCCC(C)OCCC 34a_100000210258_200011218727 [0,2,0,0,0,0|2,0,0]=4 7626 B12R0.206 CCCCCCCC(C)OCCC 34a_200011215852_100000210303 [0,2,0,0,0,0|2,0,0]=4 7627 B12R0.206 CCCCCCCC(C)OCCC 7a_200011215852_100000210303 [0,2,0,0,0,0|2,0,0]=4 7628 B12R0.206 CCCCCCCC(C)OCCF 34a_200011215852_100011217306 [0,2,0,0,0,0|2,0,0]=4 7629 B12R0.206 CCCCCCCC(C)OCCF 7a_200011215852_100011217306 [0,2,0,0,0,0|2,0,0]=4 7630 B12R0.206 CCCCCCCC(C)OCCN 34a_100000210304_200011218727 [0,2,0,0,0,0|2,0,0]=4 7631 B12R0.206 CCCCCCCC(C)OCCO 34a_200011215852_100000211926 [0,2,0,0,0,0|2,0,0]=4 7632 B12R0.206 CCCCCCCC(C)OCCO 7a_200011215852_100000211926 [0,2,0,0,0,0|2,0,0]=4 7633 B12R0.206 CCCCCCCC(C)OCSC 34a_200011215852_100011218213 [0,2,0,0,0,0|2,0,0]=4 7634 B12R0.206 CCCCCCCN(C)COCC 269982a_100000228206_100000739092 [0,2,0,0,0,0|2,0,0]=4 7635 B12R0.206 CCCCCCOC(C)CCCC 34a_100000210259_200011215066 [0,2,0,0,0,0|2,0,0]=4 7636 B12R0.206 CCCCCCOC(C)CCCC 34a_100000687866_100000210314 [0,2,0,0,0,0|2,0,0]=4 7637 B12R0.206 CCCCCCOC(C)CCCC 7a_100000210259_200011215066 [0,2,0,0,0,0|2,0,0]=4 7638 B12R0.206 CCCCCCOC(C)CCCC 7a_100000687866_100000210314 [0,2,0,0,0,0|2,0,0]=4 7639 B12R0.206 CCCCCCOC(C)COCC 34a_100000718985_100000210314 [0,2,0,0,0,0|1,0,0]=3 7640 B12R0.206 CCCCCCOC(C)COCC 7a_100000718985_100000210314 [0,2,0,0,0,0|1,0,0]=3 7641 B12R0.206 CCCCCNCC(C)OCCC 2230a_100015185124_100000210326 [0,2,0,0,0,0|2,0,0]=4 7642 B12R0.206 CCCCCNCC(C)OCCC 34a_100015185124_100000718602 [0,2,0,0,0,0|2,0,0]=4 7643 B12R0.206 CCCCCNCC(O)COCC 2230a_102515437182_100000210326 [0,2,0,0,0,0|2,0,0]=4 7644 B12R0.206 CCCCCNCC(O)COCC 34a_102515437182_100000718602 [0,2,0,0,0,0|2,0,0]=4 7645 B12R0.206 CCCCCOCC(=O)OCCC 34a_100000210253_200011215008 [0,2,0,0,0,0|1,0,1]=4 7646 B12R0.206 CCCCCOCC(=O)OCCC 7a_100000210253_200011215008 [0,2,0,0,0,0|1,0,1]=4 7647 B12R0.206 CCCCCOCC(C)CCCC 34a_100011995851_100000718602 [0,2,0,0,0,0|2,0,0]=4 7648 B12R0.206 CCCCCOCC(C)CCCC 7a_100011995851_100000210326 [0,2,0,0,0,0|2,0,0]=4 7649 B12R0.206 CCCCCOC[C@@H](C)OCOC 34a_100016172286_100000718602 [0,2,0,0,0,0|1,0,0]=3 7650 B12R0.206 CCCCCOC[C@@H](C)OCOC 7a_100016172286_100000210326 [0,2,0,0,0,0|1,0,0]=3 7651 B12R0.206 CCCCCOC[C@@H](N)CCCC 34a_100011934283_100000718602 [0,2,0,0,0,0|2,0,0]=4 7652 B12R0.206 CCCCCOC[C@@H](N)CCSC 34a_100011827619_100000718602 [0,2,0,0,0,0|2,0,0]=4 7653 B12R0.206 CCCCOCOC(C)CCCC 34a_100000687866_100011995733 [0,2,0,0,0,0|2,0,0]=4 7654 B12R0.206 CCCCOCOC(C)COCC 34a_100000718985_100011995733 [0,2,0,0,0,0|1,0,0]=3 7655 B12R0.206 CCCC[C@H](N)COCCOCC 34a_100011934283_100000210147 [0,2,0,0,0,0|1,0,0]=3 7656 B12R0.206 CCCC[C@H](N)COCCSCC 34a_100011934283_100000757381 [0,2,0,0,0,0|1,1,0]=4 7657 B12R0.206 CCCNC(=O)COCCOCC 34a_100000210136_100000183358 [0,2,0,0,0,0|1,0,1]=4 7658 B12R0.206 CCCNC(=O)COCCOCC 7a_100000210136_100000183358 [0,2,0,0,0,0|1,0,1]=4 7659 B12R0.206 CCCOC(=O)CNCCOCC 2230a_102516460346_200011215008 [0,2,0,0,0,0|1,0,1]=4 7660 B12R0.206 CCCOC(=O)CNCCOCC 34a_102516460346_200011215008 [0,2,0,0,0,0|1,0,1]=4 7661 B12R0.206 CCCOC(=O)COCCOCC 34a_100000210136_200011215008 [0,2,0,0,0,0|0,0,1]=3 7662 B12R0.206 CCCOC(=O)COCCOCC 7a_100000210136_200011215008 [0,2,0,0,0,0|0,0,1]=3 7663 B12R0.206 CCCOC(=O)COCCSCC 34a_100000212035_200011215008 [0,2,0,0,0,0|0,1,1]=4 7664 B12R0.206 CCCOC(=O)COCCSCC 7a_100000212035_200011215008 [0,2,0,0,0,0|0,1,1]=4 7665 B12R0.206 CCCOC(=O)CSCCOCC 62a_100000210147_200011215008 [0,2,0,0,0,0|0,1,1]=4 7666 B12R0.206 CCCOC(=O)CSCCOCC 62a_200011215008_100011215890 [0,2,0,0,0,0|0,1,1]=4 7667 B12R0.206 CCCOC(C)CNCCOCC 2230a_100015185124_100011215890 [0,2,0,0,0,0|1,0,0]=3 7668 B12R0.206 CCCOC(C)CNCCOCC 34a_100015185124_100000210147 [0,2,0,0,0,0|1,0,0]=3 7669 B12R0.206 CCCOC(C)CNCCSCC 2230a_100015185124_100000757381 [0,2,0,0,0,0|1,1,0]=4 7670 B12R0.206 CCCOC(C)CNCCSCC 34a_100015185124_100000757381 [0,2,0,0,0,0|1,1,0]=4 7671 B12R0.206 CCCOCCNC(=O)COCC 1626a_100161115042_100000211967 [0,2,0,0,0,0|1,0,1]=4 7672 B12R0.206 CCCOCCNC(=O)COCC 240690a_100161115042_100000211967 [0,2,0,0,0,0|1,0,1]=4 7673 B12R0.206 CCCOCCNC(=O)COCC 527a_100161115042_100000211967 [0,2,0,0,0,0|1,0,1]=4 7674 B12R0.206 CCCOCCNC(C)CSCC 270004a_100161115042_200011216171 [0,2,0,0,0,0|1,1,0]=4 7675 B12R0.206 CCCOCCOC(C)CCCCl 34a_200000718107_100011215938 [0,2,0,0,0,0|2,0,0]=4 7676 B12R0.206 CCCOCCOC(C)CCCCl 7a_200000718107_100011215938 [0,2,0,0,0,0|2,0,0]=4 7677 B12R0.206 CCCOCCOC(C)COCC 34a_100000718985_100011215938 [0,2,0,0,0,0|0,0,0]=2 7678 B12R0.206 CCCOCCOC(C)COCC 7a_100000718985_100011215938 [0,2,0,0,0,0|0,0,0]=2 7679 B12R0.206 CCOCC(=O)NCCOCCO 240690a_100000211614_100000211967 [0,2,0,0,0,0|1,0,1]=4 7680 B12R0.206 CCOCC(C)OCCCCC#N 7a_100000718985_100000211819 [0,2,0,0,0,0|1,0,1]=4 7681 B12R0.206 CCOCC(C)OCCCCC=O 7a_100000718985_100000139335 [0,2,0,0,0,0|1,0,1]=4 7682 B12R0.206 CCOCC(C)OCCCCCF 34a_100000718985_100000729378 [0,2,0,0,0,0|1,0,0]=3 7683 B12R0.206 CCOCC(C)OCCCCCF 7a_100000718985_100000729378 [0,2,0,0,0,0|1,0,0]=3 7684 B12R0.206 CCOCC(C)OCCCCCO 34a_100000718985_100000746330 [0,2,0,0,0,0|1,0,0]=3 7685 B12R0.206 CCOCC(C)OCCCCCO 7a_100000718985_100000746330 [0,2,0,0,0,0|1,0,0]=3 7686 B12R0.206 CCOCC(C)OCCCCOC 34a_100000718985_100000755781 [0,2,0,0,0,0|1,0,0]=3 7687 B12R0.206 CCOCC(C)OCCCCOC 7a_100000718985_100000730899 [0,2,0,0,0,0|1,0,0]=3 7688 B12R0.206 CCOCC(C)OCCOCC#N 7a_100000718985_200000047693 [0,2,0,0,0,0|0,0,1]=3 7689 B12R0.206 CCOCC(C)OCCOCCO 34a_100000718985_100000692535 [0,2,0,0,0,0|0,0,0]=2 7690 B12R0.206 CCOCC(C)OCCOCCO 7a_100000718985_100011215305 [0,2,0,0,0,0|0,0,0]=2 7691 B12R0.206 CCOCC(O)CNCCSCC 2230a_102515437182_100000757381 [0,2,0,0,0,0|1,1,0]=4 7692 B12R0.206 CCOCC(O)CNCCSCC 34a_102515437182_100000757381 [0,2,0,0,0,0|1,1,0]=4 7693 B12R0.206 CCOCCCNC(=O)COCC 11a_100000210961_100000211967 [0,2,0,0,0,0|1,0,1]=4 7694 B12R0.206 CCOCCCNC(=O)COCC 1626a_100000210961_100000211967 [0,2,0,0,0,0|1,0,1]=4 7695 B12R0.206 CCOCCCNC(=O)COCC 240690a_100000210961_100000211967 [0,2,0,0,0,0|1,0,1]=4 7696 B12R0.206 CCOCCCNC(=O)COCC 527a_100000210961_100000211967 [0,2,0,0,0,0|1,0,1]=4 7697 B12R0.206 CCOCCCNC(C)CSCC 270004a_100000210961_200011216171 [0,2,0,0,0,0|1,1,0]=4 7698 B12R0.206 CCOCCCOC(C)CCCCl 34a_200000718107_100012232248 [0,2,0,0,0,0|2,0,0]=4 7699 B12R0.206 CCOCCCOC(C)CCCCl 7a_200000718107_100012232248 [0,2,0,0,0,0|2,0,0]=4 7700 B12R0.206 CCOCCCOC(C)COCC 34a_100000718985_100012232248 [0,2,0,0,0,0|0,0,0]=2 7701 B12R0.206 CCOCCCOC(C)COCC 7a_100000718985_100012232248 [0,2,0,0,0,0|0,0,0]=2 7702 B12R0.206 CCOCCNCC(O)COCC 2230a_102515437182_100011215890 [0,2,0,0,0,0|1,0,0]=3 7703 B12R0.206 CCOCCNCC(O)COCC 34a_102515437182_100000210147 [0,2,0,0,0,0|1,0,0]=3 7704 B12R0.206 CCOCCNC[C@H](C)CCCO 2230a_100160569302_100011215890 [0,2,0,0,0,0|2,0,0]=4 7705 B12R0.206 CCOCCNC[C@H](C)CCCO 34a_100160569302_100000210147 [0,2,0,0,0,0|2,0,0]=4 7706 B12R0.206 CCOCCNNC(=O)COCC 22a_100000732670_100000211967 [0,2,0,0,0,0|1,0,1]=4 7707 B12R0.206 CCOCCOC[C@@H](C)OCOC 34a_100016172286_100000210147 [0,2,0,0,0,0|0,0,0]=2 7708 B12R0.206 CCOCCOC[C@@H](C)OCOC 7a_100016172286_100011215890 [0,2,0,0,0,0|0,0,0]=2 7709 B12R0.206 CCOCCOC[C@@H](N)CCSC 34a_100011827619_100000210147 [0,2,0,0,0,0|1,0,0]=3 7710 B12R0.206 CCSCC(C)NCCOCCO 270004a_100000211614_200011216171 [0,2,0,0,0,0|1,1,0]=4 7711 B12R0.206 CCSCCOC[C@@H](C)OCOC 34a_100016172286_100000757381 [0,2,0,0,0,0|0,1,0]=3 7712 B12R0.206 CCSCCOC[C@@H](C)OCOC 7a_100016172286_100000757381 [0,2,0,0,0,0|0,1,0]=3 7713 B12R0.206 CCSCCOC[C@@H](N)CCSC 34a_100011827619_100000757381 [0,2,0,0,0,0|1,1,0]=4 7714 B12R0.206 COCCCOC[C@@H](C)OCOC 34a_100016172286_100000740836 [0,2,0,0,0,0|2,0,0]=4 7715 B12R0.206 COCCCOC[C@@H](C)OCOC 7a_100016172286_100000740836 [0,2,0,0,0,0|2,0,0]=4 7716 B12R0.206 COCO[C@H](C)COCCCCF 34a_100016172286_100000729493 [0,2,0,0,0,0|2,0,0]=4 7717 B12R0.206 COCO[C@H](C)COCCCCF 7a_100016172286_100000729493 [0,2,0,0,0,0|2,0,0]=4 7718 B12R0.206 COCO[C@H](C)COCCCCO 34a_100016172286_100011216708 [0,2,0,0,0,0|2,0,0]=4 7719 B12R0.206 COCO[C@H](C)COCCCCO 7a_100016172286_100000210776 [0,2,0,0,0,0|2,0,0]=4 7720 B12R0.234 C#CCCCCOCCOC(C)C 34a_100000211219_100010269958 [0,2,0,0,0,0|1,0,1]=4 7721 B12R0.234 C#CCCCCOCCOC(C)C 34a_100000766709_100000211751 [0,2,0,0,0,0|1,0,1]=4 7722 B12R0.234 C#CCCCCOCCOC(C)C 7a_100000211219_100010269958 [0,2,0,0,0,0|1,0,1]=4 7723 B12R0.234 C#CCCCCOCCOC(C)C 7a_100000766709_100000211751 [0,2,0,0,0,0|1,0,1]=4 7724 B12R0.234 C#CCOCCNCCOC(C)C 2230a_100000700922_100000211751 [0,2,0,0,0,0|1,0,1]=4 7725 B12R0.234 C#CCOCCNCCOC(C)C 2230a_100000701111_100010402529 [0,2,0,0,0,0|1,0,1]=4 7726 B12R0.234 C#CCOCCNCCOC(C)C 34a_100000700922_100000211751 [0,2,0,0,0,0|1,0,1]=4 7727 B12R0.234 C#CCOCCNCCOC(C)C 34a_100000701111_100010402529 [0,2,0,0,0,0|1,0,1]=4 7728 B12R0.234 C#CCOCCOCCCC(C)C 34a_100000054580_100011214892 [0,2,0,0,0,0|1,0,1]=4 7729 B12R0.234 C#CCOCCOCCCC(C)C 34a_100000210774_100010402529 [0,2,0,0,0,0|1,0,1]=4 7730 B12R0.234 C#CCOCCOCCCC(C)C 7a_100000054580_100011214892 [0,2,0,0,0,0|1,0,1]=4 7731 B12R0.234 C#CCOCCOCCCC(C)C 7a_100000210774_100010402529 [0,2,0,0,0,0|1,0,1]=4 7732 B12R0.234 C#CCOCCOCCCC(C)O 34a_100000054580_200000718107 [0,2,0,0,0,0|1,0,1]=4 7733 B12R0.234 C#CCOCCOCCCC(C)O 7a_100000054580_200000718107 [0,2,0,0,0,0|1,0,1]=4 7734 B12R0.234 C#CCOCCOCCNC(C)C 2230a_100000056377_100000210206 [0,2,0,0,0,0|1,0,1]=4 7735 B12R0.234 C#CCOCCOCCNC(C)C 2230a_100138425928_100010408581 [0,2,0,0,0,0|1,0,1]=4 7736 B12R0.234 C#CCOCCOCCNC(C)C 34a_100000056377_100000210206 [0,2,0,0,0,0|1,0,1]=4 7737 B12R0.234 C#CCOCCOCCNC(C)C 34a_100000224655_100010402529 [0,2,0,0,0,0|1,0,1]=4 7738 B12R0.234 C#CCOCCOCCNC(C)C 34a_100138425928_100010408581 [0,2,0,0,0,0|1,0,1]=4 7739 B12R0.234 C#CCOCCOCCOC(=O)C 34a_100000054580_100009814007 [0,2,0,0,0,0|0,0,2]=4 7740 B12R0.234 C#CCOCCOCCOC(=O)C 34a_100000210247_200000083610 [0,2,0,0,0,0|0,0,2]=4 7741 B12R0.234 C#CCOCCOCCOC(=O)C 7a_100000054580_100009814007 [0,2,0,0,0,0|0,0,2]=4 7742 B12R0.234 C#CCOCCOCCOC(C)C 34a_100000041007_100000210206 [0,2,0,0,0,0|0,0,1]=3 7743 B12R0.234 C#CCOCCOCCOC(C)C 34a_100000054580_100000211751 [0,2,0,0,0,0|0,0,1]=3 7744 B12R0.234 C#CCOCCOCCOC(C)C 34a_100000211219_100010402529 [0,2,0,0,0,0|0,0,1]=3 7745 B12R0.234 C#CCOCCOCCOC(C)C 34a_100000212225_100010408581 [0,2,0,0,0,0|0,0,1]=3 7746 B12R0.234 C#CCOCCOCCOC(C)C 7a_100000041007_100000210206 [0,2,0,0,0,0|0,0,1]=3 7747 B12R0.234 C#CCOCCOCCOC(C)C 7a_100000054580_100000211751 [0,2,0,0,0,0|0,0,1]=3 7748 B12R0.234 C#CCOCCOCCOC(C)C 7a_100000211219_100010402529 [0,2,0,0,0,0|0,0,1]=3 7749 B12R0.234 C#CCOCCOCCSC(C)C 34a_100000054580_100000730970 [0,2,0,0,0,0|0,1,1]=4 7750 B12R0.234 C#CCOCCOCCSC(C)C 34a_200011212901_100010402529 [0,2,0,0,0,0|0,1,1]=4 7751 B12R0.234 C#CCOCCOCCSC(C)C 62a_100000210206_100010408581 [0,2,0,0,0,0|0,1,1]=4 7752 B12R0.234 C#CCOCCOCCSC(C)C 62a_100010408581_100000210206 [0,2,0,0,0,0|0,1,1]=4 7753 B12R0.234 C#CCOCCOCCSC(C)C 7a_100000054580_100000730970 [0,2,0,0,0,0|0,1,1]=4 7754 B12R0.234 C#CCOCCOCCSC(C)C 7a_200011212901_100010402529 [0,2,0,0,0,0|0,1,1]=4 7755 B12R0.234 C#CCOCCSCCOC(C)C 62a_100000211751_100010402529 [0,2,0,0,0,0|0,1,1]=4 7756 B12R0.234 C#CCOCCSCCOC(C)C 62a_100010402529_100000211751 [0,2,0,0,0,0|0,1,1]=4 7757 B12R0.234 C/C=C/CCOCCOCC(F)F 34a_100016278192_200012177212 [0,2,0,0,0,0|1,0,1]=4 7758 B12R0.234 C=C(C)CNCCOCCOCC 2230a_100102712874_100000748629 [0,2,0,0,0,0|1,0,0]=3 7759 B12R0.234 C=C(C)CNCCOCCOCC 34a_100102712874_100000748629 [0,2,0,0,0,0|1,0,0]=3 7760 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210232_100000748629 [0,2,0,0,0,0|2,0,0]=4 7761 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210245_100000210759 [0,2,0,0,0,0|2,0,0]=4 7762 B12R0.234 C=C(C)COCCCCCCCC 7a_100000210232_100000748629 [0,2,0,0,0,0|2,0,0]=4 7763 B12R0.234 C=C(C)COCCNCCCCC 34a_100000224656_100000748629 [0,2,0,0,0,0|2,0,0]=4 7764 B12R0.234 C=C(C)COCCOCCCCC 34a_100011215259_100000748629 [0,2,0,0,0,0|1,0,0]=3 7765 B12R0.234 C=C(C)COCCOCCCCC 7a_100011215259_100000748629 [0,2,0,0,0,0|1,0,0]=3 7766 B12R0.234 C=C(C)COCCOCCOCC 34a_100000210240_100000748629 [0,2,0,0,0,0|0,0,0]=2 7767 B12R0.234 C=C(C)COCCOCCOCC 34a_100000210245_100011211534 [0,2,0,0,0,0|0,0,0]=2 7768 B12R0.234 C=C(C)COCCOCCOCC 7a_100000210240_100000748629 [0,2,0,0,0,0|0,0,0]=2 7769 B12R0.234 C=C(C)CSCCOCCOCC 62a_100000748629_100011211534 [0,2,0,0,0,0|0,1,0]=3 7770 B12R0.234 C=C(C)CSCCOCCOCC 62a_100011211534_100000211660 [0,2,0,0,0,0|0,1,0]=3 7771 B12R0.234 C=C(F)CNCCOCCOCC 2230a_100102712874_100009893438 [0,2,0,0,0,0|1,0,1]=4 7772 B12R0.234 C=C(F)CNCCOCCOCC 34a_100102712874_100009893438 [0,2,0,0,0,0|1,0,1]=4 7773 B12R0.234 C=C(F)COCCOCCCCC 34a_100011215259_100009893438 [0,2,0,0,0,0|1,0,1]=4 7774 B12R0.234 C=C(F)COCCOCCCCC 7a_100011215259_100000042424 [0,2,0,0,0,0|1,0,1]=4 7775 B12R0.234 C=C(F)COCCOCCOCC 34a_100000210240_100009893438 [0,2,0,0,0,0|0,0,1]=3 7776 B12R0.234 C=C(F)COCCOCCOCC 34a_200010262243_100011211534 [0,2,0,0,0,0|0,0,1]=3 7777 B12R0.234 C=C(F)COCCOCCOCC 7a_100000210240_100000042424 [0,2,0,0,0,0|0,0,1]=3 7778 B12R0.234 C=C(F)CSCCOCCOCC 62a_100000042424_100011211534 [0,2,0,0,0,0|0,1,1]=4 7779 B12R0.234 C=C(F)CSCCOCCOCC 62a_100011211534_100000042424 [0,2,0,0,0,0|0,1,1]=4 7780 B12R0.234 C=CCCCCOCCOC(C)C 34a_100000211219_100011215482 [0,2,0,0,0,0|1,0,1]=4 7781 B12R0.234 C=CCCCCOCCOC(C)C 34a_100000766645_100000211751 [0,2,0,0,0,0|1,0,1]=4 7782 B12R0.234 C=CCCCCOCCOC(C)C 7a_100000211219_100011215482 [0,2,0,0,0,0|1,0,1]=4 7783 B12R0.234 C=CCCCCOCCOC(C)C 7a_100000766645_100000211751 [0,2,0,0,0,0|1,0,1]=4 7784 B12R0.234 C=CCOCCOCCCC(C)C 34a_100000037705_100011214892 [0,2,0,0,0,0|1,0,1]=4 7785 B12R0.234 C=CCOCCOCCCC(C)C 7a_100000037705_100011214892 [0,2,0,0,0,0|1,0,1]=4 7786 B12R0.234 C=CCOCCOCCCC(C)O 34a_100000037705_200000718107 [0,2,0,0,0,0|1,0,1]=4 7787 B12R0.234 C=CCOCCOCCCC(C)O 7a_100000037705_200000718107 [0,2,0,0,0,0|1,0,1]=4 7788 B12R0.234 C=CCOCCOCCOC(=O)C 34a_100000037705_100009814007 [0,2,0,0,0,0|0,0,2]=4 7789 B12R0.234 C=CCOCCOCCOC(=O)C 34a_200000210373_200000083610 [0,2,0,0,0,0|0,0,2]=4 7790 B12R0.234 C=CCOCCOCCOC(=O)C 7a_100000037705_100009814007 [0,2,0,0,0,0|0,0,2]=4 7791 B12R0.234 C=CCOCCOCCOC(C)C 34a_100000037705_100000211751 [0,2,0,0,0,0|0,0,1]=3 7792 B12R0.234 C=CCOCCOCCOC(C)C 34a_100000065479_100000210206 [0,2,0,0,0,0|0,0,1]=3 7793 B12R0.234 C=CCOCCOCCOC(C)C 7a_100000037705_100000211751 [0,2,0,0,0,0|0,0,1]=3 7794 B12R0.234 C=CCOCCOCCOC(C)C 7a_100000065479_100000210206 [0,2,0,0,0,0|0,0,1]=3 7795 B12R0.234 C=CCOCCOCCSC(C)C 34a_100000037705_100000730970 [0,2,0,0,0,0|0,1,1]=4 7796 B12R0.234 C=CCOCCOCCSC(C)C 7a_100000037705_100000730970 [0,2,0,0,0,0|0,1,1]=4 7797 B12R0.234 C=COCCOCCOCC(=C)C 34a_100000039918_100000748629 [0,2,0,0,0,0|0,0,2]=4 7798 B12R0.234 C=COCCOCCOCC(=C)C 7a_100000039918_100000748629 [0,2,0,0,0,0|0,0,2]=4 7799 B12R0.234 C=COCCOCCOCC(C)C 34a_100000039918_100000210624 [0,2,0,0,0,0|0,0,2]=4 7800 B12R0.234 C=COCCOCCOCC(C)C 34a_100000703358_100000039644 [0,2,0,0,0,0|0,0,2]=4 7801 B12R0.234 C=COCCOCCOCC(C)C 7a_100000039918_100000210760 [0,2,0,0,0,0|0,0,2]=4 7802 B12R0.234 C=COCCOCCOCC(C)C 7a_100000703358_100000039644 [0,2,0,0,0,0|0,0,2]=4 7803 B12R0.234 C=COCCOCCOCC(C)O 34a_100000039918_100011218427 [0,2,0,0,0,0|0,0,2]=4 7804 B12R0.234 C=COCCOCCOCC(C)O 7a_100000039918_100011218427 [0,2,0,0,0,0|0,0,2]=4 7805 B12R0.234 C=COCCOCCOCC(F)F 34a_100000033082_200012177212 [0,2,0,0,0,0|0,0,2]=4 7806 B12R0.234 C=COCCOCCOCC(F)F 34a_100000039918_100011934356 [0,2,0,0,0,0|0,0,2]=4 7807 B12R0.234 C=COCCOCCOCC(F)F 34a_100000704375_100000039644 [0,2,0,0,0,0|0,0,2]=4 7808 B12R0.234 C=COCCOCCOCC(F)F 7a_100000039918_100011934356 [0,2,0,0,0,0|0,0,2]=4 7809 B12R0.234 C=COCCOCCOCC(F)F 7a_100000704375_100000039644 [0,2,0,0,0,0|0,0,2]=4 7810 B12R0.234 C=COCCOCCOC[C@@H](C)O 34a_100000039918_100009817552 [0,2,0,0,0,0|0,0,2]=4 7811 B12R0.234 C=COCCOCCOC[C@@H](C)O 7a_100000039918_100009817552 [0,2,0,0,0,0|0,0,2]=4 7812 B12R0.234 CC#CCCOCCOCC(F)F 34a_100000750427_200012177212 [0,2,0,0,0,0|1,0,1]=4 7813 B12R0.234 CC(=CCCOCCOCCBr)C 34a_100000692535_100011217483 [0,2,0,0,0,0|1,0,1]=4 7814 B12R0.234 CC(=CCCOCCOCCBr)C 7a_100000692535_100011217483 [0,2,0,0,0,0|1,0,1]=4 7815 B12R0.234 CC(=CCCOCCOCCCl)C 34a_100011215305_100011217483 [0,2,0,0,0,0|1,0,1]=4 7816 B12R0.234 CC(=CCCOCCOCCCl)C 7a_100011215305_100011217483 [0,2,0,0,0,0|1,0,1]=4 7817 B12R0.234 CC(=CCCOCCOCCF)C 34a_200015357709_100011217483 [0,2,0,0,0,0|1,0,1]=4 7818 B12R0.234 CC(=CCCOCCOCCF)C 7a_200015357709_100011217483 [0,2,0,0,0,0|1,0,1]=4 7819 B12R0.234 CC(=CCCOCCOCCI)C 34a_100012149058_100011217483 [0,2,0,0,0,0|1,0,1]=4 7820 B12R0.234 CC(=CCCOCCOCCI)C 7a_100012149058_100011217483 [0,2,0,0,0,0|1,0,1]=4 7821 B12R0.234 CC(=CCCOCCOCCN)C 34a_100000211614_100011217483 [0,2,0,0,0,0|1,0,1]=4 7822 B12R0.234 CC(=O)CCCOCCOCCBr 34a_100000692535_100000685027 [0,2,0,0,0,0|1,0,1]=4 7823 B12R0.234 CC(=O)CCCOCCOCCBr 7a_100000692535_100011215641 [0,2,0,0,0,0|1,0,1]=4 7824 B12R0.234 CC(=O)CCCOCCOCCCl 34a_100011215305_100000685027 [0,2,0,0,0,0|1,0,1]=4 7825 B12R0.234 CC(=O)CCCOCCOCCCl 7a_100011215305_100011215641 [0,2,0,0,0,0|1,0,1]=4 7826 B12R0.234 CC(=O)CCCOCCOCCF 34a_200015357709_100000685027 [0,2,0,0,0,0|1,0,1]=4 7827 B12R0.234 CC(=O)CCCOCCOCCF 7a_200015357709_100011215641 [0,2,0,0,0,0|1,0,1]=4 7828 B12R0.234 CC(=O)CCCOCCOCCI 34a_100012149058_100000685027 [0,2,0,0,0,0|1,0,1]=4 7829 B12R0.234 CC(=O)CCCOCCOCCI 7a_100012149058_100011215641 [0,2,0,0,0,0|1,0,1]=4 7830 B12R0.234 CC(=O)CCCOCCOCCN 34a_100000211614_100000685027 [0,2,0,0,0,0|1,0,1]=4 7831 B12R0.234 CC(=O)CCCOCCOCCO 34a_100000759063_100000692535 [0,2,0,0,0,0|1,0,1]=4 7832 B12R0.234 CC(=O)CCCOCCOCCO 7a_100000759063_100011215305 [0,2,0,0,0,0|1,0,1]=4 7833 B12R0.234 CC(=O)NCCOCCOCCBr 7a_100000692535_100000189650 [0,2,0,0,0,0|1,0,1]=4 7834 B12R0.234 CC(=O)NCCOCCOCCCl 7a_100011215305_100000189650 [0,2,0,0,0,0|1,0,1]=4 7835 B12R0.234 CC(=O)NCCOCCOCCF 7a_200015357709_100000189650 [0,2,0,0,0,0|1,0,1]=4 7836 B12R0.234 CC(=O)NCCOCCOCCI 7a_100012149058_100000189650 [0,2,0,0,0,0|1,0,1]=4 7837 B12R0.234 CC(=O)NCCOCCOCCO 240690a_100011998139_100015343762 [0,2,0,0,0,0|1,0,1]=4 7838 B12R0.234 CC(=O)NCCOCCOCCO 34a_100000158858_100000692535 [0,2,0,0,0,0|1,0,1]=4 7839 B12R0.234 CC(=O)OCCCCCOCCBr 34a_100000211926_100000033007 [0,2,0,0,0,0|1,0,1]=4 7840 B12R0.234 CC(=O)OCCCCCOCCN 34a_100000210304_100000033007 [0,2,0,0,0,0|1,0,1]=4 7841 B12R0.234 CC(=O)OCCNCCOCCO 34a_100000211614_100009814007 [0,2,0,0,0,0|1,0,1]=4 7842 B12R0.234 CC(=O)OCCOCCCCCBr 34a_100000746331_100009814007 [0,2,0,0,0,0|1,0,1]=4 7843 B12R0.234 CC(=O)OCCOCCCCCBr 7a_100000746331_100009814007 [0,2,0,0,0,0|1,0,1]=4 7844 B12R0.234 CC(=O)OCCOCCCCCCl 34a_100000746330_100009814007 [0,2,0,0,0,0|1,0,1]=4 7845 B12R0.234 CC(=O)OCCOCCCCCCl 7a_100000746330_100009814007 [0,2,0,0,0,0|1,0,1]=4 7846 B12R0.234 CC(=O)OCCOCCCCCI 34a_200012148887_100009814007 [0,2,0,0,0,0|1,0,1]=4 7847 B12R0.234 CC(=O)OCCOCCCCCI 7a_200012148887_100009814007 [0,2,0,0,0,0|1,0,1]=4 7848 B12R0.234 CC(=O)OCCOCCCCCN 34a_100000762737_100009814007 [0,2,0,0,0,0|1,0,1]=4 7849 B12R0.234 CC(=O)OCCOCCNCCF 34a_100000724931_200000083610 [0,2,0,0,0,0|1,0,1]=4 7850 B12R0.234 CC(=O)OCCOCCNCCO 2230a_100016997473_200000083610 [0,2,0,0,0,0|1,0,1]=4 7851 B12R0.234 CC(=O)OCCOCCNCCO 34a_100016990907_200000083610 [0,2,0,0,0,0|1,0,1]=4 7852 B12R0.234 CC(=O)OCCOCCOCCBr 34a_100000211926_200000083610 [0,2,0,0,0,0|0,0,1]=3 7853 B12R0.234 CC(=O)OCCOCCOCCBr 34a_100000692535_100009814007 [0,2,0,0,0,0|0,0,1]=3 7854 B12R0.234 CC(=O)OCCOCCOCCBr 7a_100000692535_100009814007 [0,2,0,0,0,0|0,0,1]=3 7855 B12R0.234 CC(=O)OCCOCCOCCCl 34a_100011215305_100009814007 [0,2,0,0,0,0|0,0,1]=3 7856 B12R0.234 CC(=O)OCCOCCOCCCl 7a_100011215305_100009814007 [0,2,0,0,0,0|0,0,1]=3 7857 B12R0.234 CC(=O)OCCOCCOCCF 34a_200015357709_100009814007 [0,2,0,0,0,0|0,0,1]=3 7858 B12R0.234 CC(=O)OCCOCCOCCF 7a_200015357709_100009814007 [0,2,0,0,0,0|0,0,1]=3 7859 B12R0.234 CC(=O)OCCOCCOCCI 34a_100012149058_100009814007 [0,2,0,0,0,0|0,0,1]=3 7860 B12R0.234 CC(=O)OCCOCCOCCI 7a_100012149058_100009814007 [0,2,0,0,0,0|0,0,1]=3 7861 B12R0.234 CC(=O)OCCOCCOCCN 34a_100000210304_200000083610 [0,2,0,0,0,0|0,0,1]=3 7862 B12R0.234 CC(=O)OCCOCCOCCN 34a_100000211614_100009814007 [0,2,0,0,0,0|0,0,1]=3 7863 B12R0.234 CC(=O)OCCOCCSCCF 62a_100011217306_200000083610 [0,2,0,0,0,0|0,1,1]=4 7864 B12R0.234 CC(=O)OCCOCCSCCF 62a_200000083610_100011217306 [0,2,0,0,0,0|0,1,1]=4 7865 B12R0.234 CC(=O)OCCOCCSCCO 62a_100000211926_200000083610 [0,2,0,0,0,0|0,1,1]=4 7866 B12R0.234 CC(=O)OCCOCCSCCO 62a_200000083610_100000211926 [0,2,0,0,0,0|0,1,1]=4 7867 B12R0.234 CC(=O)OCCSCCOCCO 62a_100009814007_100011215305 [0,2,0,0,0,0|0,1,1]=4 7868 B12R0.234 CC(=O)OCCSCCOCCO 62a_100011215305_100009814007 [0,2,0,0,0,0|0,1,1]=4 7869 B12R0.234 CC(C)CCCNCCOCCO 2230a_100000211614_100011214892 [0,2,0,0,0,0|2,0,0]=4 7870 B12R0.234 CC(C)CCCNCCOCCO 2230a_200000737386_100011215305 [0,2,0,0,0,0|2,0,0]=4 7871 B12R0.234 CC(C)CCCNCCOCCO 34a_100000211614_100011214892 [0,2,0,0,0,0|2,0,0]=4 7872 B12R0.234 CC(C)CCCNCCOCCO 34a_200000737386_100000692535 [0,2,0,0,0,0|2,0,0]=4 7873 B12R0.234 CC(C)CCCOCCCCCBr 34a_100000746331_100011214892 [0,2,0,0,0,0|2,0,0]=4 7874 B12R0.234 CC(C)CCCOCCCCCBr 7a_100000746331_100011214892 [0,2,0,0,0,0|2,0,0]=4 7875 B12R0.234 CC(C)CCCOCCCCCCl 34a_100000746330_100011214892 [0,2,0,0,0,0|2,0,0]=4 7876 B12R0.234 CC(C)CCCOCCCCCCl 7a_100000746330_100011214892 [0,2,0,0,0,0|2,0,0]=4 7877 B12R0.234 CC(C)CCCOCCCCCF 34a_100000210774_100000729378 [0,2,0,0,0,0|2,0,0]=4 7878 B12R0.234 CC(C)CCCOCCCCCF 7a_100000210774_100000729378 [0,2,0,0,0,0|2,0,0]=4 7879 B12R0.234 CC(C)CCCOCCCCCI 34a_200012148887_100011214892 [0,2,0,0,0,0|2,0,0]=4 7880 B12R0.234 CC(C)CCCOCCCCCI 7a_200012148887_100011214892 [0,2,0,0,0,0|2,0,0]=4 7881 B12R0.234 CC(C)CCCOCCCCCN 34a_100000762737_100011214892 [0,2,0,0,0,0|2,0,0]=4 7882 B12R0.234 CC(C)CCCOCCCCCO 34a_100000210774_100000746330 [0,2,0,0,0,0|2,0,0]=4 7883 B12R0.234 CC(C)CCCOCCCCCO 7a_100000210774_100000746330 [0,2,0,0,0,0|2,0,0]=4 7884 B12R0.234 CC(C)CCCOCCOCC#N 7a_100000210774_200000047693 [0,2,0,0,0,0|1,0,1]=4 7885 B12R0.234 CC(C)CCCOCCOCCBr 34a_100000692535_100011214892 [0,2,0,0,0,0|1,0,0]=3 7886 B12R0.234 CC(C)CCCOCCOCCBr 7a_100000692535_100011214892 [0,2,0,0,0,0|1,0,0]=3 7887 B12R0.234 CC(C)CCCOCCOCCCl 34a_100011215305_100011214892 [0,2,0,0,0,0|1,0,0]=3 7888 B12R0.234 CC(C)CCCOCCOCCCl 7a_100011215305_100011214892 [0,2,0,0,0,0|1,0,0]=3 7889 B12R0.234 CC(C)CCCOCCOCCF 34a_200015357709_100011214892 [0,2,0,0,0,0|1,0,0]=3 7890 B12R0.234 CC(C)CCCOCCOCCF 7a_200015357709_100011214892 [0,2,0,0,0,0|1,0,0]=3 7891 B12R0.234 CC(C)CCCOCCOCCI 34a_100012149058_100011214892 [0,2,0,0,0,0|1,0,0]=3 7892 B12R0.234 CC(C)CCCOCCOCCI 7a_100012149058_100011214892 [0,2,0,0,0,0|1,0,0]=3 7893 B12R0.234 CC(C)CCCOCCOCCN 34a_100000211614_100011214892 [0,2,0,0,0,0|1,0,0]=3 7894 B12R0.234 CC(C)CCCOCCOCCO 34a_100000210774_100000692535 [0,2,0,0,0,0|1,0,0]=3 7895 B12R0.234 CC(C)CCCOCCOCCO 7a_100000210774_100011215305 [0,2,0,0,0,0|1,0,0]=3 7896 B12R0.234 CC(C)CCCSCCOCCO 62a_100011214892_100011215305 [0,2,0,0,0,0|1,1,0]=4 7897 B12R0.234 CC(C)CCCSCCOCCO 62a_100011215305_100011214892 [0,2,0,0,0,0|1,1,0]=4 7898 B12R0.234 CC(C)COCCOCCCCF 34a_100000703358_100000729493 [0,2,0,0,0,0|2,0,0]=4 7899 B12R0.234 CC(C)COCCOCCCCF 7a_100000703358_100000729493 [0,2,0,0,0,0|2,0,0]=4 7900 B12R0.234 CC(C)COCCOCCCCO 34a_100000703358_100011216708 [0,2,0,0,0,0|2,0,0]=4 7901 B12R0.234 CC(C)COCCOCCCCO 7a_100000703358_100000210776 [0,2,0,0,0,0|2,0,0]=4 7902 B12R0.234 CC(C)NCCCCCOCCF 34a_100011629493_100011217306 [0,2,0,0,0,0|2,0,0]=4 7903 B12R0.234 CC(C)NCCCCCOCCO 34a_100011629493_100000211926 [0,2,0,0,0,0|2,0,0]=4 7904 B12R0.234 CC(C)NCCOCCCCCF 34a_100000224655_100000729378 [0,2,0,0,0,0|2,0,0]=4 7905 B12R0.234 CC(C)NCCOCCCCCO 34a_100000224655_100000746330 [0,2,0,0,0,0|2,0,0]=4 7906 B12R0.234 CC(C)NCCOCCOCCO 2230a_100011998139_100000210206 [0,2,0,0,0,0|1,0,0]=3 7907 B12R0.234 CC(C)NCCOCCOCCO 2230a_100138425928_100000032323 [0,2,0,0,0,0|1,0,0]=3 7908 B12R0.234 CC(C)NCCOCCOCCO 34a_100000224655_100000692535 [0,2,0,0,0,0|1,0,0]=3 7909 B12R0.234 CC(C)NCCOCCOCCO 34a_100011998139_100000210206 [0,2,0,0,0,0|1,0,0]=3 7910 B12R0.234 CC(C)NCCOCCOCCO 34a_100138425928_100000032323 [0,2,0,0,0,0|1,0,0]=3 7911 B12R0.234 CC(C)OCCCCCCCCBr 34a_100009813846_100000210206 [0,2,0,0,0,0|2,0,0]=4 7912 B12R0.234 CC(C)OCCCCCCCCBr 7a_100009813846_100000210206 [0,2,0,0,0,0|2,0,0]=4 7913 B12R0.234 CC(C)OCCCCCCCCCl 34a_100000033203_100000210206 [0,2,0,0,0,0|2,0,0]=4 7914 B12R0.234 CC(C)OCCCCCCCCCl 7a_100000033203_100000210206 [0,2,0,0,0,0|2,0,0]=4 7915 B12R0.234 CC(C)OCCCCCCCCN 34a_102515433106_100000210206 [0,2,0,0,0,0|2,0,0]=4 7916 B12R0.234 CC(C)OCCCCCCCCO 34a_100000212225_100000033203 [0,2,0,0,0,0|2,0,0]=4 7917 B12R0.234 CC(C)OCCCCCNCCN 34a_103619048469_100000210206 [0,2,0,0,0,0|2,0,0]=4 7918 B12R0.234 CC(C)OCCNCCCCCF 2230a_100000701111_100000729378 [0,2,0,0,0,0|2,0,0]=4 7919 B12R0.234 CC(C)OCCNCCCCCF 34a_100000701111_100000729378 [0,2,0,0,0,0|2,0,0]=4 7920 B12R0.234 CC(C)OCCNCCCCCO 2230a_100000701111_100000746330 [0,2,0,0,0,0|2,0,0]=4 7921 B12R0.234 CC(C)OCCNCCCCCO 2230a_100000762737_100000211751 [0,2,0,0,0,0|2,0,0]=4 7922 B12R0.234 CC(C)OCCNCCCCCO 34a_100000701111_100000746330 [0,2,0,0,0,0|2,0,0]=4 7923 B12R0.234 CC(C)OCCNCCCCCO 34a_100000762737_100000211751 [0,2,0,0,0,0|2,0,0]=4 7924 B12R0.234 CC(C)OCCNCCOCC#N 2230a_100000701111_200000047693 [0,2,0,0,0,0|1,0,1]=4 7925 B12R0.234 CC(C)OCCNCCOCCO 2230a_100000211614_100000211751 [0,2,0,0,0,0|1,0,0]=3 7926 B12R0.234 CC(C)OCCNCCOCCO 2230a_100000701111_100011215305 [0,2,0,0,0,0|1,0,0]=3 7927 B12R0.234 CC(C)OCCNCCOCCO 34a_100000211614_100000211751 [0,2,0,0,0,0|1,0,0]=3 7928 B12R0.234 CC(C)OCCNCCOCCO 34a_100000701111_100000692535 [0,2,0,0,0,0|1,0,0]=3 7929 B12R0.234 CC(C)OCCNCCSCCO 2230a_100011219999_100000211751 [0,2,0,0,0,0|1,1,0]=4 7930 B12R0.234 CC(C)OCCOCCCCC#N 7a_100000211219_100000211819 [0,2,0,0,0,0|1,0,1]=4 7931 B12R0.234 CC(C)OCCOCCCCC=O 7a_100000211219_100000139335 [0,2,0,0,0,0|1,0,1]=4 7932 B12R0.234 CC(C)OCCOCCCCCBr 34a_100000746331_100000211751 [0,2,0,0,0,0|1,0,0]=3 7933 B12R0.234 CC(C)OCCOCCCCCBr 7a_100000746331_100000211751 [0,2,0,0,0,0|1,0,0]=3 7934 B12R0.234 CC(C)OCCOCCCCCCl 34a_100000746330_100000211751 [0,2,0,0,0,0|1,0,0]=3 7935 B12R0.234 CC(C)OCCOCCCCCCl 7a_100000746330_100000211751 [0,2,0,0,0,0|1,0,0]=3 7936 B12R0.234 CC(C)OCCOCCCCCF 34a_100000211219_100000729378 [0,2,0,0,0,0|1,0,0]=3 7937 B12R0.234 CC(C)OCCOCCCCCF 7a_100000211219_100000729378 [0,2,0,0,0,0|1,0,0]=3 7938 B12R0.234 CC(C)OCCOCCCCCI 34a_200012148887_100000211751 [0,2,0,0,0,0|1,0,0]=3 7939 B12R0.234 CC(C)OCCOCCCCCI 7a_200012148887_100000211751 [0,2,0,0,0,0|1,0,0]=3 7940 B12R0.234 CC(C)OCCOCCCCCN 34a_100000762737_100000211751 [0,2,0,0,0,0|1,0,0]=3 7941 B12R0.234 CC(C)OCCOCCCCCO 34a_100000211219_100000746330 [0,2,0,0,0,0|1,0,0]=3 7942 B12R0.234 CC(C)OCCOCCCCCO 7a_100000211219_100000746330 [0,2,0,0,0,0|1,0,0]=3 7943 B12R0.234 CC(C)OCCOCCOCC#N 7a_100000211219_200000047693 [0,2,0,0,0,0|0,0,1]=3 7944 B12R0.234 CC(C)OCCOCCOCCBr 34a_100000692535_100000211751 [0,2,0,0,0,0|0,0,0]=2 7945 B12R0.234 CC(C)OCCOCCOCCBr 34a_100010132937_100000210206 [0,2,0,0,0,0|0,0,0]=2 7946 B12R0.234 CC(C)OCCOCCOCCBr 7a_100000692535_100000211751 [0,2,0,0,0,0|0,0,0]=2 7947 B12R0.234 CC(C)OCCOCCOCCBr 7a_100010132937_100000210206 [0,2,0,0,0,0|0,0,0]=2 7948 B12R0.234 CC(C)OCCOCCOCCCl 34a_100000032323_100000210206 [0,2,0,0,0,0|0,0,0]=2 7949 B12R0.234 CC(C)OCCOCCOCCCl 34a_100011215305_100000211751 [0,2,0,0,0,0|0,0,0]=2 7950 B12R0.234 CC(C)OCCOCCOCCCl 7a_100000032323_100000210206 [0,2,0,0,0,0|0,0,0]=2 7951 B12R0.234 CC(C)OCCOCCOCCCl 7a_100011215305_100000211751 [0,2,0,0,0,0|0,0,0]=2 7952 B12R0.234 CC(C)OCCOCCOCCF 34a_200015357709_100000211751 [0,2,0,0,0,0|0,0,0]=2 7953 B12R0.234 CC(C)OCCOCCOCCF 7a_200015357709_100000211751 [0,2,0,0,0,0|0,0,0]=2 7954 B12R0.234 CC(C)OCCOCCOCCI 34a_100012149058_100000211751 [0,2,0,0,0,0|0,0,0]=2 7955 B12R0.234 CC(C)OCCOCCOCCI 7a_100012149058_100000211751 [0,2,0,0,0,0|0,0,0]=2 7956 B12R0.234 CC(C)OCCOCCOCCN 34a_100000211614_100000211751 [0,2,0,0,0,0|0,0,0]=2 7957 B12R0.234 CC(C)OCCOCCOCCN 34a_100011998139_100000210206 [0,2,0,0,0,0|0,0,0]=2 7958 B12R0.234 CC(C)OCCOCCOCCO 34a_100000211219_100000692535 [0,2,0,0,0,0|0,0,0]=2 7959 B12R0.234 CC(C)OCCOCCOCCO 34a_100000212225_100000032323 [0,2,0,0,0,0|0,0,0]=2 7960 B12R0.234 CC(C)OCCOCCOCCO 7a_100000211219_100011215305 [0,2,0,0,0,0|0,0,0]=2 7961 B12R0.234 CC(C)OCCSCCCCCF 62a_100000211751_100000729378 [0,2,0,0,0,0|1,1,0]=4 7962 B12R0.234 CC(C)OCCSCCCCCF 62a_100000729378_100000211751 [0,2,0,0,0,0|1,1,0]=4 7963 B12R0.234 CC(C)OCCSCCCCCO 62a_100000211751_100000746330 [0,2,0,0,0,0|1,1,0]=4 7964 B12R0.234 CC(C)OCCSCCCCCO 62a_100000746330_100000211751 [0,2,0,0,0,0|1,1,0]=4 7965 B12R0.234 CC(C)OCCSCCOCC#N 62a_100000211751_200000047693 [0,2,0,0,0,0|0,1,1]=4 7966 B12R0.234 CC(C)OCCSCCOCC#N 62a_200000047693_100000211751 [0,2,0,0,0,0|0,1,1]=4 7967 B12R0.234 CC(C)OCCSCCOCCO 62a_100000211751_100011215305 [0,2,0,0,0,0|0,1,0]=3 7968 B12R0.234 CC(C)OCCSCCOCCO 62a_100011215305_100000211751 [0,2,0,0,0,0|0,1,0]=3 7969 B12R0.234 CC(C)SCCNCCOCCO 2230a_100000211614_100000730970 [0,2,0,0,0,0|1,1,0]=4 7970 B12R0.234 CC(C)SCCNCCOCCO 2230a_100000731138_100011215305 [0,2,0,0,0,0|1,1,0]=4 7971 B12R0.234 CC(C)SCCNCCOCCO 34a_100000211614_100000730970 [0,2,0,0,0,0|1,1,0]=4 7972 B12R0.234 CC(C)SCCNCCOCCO 34a_100000731138_100000692535 [0,2,0,0,0,0|1,1,0]=4 7973 B12R0.234 CC(C)SCCOCCCCCBr 34a_100000746331_100000730970 [0,2,0,0,0,0|1,1,0]=4 7974 B12R0.234 CC(C)SCCOCCCCCBr 7a_100000746331_100000730970 [0,2,0,0,0,0|1,1,0]=4 7975 B12R0.234 CC(C)SCCOCCCCCCl 34a_100000746330_100000730970 [0,2,0,0,0,0|1,1,0]=4 7976 B12R0.234 CC(C)SCCOCCCCCCl 7a_100000746330_100000730970 [0,2,0,0,0,0|1,1,0]=4 7977 B12R0.234 CC(C)SCCOCCCCCF 34a_200011212901_100000729378 [0,2,0,0,0,0|1,1,0]=4 7978 B12R0.234 CC(C)SCCOCCCCCF 7a_200011212901_100000729378 [0,2,0,0,0,0|1,1,0]=4 7979 B12R0.234 CC(C)SCCOCCCCCI 34a_200012148887_100000730970 [0,2,0,0,0,0|1,1,0]=4 7980 B12R0.234 CC(C)SCCOCCCCCI 7a_200012148887_100000730970 [0,2,0,0,0,0|1,1,0]=4 7981 B12R0.234 CC(C)SCCOCCCCCN 34a_100000762737_100000730970 [0,2,0,0,0,0|1,1,0]=4 7982 B12R0.234 CC(C)SCCOCCCCCO 34a_200011212901_100000746330 [0,2,0,0,0,0|1,1,0]=4 7983 B12R0.234 CC(C)SCCOCCCCCO 7a_200011212901_100000746330 [0,2,0,0,0,0|1,1,0]=4 7984 B12R0.234 CC(C)SCCOCCOCC#N 7a_200011212901_200000047693 [0,2,0,0,0,0|0,1,1]=4 7985 B12R0.234 CC(C)SCCOCCOCCBr 34a_100000692535_100000730970 [0,2,0,0,0,0|0,1,0]=3 7986 B12R0.234 CC(C)SCCOCCOCCBr 7a_100000692535_100000730970 [0,2,0,0,0,0|0,1,0]=3 7987 B12R0.234 CC(C)SCCOCCOCCCl 34a_100011215305_100000730970 [0,2,0,0,0,0|0,1,0]=3 7988 B12R0.234 CC(C)SCCOCCOCCCl 7a_100011215305_100000730970 [0,2,0,0,0,0|0,1,0]=3 7989 B12R0.234 CC(C)SCCOCCOCCF 34a_200015357709_100000730970 [0,2,0,0,0,0|0,1,0]=3 7990 B12R0.234 CC(C)SCCOCCOCCF 7a_200015357709_100000730970 [0,2,0,0,0,0|0,1,0]=3 7991 B12R0.234 CC(C)SCCOCCOCCI 34a_100012149058_100000730970 [0,2,0,0,0,0|0,1,0]=3 7992 B12R0.234 CC(C)SCCOCCOCCI 7a_100012149058_100000730970 [0,2,0,0,0,0|0,1,0]=3 7993 B12R0.234 CC(C)SCCOCCOCCN 34a_100000211614_100000730970 [0,2,0,0,0,0|0,1,0]=3 7994 B12R0.234 CC(C)SCCOCCOCCO 34a_200011212901_100000692535 [0,2,0,0,0,0|0,1,0]=3 7995 B12R0.234 CC(C)SCCOCCOCCO 62a_100000032323_100000210206 [0,2,0,0,0,0|0,1,0]=3 7996 B12R0.234 CC(C)SCCOCCOCCO 62a_100000210206_100000032323 [0,2,0,0,0,0|0,1,0]=3 7997 B12R0.234 CC(C)SCCOCCOCCO 7a_200011212901_100011215305 [0,2,0,0,0,0|0,1,0]=3 7998 B12R0.234 CC(C)SCCSCCOCCO 62a_100000730970_100011215305 [0,2,0,0,0,0|0,2,0]=4 7999 B12R0.234 CC(C)SCCSCCOCCO 62a_100011215305_100000730970 [0,2,0,0,0,0|0,2,0]=4 8000 B12R0.234 CC(O)CCCNCCOCCO 2230a_100000211614_200000718107 [0,2,0,0,0,0|2,0,0]=4 8001 B12R0.234 CC(O)CCCNCCOCCO 34a_100000211614_200000718107 [0,2,0,0,0,0|2,0,0]=4 8002 B12R0.234 CC(O)CCCOCCCCCBr 34a_100000746331_200000718107 [0,2,0,0,0,0|2,0,0]=4 8003 B12R0.234 CC(O)CCCOCCCCCBr 7a_100000746331_200000718107 [0,2,0,0,0,0|2,0,0]=4 8004 B12R0.234 CC(O)CCCOCCCCCCl 34a_100000746330_200000718107 [0,2,0,0,0,0|2,0,0]=4 8005 B12R0.234 CC(O)CCCOCCCCCCl 7a_100000746330_200000718107 [0,2,0,0,0,0|2,0,0]=4 8006 B12R0.234 CC(O)CCCOCCCCCI 34a_200012148887_200000718107 [0,2,0,0,0,0|2,0,0]=4 8007 B12R0.234 CC(O)CCCOCCCCCI 7a_200012148887_200000718107 [0,2,0,0,0,0|2,0,0]=4 8008 B12R0.234 CC(O)CCCOCCCCCN 34a_100000762737_200000718107 [0,2,0,0,0,0|2,0,0]=4 8009 B12R0.234 CC(O)CCCOCCOCCBr 34a_100000692535_200000718107 [0,2,0,0,0,0|1,0,0]=3 8010 B12R0.234 CC(O)CCCOCCOCCBr 7a_100000692535_200000718107 [0,2,0,0,0,0|1,0,0]=3 8011 B12R0.234 CC(O)CCCOCCOCCCl 34a_100011215305_200000718107 [0,2,0,0,0,0|1,0,0]=3 8012 B12R0.234 CC(O)CCCOCCOCCCl 7a_100011215305_200000718107 [0,2,0,0,0,0|1,0,0]=3 8013 B12R0.234 CC(O)CCCOCCOCCF 34a_200015357709_200000718107 [0,2,0,0,0,0|1,0,0]=3 8014 B12R0.234 CC(O)CCCOCCOCCF 7a_200015357709_200000718107 [0,2,0,0,0,0|1,0,0]=3 8015 B12R0.234 CC(O)CCCOCCOCCI 34a_100012149058_200000718107 [0,2,0,0,0,0|1,0,0]=3 8016 B12R0.234 CC(O)CCCOCCOCCI 7a_100012149058_200000718107 [0,2,0,0,0,0|1,0,0]=3 8017 B12R0.234 CC(O)CCCOCCOCCN 34a_100000211614_200000718107 [0,2,0,0,0,0|1,0,0]=3 8018 B12R0.234 CC(O)CCCSCCOCCO 62a_100011215305_200000718107 [0,2,0,0,0,0|1,1,0]=4 8019 B12R0.234 CC(O)CCCSCCOCCO 62a_200000718107_100011215305 [0,2,0,0,0,0|1,1,0]=4 8020 B12R0.234 CC/C=C\CCCCCOC(C)C 34a_100016268722_100000210206 [0,2,0,0,0,0|2,0,0]=4 8021 B12R0.234 CC/C=C\CCCCCOC(C)C 7a_100016268722_100000210206 [0,2,0,0,0,0|2,0,0]=4 8022 B12R0.234 CC/C=C\CCNCCOC(C)C 2230a_100000701111_100015370543 [0,2,0,0,0,0|2,0,0]=4 8023 B12R0.234 CC/C=C\CCNCCOC(C)C 34a_100000701111_100015370543 [0,2,0,0,0,0|2,0,0]=4 8024 B12R0.234 CC/C=C\CCOCCCC(C)C 34a_100000210774_100015370543 [0,2,0,0,0,0|2,0,0]=4 8025 B12R0.234 CC/C=C\CCOCCCC(C)C 34a_100016288707_100011214892 [0,2,0,0,0,0|2,0,0]=4 8026 B12R0.234 CC/C=C\CCOCCCC(C)C 7a_100000210774_100015370543 [0,2,0,0,0,0|2,0,0]=4 8027 B12R0.234 CC/C=C\CCOCCCC(C)C 7a_100016288707_100011214892 [0,2,0,0,0,0|2,0,0]=4 8028 B12R0.234 CC/C=C\CCOCCCC(C)O 34a_100016288707_200000718107 [0,2,0,0,0,0|2,0,0]=4 8029 B12R0.234 CC/C=C\CCOCCCC(C)O 7a_100016288707_200000718107 [0,2,0,0,0,0|2,0,0]=4 8030 B12R0.234 CC/C=C\CCOCCNC(C)C 34a_100000224655_100015370543 [0,2,0,0,0,0|2,0,0]=4 8031 B12R0.234 CC/C=C\CCOCCOC(=O)C 34a_100016288707_100009814007 [0,2,0,0,0,0|1,0,1]=4 8032 B12R0.234 CC/C=C\CCOCCOC(=O)C 7a_100016288707_100009814007 [0,2,0,0,0,0|1,0,1]=4 8033 B12R0.234 CC/C=C\CCOCCOC(C)C 34a_100000211219_100015370543 [0,2,0,0,0,0|1,0,0]=3 8034 B12R0.234 CC/C=C\CCOCCOC(C)C 34a_100016288707_100000211751 [0,2,0,0,0,0|1,0,0]=3 8035 B12R0.234 CC/C=C\CCOCCOC(C)C 7a_100000211219_100015370543 [0,2,0,0,0,0|1,0,0]=3 8036 B12R0.234 CC/C=C\CCOCCOC(C)C 7a_100016288707_100000211751 [0,2,0,0,0,0|1,0,0]=3 8037 B12R0.234 CC/C=C\CCOCCSC(C)C 34a_100016288707_100000730970 [0,2,0,0,0,0|1,1,0]=4 8038 B12R0.234 CC/C=C\CCOCCSC(C)C 34a_200011212901_100015370543 [0,2,0,0,0,0|1,1,0]=4 8039 B12R0.234 CC/C=C\CCOCCSC(C)C 7a_100016288707_100000730970 [0,2,0,0,0,0|1,1,0]=4 8040 B12R0.234 CC/C=C\CCOCCSC(C)C 7a_200011212901_100015370543 [0,2,0,0,0,0|1,1,0]=4 8041 B12R0.234 CC/C=C\CCSCCOC(C)C 62a_100000211751_100015370543 [0,2,0,0,0,0|1,1,0]=4 8042 B12R0.234 CC/C=C\CCSCCOC(C)C 62a_100015370543_100000211751 [0,2,0,0,0,0|1,1,0]=4 8043 B12R0.234 CC/C=C\COCCOCC(C)C 34a_100000703358_100103147603 [0,2,0,0,0,0|1,0,1]=4 8044 B12R0.234 CC/C=C\COCCOCC(C)C 7a_100000703358_100103147603 [0,2,0,0,0,0|1,0,1]=4 8045 B12R0.234 CC/C=C\COCCOCC(F)F 34a_100000704375_100103147603 [0,2,0,0,0,0|1,0,1]=4 8046 B12R0.234 CC/C=C\COCCOCC(F)F 34a_100016268518_200012177212 [0,2,0,0,0,0|1,0,1]=4 8047 B12R0.234 CC/C=C\COCCOCC(F)F 7a_100000704375_100103147603 [0,2,0,0,0,0|1,0,1]=4 8048 B12R0.234 CC=C=CCCOCCOC(C)C 34a_100011020354_100000211751 [0,2,0,0,0,0|1,0,1]=4 8049 B12R0.234 CC=CCCCOCCOC(C)C 34a_100020645299_100000211751 [0,2,0,0,0,0|1,0,1]=4 8050 B12R0.234 CCC#CCCOCCCC(C)C 34a_100000036655_100011214892 [0,2,0,0,0,0|2,0,0]=4 8051 B12R0.234 CCC#CCCOCCCC(C)C 7a_100000036655_100011214892 [0,2,0,0,0,0|2,0,0]=4 8052 B12R0.234 CCC#CCCOCCCC(C)O 34a_100000036655_200000718107 [0,2,0,0,0,0|2,0,0]=4 8053 B12R0.234 CCC#CCCOCCCC(C)O 7a_100000036655_200000718107 [0,2,0,0,0,0|2,0,0]=4 8054 B12R0.234 CCC#CCCOCCOC(=O)C 34a_100000036655_100009814007 [0,2,0,0,0,0|1,0,1]=4 8055 B12R0.234 CCC#CCCOCCOC(=O)C 7a_100000036655_100009814007 [0,2,0,0,0,0|1,0,1]=4 8056 B12R0.234 CCC#CCCOCCOC(C)C 34a_100000036655_100000211751 [0,2,0,0,0,0|1,0,0]=3 8057 B12R0.234 CCC#CCCOCCOC(C)C 7a_100000036655_100000211751 [0,2,0,0,0,0|1,0,0]=3 8058 B12R0.234 CCC#CCCOCCSC(C)C 34a_100000036655_100000730970 [0,2,0,0,0,0|1,1,0]=4 8059 B12R0.234 CCC#CCCOCCSC(C)C 7a_100000036655_100000730970 [0,2,0,0,0,0|1,1,0]=4 8060 B12R0.234 CCC#CCOCCOCC(C)C 34a_100000703358_100009813939 [0,2,0,0,0,0|1,0,1]=4 8061 B12R0.234 CCC#CCOCCOCC(C)C 7a_100000703358_100009813939 [0,2,0,0,0,0|1,0,1]=4 8062 B12R0.234 CCC#CCOCCOCC(F)F 34a_100000032950_200012177212 [0,2,0,0,0,0|1,0,1]=4 8063 B12R0.234 CCC#CCOCCOCC(F)F 34a_100000704375_100009813939 [0,2,0,0,0,0|1,0,1]=4 8064 B12R0.234 CCC#CCOCCOCC(F)F 7a_100000704375_100009813939 [0,2,0,0,0,0|1,0,1]=4 8065 B12R0.234 CCC/C=C/COCCOC(C)C 34a_100016278788_100000211751 [0,2,0,0,0,0|1,0,1]=4 8066 B12R0.234 CCC/C=C/COCCOC(C)C 7a_100016278788_100000211751 [0,2,0,0,0,0|1,0,1]=4 8067 B12R0.234 CCCC#CCOCCOC(C)C 34a_100000034806_100000211751 [0,2,0,0,0,0|1,0,1]=4 8068 B12R0.234 CCCC#CCOCCOC(C)C 7a_100000034806_100000211751 [0,2,0,0,0,0|1,0,1]=4 8069 B12R0.234 CCCCC/C=C\CCOC(C)C 34a_100016277358_100000210206 [0,2,0,0,0,0|2,0,0]=4 8070 B12R0.234 CCCCC/C=C\CCOC(C)C 7a_100016277358_100000210206 [0,2,0,0,0,0|2,0,0]=4 8071 B12R0.234 CCCCCC#CCCOC(C)C 34a_200000042877_100000210206 [0,2,0,0,0,0|2,0,0]=4 8072 B12R0.234 CCCCCC#CCCOC(C)C 7a_200000042877_100000210206 [0,2,0,0,0,0|2,0,0]=4 8073 B12R0.234 CCCCCCCCCOC(C)C 34a_100000210712_100000210206 [0,2,0,0,0,0|2,0,0]=4 8074 B12R0.234 CCCCCCCCCOC(C)C 34a_100000212225_100011214924 [0,2,0,0,0,0|2,0,0]=4 8075 B12R0.234 CCCCCCCCCOC(C)C 7a_100000210712_100000210206 [0,2,0,0,0,0|2,0,0]=4 8076 B12R0.234 CCCCCCCCOCC(=O)C 1458a_100000759886_200000210301 [0,2,0,0,0,0|2,0,0]=4 8077 B12R0.234 CCCCCCCCOCC(=O)C 34a_100000211253_100000210759 [0,2,0,0,0,0|2,0,0]=4 8078 B12R0.234 CCCCCCCCOCC(=O)[13CH3] 1458a_100000759886_200025704644 [0,2,0,0,0,0|2,0,0]=4 8079 B12R0.234 CCCCCCCCOCC(C)Br 34a_100012180447_100000210759 [0,2,0,0,0,0|2,0,0]=4 8080 B12R0.234 CCCCCCCCOCC(C)C 34a_100000210232_100000210624 [0,2,0,0,0,0|2,0,0]=4 8081 B12R0.234 CCCCCCCCOCC(C)C 34a_100000210257_100000210759 [0,2,0,0,0,0|2,0,0]=4 8082 B12R0.234 CCCCCCCCOCC(C)C 7a_100000210232_100000210760 [0,2,0,0,0,0|2,0,0]=4 8083 B12R0.234 CCCCCCCCOCC(C)F 34a_100015925927_100000210759 [0,2,0,0,0,0|2,0,0]=4 8084 B12R0.234 CCCCCCCCOCC(C)O 34a_100000210232_100011218427 [0,2,0,0,0,0|2,0,0]=4 8085 B12R0.234 CCCCCCCCOCC(C)O 7a_100000210232_100011218427 [0,2,0,0,0,0|2,0,0]=4 8086 B12R0.234 CCCCCCCCOCC(F)F 34a_100000210232_100011934356 [0,2,0,0,0,0|2,0,0]=4 8087 B12R0.234 CCCCCCCCOCC(F)F 34a_100000743014_100000210759 [0,2,0,0,0,0|2,0,0]=4 8088 B12R0.234 CCCCCCCCOCC(F)F 7a_100000210232_100011934356 [0,2,0,0,0,0|2,0,0]=4 8089 B12R0.234 CCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210759 [0,2,0,0,0,0|2,0,0]=4 8090 B12R0.234 CCCCCCCCOC[C@@H](C)N 34a_100000737577_100000210759 [0,2,0,0,0,0|2,0,0]=4 8091 B12R0.234 CCCCCCCCOC[C@@H](C)O 34a_100000210232_100009817552 [0,2,0,0,0,0|2,0,0]=4 8092 B12R0.234 CCCCCCCCOC[C@@H](C)O 7a_100000210232_100009817552 [0,2,0,0,0,0|2,0,0]=4 8093 B12R0.234 CCCCCCCNCOC(C)C 2230a_100000229938_100000709892 [0,2,0,0,0,0|2,0,0]=4 8094 B12R0.234 CCCCCCCOCOC(C)C 34a_100000210272_100000709892 [0,2,0,0,0,0|2,0,0]=4 8095 B12R0.234 CCCCCCCSCOC(C)C 62a_100000210614_100000709892 [0,2,0,0,0,0|2,0,0]=4 8096 B12R0.234 CCCCCCCSCOC(C)C 62a_100000709892_100000210316 [0,2,0,0,0,0|2,0,0]=4 8097 B12R0.234 CCCCCCNCCOC(C)C 2230a_100000210581_100000211751 [0,2,0,0,0,0|2,0,0]=4 8098 B12R0.234 CCCCCCNCCOC(C)C 2230a_100000701111_100000210314 [0,2,0,0,0,0|2,0,0]=4 8099 B12R0.234 CCCCCCNCCOC(C)C 34a_100000701111_100000210314 [0,2,0,0,0,0|2,0,0]=4 8100 B12R0.234 CCCCCCOCCCC(C)C 34a_100000210259_100011214892 [0,2,0,0,0,0|2,0,0]=4 8101 B12R0.234 CCCCCCOCCCC(C)C 34a_100000210774_100000210314 [0,2,0,0,0,0|2,0,0]=4 8102 B12R0.234 CCCCCCOCCCC(C)C 7a_100000210259_100011214892 [0,2,0,0,0,0|2,0,0]=4 8103 B12R0.234 CCCCCCOCCCC(C)C 7a_100000210774_100000210314 [0,2,0,0,0,0|2,0,0]=4 8104 B12R0.234 CCCCCCOCCCC(C)O 34a_100000210259_200000718107 [0,2,0,0,0,0|2,0,0]=4 8105 B12R0.234 CCCCCCOCCCC(C)O 7a_100000210259_200000718107 [0,2,0,0,0,0|2,0,0]=4 8106 B12R0.234 CCCCCCOCCNC(C)C 34a_100000224655_100000210314 [0,2,0,0,0,0|2,0,0]=4 8107 B12R0.234 CCCCCCOCCOC(=O)C 34a_100000210259_100009814007 [0,2,0,0,0,0|1,0,1]=4 8108 B12R0.234 CCCCCCOCCOC(=O)C 7a_100000210259_100009814007 [0,2,0,0,0,0|1,0,1]=4 8109 B12R0.234 CCCCCCOCCOC(C)C 34a_100000210259_100000211751 [0,2,0,0,0,0|1,0,0]=3 8110 B12R0.234 CCCCCCOCCOC(C)C 34a_100000211219_100000210314 [0,2,0,0,0,0|1,0,0]=3 8111 B12R0.234 CCCCCCOCCOC(C)C 34a_100000691444_100000210206 [0,2,0,0,0,0|1,0,0]=3 8112 B12R0.234 CCCCCCOCCOC(C)C 7a_100000210259_100000211751 [0,2,0,0,0,0|1,0,0]=3 8113 B12R0.234 CCCCCCOCCOC(C)C 7a_100000211219_100000210314 [0,2,0,0,0,0|1,0,0]=3 8114 B12R0.234 CCCCCCOCCOC(C)C 7a_100000691444_100000210206 [0,2,0,0,0,0|1,0,0]=3 8115 B12R0.234 CCCCCCOCCSC(C)C 34a_100000210259_100000730970 [0,2,0,0,0,0|1,1,0]=4 8116 B12R0.234 CCCCCCOCCSC(C)C 34a_200011212901_100000210314 [0,2,0,0,0,0|1,1,0]=4 8117 B12R0.234 CCCCCCOCCSC(C)C 7a_100000210259_100000730970 [0,2,0,0,0,0|1,1,0]=4 8118 B12R0.234 CCCCCCOCCSC(C)C 7a_200011212901_100000210314 [0,2,0,0,0,0|1,1,0]=4 8119 B12R0.234 CCCCCCSCCOC(C)C 62a_100000210314_100000211751 [0,2,0,0,0,0|1,1,0]=4 8120 B12R0.234 CCCCCCSCCOC(C)C 62a_100000211751_100000210757 [0,2,0,0,0,0|1,1,0]=4 8121 B12R0.234 CCCCCNCCCOC(C)C 2230a_100000737246_100000210326 [0,2,0,0,0,0|2,0,0]=4 8122 B12R0.234 CCCCCNCCCOC(C)C 34a_100000737246_100000718602 [0,2,0,0,0,0|2,0,0]=4 8123 B12R0.234 CCCCCNCCOCC(C)C 34a_100000224656_100000210624 [0,2,0,0,0,0|2,0,0]=4 8124 B12R0.234 CCCCCNCCOCC(C)O 34a_100000224656_100011218427 [0,2,0,0,0,0|2,0,0]=4 8125 B12R0.234 CCCCCNCCOCC(F)F 2230a_100000209983_200012177212 [0,2,0,0,0,0|2,0,0]=4 8126 B12R0.234 CCCCCNCCOCC(F)F 34a_100000224656_100011934356 [0,2,0,0,0,0|2,0,0]=4 8127 B12R0.234 CCCCCNCCOC[C@@H](C)O 34a_100000224656_100009817552 [0,2,0,0,0,0|2,0,0]=4 8128 B12R0.234 CCCCCOCCCCC(=O)C 34a_100000210253_100009817362 [0,2,0,0,0,0|2,0,0]=4 8129 B12R0.234 CCCCCOCCCCC(=O)C 7a_100000210253_100000735457 [0,2,0,0,0,0|2,0,0]=4 8130 B12R0.234 CCCCCOCCCCC(C)C 34a_100000210253_100011216152 [0,2,0,0,0,0|2,0,0]=4 8131 B12R0.234 CCCCCOCCCCC(C)C 34a_100011214890_100000718602 [0,2,0,0,0,0|2,0,0]=4 8132 B12R0.234 CCCCCOCCCCC(C)C 7a_100000210253_100011216152 [0,2,0,0,0,0|2,0,0]=4 8133 B12R0.234 CCCCCOCCCCC(C)C 7a_100011214890_100000210326 [0,2,0,0,0,0|2,0,0]=4 8134 B12R0.234 CCCCCOCCCNC(C)C 34a_100000182298_100000718602 [0,2,0,0,0,0|2,0,0]=4 8135 B12R0.234 CCCCCOCCCOC(=O)C 34a_100000210253_100000042594 [0,2,0,0,0,0|1,0,1]=4 8136 B12R0.234 CCCCCOCCCOC(=O)C 7a_100000210253_100000042594 [0,2,0,0,0,0|1,0,1]=4 8137 B12R0.234 CCCCCOCCCOC(=S)C 34a_100000210253_200135323944 [0,2,0,0,0,0|1,0,1]=4 8138 B12R0.234 CCCCCOCCCOC(=S)C 7a_100000210253_200135323944 [0,2,0,0,0,0|1,0,1]=4 8139 B12R0.234 CCCCCOCCNCC(C)C 34a_100015185251_100000718602 [0,2,0,0,0,0|2,0,0]=4 8140 B12R0.234 CCCCCOCCOCC(=O)N 34a_100000210253_100000076697 [0,2,0,0,0,0|1,0,1]=4 8141 B12R0.234 CCCCCOCCOCC(=O)N 34a_100011215259_100000187820 [0,2,0,0,0,0|1,0,1]=4 8142 B12R0.234 CCCCCOCCOCC(=O)N 7a_100000210253_100000076697 [0,2,0,0,0,0|1,0,1]=4 8143 B12R0.234 CCCCCOCCOCC(=O)N 7a_100011215259_100000187820 [0,2,0,0,0,0|1,0,1]=4 8144 B12R0.234 CCCCCOCCOCC(=O)[O-] 34a_100011215259_100020667443 [0,2,0,0,0,0|1,0,1]=4 8145 B12R0.234 CCCCCOCCOCC(C)C 34a_100000703358_100000718602 [0,2,0,0,0,0|1,0,0]=3 8146 B12R0.234 CCCCCOCCOCC(C)C 34a_100011215259_100000210624 [0,2,0,0,0,0|1,0,0]=3 8147 B12R0.234 CCCCCOCCOCC(C)C 7a_100000703358_100000210326 [0,2,0,0,0,0|1,0,0]=3 8148 B12R0.234 CCCCCOCCOCC(C)C 7a_100011215259_100000210760 [0,2,0,0,0,0|1,0,0]=3 8149 B12R0.234 CCCCCOCCOCC(C)O 34a_100011215259_100011218427 [0,2,0,0,0,0|1,0,0]=3 8150 B12R0.234 CCCCCOCCOCC(C)O 7a_100011215259_100011218427 [0,2,0,0,0,0|1,0,0]=3 8151 B12R0.234 CCCCCOCCOCC(F)F 34a_100000210253_200012177212 [0,2,0,0,0,0|1,0,0]=3 8152 B12R0.234 CCCCCOCCOCC(F)F 34a_100000704375_100000718602 [0,2,0,0,0,0|1,0,0]=3 8153 B12R0.234 CCCCCOCCOCC(F)F 34a_100011215259_100011934356 [0,2,0,0,0,0|1,0,0]=3 8154 B12R0.234 CCCCCOCCOCC(F)F 7a_100000210253_200012177212 [0,2,0,0,0,0|1,0,0]=3 8155 B12R0.234 CCCCCOCCOCC(F)F 7a_100000704375_100000210326 [0,2,0,0,0,0|1,0,0]=3 8156 B12R0.234 CCCCCOCCOCC(F)F 7a_100011215259_100011934356 [0,2,0,0,0,0|1,0,0]=3 8157 B12R0.234 CCCCCOCCOC[C@@H](C)O 34a_100011215259_100009817552 [0,2,0,0,0,0|1,0,0]=3 8158 B12R0.234 CCCCCOCCOC[C@@H](C)O 7a_100011215259_100009817552 [0,2,0,0,0,0|1,0,0]=3 8159 B12R0.234 CCCCCOCCOC[N+](=O)[O-] 34a_100011215259_100000761209 [0,2,0,0,0,0|2,0,0]=4 8160 B12R0.234 CCCCCOCCSCC(C)C 34a_200000230437_100000718602 [0,2,0,0,0,0|1,1,0]=4 8161 B12R0.234 CCCCCOCCSCC(C)C 7a_200000230437_100000210326 [0,2,0,0,0,0|1,1,0]=4 8162 B12R0.234 CCCCCSCCOCC(F)F 62a_100000210326_200012177212 [0,2,0,0,0,0|1,1,0]=4 8163 B12R0.234 CCCCCSCCOCC(F)F 62a_200012177212_100000210326 [0,2,0,0,0,0|1,1,0]=4 8164 B12R0.234 CCCCNCCCCOC(C)C 34a_200011216965_100000210206 [0,2,0,0,0,0|2,0,0]=4 8165 B12R0.234 CCCCOCCCCOC(C)C 34a_200000760531_100000210206 [0,2,0,0,0,0|2,0,0]=4 8166 B12R0.234 CCCCOCCCCOC(C)C 7a_200000760531_100000210206 [0,2,0,0,0,0|2,0,0]=4 8167 B12R0.234 CCCCOCNCCOC(C)C 2230a_100000701111_100011995733 [0,2,0,0,0,0|2,0,0]=4 8168 B12R0.234 CCCCOCNCCOC(C)C 34a_100000701111_100011995733 [0,2,0,0,0,0|2,0,0]=4 8169 B12R0.234 CCCCOCOCCCC(C)C 34a_100000210774_100011995733 [0,2,0,0,0,0|2,0,0]=4 8170 B12R0.234 CCCCOCOCCNC(C)C 34a_100000224655_100011995733 [0,2,0,0,0,0|2,0,0]=4 8171 B12R0.234 CCCCOCOCCOC(=O)C 34a_100000210227_100000076355 [0,2,0,0,0,0|1,0,1]=4 8172 B12R0.234 CCCCOCOCCOC(C)C 34a_100000211219_100011995733 [0,2,0,0,0,0|1,0,0]=3 8173 B12R0.234 CCCCOCOCCSC(C)C 34a_200011212901_100011995733 [0,2,0,0,0,0|1,1,0]=4 8174 B12R0.234 CCCCOCSCCOC(C)C 62a_100000211751_100011995733 [0,2,0,0,0,0|1,1,0]=4 8175 B12R0.234 CCCCOCSCCOC(C)C 62a_100011995733_100000211751 [0,2,0,0,0,0|1,1,0]=4 8176 B12R0.234 CCCCSCOCCOC(=O)C 62a_100000076355_100000210210 [0,2,0,0,0,0|1,0,1]=4 8177 B12R0.234 CCCCSCOCCOC(=O)C 62a_100000210211_100000076355 [0,2,0,0,0,0|1,0,1]=4 8178 B12R0.234 CCCOCCCCCNC(C)C 34a_100011629493_100000210303 [0,2,0,0,0,0|2,0,0]=4 8179 B12R0.234 CCCOCCCCCOC(=O)C 34a_100000210258_100000033007 [0,2,0,0,0,0|1,0,1]=4 8180 B12R0.234 CCCOCCCNCOC(C)C 2230a_100011217757_100000709892 [0,2,0,0,0,0|2,0,0]=4 8181 B12R0.234 CCCOCCCNCOC(C)C 34a_100011217757_100000709892 [0,2,0,0,0,0|2,0,0]=4 8182 B12R0.234 CCCOCCNCCCC(C)C 2230a_100161115042_100011214892 [0,2,0,0,0,0|2,0,0]=4 8183 B12R0.234 CCCOCCNCCCC(C)C 2230a_200000737386_100011215938 [0,2,0,0,0,0|2,0,0]=4 8184 B12R0.234 CCCOCCNCCCC(C)C 34a_100161115042_100011214892 [0,2,0,0,0,0|2,0,0]=4 8185 B12R0.234 CCCOCCNCCCC(C)C 34a_200000737386_100011215938 [0,2,0,0,0,0|2,0,0]=4 8186 B12R0.234 CCCOCCNCCCC(C)O 2230a_100161115042_200000718107 [0,2,0,0,0,0|2,0,0]=4 8187 B12R0.234 CCCOCCNCCCC(C)O 34a_100161115042_200000718107 [0,2,0,0,0,0|2,0,0]=4 8188 B12R0.234 CCCOCCNCCOC(=O)C 34a_100161115042_100009814007 [0,2,0,0,0,0|1,0,1]=4 8189 B12R0.234 CCCOCCNCCOC(C)C 2230a_100000701111_100011215938 [0,2,0,0,0,0|1,0,0]=3 8190 B12R0.234 CCCOCCNCCOC(C)C 2230a_100161115042_100000211751 [0,2,0,0,0,0|1,0,0]=3 8191 B12R0.234 CCCOCCNCCOC(C)C 34a_100000701111_100011215938 [0,2,0,0,0,0|1,0,0]=3 8192 B12R0.234 CCCOCCNCCOC(C)C 34a_100161115042_100000211751 [0,2,0,0,0,0|1,0,0]=3 8193 B12R0.234 CCCOCCNCCSC(C)C 2230a_100000731138_100011215938 [0,2,0,0,0,0|1,1,0]=4 8194 B12R0.234 CCCOCCNCCSC(C)C 2230a_100161115042_100000730970 [0,2,0,0,0,0|1,1,0]=4 8195 B12R0.234 CCCOCCNCCSC(C)C 34a_100000731138_100011215938 [0,2,0,0,0,0|1,1,0]=4 8196 B12R0.234 CCCOCCNCCSC(C)C 34a_100161115042_100000730970 [0,2,0,0,0,0|1,1,0]=4 8197 B12R0.234 CCCOCCOCCC=C(C)C 34a_100000752267_100011217483 [0,2,0,0,0,0|1,0,1]=4 8198 B12R0.234 CCCOCCOCCC=C(C)C 7a_100000752267_100011217483 [0,2,0,0,0,0|1,0,1]=4 8199 B12R0.234 CCCOCCOCCCC(=O)C 34a_100000752267_100000685027 [0,2,0,0,0,0|1,0,1]=4 8200 B12R0.234 CCCOCCOCCCC(=O)C 34a_100000759063_100011215938 [0,2,0,0,0,0|1,0,1]=4 8201 B12R0.234 CCCOCCOCCCC(=O)C 7a_100000752267_100011215641 [0,2,0,0,0,0|1,0,1]=4 8202 B12R0.234 CCCOCCOCCCC(=O)C 7a_100000759063_100011215938 [0,2,0,0,0,0|1,0,1]=4 8203 B12R0.234 CCCOCCOCCCC(C)C 34a_100000210774_100011215938 [0,2,0,0,0,0|1,0,0]=3 8204 B12R0.234 CCCOCCOCCCC(C)C 34a_100000752267_100011214892 [0,2,0,0,0,0|1,0,0]=3 8205 B12R0.234 CCCOCCOCCCC(C)C 7a_100000210774_100011215938 [0,2,0,0,0,0|1,0,0]=3 8206 B12R0.234 CCCOCCOCCCC(C)C 7a_100000752267_100011214892 [0,2,0,0,0,0|1,0,0]=3 8207 B12R0.234 CCCOCCOCCCC(C)O 34a_100000752267_200000718107 [0,2,0,0,0,0|1,0,0]=3 8208 B12R0.234 CCCOCCOCCCC(C)O 7a_100000752267_200000718107 [0,2,0,0,0,0|1,0,0]=3 8209 B12R0.234 CCCOCCOCCCN(C)C 7a_100000752267_100000757444 [0,2,0,0,0,0|2,0,0]=4 8210 B12R0.234 CCCOCCOCCNC(=O)C 11a_200011904461_100015343762 [0,2,0,0,0,0|1,0,1]=4 8211 B12R0.234 CCCOCCOCCNC(=O)C 1626a_200011904461_100015343762 [0,2,0,0,0,0|1,0,1]=4 8212 B12R0.234 CCCOCCOCCNC(=O)C 240690a_200011904461_100015343762 [0,2,0,0,0,0|1,0,1]=4 8213 B12R0.234 CCCOCCOCCNC(=O)C 34a_100000158858_100011215938 [0,2,0,0,0,0|1,0,1]=4 8214 B12R0.234 CCCOCCOCCNC(=O)C 7a_100000752267_100000189650 [0,2,0,0,0,0|1,0,1]=4 8215 B12R0.234 CCCOCCOCCNC(C)C 2230a_200011904461_100000210206 [0,2,0,0,0,0|1,0,0]=3 8216 B12R0.234 CCCOCCOCCNC(C)C 34a_100000224655_100011215938 [0,2,0,0,0,0|1,0,0]=3 8217 B12R0.234 CCCOCCOCCNC(C)C 34a_200011904461_100000210206 [0,2,0,0,0,0|1,0,0]=3 8218 B12R0.234 CCCOCCOCCOC(=O)C 34a_100000210258_200000083610 [0,2,0,0,0,0|0,0,1]=3 8219 B12R0.234 CCCOCCOCCOC(=O)C 34a_100000752267_100009814007 [0,2,0,0,0,0|0,0,1]=3 8220 B12R0.234 CCCOCCOCCOC(=O)C 7a_100000752267_100009814007 [0,2,0,0,0,0|0,0,1]=3 8221 B12R0.234 CCCOCCOCCOC(=O)N 34a_100000752267_200011214921 [0,2,0,0,0,0|1,0,1]=4 8222 B12R0.234 CCCOCCOCCOC(=O)N 7a_100000752267_200011214921 [0,2,0,0,0,0|1,0,1]=4 8223 B12R0.234 CCCOCCOCCOC(=O)N 7a_100000766696_100011215938 [0,2,0,0,0,0|1,0,1]=4 8224 B12R0.234 CCCOCCOCCOC(C)C 34a_100000211219_100011215938 [0,2,0,0,0,0|0,0,0]=2 8225 B12R0.234 CCCOCCOCCOC(C)C 34a_100000752267_100000211751 [0,2,0,0,0,0|0,0,0]=2 8226 B12R0.234 CCCOCCOCCOC(C)C 7a_100000211219_100011215938 [0,2,0,0,0,0|0,0,0]=2 8227 B12R0.234 CCCOCCOCCOC(C)C 7a_100000752267_100000211751 [0,2,0,0,0,0|0,0,0]=2 8228 B12R0.234 CCCOCCOCCSC(C)C 34a_100000752267_100000730970 [0,2,0,0,0,0|0,1,0]=3 8229 B12R0.234 CCCOCCOCCSC(C)C 34a_200011212901_100011215938 [0,2,0,0,0,0|0,1,0]=3 8230 B12R0.234 CCCOCCOCCSC(C)C 7a_100000752267_100000730970 [0,2,0,0,0,0|0,1,0]=3 8231 B12R0.234 CCCOCCOCCSC(C)C 7a_200011212901_100011215938 [0,2,0,0,0,0|0,1,0]=3 8232 B12R0.234 CCCOCCSCCCC(C)C 62a_100011214892_100011215938 [0,2,0,0,0,0|1,1,0]=4 8233 B12R0.234 CCCOCCSCCCC(C)C 62a_100011215938_100011214892 [0,2,0,0,0,0|1,1,0]=4 8234 B12R0.234 CCCOCCSCCCC(C)O 62a_100011215938_200000718107 [0,2,0,0,0,0|1,1,0]=4 8235 B12R0.234 CCCOCCSCCCC(C)O 62a_200000718107_100011215938 [0,2,0,0,0,0|1,1,0]=4 8236 B12R0.234 CCCOCCSCCOC(=O)C 62a_100009814007_100011215938 [0,2,0,0,0,0|0,1,1]=4 8237 B12R0.234 CCCOCCSCCOC(=O)C 62a_100011215938_100009814007 [0,2,0,0,0,0|0,1,1]=4 8238 B12R0.234 CCCOCCSCCOC(C)C 62a_100000211751_100011215938 [0,2,0,0,0,0|0,1,0]=3 8239 B12R0.234 CCCOCCSCCOC(C)C 62a_100011215938_100000211751 [0,2,0,0,0,0|0,1,0]=3 8240 B12R0.234 CCCOCCSCCSC(C)C 62a_100000730970_100011215938 [0,2,0,0,0,0|0,2,0]=4 8241 B12R0.234 CCCOCCSCCSC(C)C 62a_100011215938_100000730970 [0,2,0,0,0,0|0,2,0]=4 8242 B12R0.234 CCCSCCNCCOC(C)C 2230a_100020603323_100000211751 [0,2,0,0,0,0|1,1,0]=4 8243 B12R0.234 CCCSCCOCCCC(C)C 34a_200000230433_100011214892 [0,2,0,0,0,0|1,1,0]=4 8244 B12R0.234 CCCSCCOCCCC(C)C 7a_200000230433_100011214892 [0,2,0,0,0,0|1,1,0]=4 8245 B12R0.234 CCCSCCOCCCC(C)O 34a_200000230433_200000718107 [0,2,0,0,0,0|1,1,0]=4 8246 B12R0.234 CCCSCCOCCCC(C)O 7a_200000230433_200000718107 [0,2,0,0,0,0|1,1,0]=4 8247 B12R0.234 CCCSCCOCCOC(=O)C 34a_200000230433_100009814007 [0,2,0,0,0,0|0,1,1]=4 8248 B12R0.234 CCCSCCOCCOC(=O)C 62a_100000210303_200000083610 [0,2,0,0,0,0|0,1,1]=4 8249 B12R0.234 CCCSCCOCCOC(=O)C 62a_200000083610_100000210303 [0,2,0,0,0,0|0,1,1]=4 8250 B12R0.234 CCCSCCOCCOC(=O)C 7a_200000230433_100009814007 [0,2,0,0,0,0|0,1,1]=4 8251 B12R0.234 CCCSCCOCCOC(C)C 34a_200000230433_100000211751 [0,2,0,0,0,0|0,1,0]=3 8252 B12R0.234 CCCSCCOCCOC(C)C 7a_200000230433_100000211751 [0,2,0,0,0,0|0,1,0]=3 8253 B12R0.234 CCCSCCOCCSC(C)C 34a_200000230433_100000730970 [0,2,0,0,0,0|0,2,0]=4 8254 B12R0.234 CCCSCCOCCSC(C)C 7a_200000230433_100000730970 [0,2,0,0,0,0|0,2,0]=4 8255 B12R0.234 CCNCCOCCOCC(=O)O 269956a_100009854275_100000210202 [0,2,0,0,0,0|1,0,1]=4 8256 B12R0.234 CCOCCCCCCCC(C)C 34a_200000210741_100000210202 [0,2,0,0,0,0|2,0,0]=4 8257 B12R0.234 CCOCCCCCCCC(C)C 7a_200000210741_100000210202 [0,2,0,0,0,0|2,0,0]=4 8258 B12R0.234 CCOCCCNCCCC(C)C 2230a_100000210961_100011214892 [0,2,0,0,0,0|2,0,0]=4 8259 B12R0.234 CCOCCCNCCCC(C)C 2230a_200000737386_100012232248 [0,2,0,0,0,0|2,0,0]=4 8260 B12R0.234 CCOCCCNCCCC(C)C 34a_100000210961_100011214892 [0,2,0,0,0,0|2,0,0]=4 8261 B12R0.234 CCOCCCNCCCC(C)C 34a_200000737386_100012232248 [0,2,0,0,0,0|2,0,0]=4 8262 B12R0.234 CCOCCCNCCCC(C)O 2230a_100000210961_200000718107 [0,2,0,0,0,0|2,0,0]=4 8263 B12R0.234 CCOCCCNCCCC(C)O 34a_100000210961_200000718107 [0,2,0,0,0,0|2,0,0]=4 8264 B12R0.234 CCOCCCNCCOC(=O)C 34a_100000210961_100009814007 [0,2,0,0,0,0|1,0,1]=4 8265 B12R0.234 CCOCCCNCCOC(C)C 2230a_100000210961_100000211751 [0,2,0,0,0,0|1,0,0]=3 8266 B12R0.234 CCOCCCNCCOC(C)C 2230a_100000701111_100012232248 [0,2,0,0,0,0|1,0,0]=3 8267 B12R0.234 CCOCCCNCCOC(C)C 34a_100000210961_100000211751 [0,2,0,0,0,0|1,0,0]=3 8268 B12R0.234 CCOCCCNCCOC(C)C 34a_100000701111_100012232248 [0,2,0,0,0,0|1,0,0]=3 8269 B12R0.234 CCOCCCNCCSC(C)C 2230a_100000210961_100000730970 [0,2,0,0,0,0|1,1,0]=4 8270 B12R0.234 CCOCCCNCCSC(C)C 2230a_100000731138_100012232248 [0,2,0,0,0,0|1,1,0]=4 8271 B12R0.234 CCOCCCNCCSC(C)C 34a_100000210961_100000730970 [0,2,0,0,0,0|1,1,0]=4 8272 B12R0.234 CCOCCCNCCSC(C)C 34a_100000731138_100012232248 [0,2,0,0,0,0|1,1,0]=4 8273 B12R0.234 CCOCCCOCCC=C(C)C 34a_100000757476_100011217483 [0,2,0,0,0,0|1,0,1]=4 8274 B12R0.234 CCOCCCOCCC=C(C)C 7a_100000757476_100011217483 [0,2,0,0,0,0|1,0,1]=4 8275 B12R0.234 CCOCCCOCCCC(=O)C 34a_100000757476_100000685027 [0,2,0,0,0,0|1,0,1]=4 8276 B12R0.234 CCOCCCOCCCC(=O)C 34a_100000759063_100012232248 [0,2,0,0,0,0|1,0,1]=4 8277 B12R0.234 CCOCCCOCCCC(=O)C 7a_100000757476_100011215641 [0,2,0,0,0,0|1,0,1]=4 8278 B12R0.234 CCOCCCOCCCC(=O)C 7a_100000759063_100012232248 [0,2,0,0,0,0|1,0,1]=4 8279 B12R0.234 CCOCCCOCCCC(C)C 34a_100000210774_100012232248 [0,2,0,0,0,0|1,0,0]=3 8280 B12R0.234 CCOCCCOCCCC(C)C 34a_100000757476_100011214892 [0,2,0,0,0,0|1,0,0]=3 8281 B12R0.234 CCOCCCOCCCC(C)C 7a_100000210774_100012232248 [0,2,0,0,0,0|1,0,0]=3 8282 B12R0.234 CCOCCCOCCCC(C)C 7a_100000757476_100011214892 [0,2,0,0,0,0|1,0,0]=3 8283 B12R0.234 CCOCCCOCCCC(C)O 34a_100000757476_200000718107 [0,2,0,0,0,0|1,0,0]=3 8284 B12R0.234 CCOCCCOCCCC(C)O 7a_100000757476_200000718107 [0,2,0,0,0,0|1,0,0]=3 8285 B12R0.234 CCOCCCOCCCN(C)C 7a_100000757476_100000757444 [0,2,0,0,0,0|2,0,0]=4 8286 B12R0.234 CCOCCCOCCNC(=O)C 34a_100000158858_100012232248 [0,2,0,0,0,0|1,0,1]=4 8287 B12R0.234 CCOCCCOCCNC(=O)C 7a_100000757476_100000189650 [0,2,0,0,0,0|1,0,1]=4 8288 B12R0.234 CCOCCCOCCNC(C)C 34a_100000224655_100012232248 [0,2,0,0,0,0|1,0,0]=3 8289 B12R0.234 CCOCCCOCCOC(=O)C 34a_100000757476_100009814007 [0,2,0,0,0,0|0,0,1]=3 8290 B12R0.234 CCOCCCOCCOC(=O)C 7a_100000757476_100009814007 [0,2,0,0,0,0|0,0,1]=3 8291 B12R0.234 CCOCCCOCCOC(=O)N 34a_100000757476_200011214921 [0,2,0,0,0,0|1,0,1]=4 8292 B12R0.234 CCOCCCOCCOC(=O)N 7a_100000757476_200011214921 [0,2,0,0,0,0|1,0,1]=4 8293 B12R0.234 CCOCCCOCCOC(=O)N 7a_100000766696_100012232248 [0,2,0,0,0,0|1,0,1]=4 8294 B12R0.234 CCOCCCOCCOC(C)C 34a_100000211219_100012232248 [0,2,0,0,0,0|0,0,0]=2 8295 B12R0.234 CCOCCCOCCOC(C)C 34a_100000757476_100000211751 [0,2,0,0,0,0|0,0,0]=2 8296 B12R0.234 CCOCCCOCCOC(C)C 7a_100000211219_100012232248 [0,2,0,0,0,0|0,0,0]=2 8297 B12R0.234 CCOCCCOCCOC(C)C 7a_100000757476_100000211751 [0,2,0,0,0,0|0,0,0]=2 8298 B12R0.234 CCOCCCOCCSC(C)C 34a_100000757476_100000730970 [0,2,0,0,0,0|0,1,0]=3 8299 B12R0.234 CCOCCCOCCSC(C)C 34a_200011212901_100012232248 [0,2,0,0,0,0|0,1,0]=3 8300 B12R0.234 CCOCCCOCCSC(C)C 7a_100000757476_100000730970 [0,2,0,0,0,0|0,1,0]=3 8301 B12R0.234 CCOCCCOCCSC(C)C 7a_200011212901_100012232248 [0,2,0,0,0,0|0,1,0]=3 8302 B12R0.234 CCOCCCSCCCC(C)C 62a_100011214892_100012232248 [0,2,0,0,0,0|1,1,0]=4 8303 B12R0.234 CCOCCCSCCCC(C)C 62a_100012232248_100011214892 [0,2,0,0,0,0|1,1,0]=4 8304 B12R0.234 CCOCCCSCCCC(C)O 62a_100012232248_200000718107 [0,2,0,0,0,0|1,1,0]=4 8305 B12R0.234 CCOCCCSCCCC(C)O 62a_200000718107_100012232248 [0,2,0,0,0,0|1,1,0]=4 8306 B12R0.234 CCOCCCSCCOC(=O)C 62a_100009814007_100012232248 [0,2,0,0,0,0|0,1,1]=4 8307 B12R0.234 CCOCCCSCCOC(=O)C 62a_100012232248_100009814007 [0,2,0,0,0,0|0,1,1]=4 8308 B12R0.234 CCOCCCSCCOC(C)C 62a_100000211751_100012232248 [0,2,0,0,0,0|0,1,0]=3 8309 B12R0.234 CCOCCCSCCOC(C)C 62a_100012232248_100000211751 [0,2,0,0,0,0|0,1,0]=3 8310 B12R0.234 CCOCCCSCCSC(C)C 62a_100000730970_100012232248 [0,2,0,0,0,0|0,2,0]=4 8311 B12R0.234 CCOCCCSCCSC(C)C 62a_100012232248_100000730970 [0,2,0,0,0,0|0,2,0]=4 8312 B12R0.234 CCOCCNCCCCC(=O)C 34a_102516460346_100009817362 [0,2,0,0,0,0|2,0,0]=4 8313 B12R0.234 CCOCCNCCCCC(C)C 2230a_102516460346_100011216152 [0,2,0,0,0,0|2,0,0]=4 8314 B12R0.234 CCOCCNCCCCC(C)C 34a_102516460346_100011216152 [0,2,0,0,0,0|2,0,0]=4 8315 B12R0.234 CCOCCNCCCOC(=O)C 34a_102516460346_100000042594 [0,2,0,0,0,0|1,0,1]=4 8316 B12R0.234 CCOCCNCCCOC(=S)C 2230a_102516460346_200135323944 [0,2,0,0,0,0|1,0,1]=4 8317 B12R0.234 CCOCCNCCCOC(=S)C 34a_102516460346_200135323944 [0,2,0,0,0,0|1,0,1]=4 8318 B12R0.234 CCOCCNCCCOC(C)C 2230a_100000737246_100011215890 [0,2,0,0,0,0|1,0,0]=3 8319 B12R0.234 CCOCCNCCCOC(C)C 34a_100000737246_100000210147 [0,2,0,0,0,0|1,0,0]=3 8320 B12R0.234 CCOCCNCCOCC(=O)N 2230a_102516460346_100000076697 [0,2,0,0,0,0|1,0,1]=4 8321 B12R0.234 CCOCCNCCOCC(=O)N 34a_102516460346_100000076697 [0,2,0,0,0,0|1,0,1]=4 8322 B12R0.234 CCOCCNCCOCC(=O)O 269956a_100000700818_100000210147 [0,2,0,0,0,0|1,0,1]=4 8323 B12R0.234 CCOCCNCCOCC(F)F 2230a_102516460346_200012177212 [0,2,0,0,0,0|1,0,0]=3 8324 B12R0.234 CCOCCNCCOCC(F)F 34a_102516460346_200012177212 [0,2,0,0,0,0|1,0,0]=3 8325 B12R0.234 CCOCCOCCCCB(O)O 34a_100000210136_200009817182 [0,2,0,0,0,0|2,0,0]=4 8326 B12R0.234 CCOCCOCCCCB(O)O 7a_100000210136_200009817182 [0,2,0,0,0,0|2,0,0]=4 8327 B12R0.234 CCOCCOCCCCC(=O)C 34a_100000210136_100009817362 [0,2,0,0,0,0|1,0,0]=3 8328 B12R0.234 CCOCCOCCCCC(=O)C 7a_100000210136_100000735457 [0,2,0,0,0,0|1,0,0]=3 8329 B12R0.234 CCOCCOCCCCC(=O)N 34a_100012022536_100000210147 [0,2,0,0,0,0|1,0,1]=4 8330 B12R0.234 CCOCCOCCCCC(=O)N 7a_100012022536_100011215890 [0,2,0,0,0,0|1,0,1]=4 8331 B12R0.234 CCOCCOCCCCC(C)C 34a_100000210136_100011216152 [0,2,0,0,0,0|1,0,0]=3 8332 B12R0.234 CCOCCOCCCCC(C)C 34a_100011214890_100000210147 [0,2,0,0,0,0|1,0,0]=3 8333 B12R0.234 CCOCCOCCCCC(C)C 7a_100000210136_100011216152 [0,2,0,0,0,0|1,0,0]=3 8334 B12R0.234 CCOCCOCCCCC(C)C 7a_100011214890_100011215890 [0,2,0,0,0,0|1,0,0]=3 8335 B12R0.234 CCOCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210147 [0,2,0,0,0,0|2,0,0]=4 8336 B12R0.234 CCOCCOCCCC[N+](=O)[O-] 7a_200015379883_100011215890 [0,2,0,0,0,0|2,0,0]=4 8337 B12R0.234 CCOCCOCCCNC(=O)C 34a_100000752032_100000210147 [0,2,0,0,0,0|1,0,1]=4 8338 B12R0.234 CCOCCOCCCNC(C)C 34a_100000182298_100000210147 [0,2,0,0,0,0|1,0,0]=3 8339 B12R0.234 CCOCCOCCCOC(=O)C 34a_100000210136_100000042594 [0,2,0,0,0,0|0,0,1]=3 8340 B12R0.234 CCOCCOCCCOC(=O)C 7a_100000210136_100000042594 [0,2,0,0,0,0|0,0,1]=3 8341 B12R0.234 CCOCCOCCCOC(=S)C 34a_100000210136_200135323944 [0,2,0,0,0,0|0,0,1]=3 8342 B12R0.234 CCOCCOCCCOC(=S)C 7a_100000210136_200135323944 [0,2,0,0,0,0|0,0,1]=3 8343 B12R0.234 CCOCCOCCCSC(=O)C 34a_100000210136_100000038929 [0,2,0,0,0,0|0,1,1]=4 8344 B12R0.234 CCOCCOCCCSC(=O)C 7a_100000210136_100000038929 [0,2,0,0,0,0|0,1,1]=4 8345 B12R0.234 CCOCCOCCNCC(=O)N 2230a_100000711301_100011211534 [0,2,0,0,0,0|1,0,1]=4 8346 B12R0.234 CCOCCOCCNCC(=O)N 2230a_100102712874_100000747473 [0,2,0,0,0,0|1,0,1]=4 8347 B12R0.234 CCOCCOCCNCC(=O)N 34a_100102712874_100000187820 [0,2,0,0,0,0|1,0,1]=4 8348 B12R0.234 CCOCCOCCNCC(=O)O 269956a_100016091260_100011211534 [0,2,0,0,0,0|1,0,1]=4 8349 B12R0.234 CCOCCOCCNCC(=O)[O-] 34a_100102712874_100020667443 [0,2,0,0,0,0|1,0,1]=4 8350 B12R0.234 CCOCCOCCNCC(C)C 2230a_100000210953_100011211534 [0,2,0,0,0,0|1,0,0]=3 8351 B12R0.234 CCOCCOCCNCC(C)C 2230a_100102712874_100000210760 [0,2,0,0,0,0|1,0,0]=3 8352 B12R0.234 CCOCCOCCNCC(C)C 270004a_100102712874_100000210432 [0,2,0,0,0,0|1,0,0]=3 8353 B12R0.234 CCOCCOCCNCC(C)C 34a_100000210953_100011211534 [0,2,0,0,0,0|1,0,0]=3 8354 B12R0.234 CCOCCOCCNCC(C)C 34a_100015185251_100000210147 [0,2,0,0,0,0|1,0,0]=3 8355 B12R0.234 CCOCCOCCNCC(C)C 34a_100102712874_100000210624 [0,2,0,0,0,0|1,0,0]=3 8356 B12R0.234 CCOCCOCCNCC(C)O 2230a_100000210904_100011211534 [0,2,0,0,0,0|1,0,0]=3 8357 B12R0.234 CCOCCOCCNCC(C)O 2230a_100102712874_100011218427 [0,2,0,0,0,0|1,0,0]=3 8358 B12R0.234 CCOCCOCCNCC(C)O 34a_100000210904_100011211534 [0,2,0,0,0,0|1,0,0]=3 8359 B12R0.234 CCOCCOCCNCC(C)O 34a_100102712874_100011218427 [0,2,0,0,0,0|1,0,0]=3 8360 B12R0.234 CCOCCOCCNCC(F)F 2230a_100102712874_100011934356 [0,2,0,0,0,0|1,0,0]=3 8361 B12R0.234 CCOCCOCCNCC(F)F 34a_100000765723_100011211534 [0,2,0,0,0,0|1,0,0]=3 8362 B12R0.234 CCOCCOCCNCC(F)F 34a_100102712874_100011934356 [0,2,0,0,0,0|1,0,0]=3 8363 B12R0.234 CCOCCOCCNC[C@@H](C)O 2230a_100102712874_100009817552 [0,2,0,0,0,0|1,0,0]=3 8364 B12R0.234 CCOCCOCCNC[C@@H](C)O 34a_100102712874_100009817552 [0,2,0,0,0,0|1,0,0]=3 8365 B12R0.234 CCOCCOCCNC[N+](=O)[O-] 34a_100102712874_100000761209 [0,2,0,0,0,0|2,0,0]=4 8366 B12R0.234 CCOCCOCCOCC(=O)C 34a_100000211253_100011211534 [0,2,0,0,0,0|0,0,0]=2 8367 B12R0.234 CCOCCOCCOCC(=O)N 34a_100000210136_100000076697 [0,2,0,0,0,0|0,0,1]=3 8368 B12R0.234 CCOCCOCCOCC(=O)N 34a_100000210240_100000187820 [0,2,0,0,0,0|0,0,1]=3 8369 B12R0.234 CCOCCOCCOCC(=O)N 7a_100000210136_100000076697 [0,2,0,0,0,0|0,0,1]=3 8370 B12R0.234 CCOCCOCCOCC(=O)N 7a_100000210240_100000187820 [0,2,0,0,0,0|0,0,1]=3 8371 B12R0.234 CCOCCOCCOCC(=O)[O-] 34a_100000210240_100020667443 [0,2,0,0,0,0|0,0,1]=3 8372 B12R0.234 CCOCCOCCOCC(C)Br 34a_100012180447_100011211534 [0,2,0,0,0,0|0,0,0]=2 8373 B12R0.234 CCOCCOCCOCC(C)C 34a_100000210240_100000210624 [0,2,0,0,0,0|0,0,0]=2 8374 B12R0.234 CCOCCOCCOCC(C)C 34a_100000210257_100011211534 [0,2,0,0,0,0|0,0,0]=2 8375 B12R0.234 CCOCCOCCOCC(C)C 34a_100000703358_100000210147 [0,2,0,0,0,0|0,0,0]=2 8376 B12R0.234 CCOCCOCCOCC(C)C 7a_100000210240_100000210760 [0,2,0,0,0,0|0,0,0]=2 8377 B12R0.234 CCOCCOCCOCC(C)C 7a_100000703358_100011215890 [0,2,0,0,0,0|0,0,0]=2 8378 B12R0.234 CCOCCOCCOCC(C)F 34a_100015925927_100011211534 [0,2,0,0,0,0|0,0,0]=2 8379 B12R0.234 CCOCCOCCOCC(C)O 34a_100000210240_100011218427 [0,2,0,0,0,0|0,0,0]=2 8380 B12R0.234 CCOCCOCCOCC(C)O 7a_100000210240_100011218427 [0,2,0,0,0,0|0,0,0]=2 8381 B12R0.234 CCOCCOCCOCC(F)F 34a_100000210136_200012177212 [0,2,0,0,0,0|0,0,0]=2 8382 B12R0.234 CCOCCOCCOCC(F)F 34a_100000210240_100011934356 [0,2,0,0,0,0|0,0,0]=2 8383 B12R0.234 CCOCCOCCOCC(F)F 34a_100000704375_100000210147 [0,2,0,0,0,0|0,0,0]=2 8384 B12R0.234 CCOCCOCCOCC(F)F 34a_100000743014_100011211534 [0,2,0,0,0,0|0,0,0]=2 8385 B12R0.234 CCOCCOCCOCC(F)F 34a_100010782186_100000210202 [0,2,0,0,0,0|0,0,0]=2 8386 B12R0.234 CCOCCOCCOCC(F)F 7a_100000210136_200012177212 [0,2,0,0,0,0|0,0,0]=2 8387 B12R0.234 CCOCCOCCOCC(F)F 7a_100000210240_100011934356 [0,2,0,0,0,0|0,0,0]=2 8388 B12R0.234 CCOCCOCCOCC(F)F 7a_100000704375_100011215890 [0,2,0,0,0,0|0,0,0]=2 8389 B12R0.234 CCOCCOCCOCC(F)F 7a_100010782186_100000210202 [0,2,0,0,0,0|0,0,0]=2 8390 B12R0.234 CCOCCOCCOC[C@@H](C)Cl 34a_100016084084_100011211534 [0,2,0,0,0,0|0,0,0]=2 8391 B12R0.234 CCOCCOCCOC[C@@H](C)N 34a_100000737577_100011211534 [0,2,0,0,0,0|0,0,0]=2 8392 B12R0.234 CCOCCOCCOC[C@@H](C)O 34a_100000210240_100009817552 [0,2,0,0,0,0|0,0,0]=2 8393 B12R0.234 CCOCCOCCOC[C@@H](C)O 7a_100000210240_100009817552 [0,2,0,0,0,0|0,0,0]=2 8394 B12R0.234 CCOCCOCCOC[N+](=O)[O-] 34a_100000210240_100000761209 [0,2,0,0,0,0|1,0,0]=3 8395 B12R0.234 CCOCCOCCSCC(=O)N 62a_100000747473_100011211534 [0,2,0,0,0,0|0,1,1]=4 8396 B12R0.234 CCOCCOCCSCC(=O)N 62a_100011211534_100000747473 [0,2,0,0,0,0|0,1,1]=4 8397 B12R0.234 CCOCCOCCSCC(=O)[O-] 62a_100011211534_100020667443 [0,2,0,0,0,0|0,1,1]=4 8398 B12R0.234 CCOCCOCCSCC(=O)[O-] 62a_100020667443_100011211534 [0,2,0,0,0,0|0,1,1]=4 8399 B12R0.234 CCOCCOCCSCC(C)C 34a_200000230437_100000210147 [0,2,0,0,0,0|0,1,0]=3 8400 B12R0.234 CCOCCOCCSCC(C)C 62a_100000210624_100011211534 [0,2,0,0,0,0|0,1,0]=3 8401 B12R0.234 CCOCCOCCSCC(C)C 62a_100011211534_100000210760 [0,2,0,0,0,0|0,1,0]=3 8402 B12R0.234 CCOCCOCCSCC(C)C 7a_200000230437_100011215890 [0,2,0,0,0,0|0,1,0]=3 8403 B12R0.234 CCOCCOCCSCC(C)O 62a_100011211534_100011218427 [0,2,0,0,0,0|0,1,0]=3 8404 B12R0.234 CCOCCOCCSCC(C)O 62a_100011218427_100011211534 [0,2,0,0,0,0|0,1,0]=3 8405 B12R0.234 CCOCCOCCSCC(F)F 62a_100011211534_100011934356 [0,2,0,0,0,0|0,1,0]=3 8406 B12R0.234 CCOCCOCCSCC(F)F 62a_100011934356_100011211534 [0,2,0,0,0,0|0,1,0]=3 8407 B12R0.234 CCOCCOCCSC[C@@H](C)O 62a_100009817552_100011211534 [0,2,0,0,0,0|0,1,0]=3 8408 B12R0.234 CCOCCOCCSC[C@@H](C)O 62a_100011211534_100009817552 [0,2,0,0,0,0|0,1,0]=3 8409 B12R0.234 CCOCCOCCSC[N+](=O)[O-] 62a_100011211534_100000761209 [0,2,0,0,0,0|1,1,0]=4 8410 B12R0.234 CCOCCSCCCCC(=O)C 62a_100000210147_100000735457 [0,2,0,0,0,0|1,1,0]=4 8411 B12R0.234 CCOCCSCCCCC(=O)C 62a_100000735457_100011215890 [0,2,0,0,0,0|1,1,0]=4 8412 B12R0.234 CCOCCSCCCCC(C)C 62a_100000210147_100011216152 [0,2,0,0,0,0|1,1,0]=4 8413 B12R0.234 CCOCCSCCCCC(C)C 62a_100011216152_100011215890 [0,2,0,0,0,0|1,1,0]=4 8414 B12R0.234 CCOCCSCCCCN(C)C 62a_100000210147_100000690147 [0,2,0,0,0,0|1,1,0]=4 8415 B12R0.234 CCOCCSCCCOC(=O)C 62a_100000042594_100011215890 [0,2,0,0,0,0|0,1,1]=4 8416 B12R0.234 CCOCCSCCCOC(=O)C 62a_100000210147_100000042594 [0,2,0,0,0,0|0,1,1]=4 8417 B12R0.234 CCOCCSCCCOC(=S)C 62a_100000210147_200135323944 [0,2,0,0,0,0|0,1,1]=4 8418 B12R0.234 CCOCCSCCCOC(=S)C 62a_200135323944_100011215890 [0,2,0,0,0,0|0,1,1]=4 8419 B12R0.234 CCOCCSCCOCC(=O)N 62a_100000076697_100011215890 [0,2,0,0,0,0|0,1,1]=4 8420 B12R0.234 CCOCCSCCOCC(=O)N 62a_100000210147_100000076697 [0,2,0,0,0,0|0,1,1]=4 8421 B12R0.234 CCOCCSCCOCC(F)F 62a_100000210147_200012177212 [0,2,0,0,0,0|0,1,0]=3 8422 B12R0.234 CCOCCSCCOCC(F)F 62a_200012177212_100011215890 [0,2,0,0,0,0|0,1,0]=3 8423 B12R0.234 CCOCSCCCCCC(C)C 62a_100000210682_100000739092 [0,2,0,0,0,0|2,0,0]=4 8424 B12R0.234 CCOCSCCCCCC(C)C 62a_100000739092_100000210682 [0,2,0,0,0,0|2,0,0]=4 8425 B12R0.234 CCOCSCCCCOC(=O)C 62a_100000033659_100000739092 [0,2,0,0,0,0|1,0,1]=4 8426 B12R0.234 CCOCSCCCCOC(=O)C 62a_100000739092_100000033659 [0,2,0,0,0,0|1,0,1]=4 8427 B12R0.234 CCOCSCOCCOC(=O)C 62a_100000076355_100000739092 [0,2,0,0,0,0|0,0,1]=3 8428 B12R0.234 CCOCSCOCCOC(=O)C 62a_100000739092_100000076355 [0,2,0,0,0,0|0,0,1]=3 8429 B12R0.234 CCSCCCOCCCC(C)C 34a_100011216438_100011214892 [0,2,0,0,0,0|1,1,0]=4 8430 B12R0.234 CCSCCCOCCCC(C)C 7a_100011216438_100011214892 [0,2,0,0,0,0|1,1,0]=4 8431 B12R0.234 CCSCCCOCCCC(C)O 34a_100011216438_200000718107 [0,2,0,0,0,0|1,1,0]=4 8432 B12R0.234 CCSCCCOCCCC(C)O 7a_100011216438_200000718107 [0,2,0,0,0,0|1,1,0]=4 8433 B12R0.234 CCSCCCOCCOC(=O)C 34a_100011216438_100009814007 [0,2,0,0,0,0|0,1,1]=4 8434 B12R0.234 CCSCCCOCCOC(=O)C 7a_100011216438_100009814007 [0,2,0,0,0,0|0,1,1]=4 8435 B12R0.234 CCSCCCOCCOC(C)C 34a_100011216438_100000211751 [0,2,0,0,0,0|0,1,0]=3 8436 B12R0.234 CCSCCCOCCOC(C)C 7a_100011216438_100000211751 [0,2,0,0,0,0|0,1,0]=3 8437 B12R0.234 CCSCCCOCCSC(C)C 34a_100011216438_100000730970 [0,2,0,0,0,0|0,2,0]=4 8438 B12R0.234 CCSCCCOCCSC(C)C 7a_100011216438_100000730970 [0,2,0,0,0,0|0,2,0]=4 8439 B12R0.234 CCSCCNCCCOC(C)C 2230a_100000737246_100000757381 [0,2,0,0,0,0|1,1,0]=4 8440 B12R0.234 CCSCCNCCCOC(C)C 34a_100000737246_100000757381 [0,2,0,0,0,0|1,1,0]=4 8441 B12R0.234 CCSCCNCCOCC(F)F 2230a_100000106463_200012177212 [0,2,0,0,0,0|1,1,0]=4 8442 B12R0.234 CCSCCOCCCCC(=O)C 34a_100000212035_100009817362 [0,2,0,0,0,0|1,1,0]=4 8443 B12R0.234 CCSCCOCCCCC(=O)C 7a_100000212035_100000735457 [0,2,0,0,0,0|1,1,0]=4 8444 B12R0.234 CCSCCOCCCCC(C)C 34a_100000212035_100011216152 [0,2,0,0,0,0|1,1,0]=4 8445 B12R0.234 CCSCCOCCCCC(C)C 34a_100011214890_100000757381 [0,2,0,0,0,0|1,1,0]=4 8446 B12R0.234 CCSCCOCCCCC(C)C 7a_100000212035_100011216152 [0,2,0,0,0,0|1,1,0]=4 8447 B12R0.234 CCSCCOCCCCC(C)C 7a_100011214890_100000757381 [0,2,0,0,0,0|1,1,0]=4 8448 B12R0.234 CCSCCOCCCNC(C)C 34a_100000182298_100000757381 [0,2,0,0,0,0|1,1,0]=4 8449 B12R0.234 CCSCCOCCCOC(=O)C 34a_100000212035_100000042594 [0,2,0,0,0,0|0,1,1]=4 8450 B12R0.234 CCSCCOCCCOC(=O)C 7a_100000212035_100000042594 [0,2,0,0,0,0|0,1,1]=4 8451 B12R0.234 CCSCCOCCCOC(=S)C 34a_100000212035_200135323944 [0,2,0,0,0,0|0,1,1]=4 8452 B12R0.234 CCSCCOCCCOC(=S)C 7a_100000212035_200135323944 [0,2,0,0,0,0|0,1,1]=4 8453 B12R0.234 CCSCCOCCNCC(C)C 34a_100015185251_100000757381 [0,2,0,0,0,0|1,1,0]=4 8454 B12R0.234 CCSCCOCCOCC(=O)N 34a_100000212035_100000076697 [0,2,0,0,0,0|0,1,1]=4 8455 B12R0.234 CCSCCOCCOCC(=O)N 7a_100000212035_100000076697 [0,2,0,0,0,0|0,1,1]=4 8456 B12R0.234 CCSCCOCCOCC(C)C 34a_100000703358_100000757381 [0,2,0,0,0,0|0,1,0]=3 8457 B12R0.234 CCSCCOCCOCC(C)C 7a_100000703358_100000757381 [0,2,0,0,0,0|0,1,0]=3 8458 B12R0.234 CCSCCOCCOCC(F)F 34a_100000212035_200012177212 [0,2,0,0,0,0|0,1,0]=3 8459 B12R0.234 CCSCCOCCOCC(F)F 34a_100000704375_100000757381 [0,2,0,0,0,0|0,1,0]=3 8460 B12R0.234 CCSCCOCCOCC(F)F 7a_100000212035_200012177212 [0,2,0,0,0,0|0,1,0]=3 8461 B12R0.234 CCSCCOCCOCC(F)F 7a_100000704375_100000757381 [0,2,0,0,0,0|0,1,0]=3 8462 B12R0.234 CCSCCOCCSCC(C)C 34a_200000230437_100000757381 [0,2,0,0,0,0|0,2,0]=4 8463 B12R0.234 CCSCCOCCSCC(C)C 7a_200000230437_100000757381 [0,2,0,0,0,0|0,2,0]=4 8464 B12R0.234 CCSCCSCCOCC(F)F 62a_100000757381_200012177212 [0,2,0,0,0,0|0,2,0]=4 8465 B12R0.234 CCSCCSCCOCC(F)F 62a_200012177212_100000757381 [0,2,0,0,0,0|0,2,0]=4 8466 B12R0.234 CN(C)CCCOCCOCCBr 7a_100000692535_100000757444 [0,2,0,0,0,0|2,0,0]=4 8467 B12R0.234 CN(C)CCCOCCOCCCl 7a_100011215305_100000757444 [0,2,0,0,0,0|2,0,0]=4 8468 B12R0.234 CN(C)CCCOCCOCCF 7a_200015357709_100000757444 [0,2,0,0,0,0|2,0,0]=4 8469 B12R0.234 CN(C)CCCOCCOCCI 7a_100012149058_100000757444 [0,2,0,0,0,0|2,0,0]=4 8470 B12R0.234 CNCCCOCCOCC(F)F 34a_100000213112_200012177212 [0,2,0,0,0,0|2,0,0]=4 8471 B12R0.234 COCCCCNCCOC(C)C 2230a_100000701111_100000730899 [0,2,0,0,0,0|2,0,0]=4 8472 B12R0.234 COCCCCNCCOC(C)C 34a_100000701111_100000755781 [0,2,0,0,0,0|2,0,0]=4 8473 B12R0.234 COCCCCOCCCC(C)C 34a_100000210774_100000755781 [0,2,0,0,0,0|2,0,0]=4 8474 B12R0.234 COCCCCOCCCC(C)C 34a_100000740925_100011214892 [0,2,0,0,0,0|2,0,0]=4 8475 B12R0.234 COCCCCOCCCC(C)C 7a_100000210774_100000730899 [0,2,0,0,0,0|2,0,0]=4 8476 B12R0.234 COCCCCOCCCC(C)O 34a_100000740925_200000718107 [0,2,0,0,0,0|2,0,0]=4 8477 B12R0.234 COCCCCOCCNC(C)C 34a_100000224655_100000755781 [0,2,0,0,0,0|2,0,0]=4 8478 B12R0.234 COCCCCOCCOC(=O)C 34a_100000740925_100009814007 [0,2,0,0,0,0|1,0,1]=4 8479 B12R0.234 COCCCCOCCOC(C)C 34a_100000211219_100000755781 [0,2,0,0,0,0|1,0,0]=3 8480 B12R0.234 COCCCCOCCOC(C)C 34a_100000740925_100000211751 [0,2,0,0,0,0|1,0,0]=3 8481 B12R0.234 COCCCCOCCOC(C)C 7a_100000211219_100000730899 [0,2,0,0,0,0|1,0,0]=3 8482 B12R0.234 COCCCCOCCSC(C)C 34a_100000740925_100000730970 [0,2,0,0,0,0|1,1,0]=4 8483 B12R0.234 COCCCCOCCSC(C)C 34a_200011212901_100000755781 [0,2,0,0,0,0|1,1,0]=4 8484 B12R0.234 COCCCCOCCSC(C)C 7a_200011212901_100000730899 [0,2,0,0,0,0|1,1,0]=4 8485 B12R0.234 COCCCCSCCOC(C)C 62a_100000211751_100000730899 [0,2,0,0,0,0|1,1,0]=4 8486 B12R0.234 COCCCCSCCOC(C)C 62a_100000730899_100000211751 [0,2,0,0,0,0|1,1,0]=4 8487 B12R0.234 COCCCOCCCOC(C)C 34a_200011215475_100000210206 [0,2,0,0,0,0|2,0,0]=4 8488 B12R0.234 COCCCOCCCOC(C)C 7a_200011215475_100000210206 [0,2,0,0,0,0|2,0,0]=4 8489 B12R0.234 COCCCOCCOCC(C)C 34a_100000703358_100000740836 [0,2,0,0,0,0|2,0,0]=4 8490 B12R0.234 COCCCOCCOCC(C)C 7a_100000703358_100000740836 [0,2,0,0,0,0|2,0,0]=4 8491 B12R0.234 COCCCOCCOCC(F)F 34a_100000704375_100000740836 [0,2,0,0,0,0|2,0,0]=4 8492 B12R0.234 COCCCOCCOCC(F)F 34a_100000740835_200012177212 [0,2,0,0,0,0|2,0,0]=4 8493 B12R0.234 COCCCOCCOCC(F)F 7a_100000704375_100000740836 [0,2,0,0,0,0|2,0,0]=4 8494 B12R0.234 COCSCCOCCOC(=O)C 62a_100000766300_200000083610 [0,2,0,0,0,0|0,1,1]=4 8495 B12R0.234 COCSCCOCCOC(=O)C 62a_200000083610_100000766300 [0,2,0,0,0,0|0,1,1]=4 8496 B12R0.234 CSCCCCOCCCC(C)C 34a_100011217163_100011214892 [0,2,0,0,0,0|2,0,0]=4 8497 B12R0.234 CSCCCCOCCCC(C)C 7a_100011217163_100011214892 [0,2,0,0,0,0|2,0,0]=4 8498 B12R0.234 CSCCCCOCCCC(C)O 34a_100011217163_200000718107 [0,2,0,0,0,0|2,0,0]=4 8499 B12R0.234 CSCCCCOCCCC(C)O 7a_100011217163_200000718107 [0,2,0,0,0,0|2,0,0]=4 8500 B12R0.234 CSCCCCOCCOC(=O)C 34a_100011217163_100009814007 [0,2,0,0,0,0|1,0,1]=4 8501 B12R0.234 CSCCCCOCCOC(=O)C 7a_100011217163_100009814007 [0,2,0,0,0,0|1,0,1]=4 8502 B12R0.234 CSCCCCOCCOC(C)C 34a_100011217163_100000211751 [0,2,0,0,0,0|1,0,0]=3 8503 B12R0.234 CSCCCCOCCOC(C)C 7a_100011217163_100000211751 [0,2,0,0,0,0|1,0,0]=3 8504 B12R0.234 CSCCCCOCCSC(C)C 34a_100011217163_100000730970 [0,2,0,0,0,0|1,1,0]=4 8505 B12R0.234 CSCCCCOCCSC(C)C 7a_100011217163_100000730970 [0,2,0,0,0,0|1,1,0]=4 8506 B12R0.234 CSCCCOCCOCC(F)F 34a_100000690336_200012177212 [0,2,0,0,0,0|2,0,0]=4 8507 B12R0.234 CSCCCOCCOCC(F)F 7a_100000690336_200012177212 [0,2,0,0,0,0|2,0,0]=4 8508 B12R0.234 CSCOCCCCCNC(C)C 34a_100011629493_100011218213 [0,2,0,0,0,0|2,0,0]=4 8509 B12R0.234 CSCSCCOCCOC(=O)C 62a_100011218213_200000083610 [0,2,0,0,0,0|0,1,1]=4 8510 B12R0.234 CSCSCCOCCOC(=O)C 62a_200000083610_100011218213 [0,2,0,0,0,0|0,1,1]=4 8511 B12R0.234 FC(F)COCCOCCCCBr 34a_100011216708_200012177212 [0,2,0,0,0,0|2,0,0]=4 8512 B12R0.234 FC(F)COCCOCCCCCl 34a_100000210776_200012177212 [0,2,0,0,0,0|2,0,0]=4 8513 B12R0.234 FC(F)COCCOCCCCCl 7a_100000210776_200012177212 [0,2,0,0,0,0|2,0,0]=4 8514 B12R0.234 FC(F)COCCOCCCCI 34a_200012148704_200012177212 [0,2,0,0,0,0|2,0,0]=4 8515 B12R0.234 FCCCCOCCOCC(F)F 34a_100000704375_100000729493 [0,2,0,0,0,0|2,0,0]=4 8516 B12R0.234 FCCCCOCCOCC(F)F 34a_100011995726_200012177212 [0,2,0,0,0,0|2,0,0]=4 8517 B12R0.234 FCCCCOCCOCC(F)F 7a_100000704375_100000729493 [0,2,0,0,0,0|2,0,0]=4 8518 B12R0.234 FCCCCOCCOCC(F)F 7a_100011995726_200012177212 [0,2,0,0,0,0|2,0,0]=4 8519 B12R0.234 FCOCCOCCOCC(F)F 34a_100010782186_100015361967 [0,2,0,0,0,0|1,0,0]=3 8520 B12R0.234 FCOCCOCCOCC(F)F 7a_100010782186_100015361967 [0,2,0,0,0,0|1,0,0]=3 8521 B12R0.234 NC(=O)OCCOCCOCCBr 34a_100000692535_200011214921 [0,2,0,0,0,0|1,0,1]=4 8522 B12R0.234 NC(=O)OCCOCCOCCBr 7a_100000692535_200011214921 [0,2,0,0,0,0|1,0,1]=4 8523 B12R0.234 NC(=O)OCCOCCOCCCl 34a_100011215305_200011214921 [0,2,0,0,0,0|1,0,1]=4 8524 B12R0.234 NC(=O)OCCOCCOCCCl 7a_100011215305_200011214921 [0,2,0,0,0,0|1,0,1]=4 8525 B12R0.234 NC(=O)OCCOCCOCCF 34a_200015357709_200011214921 [0,2,0,0,0,0|1,0,1]=4 8526 B12R0.234 NC(=O)OCCOCCOCCF 7a_200015357709_200011214921 [0,2,0,0,0,0|1,0,1]=4 8527 B12R0.234 NC(=O)OCCOCCOCCI 34a_100012149058_200011214921 [0,2,0,0,0,0|1,0,1]=4 8528 B12R0.234 NC(=O)OCCOCCOCCI 7a_100012149058_200011214921 [0,2,0,0,0,0|1,0,1]=4 8529 B12R0.234 NC(=O)OCCOCCOCCO 7a_100000766696_100011215305 [0,2,0,0,0,0|1,0,1]=4 8530 B12R0.234 NCCCCOCCOCC(F)F 34a_100000750430_200012177212 [0,2,0,0,0,0|2,0,0]=4 8531 B12R0.234 NCCOCCOCCOC(=O)N 34a_100000211614_200011214921 [0,2,0,0,0,0|1,0,1]=4 8532 B12R0.234 OCCCCOCCOCC(F)F 34a_100000704375_100011216708 [0,2,0,0,0,0|2,0,0]=4 8533 B12R0.234 OCCCCOCCOCC(F)F 7a_100000704375_100000210776 [0,2,0,0,0,0|2,0,0]=4 8534 B12R0.248 C#CC(C)NCCOCCOCC 2230a_100000707721_100011211534 [0,2,0,0,0,0|1,0,0]=3 8535 B12R0.248 C#CC(C)NCCOCCOCC 34a_100000707721_100011211534 [0,2,0,0,0,0|1,0,0]=3 8536 B12R0.248 C#CC(C)NCCOCCOCC 34a_100102712874_200000035995 [0,2,0,0,0,0|1,0,0]=3 8537 B12R0.248 C#CC(C)OCCCCCCCC 34a_100000210232_200000035995 [0,2,0,0,0,0|2,0,0]=4 8538 B12R0.248 C#CC(C)OCCNCCCCC 34a_100000224656_200000035995 [0,2,0,0,0,0|2,0,0]=4 8539 B12R0.248 C#CC(C)OCCOCCCCC 34a_100011215259_200000035995 [0,2,0,0,0,0|1,0,0]=3 8540 B12R0.248 C#CC(C)OCCOCCOC=C 34a_100000039918_200000035995 [0,2,0,0,0,0|0,0,2]=4 8541 B12R0.248 C#CC(C)OCCOCCOCC 34a_100000210240_200000035995 [0,2,0,0,0,0|0,0,0]=2 8542 B12R0.248 C#CC(C)SCCOCCOCC 62a_200000035995_100011211534 [0,2,0,0,0,0|0,1,0]=3 8543 B12R0.248 C#CCOCCOCCC(=O)CC 1458a_100000210414_100010408581 [0,2,0,0,0,0|1,0,1]=4 8544 B12R0.248 C#CCOCCOCCC(=O)CC 1458a_100019993476_100000210202 [0,2,0,0,0,0|1,0,1]=4 8545 B12R0.248 C#CCOCCOCCC(C)CC 7a_100011215188_100010402529 [0,2,0,0,0,0|1,0,1]=4 8546 B12R0.248 C#CCOCCOCCN(C)CC 2230a_100000225621_100010408581 [0,2,0,0,0,0|1,0,1]=4 8547 B12R0.248 C#C[C@@H](C)OCCCCCCCC 34a_100009815206_100000210759 [0,2,0,0,0,0|2,0,0]=4 8548 B12R0.248 C#C[C@@H](C)OCCCCCCCC 7a_100009815206_100000210759 [0,2,0,0,0,0|2,0,0]=4 8549 B12R0.248 C#C[C@@H](C)OCCOCCOCC 34a_100009815206_100011211534 [0,2,0,0,0,0|0,0,0]=2 8550 B12R0.248 C#C[C@@H](C)OCCOCCOCC 7a_100009815206_100011211534 [0,2,0,0,0,0|0,0,0]=2 8551 B12R0.248 C=CC(=O)OCCOCCOCC 34a_100000210136_100009813456 [0,2,0,0,0,0|0,0,2]=4 8552 B12R0.248 C=CC(=O)OCCOCCOCC 7a_100000210136_100009813456 [0,2,0,0,0,0|0,0,2]=4 8553 B12R0.248 C=CC(C)OCCCCCCCC 34a_100000695699_100000210759 [0,2,0,0,0,0|2,0,0]=4 8554 B12R0.248 C=CC(C)OCCOCCOCC 34a_100000695699_100011211534 [0,2,0,0,0,0|0,0,0]=2 8555 B12R0.248 C=CC(C)SCCOCCOCC 62a_100011215867_100011211534 [0,2,0,0,0,0|0,1,0]=3 8556 B12R0.248 C=COCCOCCOC(=O)CC 7a_200000031056_100000039644 [0,2,0,0,0,0|0,0,2]=4 8557 B12R0.248 C=COCCOCCOC(C)C#N 7a_100000039918_100000703298 [0,2,0,0,0,0|0,0,2]=4 8558 B12R0.248 C=COCCOCCOC(C)CC 34a_100000039918_100011215416 [0,2,0,0,0,0|0,0,2]=4 8559 B12R0.248 C=COCCOCCOC(C)CC 7a_100000039918_100000758301 [0,2,0,0,0,0|0,0,2]=4 8560 B12R0.248 C=COCCOCCOC(C)CO 34a_100000039918_100012180447 [0,2,0,0,0,0|0,0,2]=4 8561 B12R0.248 C=COCCOCCOC(C)CO 7a_100000039918_100012180447 [0,2,0,0,0,0|0,0,2]=4 8562 B12R0.248 CC/C=C\CCOCCC(C)CC 7a_100011215188_100015370543 [0,2,0,0,0,0|2,0,0]=4 8563 B12R0.248 CC/C=C\COCCOC(=O)CC 7a_200000031056_100103147603 [0,2,0,0,0,0|1,0,1]=4 8564 B12R0.248 CCC#CCOCCOC(=O)CC 7a_200000031056_100009813939 [0,2,0,0,0,0|1,0,1]=4 8565 B12R0.248 CCC(=O)CCOCCOCCO 1458a_100000210414_100000032323 [0,2,0,0,0,0|1,0,0]=3 8566 B12R0.248 CCC(=O)CCOCCOCCO 1458a_100009915118_100000210202 [0,2,0,0,0,0|1,0,0]=3 8567 B12R0.248 CCC(=O)OCCOCCCCF 7a_200000031056_100000729493 [0,2,0,0,0,0|2,0,0]=4 8568 B12R0.248 CCC(=O)OCCOCCCCO 7a_200000031056_100000210776 [0,2,0,0,0,0|2,0,0]=4 8569 B12R0.248 CCC(=O)OCCOCCCOC 7a_200000031056_100000740836 [0,2,0,0,0,0|2,0,0]=4 8570 B12R0.248 CCC(C)CCCCCOCCF 7a_200000035636_100011217306 [0,2,0,0,0,0|2,0,0]=4 8571 B12R0.248 CCC(C)CCCCCOCCO 7a_200000035636_100000211926 [0,2,0,0,0,0|2,0,0]=4 8572 B12R0.248 CCC(C)CCNCCOCCO 2230a_100020591266_100011215305 [0,2,0,0,0,0|2,0,0]=4 8573 B12R0.248 CCC(C)CCOCCCCCF 7a_100011215188_100000729378 [0,2,0,0,0,0|2,0,0]=4 8574 B12R0.248 CCC(C)CCOCCCCCO 7a_100011215188_100000746330 [0,2,0,0,0,0|2,0,0]=4 8575 B12R0.248 CCC(C)CCOCCCCOC 7a_100011215188_100000730899 [0,2,0,0,0,0|2,0,0]=4 8576 B12R0.248 CCC(C)CCOCCOCC#N 7a_100011215188_200000047693 [0,2,0,0,0,0|1,0,1]=4 8577 B12R0.248 CCC(C)CCOCCOCCO 7a_100011215188_100011215305 [0,2,0,0,0,0|1,0,0]=3 8578 B12R0.248 CCCCCCCCOC(C)C#N 34a_100011218135_100000210759 [0,2,0,0,0,0|2,0,0]=4 8579 B12R0.248 CCCCCCCCOC(C)C#N 7a_100000210232_100000703298 [0,2,0,0,0,0|2,0,0]=4 8580 B12R0.248 CCCCCCCCOC(C)CC 34a_100000210232_100011215416 [0,2,0,0,0,0|2,0,0]=4 8581 B12R0.248 CCCCCCCCOC(C)CC 7a_100000210228_100000210759 [0,2,0,0,0,0|2,0,0]=4 8582 B12R0.248 CCCCCCCCOC(C)CC 7a_100000210232_100000758301 [0,2,0,0,0,0|2,0,0]=4 8583 B12R0.248 CCCCCCCCOC(C)CF 34a_100016041109_100000210759 [0,2,0,0,0,0|2,0,0]=4 8584 B12R0.248 CCCCCCCCOC(C)CF 7a_100016041109_100000210759 [0,2,0,0,0,0|2,0,0]=4 8585 B12R0.248 CCCCCCCCOC(C)CN 34a_100000210904_100000210759 [0,2,0,0,0,0|2,0,0]=4 8586 B12R0.248 CCCCCCCCOC(C)CO 34a_100000210232_100012180447 [0,2,0,0,0,0|2,0,0]=4 8587 B12R0.248 CCCCCCCCOC(C)CO 7a_100000210232_100012180447 [0,2,0,0,0,0|2,0,0]=4 8588 B12R0.248 CCCCCCOCCC(C)CC 7a_100011215188_100000210314 [0,2,0,0,0,0|2,0,0]=4 8589 B12R0.248 CCCCCNCCOC(C)CC 34a_100000224656_100011215416 [0,2,0,0,0,0|2,0,0]=4 8590 B12R0.248 CCCCCNCCOC(C)CO 34a_100000224656_100012180447 [0,2,0,0,0,0|2,0,0]=4 8591 B12R0.248 CCCCCOCCCC(C)CC 7a_100011216074_100000210326 [0,2,0,0,0,0|2,0,0]=4 8592 B12R0.248 CCCCCOCCCN(C)CC 7a_100000210253_100015186262 [0,2,0,0,0,0|2,0,0]=4 8593 B12R0.248 CCCCCOCCC[C@@H](C)CN 34a_100160569302_100000718602 [0,2,0,0,0,0|2,0,0]=4 8594 B12R0.248 CCCCCOCCNC(=O)CC 34a_200000158885_100000718602 [0,2,0,0,0,0|2,0,0]=4 8595 B12R0.248 CCCCCOCCNC(=O)CC 7a_200000158885_100000210326 [0,2,0,0,0,0|2,0,0]=4 8596 B12R0.248 CCCCCOCCOC(=O)CC 7a_200000031056_100000210326 [0,2,0,0,0,0|1,0,0]=3 8597 B12R0.248 CCCCCOCCOC(=O)NC 34a_100000210253_200011997002 [0,2,0,0,0,0|1,0,1]=4 8598 B12R0.248 CCCCCOCCOC(=O)NC 7a_100000210253_200011997002 [0,2,0,0,0,0|1,0,1]=4 8599 B12R0.248 CCCCCOCCOC(=O)OC 34a_100010262106_100000718602 [0,2,0,0,0,0|1,0,1]=4 8600 B12R0.248 CCCCCOCCOC(C)C#N 7a_100011215259_100000703298 [0,2,0,0,0,0|1,0,0]=3 8601 B12R0.248 CCCCCOCCOC(C)CC 34a_100011215259_100011215416 [0,2,0,0,0,0|1,0,0]=3 8602 B12R0.248 CCCCCOCCOC(C)CC 7a_100011215259_100000758301 [0,2,0,0,0,0|1,0,0]=3 8603 B12R0.248 CCCCCOCCOC(C)CO 34a_100011215259_100012180447 [0,2,0,0,0,0|1,0,0]=3 8604 B12R0.248 CCCCCOCCOC(C)CO 7a_100011215259_100012180447 [0,2,0,0,0,0|1,0,0]=3 8605 B12R0.248 CCCOCCCCCC(C)CC 7a_200000035636_100000210303 [0,2,0,0,0,0|2,0,0]=4 8606 B12R0.248 CCCOCCNCCC(C)CC 2230a_100020591266_100011215938 [0,2,0,0,0,0|2,0,0]=4 8607 B12R0.248 CCCOCCOCCC(=O)NC 34a_100000752267_100012179268 [0,2,0,0,0,0|2,0,0]=4 8608 B12R0.248 CCCOCCOCCC(=O)NC 34a_100000754576_100011215938 [0,2,0,0,0,0|2,0,0]=4 8609 B12R0.248 CCCOCCOCCC(=O)NC 7a_100000752267_100000737683 [0,2,0,0,0,0|2,0,0]=4 8610 B12R0.248 CCCOCCOCCC(=O)OC 34a_100000752267_100000742370 [0,2,0,0,0,0|2,0,0]=4 8611 B12R0.248 CCCOCCOCCC(=O)OC 7a_100000752267_100000204255 [0,2,0,0,0,0|2,0,0]=4 8612 B12R0.248 CCCOCCOCCC(C)CC 7a_100011215188_100011215938 [0,2,0,0,0,0|1,0,0]=3 8613 B12R0.248 CCCOCCOCCC(C)OC 7a_100000764861_100011215938 [0,2,0,0,0,0|2,0,0]=4 8614 B12R0.248 CCN(C)CCOCCOCCO 2230a_100000225621_100000032323 [0,2,0,0,0,0|1,0,0]=3 8615 B12R0.248 CCN(C)CCOCCOCCO 2230a_200014138305_100000210202 [0,2,0,0,0,0|1,0,0]=3 8616 B12R0.248 CCN(C)CCOCCOCCO 269982a_100000225621_100000032323 [0,2,0,0,0,0|1,0,0]=3 8617 B12R0.248 CCN(C)CCOCCOCCO 269982a_200014138305_100000204670 [0,2,0,0,0,0|1,0,0]=3 8618 B12R0.248 CCN(C)CCOCCOCCO 34a_200014138305_100000210202 [0,2,0,0,0,0|1,0,0]=3 8619 B12R0.248 CCOCCCNCCC(C)CC 2230a_100020591266_100012232248 [0,2,0,0,0,0|2,0,0]=4 8620 B12R0.248 CCOCCCOCCC(=O)NC 34a_100000754576_100012232248 [0,2,0,0,0,0|2,0,0]=4 8621 B12R0.248 CCOCCCOCCC(=O)NC 34a_100000757476_100012179268 [0,2,0,0,0,0|2,0,0]=4 8622 B12R0.248 CCOCCCOCCC(=O)NC 7a_100000757476_100000737683 [0,2,0,0,0,0|2,0,0]=4 8623 B12R0.248 CCOCCCOCCC(=O)OC 34a_100000757476_100000742370 [0,2,0,0,0,0|2,0,0]=4 8624 B12R0.248 CCOCCCOCCC(=O)OC 7a_100000757476_100000204255 [0,2,0,0,0,0|2,0,0]=4 8625 B12R0.248 CCOCCCOCCC(C)CC 7a_100011215188_100012232248 [0,2,0,0,0,0|1,0,0]=3 8626 B12R0.248 CCOCCCOCCC(C)OC 7a_100000764861_100012232248 [0,2,0,0,0,0|2,0,0]=4 8627 B12R0.248 CCOCCNCCCN(C)CC 2230a_102516460346_100015186262 [0,2,0,0,0,0|2,0,0]=4 8628 B12R0.248 CCOCCNCCNC(=O)CC 34a_100132302217_100000210147 [0,2,0,0,0,0|2,0,0]=4 8629 B12R0.248 CCOCCNCCOC(=O)NC 34a_102516460346_200011997002 [0,2,0,0,0,0|1,0,1]=4 8630 B12R0.248 CCOCCOCCCC(=O)NC 34a_100000210136_100000741757 [0,2,0,0,0,0|1,0,1]=4 8631 B12R0.248 CCOCCOCCCC(=O)NC 7a_100000210136_100000741757 [0,2,0,0,0,0|1,0,1]=4 8632 B12R0.248 CCOCCOCCCC(=O)OC 34a_100000210136_100000742333 [0,2,0,0,0,0|1,0,1]=4 8633 B12R0.248 CCOCCOCCCC(=O)OC 7a_100000210136_100011218270 [0,2,0,0,0,0|1,0,1]=4 8634 B12R0.248 CCOCCOCCCC(C)CC 7a_100011216074_100011215890 [0,2,0,0,0,0|1,0,0]=3 8635 B12R0.248 CCOCCOCCCN(C)CC 7a_100000210136_100015186262 [0,2,0,0,0,0|1,0,0]=3 8636 B12R0.248 CCOCCOCCC[C@@H](C)CN 34a_100160569302_100000210147 [0,2,0,0,0,0|1,0,0]=3 8637 B12R0.248 CCOCCOCCNC(=O)CC 11a_100102712874_100000210414 [0,2,0,0,0,0|1,0,0]=3 8638 B12R0.248 CCOCCOCCNC(=O)CC 1626a_100102712874_100000210414 [0,2,0,0,0,0|1,0,0]=3 8639 B12R0.248 CCOCCOCCNC(=O)CC 240690a_100102712874_100000210414 [0,2,0,0,0,0|1,0,0]=3 8640 B12R0.248 CCOCCOCCNC(=O)CC 34a_200000158885_100000210147 [0,2,0,0,0,0|1,0,0]=3 8641 B12R0.248 CCOCCOCCNC(=O)CC 527a_100102712874_100000210414 [0,2,0,0,0,0|1,0,0]=3 8642 B12R0.248 CCOCCOCCNC(=O)CC 7a_200000158885_100011215890 [0,2,0,0,0,0|1,0,0]=3 8643 B12R0.248 CCOCCOCCNC(=O)CO 240690a_100102712874_100000210174 [0,2,0,0,0,0|1,0,1]=4 8644 B12R0.248 CCOCCOCCNC(=O)CO 527a_100102712874_100000210174 [0,2,0,0,0,0|1,0,1]=4 8645 B12R0.248 CCOCCOCCNC(=O)NC 2708a_100102657272_100102712874 [0,2,0,0,0,0|1,0,1]=4 8646 B12R0.248 CCOCCOCCNC(=O)NC 2708a_100102712874_106832991635 [0,2,0,0,0,0|1,0,1]=4 8647 B12R0.248 CCOCCOCCNC(=O)NC 273464a_100102657272_100102712874 [0,2,0,0,0,0|1,0,1]=4 8648 B12R0.248 CCOCCOCCNC(=O)NC 273464a_100102712874_100102657272 [0,2,0,0,0,0|1,0,1]=4 8649 B12R0.248 CCOCCOCCNC(=O)NC 512a_100102712874_100102657272 [0,2,0,0,0,0|1,0,1]=4 8650 B12R0.248 CCOCCOCCNC(=O)OC 34a_100000757965_100000210147 [0,2,0,0,0,0|1,0,1]=4 8651 B12R0.248 CCOCCOCCNC(C)C#N 2230a_100000737613_100011211534 [0,2,0,0,0,0|1,0,0]=3 8652 B12R0.248 CCOCCOCCNC(C)C#N 2230a_100102712874_100000184139 [0,2,0,0,0,0|1,0,0]=3 8653 B12R0.248 CCOCCOCCNC(C)CC 2230a_100000209981_100011211534 [0,2,0,0,0,0|1,0,0]=3 8654 B12R0.248 CCOCCOCCNC(C)CC 2230a_100102712874_100000758301 [0,2,0,0,0,0|1,0,0]=3 8655 B12R0.248 CCOCCOCCNC(C)CC 34a_100102712874_100011215416 [0,2,0,0,0,0|1,0,0]=3 8656 B12R0.248 CCOCCOCCNC(C)CO 2230a_100102712874_100012180447 [0,2,0,0,0,0|1,0,0]=3 8657 B12R0.248 CCOCCOCCNC(C)CO 34a_100102712874_100012180447 [0,2,0,0,0,0|1,0,0]=3 8658 B12R0.248 CCOCCOCCN[C@H](C)CO 2230a_100000737577_100011211534 [0,2,0,0,0,0|1,0,0]=3 8659 B12R0.248 CCOCCOCCOC(=O)CC 7a_200000031056_100011215890 [0,2,0,0,0,0|0,0,0]=2 8660 B12R0.248 CCOCCOCCOC(=O)NC 34a_100000210136_200011997002 [0,2,0,0,0,0|0,0,1]=3 8661 B12R0.248 CCOCCOCCOC(=O)NC 7a_100000210136_200011997002 [0,2,0,0,0,0|0,0,1]=3 8662 B12R0.248 CCOCCOCCOC(=O)OC 34a_100010262106_100000210147 [0,2,0,0,0,0|0,0,1]=3 8663 B12R0.248 CCOCCOCCOC(C)C#N 34a_100011218135_100011211534 [0,2,0,0,0,0|0,0,0]=2 8664 B12R0.248 CCOCCOCCOC(C)C#N 7a_100000210240_100000703298 [0,2,0,0,0,0|0,0,0]=2 8665 B12R0.248 CCOCCOCCOC(C)CC 34a_100000210240_100011215416 [0,2,0,0,0,0|0,0,0]=2 8666 B12R0.248 CCOCCOCCOC(C)CC 7a_100000210228_100011211534 [0,2,0,0,0,0|0,0,0]=2 8667 B12R0.248 CCOCCOCCOC(C)CC 7a_100000210240_100000758301 [0,2,0,0,0,0|0,0,0]=2 8668 B12R0.248 CCOCCOCCOC(C)CF 34a_100016041109_100011211534 [0,2,0,0,0,0|0,0,0]=2 8669 B12R0.248 CCOCCOCCOC(C)CF 7a_100016041109_100011211534 [0,2,0,0,0,0|0,0,0]=2 8670 B12R0.248 CCOCCOCCOC(C)CN 34a_100000210904_100011211534 [0,2,0,0,0,0|0,0,0]=2 8671 B12R0.248 CCOCCOCCOC(C)CO 34a_100000210240_100012180447 [0,2,0,0,0,0|0,0,0]=2 8672 B12R0.248 CCOCCOCCOC(C)CO 7a_100000210240_100012180447 [0,2,0,0,0,0|0,0,0]=2 8673 B12R0.248 CCOCCOCCSC(C)C#N 62a_100000703298_100011211534 [0,2,0,0,0,0|0,1,0]=3 8674 B12R0.248 CCOCCOCCSC(C)C#N 62a_100011211534_100000703298 [0,2,0,0,0,0|0,1,0]=3 8675 B12R0.248 CCOCCOCCSC(C)CC 62a_100000758301_100011211534 [0,2,0,0,0,0|0,1,0]=3 8676 B12R0.248 CCOCCOCCSC(C)CC 62a_100011211534_100000758301 [0,2,0,0,0,0|0,1,0]=3 8677 B12R0.248 CCOCCOCCSC(C)CO 62a_100012180447_100011211534 [0,2,0,0,0,0|0,1,0]=3 8678 B12R0.248 CCOCCOCCSC(C)OC 62a_100009879195_100011211534 [0,2,0,0,0,0|0,1,0]=3 8679 B12R0.248 CCOCCOCCSC(C)OC 62a_100011211534_100009879195 [0,2,0,0,0,0|0,1,0]=3 8680 B12R0.248 CCOCCOCCSC(F)C#N 62a_100011211534_200000117898 [0,2,0,0,0,0|0,1,1]=4 8681 B12R0.248 CCOCCOCCSC(F)C#N 62a_200000117898_100011211534 [0,2,0,0,0,0|0,1,1]=4 8682 B12R0.248 CCOCCOCCS[C@H](C)CO 62a_100011211534_100016084084 [0,2,0,0,0,0|0,1,0]=3 8683 B12R0.248 CCOCCOCCS[C@H](C)CO 62a_100016084084_100011211534 [0,2,0,0,0,0|0,1,0]=3 8684 B12R0.248 CCOCCSCCCN(C)CC 62a_100000210147_100015186262 [0,2,0,0,0,0|1,1,0]=4 8685 B12R0.248 CCOCCSCCOC(=O)NC 62a_100000210147_200011997002 [0,2,0,0,0,0|0,1,1]=4 8686 B12R0.248 CCOCCSCCOC(=O)NC 62a_200011997002_100011215890 [0,2,0,0,0,0|0,1,1]=4 8687 B12R0.248 CCSCCOCCCC(C)CC 7a_100011216074_100000757381 [0,2,0,0,0,0|1,1,0]=4 8688 B12R0.248 CCSCCOCCCN(C)CC 7a_100000212035_100015186262 [0,2,0,0,0,0|1,1,0]=4 8689 B12R0.248 CCSCCOCCC[C@@H](C)CN 34a_100160569302_100000757381 [0,2,0,0,0,0|1,1,0]=4 8690 B12R0.248 CCSCCOCCNC(=O)CC 34a_200000158885_100000757381 [0,2,0,0,0,0|1,1,0]=4 8691 B12R0.248 CCSCCOCCNC(=O)CC 7a_200000158885_100000757381 [0,2,0,0,0,0|1,1,0]=4 8692 B12R0.248 CCSCCOCCOC(=O)CC 7a_200000031056_100000757381 [0,2,0,0,0,0|0,1,0]=3 8693 B12R0.248 CCSCCOCCOC(=O)NC 34a_100000212035_200011997002 [0,2,0,0,0,0|0,1,1]=4 8694 B12R0.248 CCSCCOCCOC(=O)NC 7a_100000212035_200011997002 [0,2,0,0,0,0|0,1,1]=4 8695 B12R0.248 CCSCCOCCOC(=O)OC 34a_100010262106_100000757381 [0,2,0,0,0,0|0,1,1]=4 8696 B12R0.248 CN(CF)CCOCCOCCO 269982a_200014138305_100015361967 [0,2,0,0,0,0|2,0,0]=4 8697 B12R0.248 CN(CF)CCOCCOCCO 34a_200014138305_100015361967 [0,2,0,0,0,0|2,0,0]=4 8698 B12R0.248 CNC(=O)CCOCCOCCBr 34a_100000692535_100012179268 [0,2,0,0,0,0|2,0,0]=4 8699 B12R0.248 CNC(=O)CCOCCOCCBr 7a_100000692535_100000737683 [0,2,0,0,0,0|2,0,0]=4 8700 B12R0.248 CNC(=O)CCOCCOCCCl 34a_100011215305_100012179268 [0,2,0,0,0,0|2,0,0]=4 8701 B12R0.248 CNC(=O)CCOCCOCCCl 7a_100011215305_100000737683 [0,2,0,0,0,0|2,0,0]=4 8702 B12R0.248 CNC(=O)CCOCCOCCF 34a_200015357709_100012179268 [0,2,0,0,0,0|2,0,0]=4 8703 B12R0.248 CNC(=O)CCOCCOCCF 7a_200015357709_100000737683 [0,2,0,0,0,0|2,0,0]=4 8704 B12R0.248 CNC(=O)CCOCCOCCI 34a_100012149058_100012179268 [0,2,0,0,0,0|2,0,0]=4 8705 B12R0.248 CNC(=O)CCOCCOCCI 7a_100012149058_100000737683 [0,2,0,0,0,0|2,0,0]=4 8706 B12R0.248 CNC(=O)CCOCCOCCN 34a_100000211614_100012179268 [0,2,0,0,0,0|2,0,0]=4 8707 B12R0.248 CNC(=O)CCOCCOCCO 1626a_100102657272_100009915118 [0,2,0,0,0,0|2,0,0]=4 8708 B12R0.248 CNC(=O)CCOCCOCCO 240690a_100102657272_100009915118 [0,2,0,0,0,0|2,0,0]=4 8709 B12R0.248 CNC(=O)CCOCCOCCO 34a_100000754576_100000692535 [0,2,0,0,0,0|2,0,0]=4 8710 B12R0.248 COC(=O)CCOCCOCCBr 34a_100000692535_100000742370 [0,2,0,0,0,0|2,0,0]=4 8711 B12R0.248 COC(=O)CCOCCOCCBr 7a_100000692535_100000204255 [0,2,0,0,0,0|2,0,0]=4 8712 B12R0.248 COC(=O)CCOCCOCCCl 34a_100011215305_100000742370 [0,2,0,0,0,0|2,0,0]=4 8713 B12R0.248 COC(=O)CCOCCOCCCl 7a_100011215305_100000204255 [0,2,0,0,0,0|2,0,0]=4 8714 B12R0.248 COC(=O)CCOCCOCCF 34a_200015357709_100000742370 [0,2,0,0,0,0|2,0,0]=4 8715 B12R0.248 COC(=O)CCOCCOCCF 7a_200015357709_100000204255 [0,2,0,0,0,0|2,0,0]=4 8716 B12R0.248 COC(=O)CCOCCOCCI 34a_100012149058_100000742370 [0,2,0,0,0,0|2,0,0]=4 8717 B12R0.248 COC(=O)CCOCCOCCI 7a_100012149058_100000204255 [0,2,0,0,0,0|2,0,0]=4 8718 B12R0.248 COC(=O)CCOCCOCCN 34a_100000211614_100000742370 [0,2,0,0,0,0|2,0,0]=4 8719 B12R0.248 COC(C)CCOCCOCCO 7a_100000764861_100011215305 [0,2,0,0,0,0|2,0,0]=4 8720 B12R0.248 O=C(CF)CCOCCOCCO 1458a_100009915118_100015361967 [0,2,0,0,0,0|2,0,0]=4 8721 B12R0.248 O=C(CO)CCOCCOCCO 1458a_100000210174_100000032323 [0,2,0,0,0,0|2,0,0]=4 8722 B12R0.4 CCCCCCCC(C)OC(C)C 34a_100000212225_200011218727 [0,2,0,0,0,0|2,0,0]=4 8723 B12R0.4 CCCCCCCC(C)OC(C)C 34a_200011215852_100000210206 [0,2,0,0,0,0|2,0,0]=4 8724 B12R0.4 CCCCCCCC(C)OC(C)C 7a_200011215852_100000210206 [0,2,0,0,0,0|2,0,0]=4 8725 B12R0.4 CCCCCOCC(=O)OC(C)C 34a_100000210253_100011215430 [0,2,0,0,0,0|1,0,1]=4 8726 B12R0.4 CCCCCOCC(=O)OC(C)C 7a_100000210253_100011215430 [0,2,0,0,0,0|1,0,1]=4 8727 B12R0.4 CCCCCOC[C@@H](N)CC(C)C 34a_100011830311_100000718602 [0,2,0,0,0,0|2,0,0]=4 8728 B12R0.4 CCOCCNCC(=O)OC(C)C 2230a_102516460346_100011215430 [0,2,0,0,0,0|1,0,1]=4 8729 B12R0.4 CCOCCNCC(=O)OC(C)C 34a_102516460346_100011215430 [0,2,0,0,0,0|1,0,1]=4 8730 B12R0.4 CCOCCOCC(=O)NC(C)C 34a_100000210136_100000183996 [0,2,0,0,0,0|1,0,1]=4 8731 B12R0.4 CCOCCOCC(=O)NC(C)C 7a_100000210136_100000183996 [0,2,0,0,0,0|1,0,1]=4 8732 B12R0.4 CCOCCOCC(=O)OC(C)C 34a_100000210136_100011215430 [0,2,0,0,0,0|0,0,1]=3 8733 B12R0.4 CCOCCOCC(=O)OC(C)C 7a_100000210136_100011215430 [0,2,0,0,0,0|0,0,1]=3 8734 B12R0.4 CCOCCOCC(C)CN(C)C 7a_100000210136_100015348159 [0,2,0,0,0,0|2,0,0]=4 8735 B12R0.4 CCOCCOC[C@@H](N)CC(C)C 34a_100011830311_100000210147 [0,2,0,0,0,0|1,0,0]=3 8736 B12R0.4 CCOCCSCC(=O)OC(C)C 62a_100000210147_100011215430 [0,2,0,0,0,0|0,1,1]=4 8737 B12R0.4 CCOCCSCC(=O)OC(C)C 62a_100011215430_100011215890 [0,2,0,0,0,0|0,1,1]=4 8738 B12R0.4 CCSCCOCC(=O)OC(C)C 34a_100000212035_100011215430 [0,2,0,0,0,0|0,1,1]=4 8739 B12R0.4 CCSCCOCC(=O)OC(C)C 7a_100000212035_100011215430 [0,2,0,0,0,0|0,1,1]=4 8740 B12R0.4 CCSCCOC[C@@H](N)CC(C)C 34a_100011830311_100000757381 [0,2,0,0,0,0|1,1,0]=4 8741 B12R0.49 CCCCCOCC(C)N(C)CC 7a_100000732741_100000210326 [0,2,0,0,0,0|2,0,0]=4 8742 B12R0.49 CCOCCOCC(=O)N(C)CC 34a_100000210136_100000738999 [0,2,0,0,0,0|1,0,1]=4 8743 B12R0.49 CCOCCOCC(=O)N(C)CC 7a_100000210136_100000738999 [0,2,0,0,0,0|1,0,1]=4 8744 B12R0.49 CCOCCOCC(C)C(=O)OC 34a_100000210136_100000698445 [0,2,0,0,0,0|2,0,0]=4 8745 B12R0.49 CCOCCOCC(C)C(=O)OC 34a_100000749362_100000210147 [0,2,0,0,0,0|2,0,0]=4 8746 B12R0.49 CCOCCOCC(C)C(=O)OC 7a_100000749362_100011215890 [0,2,0,0,0,0|2,0,0]=4 8747 B12R0.49 CCOCCOCC(C)N(C)CC 7a_100000732741_100011215890 [0,2,0,0,0,0|1,0,0]=3 8748 B12R0.49 CCOCCOCC(F)C(=O)OC 34a_200009849844_100000210147 [0,2,0,0,0,0|2,0,0]=4 8749 B12R0.49 CCOCCOC[C@@H](N)C(=O)OC 34a_100000003586_100000210147 [0,2,0,0,0,0|2,0,0]=4 8750 B12R0.49 CCSCCOCC(C)N(C)CC 7a_100000732741_100000757381 [0,2,0,0,0,0|1,1,0]=4 8751 B12R0.101 CCCC(=O)COC(C)COCC 7a_100000718985_100000747444 [0,2,0,0,0,0|1,0,1]=4 8752 B12R0.101 CCCC(C)COC(C)COCC 34a_100000718985_100011216630 [0,2,0,0,0,0|1,0,0]=3 8753 B12R0.101 CCCC(C)COC(C)COCC 7a_100000718985_100011216630 [0,2,0,0,0,0|1,0,0]=3 8754 B12R0.101 CCCCC(C)OCC(=O)OCC 34a_100000687866_100000188475 [0,2,0,0,0,0|1,0,1]=4 8755 B12R0.101 CCCCC(C)OCC(=O)OCC 7a_100000687866_100000188475 [0,2,0,0,0,0|1,0,1]=4 8756 B12R0.101 CCCCC(C)OCC(C)CCC 34a_100000687866_100011216630 [0,2,0,0,0,0|2,0,0]=4 8757 B12R0.101 CCCCC(C)OCC(C)CCC 34a_100000688023_200011215066 [0,2,0,0,0,0|2,0,0]=4 8758 B12R0.101 CCCCC(C)OCC(C)CCC 7a_100000687866_100011216630 [0,2,0,0,0,0|2,0,0]=4 8759 B12R0.101 CCCCC(C)OCC(C)CCC 7a_100000688023_200011215066 [0,2,0,0,0,0|2,0,0]=4 8760 B12R0.101 CCCCC(C)OC[C@@H](N)CCC 34a_100000732646_200011215066 [0,2,0,0,0,0|2,0,0]=4 8761 B12R0.101 CCNC(=O)COC(C)COCC 34a_100000718985_100000183381 [0,2,0,0,0,0|1,0,1]=4 8762 B12R0.101 CCNC(=O)COC(C)COCC 7a_100000718985_100000183381 [0,2,0,0,0,0|1,0,1]=4 8763 B12R0.101 CCOCC(C)OCC(=O)OCC 34a_100000718985_100000188475 [0,2,0,0,0,0|0,0,1]=3 8764 B12R0.101 CCOCC(C)OCC(=O)OCC 7a_100000718985_100000188475 [0,2,0,0,0,0|0,0,1]=3 8765 B12R0.101 CCOCC(C)OCC(O)COC 34a_100000718985_100011215053 [0,2,0,0,0,0|2,0,0]=4 8766 B12R0.101 CCOCC(C)OCC(O)COC 7a_100000718985_100011215053 [0,2,0,0,0,0|2,0,0]=4 8767 B12R0.114 CCCC(=O)C(C)OCCOCC 1458a_100000743585_100000210303 [0,2,0,0,0,0|1,0,1]=4 8768 B12R0.114 CCCC(C)C(C)NCCOCC 270004a_102516460346_100011216282 [0,2,0,0,0,0|2,0,0]=4 8769 B12R0.114 CCCC(C)C(C)OCCOCC 34a_100000708338_100000210147 [0,2,0,0,0,0|1,0,0]=3 8770 B12R0.114 CCCC(C)C(C)OCCOCC 7a_100000708338_100011215890 [0,2,0,0,0,0|1,0,0]=3 8771 B12R0.114 CCCC(C)C(C)OCCSCC 34a_100000708338_100000757381 [0,2,0,0,0,0|1,1,0]=4 8772 B12R0.114 CCCC(C)C(C)OCCSCC 7a_100000708338_100000757381 [0,2,0,0,0,0|1,1,0]=4 8773 B12R0.114 CCCCCOC(C)C(=O)OCC 34a_100000210253_100011216346 [0,2,0,0,0,0|1,0,1]=4 8774 B12R0.114 CCCCCOC(C)C(=O)OCC 7a_100000210253_100011216346 [0,2,0,0,0,0|1,0,1]=4 8775 B12R0.114 CCCCCOC(C)C(C)CCC 34a_100000708338_100000718602 [0,2,0,0,0,0|2,0,0]=4 8776 B12R0.114 CCCCCOC(C)C(C)CCC 7a_100000708338_100000210326 [0,2,0,0,0,0|2,0,0]=4 8777 B12R0.114 CCCCCOC(F)C(=O)OCC 34a_100000210253_100000760018 [0,2,0,0,0,0|1,0,1]=4 8778 B12R0.114 CCCCCOC(F)C(=O)OCC 7a_100000210253_100000040065 [0,2,0,0,0,0|1,0,1]=4 8779 B12R0.114 CCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210326 [0,2,0,0,0,0|1,0,1]=4 8780 B12R0.114 CCNC(=O)C(C)OCCOCC 11a_100015525214_100000743585 [0,2,0,0,0,0|1,0,1]=4 8781 B12R0.114 CCNC(=O)C(C)OCCOCC 240690a_100015525214_100000743585 [0,2,0,0,0,0|1,0,1]=4 8782 B12R0.114 CCNC(=O)C(C)OCCOCC 34a_100000210136_100000230173 [0,2,0,0,0,0|1,0,1]=4 8783 B12R0.114 CCNC(=O)C(C)OCCOCC 527a_100015525214_100000743585 [0,2,0,0,0,0|1,0,1]=4 8784 B12R0.114 CCNC(=O)C(C)OCCOCC 7a_100000210136_100000230173 [0,2,0,0,0,0|1,0,1]=4 8785 B12R0.114 CCOC(=O)C(C)OCCSCC 34a_100000212035_100011216346 [0,2,0,0,0,0|0,1,1]=4 8786 B12R0.114 CCOC(=O)C(C)OCCSCC 7a_100000212035_100011216346 [0,2,0,0,0,0|0,1,1]=4 8787 B12R0.114 CCOC(=O)C(F)OCCSCC 34a_100000212035_100000760018 [0,2,0,0,0,0|0,1,1]=4 8788 B12R0.114 CCOC(=O)C(F)OCCSCC 7a_100000212035_100000040065 [0,2,0,0,0,0|0,1,1]=4 8789 B12R0.114 CCOC(=O)[C@H](C)OCCSCC 7a_100000751109_100000757381 [0,2,0,0,0,0|0,1,1]=4 8790 B12R0.114 CCOCCCC(=O)C(C)OCC 1458a_100000739345_100012232248 [0,2,0,0,0,0|1,0,1]=4 8791 B12R0.114 CCOCCNC(=O)C(C)OCC 11a_100011200944_100000739345 [0,2,0,0,0,0|1,0,1]=4 8792 B12R0.114 CCOCCNC(=O)C(C)OCC 1626a_102516460346_100000739345 [0,2,0,0,0,0|1,0,1]=4 8793 B12R0.114 CCOCCNC(=O)C(C)OCC 240690a_100011200944_100000739345 [0,2,0,0,0,0|1,0,1]=4 8794 B12R0.114 CCOCCNC(=O)C(C)OCC 527a_100011200944_100000739345 [0,2,0,0,0,0|1,0,1]=4 8795 B12R0.114 CCOCCNC(C)C(=O)OCC 2230a_102516460346_100011215307 [0,2,0,0,0,0|1,0,1]=4 8796 B12R0.114 CCOCCNC(C)C(=O)OCC 34a_102516460346_100011216346 [0,2,0,0,0,0|1,0,1]=4 8797 B12R0.114 CCOCCNC(F)C(=O)OCC 2230a_102516460346_100000760018 [0,2,0,0,0,0|1,0,1]=4 8798 B12R0.114 CCOCCNC(F)C(=O)OCC 34a_102516460346_100000760018 [0,2,0,0,0,0|1,0,1]=4 8799 B12R0.114 CCOCCOC(C)C(=O)OCC 34a_100000210136_100011216346 [0,2,0,0,0,0|0,0,1]=3 8800 B12R0.114 CCOCCOC(C)C(=O)OCC 7a_100000210136_100011216346 [0,2,0,0,0,0|0,0,1]=3 8801 B12R0.114 CCOCCOC(F)C(=O)OCC 34a_100000210136_100000760018 [0,2,0,0,0,0|0,0,1]=3 8802 B12R0.114 CCOCCOC(F)C(=O)OCC 7a_100000210136_100000040065 [0,2,0,0,0,0|0,0,1]=3 8803 B12R0.114 CCOCCO[C@@H](C)C(=O)OCC 7a_100000751109_100011215890 [0,2,0,0,0,0|0,0,1]=3 8804 B12R0.114 CCOCCSC(C)C(=O)OCC 62a_100000210147_100011216346 [0,2,0,0,0,0|0,1,1]=4 8805 B12R0.114 CCOCCSC(C)C(=O)OCC 62a_100011216346_100011215890 [0,2,0,0,0,0|0,1,1]=4 8806 B12R0.114 CCOCCSC(F)C(=O)OCC 62a_100000210147_100000760018 [0,2,0,0,0,0|0,1,1]=4 8807 B12R0.114 CCOCCSC(F)C(=O)OCC 62a_100000760018_100011215890 [0,2,0,0,0,0|0,1,1]=4 8808 B12R0.121 C=CC(CCCCCCC)OCC 34a_200011934235_100000210202 [0,2,0,0,0,0|2,0,0]=4 8809 B12R0.121 C=CC(CCCCCCC)OCC 7a_200011934235_100000210202 [0,2,0,0,0,0|2,0,0]=4 8810 B12R0.121 CCCCCCCC(CC)OCC 34a_200011217053_100000210202 [0,2,0,0,0,0|2,0,0]=4 8811 B12R0.121 CCCCCCCC(CC)OCC 7a_200011217053_100000210202 [0,2,0,0,0,0|2,0,0]=4 8812 B12R0.121 CCCCCNCC(CC)OCC 2230a_100015183923_100000210326 [0,2,0,0,0,0|2,0,0]=4 8813 B12R0.121 CCCCCNCC(CC)OCC 34a_100015183923_100000718602 [0,2,0,0,0,0|2,0,0]=4 8814 B12R0.121 CCOC(CC)CNCCSCC 2230a_100015183923_100000757381 [0,2,0,0,0,0|1,1,0]=4 8815 B12R0.121 CCOC(CC)CNCCSCC 34a_100015183923_100000757381 [0,2,0,0,0,0|1,1,0]=4 8816 B12R0.121 CCOCCNCC(CC)OCC 2230a_100015183923_100011215890 [0,2,0,0,0,0|1,0,0]=3 8817 B12R0.121 CCOCCNCC(CC)OCC 34a_100015183923_100000210147 [0,2,0,0,0,0|1,0,0]=3 8818 B12R0.239 CCCC(C)CC(=O)CCOCC 1458a_100000748435_100011215890 [0,2,0,0,0,0|2,0,0]=4 8819 B12R0.239 CCCC(C)CC(=O)CCOCC 1458a_100000749530_100011216630 [0,2,0,0,0,0|2,0,0]=4 8820 B12R0.239 CCOCCC(=O)CC(=O)OCC 1458a_100000243816_100011215890 [0,2,0,0,0,0|1,0,1]=4 8821 B12R0.239 CCOCCC(=O)CC(=O)OCC 1458a_100000749530_100000188475 [0,2,0,0,0,0|1,0,1]=4 8822 B12R0.239 CCOCCC(=O)CC(C)SCC 1458a_200011311441_100011215890 [0,2,0,0,0,0|1,1,0]=4 8823 B12R0.239 CCOCCN(C)CC(=O)OCC 2230a_100000220588_100011215890 [0,2,0,0,0,0|1,0,1]=4 8824 B12R0.276 CCCC(C)COCCC(C)CC 7a_100011215188_100011216630 [0,2,0,0,0,0|2,0,0]=4 8825 B12R0.276 CCOC(=O)COCCC(=O)CC 1458a_100000210414_100000088970 [0,2,0,0,0,0|1,0,1]=4 8826 B12R0.276 CCOC(=O)COCCC(C)CC 7a_100011215188_100000188475 [0,2,0,0,0,0|1,0,1]=4 8827 B12R0.276 CCOC(=O)COCCN(C)CC 2230a_100000225621_100000088970 [0,2,0,0,0,0|1,0,1]=4 8828 B12R0.276 CCOC(=O)COCCN(C)CC 269982a_100000225621_100000088970 [0,2,0,0,0,0|1,0,1]=4 8829 B12R0.277 CC(CCN)COCCOC(C)C 34a_106354213184_100000211751 [0,2,0,0,0,0|2,0,0]=4 8830 B12R0.277 CCCC(=O)COCCOC(C)C 7a_100000211219_100000747444 [0,2,0,0,0,0|1,0,1]=4 8831 B12R0.277 CCCC(C)CNCCOC(C)C 2230a_100000701111_100011216630 [0,2,0,0,0,0|2,0,0]=4 8832 B12R0.277 CCCC(C)CNCCOC(C)C 270004a_100000701111_100000243154 [0,2,0,0,0,0|2,0,0]=4 8833 B12R0.277 CCCC(C)CNCCOC(C)C 34a_100000701111_100011216630 [0,2,0,0,0,0|2,0,0]=4 8834 B12R0.277 CCCC(C)COCCCC(C)C 34a_100000210774_100011216630 [0,2,0,0,0,0|2,0,0]=4 8835 B12R0.277 CCCC(C)COCCCC(C)C 34a_100000688023_100011214892 [0,2,0,0,0,0|2,0,0]=4 8836 B12R0.277 CCCC(C)COCCCC(C)C 7a_100000210774_100011216630 [0,2,0,0,0,0|2,0,0]=4 8837 B12R0.277 CCCC(C)COCCCC(C)C 7a_100000688023_100011214892 [0,2,0,0,0,0|2,0,0]=4 8838 B12R0.277 CCCC(C)COCCCC(C)O 34a_100000688023_200000718107 [0,2,0,0,0,0|2,0,0]=4 8839 B12R0.277 CCCC(C)COCCCC(C)O 7a_100000688023_200000718107 [0,2,0,0,0,0|2,0,0]=4 8840 B12R0.277 CCCC(C)COCCNC(C)C 34a_100000224655_100011216630 [0,2,0,0,0,0|2,0,0]=4 8841 B12R0.277 CCCC(C)COCCOC(=O)C 34a_100000688023_100009814007 [0,2,0,0,0,0|1,0,1]=4 8842 B12R0.277 CCCC(C)COCCOC(=O)C 7a_100000688023_100009814007 [0,2,0,0,0,0|1,0,1]=4 8843 B12R0.277 CCCC(C)COCCOC(C)C 34a_100000211219_100011216630 [0,2,0,0,0,0|1,0,0]=3 8844 B12R0.277 CCCC(C)COCCOC(C)C 34a_100000688023_100000211751 [0,2,0,0,0,0|1,0,0]=3 8845 B12R0.277 CCCC(C)COCCOC(C)C 7a_100000211219_100011216630 [0,2,0,0,0,0|1,0,0]=3 8846 B12R0.277 CCCC(C)COCCOC(C)C 7a_100000688023_100000211751 [0,2,0,0,0,0|1,0,0]=3 8847 B12R0.277 CCCC(C)COCCSC(C)C 34a_100000688023_100000730970 [0,2,0,0,0,0|1,1,0]=4 8848 B12R0.277 CCCC(C)COCCSC(C)C 34a_200011212901_100011216630 [0,2,0,0,0,0|1,1,0]=4 8849 B12R0.277 CCCC(C)COCCSC(C)C 7a_100000688023_100000730970 [0,2,0,0,0,0|1,1,0]=4 8850 B12R0.277 CCCC(C)COCCSC(C)C 7a_200011212901_100011216630 [0,2,0,0,0,0|1,1,0]=4 8851 B12R0.277 CCCC(C)CSCCOC(C)C 62a_100000211751_100011216630 [0,2,0,0,0,0|1,1,0]=4 8852 B12R0.277 CCCC(C)CSCCOC(C)C 62a_100011216630_100000211751 [0,2,0,0,0,0|1,1,0]=4 8853 B12R0.277 CCC[C@H](N)COCCCC(C)C 34a_100000732646_100011214892 [0,2,0,0,0,0|2,0,0]=4 8854 B12R0.277 CCC[C@H](N)COCCCC(C)O 34a_100000732646_200000718107 [0,2,0,0,0,0|2,0,0]=4 8855 B12R0.277 CCC[C@H](N)COCCOC(=O)C 34a_100000732646_100009814007 [0,2,0,0,0,0|1,0,1]=4 8856 B12R0.277 CCC[C@H](N)COCCOC(C)C 34a_100000732646_100000211751 [0,2,0,0,0,0|1,0,0]=3 8857 B12R0.277 CCC[C@H](N)COCCSC(C)C 34a_100000732646_100000730970 [0,2,0,0,0,0|1,1,0]=4 8858 B12R0.277 CCNC(=O)COCCOC(C)C 34a_100000211219_100000183381 [0,2,0,0,0,0|1,0,1]=4 8859 B12R0.277 CCNC(=O)COCCOC(C)C 7a_100000211219_100000183381 [0,2,0,0,0,0|1,0,1]=4 8860 B12R0.277 CCOC(=O)CCCCOC(C)C 34a_100000212225_100000750268 [0,2,0,0,0,0|1,0,1]=4 8861 B12R0.277 CCOC(=O)CNCCOC(C)C 2230a_100000701111_100000188475 [0,2,0,0,0,0|1,0,1]=4 8862 B12R0.277 CCOC(=O)CNCCOC(C)C 34a_100000701111_100000188475 [0,2,0,0,0,0|1,0,1]=4 8863 B12R0.277 CCOC(=O)COCCCC(C)C 34a_100000210774_100000188475 [0,2,0,0,0,0|1,0,1]=4 8864 B12R0.277 CCOC(=O)COCCCC(C)C 7a_100000210774_100000188475 [0,2,0,0,0,0|1,0,1]=4 8865 B12R0.277 CCOC(=O)COCCNC(C)C 2230a_100138425928_100000088970 [0,2,0,0,0,0|1,0,1]=4 8866 B12R0.277 CCOC(=O)COCCNC(C)C 34a_100000224655_100000188475 [0,2,0,0,0,0|1,0,1]=4 8867 B12R0.277 CCOC(=O)COCCNC(C)C 34a_100138425928_100000088970 [0,2,0,0,0,0|1,0,1]=4 8868 B12R0.277 CCOC(=O)COCCOC(C)C 34a_100000211219_100000188475 [0,2,0,0,0,0|0,0,1]=3 8869 B12R0.277 CCOC(=O)COCCOC(C)C 34a_100000212225_100000088970 [0,2,0,0,0,0|0,0,1]=3 8870 B12R0.277 CCOC(=O)COCCOC(C)C 7a_100000211219_100000188475 [0,2,0,0,0,0|0,0,1]=3 8871 B12R0.277 CCOC(=O)COCCSC(C)C 34a_200011212901_100000188475 [0,2,0,0,0,0|0,1,1]=4 8872 B12R0.277 CCOC(=O)COCCSC(C)C 62a_100000088970_100000210206 [0,2,0,0,0,0|0,1,1]=4 8873 B12R0.277 CCOC(=O)COCCSC(C)C 62a_100000210206_100000088970 [0,2,0,0,0,0|0,1,1]=4 8874 B12R0.277 CCOC(=O)COCCSC(C)C 7a_200011212901_100000188475 [0,2,0,0,0,0|0,1,1]=4 8875 B12R0.277 CCOC(=O)CSCCOC(C)C 62a_100000188475_100000211751 [0,2,0,0,0,0|0,1,1]=4 8876 B12R0.277 CCOC(=O)CSCCOC(C)C 62a_100000211751_100000188475 [0,2,0,0,0,0|0,1,1]=4 8877 B12R0.277 CCOC(=O)CSCCOC(C)C 7a_200000230590_100000210206 [0,2,0,0,0,0|0,1,1]=4 8878 B12R0.277 COCC(N)COCCOC(C)C 34a_100000724102_100000211751 [0,2,0,0,0,0|2,0,0]=4 8879 B12R0.277 COCC(O)COCCOC(C)C 34a_100000211219_100011215053 [0,2,0,0,0,0|2,0,0]=4 8880 B12R0.277 COCC(O)COCCOC(C)C 7a_100000211219_100011215053 [0,2,0,0,0,0|2,0,0]=4 8881 B12R0.285 CCCC(C)COCC(=O)OCC 34a_100000688023_100000188475 [0,2,0,0,0,0|1,0,1]=4 8882 B12R0.285 CCCC(C)COCC(=O)OCC 7a_100000688023_100000188475 [0,2,0,0,0,0|1,0,1]=4 8883 B12R0.285 CCCC(C)COCC(C)CCC 34a_100000688023_100011216630 [0,2,0,0,0,0|2,0,0]=4 8884 B12R0.285 CCCC(C)COCC(C)CCC 7a_100000688023_100011216630 [0,2,0,0,0,0|2,0,0]=4 8885 B12R0.285 CCCC(C)COC[C@@H](N)CCC 34a_100000732646_100011216630 [0,2,0,0,0,0|2,0,0]=4 8886 B12R0.285 CCC[C@H](N)COCC(=O)OCC 34a_100000732646_100000188475 [0,2,0,0,0,0|1,0,1]=4 8887 B12R0.434 CCCC(C)(C)COCCOCC 7a_100011995695_100011215890 [0,2,0,0,0,0|1,0,0]=3 8888 B12R0.434 CCCC(C)(C)COCCSCC 7a_100011995695_100000757381 [0,2,0,0,0,0|1,1,0]=4 8889 B12R0.434 CCCCCCCC(C)(C)OCC 34a_100121572206_200000046972 [0,2,0,0,0,0|2,0,0]=4 8890 B12R0.434 CCCCCOCC(C)(C)CCC 7a_100011995695_100000210326 [0,2,0,0,0,0|2,0,0]=4 8891 B12R0.434 CCCCCOCC(C)(C)NCC 7a_100000747347_100000210326 [0,2,0,0,0,0|2,0,0]=4 8892 B12R0.434 CCNC(C)(C)COCCOCC 7a_100000747347_100011215890 [0,2,0,0,0,0|1,0,0]=3 8893 B12R0.434 CCNC(C)(C)COCCSCC 7a_100000747347_100000757381 [0,2,0,0,0,0|1,1,0]=4 8894 B12R0.434 CCOCCSC[Si](C)(C)OCC 62a_100000210147_200000065227 [0,2,0,0,0,0|0,2,0]=4 8895 B12R0.434 CCOCCSC[Si](C)(C)OCC 62a_200000065227_100011215890 [0,2,0,0,0,0|0,2,0]=4 8896 B12R0.57 CCCCCOCCN(CC)CC 7a_100000210253_100000700428 [0,2,0,0,0,0|2,0,0]=4 8897 B12R0.57 CCCCCOCCN(CC)CC 7a_100016990331_100000210326 [0,2,0,0,0,0|2,0,0]=4 8898 B12R0.57 CCN(CC)CCOCCOCF 7a_100011217740_100015361967 [0,2,0,0,0,0|2,0,0]=4 8899 B12R0.57 CCOCCCCCN(CC)CC 7a_200011629222_100000210202 [0,2,0,0,0,0|2,0,0]=4 8900 B12R0.57 CCOCCNCCN(CC)CC 2230a_100015382049_100011215890 [0,2,0,0,0,0|2,0,0]=4 8901 B12R0.57 CCOCCNCCN(CC)CC 2230a_102516460346_100000700428 [0,2,0,0,0,0|2,0,0]=4 8902 B12R0.57 CCOCCOCCC(OC)OC 34a_100000210136_100000139399 [0,2,0,0,0,0|2,0,0]=4 8903 B12R0.57 CCOCCOCCC(OC)OC 7a_100000210136_100009813347 [0,2,0,0,0,0|2,0,0]=4 8904 B12R0.57 CCOCCOCCN(CC)CC 2230a_100000724800_100011211534 [0,2,0,0,0,0|1,0,0]=3 8905 B12R0.57 CCOCCOCCN(CC)CC 269956a_100000042499_100011211534 [0,2,0,0,0,0|1,0,0]=3 8906 B12R0.57 CCOCCOCCN(CC)CC 269982a_100000724800_100011211534 [0,2,0,0,0,0|1,0,0]=3 8907 B12R0.57 CCOCCOCCN(CC)CC 7a_100000210136_100000700428 [0,2,0,0,0,0|1,0,0]=3 8908 B12R0.57 CCOCCOCCN(CC)CC 7a_100011217740_100000210202 [0,2,0,0,0,0|1,0,0]=3 8909 B12R0.57 CCOCCOCCN(CC)CC 7a_100016990331_100011215890 [0,2,0,0,0,0|1,0,0]=3 8910 B12R0.57 CCOCCSCCN(CC)CC 62a_100000210147_100000700428 [0,2,0,0,0,0|1,1,0]=4 8911 B12R0.57 CCSCCOCCN(CC)CC 7a_100000212035_100000700428 [0,2,0,0,0,0|1,1,0]=4 8912 B12R0.57 CCSCCOCCN(CC)CC 7a_100016990331_100000757381 [0,2,0,0,0,0|1,1,0]=4 8913 B12R0.102 CCCCC(C)OCCC(C)CC 7a_100011215188_200011215066 [0,2,0,0,0,0|2,0,0]=4 8914 B12R0.102 CCOCC(C)OCCC(=O)NC 34a_100000718985_100012179268 [0,2,0,0,0,0|2,0,0]=4 8915 B12R0.102 CCOCC(C)OCCC(=O)NC 7a_100000718985_100000737683 [0,2,0,0,0,0|2,0,0]=4 8916 B12R0.102 CCOCC(C)OCCC(=O)OC 34a_100000718985_100000742370 [0,2,0,0,0,0|2,0,0]=4 8917 B12R0.102 CCOCC(C)OCCC(=O)OC 7a_100000718985_100000204255 [0,2,0,0,0,0|2,0,0]=4 8918 B12R0.113 CCOCCNC(C)CC(C)CC 2230a_100000763565_100011215890 [0,2,0,0,0,0|2,0,0]=4 8919 B12R0.113 CCOCCNC(C)CC(C)CC 270004a_102516460346_100011710205 [0,2,0,0,0,0|2,0,0]=4 8920 B12R0.113 CCOCCOC(=O)CC(=O)CC 1458a_100000210414_200000101388 [0,2,0,0,0,0|1,0,1]=4 8921 B12R0.113 CCOCCOC(=O)CN(C)CC 2230a_100000225621_200000101388 [0,2,0,0,0,0|1,0,1]=4 8922 B12R0.113 CCOCCOC(=O)CN(C)CC 269982a_100000225621_200000101388 [0,2,0,0,0,0|1,0,1]=4 8923 B12R0.113 CCOCCOC(C)CC(=O)OC 34a_100000210136_100009817358 [0,2,0,0,0,0|2,0,0]=4 8924 B12R0.113 CCOCCOC(C)CC(=O)OC 7a_100000210136_100009817358 [0,2,0,0,0,0|2,0,0]=4 8925 B12R0.142 CCOCCC(=O)CCC(C)CC 1458a_100000701222_100011215890 [0,2,0,0,0,0|2,0,0]=4 8926 B12R0.142 CCOCCC(=O)CCN(C)CC 1458a_100000755305_100011215890 [0,2,0,0,0,0|2,0,0]=4 8927 B12R0.142 CCOCCC(=O)CCS(=O)CC 1458a_100011387550_100011215890 [0,2,0,0,0,0|1,1,0]=4 8928 B12R0.184 CCC(=O)CCOCCOC(=O)C 1458a_100000210414_200000083610 [0,2,0,0,0,0|1,0,1]=4 8929 B12R0.184 CCC(C)CCCCCOC(C)C 7a_200000035636_100000210206 [0,2,0,0,0,0|2,0,0]=4 8930 B12R0.184 CCC(C)CCNCCOC(C)C 2230a_100020591266_100000211751 [0,2,0,0,0,0|2,0,0]=4 8931 B12R0.184 CCC(C)CCOCCCC(C)C 7a_100011215188_100011214892 [0,2,0,0,0,0|2,0,0]=4 8932 B12R0.184 CCC(C)CCOCCCC(C)O 7a_100011215188_200000718107 [0,2,0,0,0,0|2,0,0]=4 8933 B12R0.184 CCC(C)CCOCCOC(=O)C 7a_100011215188_100009814007 [0,2,0,0,0,0|1,0,1]=4 8934 B12R0.184 CCC(C)CCOCCOC(C)C 7a_100011215188_100000211751 [0,2,0,0,0,0|1,0,0]=3 8935 B12R0.184 CCC(C)CCOCCSC(C)C 7a_100011215188_100000730970 [0,2,0,0,0,0|1,1,0]=4 8936 B12R0.184 CCN(C)CCOCCOC(=O)C 2230a_100000225621_200000083610 [0,2,0,0,0,0|1,0,1]=4 8937 B12R0.184 CCN(C)CCOCCOC(=O)C 269982a_100000225621_200000083610 [0,2,0,0,0,0|1,0,1]=4 8938 B12R0.184 CNC(=O)CCOCCOC(C)C 34a_100000211219_100012179268 [0,2,0,0,0,0|2,0,0]=4 8939 B12R0.184 CNC(=O)CCOCCOC(C)C 34a_100000754576_100000211751 [0,2,0,0,0,0|2,0,0]=4 8940 B12R0.184 CNC(=O)CCOCCOC(C)C 7a_100000211219_100000737683 [0,2,0,0,0,0|2,0,0]=4 8941 B12R0.184 COC(=O)CCOCCOC(C)C 34a_100000211219_100000742370 [0,2,0,0,0,0|2,0,0]=4 8942 B12R0.184 COC(=O)CCOCCOC(C)C 7a_100000211219_100000204255 [0,2,0,0,0,0|2,0,0]=4 8943 B12R0.184 COC(C)CCOCCOC(C)C 7a_100000764861_100000211751 [0,2,0,0,0,0|2,0,0]=4 8944 B12R0.251 C=C(C)C(=O)CCOCCOCC 1458a_100000185857_100011211534 [0,2,0,0,0,0|1,0,1]=4 8945 B12R0.251 CCCCCOCCC(N)C(C)C 34a_100161115045_100000718602 [0,2,0,0,0,0|2,0,0]=4 8946 B12R0.251 CCOCCOCCC(=O)C(C)C 1458a_100000210198_100011211534 [0,2,0,0,0,0|1,0,0]=3 8947 B12R0.251 CCOCCOCCC(=O)C(C)F 1458a_100000062450_100011211534 [0,2,0,0,0,0|1,0,0]=3 8948 B12R0.251 CCOCCOCCC(=O)C(O)O 1458a_100000233687_100011211534 [0,2,0,0,0,0|2,0,0]=4 8949 B12R0.251 CCOCCOCCC(=O)N(C)C 34a_200000747469_100000210147 [0,2,0,0,0,0|2,0,0]=4 8950 B12R0.251 CCOCCOCCC(=O)N(C)C 7a_100000210136_100000737620 [0,2,0,0,0,0|2,0,0]=4 8951 B12R0.251 CCOCCOCCC(=O)[C@@H](C)O 1458a_100000717761_100011211534 [0,2,0,0,0,0|1,0,0]=3 8952 B12R0.251 CCOCCOCCC(=O)[C@H](C)O 1458a_217856618621_100011211534 [0,2,0,0,0,0|1,0,0]=3 8953 B12R0.251 CCOCCOCCC(N)C(C)C 34a_100161115045_100000210147 [0,2,0,0,0,0|1,0,0]=3 8954 B12R0.251 CCOCCOCCN(C)C(C)C 269982a_200000211004_100011211534 [0,2,0,0,0,0|1,0,0]=3 8955 B12R0.251 CCSCCOCCC(N)C(C)C 34a_100161115045_100000757381 [0,2,0,0,0,0|1,1,0]=4 8956 B12R0.312 CCCCCOCCS(=O)(=O)CC 34a_100000210253_100000756660 [0,2,0,0,0,0|1,1,0]=4 8957 B12R0.312 CCCCCOCCS(=O)(=O)CC 34a_200011216379_100000718602 [0,2,0,0,0,0|1,1,0]=4 8958 B12R0.312 CCCCCOCCS(=O)(=O)CC 7a_100000210253_100000756660 [0,2,0,0,0,0|1,1,0]=4 8959 B12R0.312 CCCCCOCCS(=O)(=O)CC 7a_200011216379_100000210326 [0,2,0,0,0,0|1,1,0]=4 8960 B12R0.312 CCOCCNCCS(=O)(=O)CC 2230a_100000751051_100011215890 [0,2,0,0,0,0|1,1,0]=4 8961 B12R0.312 CCOCCNCCS(=O)(=O)CC 2230a_102516460346_100000756660 [0,2,0,0,0,0|1,1,0]=4 8962 B12R0.312 CCOCCNCCS(=O)(=O)CC 34a_100000751051_100000210147 [0,2,0,0,0,0|1,1,0]=4 8963 B12R0.312 CCOCCNCCS(=O)(=O)CC 34a_102516460346_100000756660 [0,2,0,0,0,0|1,1,0]=4 8964 B12R0.312 CCOCCOCCC(C)(C)OC 7a_100000699976_100011215890 [0,2,0,0,0,0|2,0,0]=4 8965 B12R0.312 CCOCCOCCS(=O)(=O)CC 34a_100000210136_100000756660 [0,2,0,0,0,0|0,1,0]=3 8966 B12R0.312 CCOCCOCCS(=O)(=O)CC 34a_200011216379_100000210147 [0,2,0,0,0,0|0,1,0]=3 8967 B12R0.312 CCOCCOCCS(=O)(=O)CC 7a_100000210136_100000756660 [0,2,0,0,0,0|0,1,0]=3 8968 B12R0.312 CCOCCOCCS(=O)(=O)CC 7a_200011216379_100011215890 [0,2,0,0,0,0|0,1,0]=3 8969 B12R0.312 CCOCCSCCS(=O)(=O)CC 62a_100000210147_100000756660 [0,2,0,0,0,0|0,2,0]=4 8970 B12R0.312 CCOCCSCCS(=O)(=O)CC 62a_100000756660_100011215890 [0,2,0,0,0,0|0,2,0]=4 8971 B12R0.312 CCSCCOCCS(=O)(=O)CC 34a_100000212035_100000756660 [0,2,0,0,0,0|0,2,0]=4 8972 B12R0.312 CCSCCOCCS(=O)(=O)CC 34a_200011216379_100000757381 [0,2,0,0,0,0|0,2,0]=4 8973 B12R0.312 CCSCCOCCS(=O)(=O)CC 7a_100000212035_100000756660 [0,2,0,0,0,0|0,2,0]=4 8974 B12R0.312 CCSCCOCCS(=O)(=O)CC 7a_200011216379_100000757381 [0,2,0,0,0,0|0,2,0]=4 8975 B12R0.95 CC(C)OCCOC(C)CCCCl 34a_200000718107_100000211751 [0,2,0,0,0,0|2,0,0]=4 8976 B12R0.95 CC(C)OCCOC(C)CCCCl 7a_200000718107_100000211751 [0,2,0,0,0,0|2,0,0]=4 8977 B12R0.95 CCC#CC(C)OCCOC(C)C 34a_100000033903_100000211751 [0,2,0,0,0,0|1,0,1]=4 8978 B12R0.95 CCC#CC(C)OCCOC(C)C 7a_100000033903_100000211751 [0,2,0,0,0,0|1,0,1]=4 8979 B12R0.95 CCCCC(C)NCCOC(C)C 2230a_100000126638_100000211751 [0,2,0,0,0,0|2,0,0]=4 8980 B12R0.95 CCCCC(C)NCCOC(C)C 2230a_100000701111_200011215066 [0,2,0,0,0,0|2,0,0]=4 8981 B12R0.95 CCCCC(C)NCCOC(C)C 270004a_100000701111_100000210087 [0,2,0,0,0,0|2,0,0]=4 8982 B12R0.95 CCCCC(C)NCCOC(C)C 34a_100000701111_200011215066 [0,2,0,0,0,0|2,0,0]=4 8983 B12R0.95 CCCCC(C)OCCCC(C)C 34a_100000210774_200011215066 [0,2,0,0,0,0|2,0,0]=4 8984 B12R0.95 CCCCC(C)OCCCC(C)C 34a_100000687866_100011214892 [0,2,0,0,0,0|2,0,0]=4 8985 B12R0.95 CCCCC(C)OCCCC(C)C 7a_100000210774_200011215066 [0,2,0,0,0,0|2,0,0]=4 8986 B12R0.95 CCCCC(C)OCCCC(C)C 7a_100000687866_100011214892 [0,2,0,0,0,0|2,0,0]=4 8987 B12R0.95 CCCCC(C)OCCCC(C)O 34a_100000687866_200000718107 [0,2,0,0,0,0|2,0,0]=4 8988 B12R0.95 CCCCC(C)OCCCC(C)O 7a_100000687866_200000718107 [0,2,0,0,0,0|2,0,0]=4 8989 B12R0.95 CCCCC(C)OCCNC(C)C 34a_100000224655_200011215066 [0,2,0,0,0,0|2,0,0]=4 8990 B12R0.95 CCCCC(C)OCCOC(=O)C 34a_100000687866_100009814007 [0,2,0,0,0,0|1,0,1]=4 8991 B12R0.95 CCCCC(C)OCCOC(=O)C 7a_100000687866_100009814007 [0,2,0,0,0,0|1,0,1]=4 8992 B12R0.95 CCCCC(C)OCCOC(C)C 34a_100000211219_200011215066 [0,2,0,0,0,0|1,0,0]=3 8993 B12R0.95 CCCCC(C)OCCOC(C)C 34a_100000687866_100000211751 [0,2,0,0,0,0|1,0,0]=3 8994 B12R0.95 CCCCC(C)OCCOC(C)C 7a_100000211219_200011215066 [0,2,0,0,0,0|1,0,0]=3 8995 B12R0.95 CCCCC(C)OCCOC(C)C 7a_100000687866_100000211751 [0,2,0,0,0,0|1,0,0]=3 8996 B12R0.95 CCCCC(C)OCCSC(C)C 34a_100000687866_100000730970 [0,2,0,0,0,0|1,1,0]=4 8997 B12R0.95 CCCCC(C)OCCSC(C)C 34a_200011212901_200011215066 [0,2,0,0,0,0|1,1,0]=4 8998 B12R0.95 CCCCC(C)OCCSC(C)C 7a_100000687866_100000730970 [0,2,0,0,0,0|1,1,0]=4 8999 B12R0.95 CCCCC(C)OCCSC(C)C 7a_200011212901_200011215066 [0,2,0,0,0,0|1,1,0]=4 9000 B12R0.95 CCCCC(C)SCCOC(C)C 62a_100000211751_200011215066 [0,2,0,0,0,0|1,1,0]=4 9001 B12R0.95 CCCCC(C)SCCOC(C)C 62a_200011215066_100000211751 [0,2,0,0,0,0|1,1,0]=4 9002 B12R0.95 CCOCC(=O)NCCOC(C)C 11a_100000701111_100000211967 [0,2,0,0,0,0|1,0,1]=4 9003 B12R0.95 CCOCC(=O)NCCOC(C)C 1626a_100000701111_100000211967 [0,2,0,0,0,0|1,0,1]=4 9004 B12R0.95 CCOCC(=O)NCCOC(C)C 240690a_100000701111_100000211967 [0,2,0,0,0,0|1,0,1]=4 9005 B12R0.95 CCOCC(=O)NCCOC(C)C 527a_100000701111_100000211967 [0,2,0,0,0,0|1,0,1]=4 9006 B12R0.95 CCOCC(C)OCCC=C(C)C 34a_100000718985_100011217483 [0,2,0,0,0,0|1,0,1]=4 9007 B12R0.95 CCOCC(C)OCCC=C(C)C 7a_100000718985_100011217483 [0,2,0,0,0,0|1,0,1]=4 9008 B12R0.95 CCOCC(C)OCCCC(=O)C 34a_100000718985_100000685027 [0,2,0,0,0,0|1,0,1]=4 9009 B12R0.95 CCOCC(C)OCCCC(=O)C 7a_100000718985_100011215641 [0,2,0,0,0,0|1,0,1]=4 9010 B12R0.95 CCOCC(C)OCCCC(C)C 34a_100000718985_100011214892 [0,2,0,0,0,0|1,0,0]=3 9011 B12R0.95 CCOCC(C)OCCCC(C)C 7a_100000718985_100011214892 [0,2,0,0,0,0|1,0,0]=3 9012 B12R0.95 CCOCC(C)OCCCC(C)O 34a_100000718985_200000718107 [0,2,0,0,0,0|1,0,0]=3 9013 B12R0.95 CCOCC(C)OCCCC(C)O 7a_100000718985_200000718107 [0,2,0,0,0,0|1,0,0]=3 9014 B12R0.95 CCOCC(C)OCCCN(C)C 7a_100000718985_100000757444 [0,2,0,0,0,0|2,0,0]=4 9015 B12R0.95 CCOCC(C)OCCNC(=O)C 7a_100000718985_100000189650 [0,2,0,0,0,0|1,0,1]=4 9016 B12R0.95 CCOCC(C)OCCOC(=O)C 34a_100000718985_100009814007 [0,2,0,0,0,0|0,0,1]=3 9017 B12R0.95 CCOCC(C)OCCOC(=O)C 7a_100000718985_100009814007 [0,2,0,0,0,0|0,0,1]=3 9018 B12R0.95 CCOCC(C)OCCOC(=O)N 34a_100000718985_200011214921 [0,2,0,0,0,0|1,0,1]=4 9019 B12R0.95 CCOCC(C)OCCOC(=O)N 7a_100000718985_200011214921 [0,2,0,0,0,0|1,0,1]=4 9020 B12R0.95 CCOCC(C)OCCOC(C)C 34a_100000718985_100000211751 [0,2,0,0,0,0|0,0,0]=2 9021 B12R0.95 CCOCC(C)OCCOC(C)C 7a_100000718985_100000211751 [0,2,0,0,0,0|0,0,0]=2 9022 B12R0.95 CCOCC(C)OCCSC(C)C 34a_100000718985_100000730970 [0,2,0,0,0,0|0,1,0]=3 9023 B12R0.95 CCOCC(C)OCCSC(C)C 7a_100000718985_100000730970 [0,2,0,0,0,0|0,1,0]=3 9024 B12R0.95 CCOCC(O)CNCOC(C)C 2230a_102515437182_100000709892 [0,2,0,0,0,0|2,0,0]=4 9025 B12R0.95 CCOCC(O)CNCOC(C)C 34a_102515437182_100000709892 [0,2,0,0,0,0|2,0,0]=4 9026 B12R0.95 CCSCC(C)NCCOC(C)C 270004a_100000701111_200011216171 [0,2,0,0,0,0|1,1,0]=4 9027 B12R0.103 CCCCC(C)OC(C)CCCC 34a_100000687866_200011215066 [0,2,0,0,0,0|2,0,0]=4 9028 B12R0.103 CCCCC(C)OC(C)CCCC 7a_100000687866_200011215066 [0,2,0,0,0,0|2,0,0]=4 9029 B12R0.103 CCCCC(C)OC(C)COCC 34a_100000718985_200011215066 [0,2,0,0,0,0|1,0,0]=3 9030 B12R0.103 CCCCC(C)OC(C)COCC 7a_100000718985_200011215066 [0,2,0,0,0,0|1,0,0]=3 9031 B12R0.111 C#CC(CCCC)OCCCCC 34a_200011217967_100000718602 [0,2,0,0,0,0|2,0,0]=4 9032 B12R0.111 C#CC(CCCC)OCCCCC 7a_200011217967_100000210326 [0,2,0,0,0,0|2,0,0]=4 9033 B12R0.111 C#CC(CCCC)OCCOCC 34a_200011217967_100000210147 [0,2,0,0,0,0|1,0,0]=3 9034 B12R0.111 C#CC(CCCC)OCCOCC 7a_200011217967_100011215890 [0,2,0,0,0,0|1,0,0]=3 9035 B12R0.111 C#CC(CCCC)OCCSCC 34a_200011217967_100000757381 [0,2,0,0,0,0|1,1,0]=4 9036 B12R0.111 C#CC(CCCC)OCCSCC 7a_200011217967_100000757381 [0,2,0,0,0,0|1,1,0]=4 9037 B12R0.111 C=CC(CCCC)OCCCCC 34a_200011215037_100000718602 [0,2,0,0,0,0|2,0,0]=4 9038 B12R0.111 C=CC(CCCC)OCCCCC 7a_200011215037_100000210326 [0,2,0,0,0,0|2,0,0]=4 9039 B12R0.111 C=CC(CCCC)OCCOCC 34a_200011215037_100000210147 [0,2,0,0,0,0|1,0,0]=3 9040 B12R0.111 C=CC(CCCC)OCCOCC 7a_200011215037_100011215890 [0,2,0,0,0,0|1,0,0]=3 9041 B12R0.111 C=CC(CCCC)OCCSCC 34a_200011215037_100000757381 [0,2,0,0,0,0|1,1,0]=4 9042 B12R0.111 C=CC(CCCC)OCCSCC 7a_200011215037_100000757381 [0,2,0,0,0,0|1,1,0]=4 9043 B12R0.111 C=COCCOC(CN)COCC 34a_102515437182_100000039644 [0,2,0,0,0,0|0,0,2]=4 9044 B12R0.111 CC/C=C\COC(CN)COCC 34a_102515437182_100103147603 [0,2,0,0,0,0|1,0,1]=4 9045 B12R0.111 CCC#CCOC(CN)COCC 34a_102515437182_100009813939 [0,2,0,0,0,0|1,0,1]=4 9046 B12R0.111 CCCCC(CC)NCCOCC 270004a_102516460346_100000753412 [0,2,0,0,0,0|2,0,0]=4 9047 B12R0.111 CCCCC(CC)NCCOCC 34a_102516460346_200011216223 [0,2,0,0,0,0|2,0,0]=4 9048 B12R0.111 CCCCC(CC)OCCOCC 34a_100000210136_200011216223 [0,2,0,0,0,0|1,0,0]=3 9049 B12R0.111 CCCCC(CC)OCCOCC 34a_100011215227_100000210147 [0,2,0,0,0,0|1,0,0]=3 9050 B12R0.111 CCCCC(CC)OCCOCC 7a_100000210136_200011216223 [0,2,0,0,0,0|1,0,0]=3 9051 B12R0.111 CCCCC(CC)OCCOCC 7a_100011215227_100011215890 [0,2,0,0,0,0|1,0,0]=3 9052 B12R0.111 CCCCC(CC)OCCSCC 34a_100000212035_200011216223 [0,2,0,0,0,0|1,1,0]=4 9053 B12R0.111 CCCCC(CC)OCCSCC 34a_100011215227_100000757381 [0,2,0,0,0,0|1,1,0]=4 9054 B12R0.111 CCCCC(CC)OCCSCC 7a_100000212035_200011216223 [0,2,0,0,0,0|1,1,0]=4 9055 B12R0.111 CCCCC(CC)OCCSCC 7a_100011215227_100000757381 [0,2,0,0,0,0|1,1,0]=4 9056 B12R0.111 CCCCC(CC)SCCOCC 62a_100000210147_200011216223 [0,2,0,0,0,0|1,1,0]=4 9057 B12R0.111 CCCCC(CC)SCCOCC 62a_200011216223_100011215890 [0,2,0,0,0,0|1,1,0]=4 9058 B12R0.111 CCCCCOC(CC)CCCC 34a_100000210253_200011216223 [0,2,0,0,0,0|2,0,0]=4 9059 B12R0.111 CCCCCOC(CC)CCCC 34a_100011215227_100000718602 [0,2,0,0,0,0|2,0,0]=4 9060 B12R0.111 CCCCCOC(CC)CCCC 7a_100000210253_200011216223 [0,2,0,0,0,0|2,0,0]=4 9061 B12R0.111 CCCCCOC(CC)CCCC 7a_100011215227_100000210326 [0,2,0,0,0,0|2,0,0]=4 9062 B12R0.111 CCCCCOC(CN)COCC 34a_102515437182_100000718602 [0,2,0,0,0,0|1,0,0]=3 9063 B12R0.111 CCCC[C@@H](CO)NCCOCC 2230a_100011934283_100011215890 [0,2,0,0,0,0|2,0,0]=4 9064 B12R0.111 CCCC[C@@H](CO)NCCOCC 34a_100011934283_100000210147 [0,2,0,0,0,0|2,0,0]=4 9065 B12R0.111 CCOCC(CN)OCCCCF 34a_102515437182_100000729493 [0,2,0,0,0,0|2,0,0]=4 9066 B12R0.111 CCOCC(CN)OCCCCO 34a_102515437182_100011216708 [0,2,0,0,0,0|2,0,0]=4 9067 B12R0.111 CCOCC(CN)OCCCOC 34a_102515437182_100000740836 [0,2,0,0,0,0|2,0,0]=4 9068 B12R0.111 CCOCC(CN)OCCSCC 34a_102515437182_100000757381 [0,2,0,0,0,0|0,1,0]=3 9069 B12R0.111 CCOCCOC(CN)COCC 34a_102515437182_100000210147 [0,2,0,0,0,0|0,0,0]=2 9070 B12R0.255 CCCCCOC(C)CCC(C)C 34a_100000210253_100011261404 [0,2,0,0,0,0|2,0,0]=4 9071 B12R0.255 CCCCCOC(C)CCC(C)C 34a_100011215350_100000718602 [0,2,0,0,0,0|2,0,0]=4 9072 B12R0.255 CCCCCOC(C)CCC(C)C 7a_100011215350_100000210326 [0,2,0,0,0,0|2,0,0]=4 9073 B12R0.255 CCOCCCC(=O)COC(C)C 1458a_100000745533_100012232248 [0,2,0,0,0,0|1,0,1]=4 9074 B12R0.255 CCOCCNC(=O)COC(C)C 11a_100011200944_100000745533 [0,2,0,0,0,0|1,0,1]=4 9075 B12R0.255 CCOCCNC(=O)COC(C)C 1626a_102516460346_100000745533 [0,2,0,0,0,0|1,0,1]=4 9076 B12R0.255 CCOCCNC(=O)COC(C)C 240690a_100011200944_100000745533 [0,2,0,0,0,0|1,0,1]=4 9077 B12R0.255 CCOCCNC(=O)COC(C)C 527a_100011200944_100000745533 [0,2,0,0,0,0|1,0,1]=4 9078 B12R0.255 CCOCCNC(C)CCC(C)C 2230a_100138410893_100011215890 [0,2,0,0,0,0|2,0,0]=4 9079 B12R0.255 CCOCCNC(C)CCC(C)C 2230a_102516460346_100011261404 [0,2,0,0,0,0|2,0,0]=4 9080 B12R0.255 CCOCCNC(C)CCC(C)C 270004a_102516460346_100000210476 [0,2,0,0,0,0|2,0,0]=4 9081 B12R0.255 CCOCCNC(C)CCC(C)C 34a_102516460346_100011261404 [0,2,0,0,0,0|2,0,0]=4 9082 B12R0.255 CCOCCNC(C)COC(=O)C 270004a_102516460346_100000000629 [0,2,0,0,0,0|1,0,1]=4 9083 B12R0.255 CCOCCOC(=O)CNC(C)C 2230a_100138425928_200000101388 [0,2,0,0,0,0|1,0,1]=4 9084 B12R0.255 CCOCCOC(=O)CNC(C)C 34a_100138425928_200000101388 [0,2,0,0,0,0|1,0,1]=4 9085 B12R0.255 CCOCCOC(=O)COC(C)C 34a_100000212225_200000101388 [0,2,0,0,0,0|0,0,1]=3 9086 B12R0.255 CCOCCOC(=O)CSC(C)C 62a_100000210206_200000101388 [0,2,0,0,0,0|0,1,1]=4 9087 B12R0.255 CCOCCOC(=O)CSC(C)C 62a_200000101388_100000210206 [0,2,0,0,0,0|0,1,1]=4 9088 B12R0.255 CCOCCOC(C)CCC(C)C 34a_100000210136_100011261404 [0,2,0,0,0,0|1,0,0]=3 9089 B12R0.255 CCOCCOC(C)CCC(C)C 34a_100011215350_100000210147 [0,2,0,0,0,0|1,0,0]=3 9090 B12R0.255 CCOCCOC(C)CCC(C)C 7a_100011215350_100011215890 [0,2,0,0,0,0|1,0,0]=3 9091 B12R0.255 CCOCCSC(C)CCC(C)C 62a_100000210147_100011261404 [0,2,0,0,0,0|1,1,0]=4 9092 B12R0.255 CCOCCSC(C)CCC(C)C 62a_100011261404_100011215890 [0,2,0,0,0,0|1,1,0]=4 9093 B12R0.255 CCSCCOC(C)CCC(C)C 34a_100000212035_100011261404 [0,2,0,0,0,0|1,1,0]=4 9094 B12R0.255 CCSCCOC(C)CCC(C)C 34a_100011215350_100000757381 [0,2,0,0,0,0|1,1,0]=4 9095 B12R0.255 CCSCCOC(C)CCC(C)C 7a_100011215350_100000757381 [0,2,0,0,0,0|1,1,0]=4 9096 B12R0.585 CCCCC(C)(C)OCCOCC 7a_100011219641_100011215890 [0,2,0,0,0,0|1,0,0]=3 9097 B12R0.585 CCCCC(C)(C)OCCSCC 7a_100011219641_100000757381 [0,2,0,0,0,0|1,1,0]=4 9098 B12R0.585 CCCCCOC(C)(C)CCCC 7a_100011219641_100000210326 [0,2,0,0,0,0|2,0,0]=4 9099 B12R0.585 CCOCCOC(C)(C)CCCBr 7a_100009888830_100011215890 [0,2,0,0,0,0|2,0,0]=4 9100 B12R0.648 CCCCC(C)C(=O)CCOCC 1458a_100000725509_100011215890 [0,2,0,0,0,0|2,0,0]=4 9101 B12R0.648 CCCCC(C)C(=O)CCOCC 1458a_100000749530_200011215066 [0,2,0,0,0,0|2,0,0]=4 9102 B12R0.648 CCCCC(O)C(=O)CCOCC 1458a_100000720857_100011215890 [0,2,0,0,0,0|2,0,0]=4 9103 B12R0.117 CCOCCN(CC)CCOCC 2230a_100011216575_100000210202 [0,2,0,0,0,0|1,0,0]=3 9104 B12R0.117 CCOCCN(CC)CCOCC 269982a_100011216575_100000204670 [0,2,0,0,0,0|1,0,0]=3 9105 B12R0.117 CCOCCN(CF)CCOCC 269982a_100011216575_100015361967 [0,2,0,0,0,0|1,0,0]=3 9106 B12R0.233 CCCCCC(=O)CCOC(C)C 1458a_100000212188_100000211751 [0,2,0,0,0,0|2,0,0]=4 9107 B12R0.233 CCCCCN(C)CCOC(C)C 2230a_100000223495_100000211751 [0,2,0,0,0,0|2,0,0]=4 9108 B12R0.233 CCCCCN(C)CCOC(C)C 269982a_100000223495_100000211751 [0,2,0,0,0,0|2,0,0]=4 9109 B12R0.233 CCOCCC(=O)CCCC(C)C 1458a_100000749530_100011214892 [0,2,0,0,0,0|2,0,0]=4 9110 B12R0.233 CCOCCC(=O)CCCC(C)C 1458a_100011216857_100011215890 [0,2,0,0,0,0|2,0,0]=4 9111 B12R0.233 CCOCCC(=O)CCCC(C)O 1458a_100000749530_200000718107 [0,2,0,0,0,0|2,0,0]=4 9112 B12R0.233 CCOCCC(=O)CCOC(=O)C 1458a_100000749530_100009814007 [0,2,0,0,0,0|1,0,1]=4 9113 B12R0.233 CCOCCC(=O)CCOC(C)C 1458a_100000749530_100000211751 [0,2,0,0,0,0|1,0,0]=3 9114 B12R0.233 CCOCCC(=O)CCSC(C)C 1458a_100000749530_100000730970 [0,2,0,0,0,0|1,1,0]=4 9115 B12R0.233 CCOCCC(C)CCCC(C)C 34a_100000015991_100000210202 [0,2,0,0,0,0|2,0,0]=4 9116 B12R0.233 CCOCCC(C)CCCC(C)C 34a_100121572206_100009816328 [0,2,0,0,0,0|2,0,0]=4 9117 B12R0.233 CCOCCC(C)CCCC(C)C 7a_100000015991_100000210202 [0,2,0,0,0,0|2,0,0]=4 9118 B12R0.233 CCSCCC(=O)CCOC(C)C 1458a_100000230768_100000211751 [0,2,0,0,0,0|1,1,0]=4 9119 B12R0.119 C=COCCOCCOC(C)(C)C 34a_100000039918_100000210625 [0,2,0,0,0,0|0,0,2]=4 9120 B12R0.119 C=COCCOCCOC(C)(C)C 34a_100000693234_100000039644 [0,2,0,0,0,0|0,0,2]=4 9121 B12R0.119 C=COCCOCCOC(C)(C)C 7a_100000693234_100000039644 [0,2,0,0,0,0|0,0,2]=4 9122 B12R0.119 CC(C)(C)OCCOCCCCF 34a_100000693234_100000729493 [0,2,0,0,0,0|2,0,0]=4 9123 B12R0.119 CC(C)(C)OCCOCCCCF 7a_100000693234_100000729493 [0,2,0,0,0,0|2,0,0]=4 9124 B12R0.119 CC(C)(C)OCCOCCCCO 34a_100000693234_100011216708 [0,2,0,0,0,0|2,0,0]=4 9125 B12R0.119 CC(C)(C)OCCOCCCCO 7a_100000693234_100000210776 [0,2,0,0,0,0|2,0,0]=4 9126 B12R0.119 CC(C)(C)OCCOCCOCF 34a_100011997631_100015361967 [0,2,0,0,0,0|1,0,0]=3 9127 B12R0.119 CC(C)(C)OCCOCCOCF 7a_100011997631_100015361967 [0,2,0,0,0,0|1,0,0]=3 9128 B12R0.119 CC/C=C\COCCOC(C)(C)C 34a_100000693234_100103147603 [0,2,0,0,0,0|1,0,1]=4 9129 B12R0.119 CC/C=C\COCCOC(C)(C)C 7a_100000693234_100103147603 [0,2,0,0,0,0|1,0,1]=4 9130 B12R0.119 CCC#CCOCCOC(C)(C)C 34a_100000693234_100009813939 [0,2,0,0,0,0|1,0,1]=4 9131 B12R0.119 CCC#CCOCCOC(C)(C)C 7a_100000693234_100009813939 [0,2,0,0,0,0|1,0,1]=4 9132 B12R0.119 CCCCCCCCOC(C)(C)C 34a_100000210232_100000210625 [0,2,0,0,0,0|2,0,0]=4 9133 B12R0.119 CCCCCCCCOC(C)(C)C 34a_100015890283_100000210759 [0,2,0,0,0,0|2,0,0]=4 9134 B12R0.119 CCCCCCCCOC(C)(C)C 7a_100015890283_100000210759 [0,2,0,0,0,0|2,0,0]=4 9135 B12R0.119 CCCCCNCCOC(C)(C)C 2230a_100000747557_100000210326 [0,2,0,0,0,0|2,0,0]=4 9136 B12R0.119 CCCCCNCCOC(C)(C)C 34a_100000224656_100000210625 [0,2,0,0,0,0|2,0,0]=4 9137 B12R0.119 CCCCCOCCCC(C)(C)O 34a_100000210253_100009888830 [0,2,0,0,0,0|2,0,0]=4 9138 B12R0.119 CCCCCOCCCC(C)(C)O 7a_100000210253_100009888830 [0,2,0,0,0,0|2,0,0]=4 9139 B12R0.119 CCCCCOCCOC(C)(C)C 34a_100000693234_100000718602 [0,2,0,0,0,0|1,0,0]=3 9140 B12R0.119 CCCCCOCCOC(C)(C)C 34a_100011215259_100000210625 [0,2,0,0,0,0|1,0,0]=3 9141 B12R0.119 CCCCCOCCOC(C)(C)C 7a_100000693234_100000210326 [0,2,0,0,0,0|1,0,0]=3 9142 B12R0.119 CCCCCOCCOC(F)(F)F 34a_100000761981_100000718602 [0,2,0,0,0,0|2,0,0]=4 9143 B12R0.119 CCCCCOCCOC(F)(F)F 34a_100011215259_200103152311 [0,2,0,0,0,0|2,0,0]=4 9144 B12R0.119 CCCCCOCCOC(F)(F)F 7a_100011215259_200000243211 [0,2,0,0,0,0|2,0,0]=4 9145 B12R0.119 CCCCCOCCOS(=O)(=O)C 34a_100000210253_200000036756 [0,2,0,0,0,0|2,0,0]=4 9146 B12R0.119 CCCCCOCCOS(=O)(=O)C 7a_100000210253_200000036756 [0,2,0,0,0,0|2,0,0]=4 9147 B12R0.119 CCCCCOCCO[Si](C)(C)C 34a_100000210253_200000032530 [0,2,0,0,0,0|1,1,0]=4 9148 B12R0.119 CCCCCOCCO[Si](C)(C)C 7a_100000210253_200000032530 [0,2,0,0,0,0|1,1,0]=4 9149 B12R0.119 CCNCCOCCOS(=O)(=O)C 2230a_100015525214_100015571617 [0,2,0,0,0,0|2,0,0]=4 9150 B12R0.119 CCOCCNCCCC(C)(C)O 2230a_102516460346_100009888830 [0,2,0,0,0,0|2,0,0]=4 9151 B12R0.119 CCOCCNCCCC(C)(C)O 34a_102516460346_100009888830 [0,2,0,0,0,0|2,0,0]=4 9152 B12R0.119 CCOCCNCCOC(C)(C)C 2230a_100000747557_100011215890 [0,2,0,0,0,0|1,0,0]=3 9153 B12R0.119 CCOCCNCCOC(F)(F)F 34a_100000709367_100000210147 [0,2,0,0,0,0|2,0,0]=4 9154 B12R0.119 CCOCCNCCOS(=O)(=O)C 2230a_102516460346_200000036756 [0,2,0,0,0,0|2,0,0]=4 9155 B12R0.119 CCOCCNCCOS(=O)(=O)C 34a_102516460346_200000036756 [0,2,0,0,0,0|2,0,0]=4 9156 B12R0.119 CCOCCNCCO[Si](C)(C)C 2230a_102516460346_200000032530 [0,2,0,0,0,0|1,1,0]=4 9157 B12R0.119 CCOCCNCCO[Si](C)(C)C 34a_102516460346_200000032530 [0,2,0,0,0,0|1,1,0]=4 9158 B12R0.119 CCOCCNCCSC(C)(C)C 2230a_100000689375_100011215890 [0,2,0,0,0,0|1,1,0]=4 9159 B12R0.119 CCOCCOCCCC(C)(C)O 34a_100000210136_100009888830 [0,2,0,0,0,0|1,0,0]=3 9160 B12R0.119 CCOCCOCCCC(C)(C)O 7a_100000210136_100009888830 [0,2,0,0,0,0|1,0,0]=3 9161 B12R0.119 CCOCCOCCCC(F)(F)F 34a_100000210136_100011215983 [0,2,0,0,0,0|2,0,0]=4 9162 B12R0.119 CCOCCOCCCC(F)(F)F 34a_100000749235_100000210147 [0,2,0,0,0,0|2,0,0]=4 9163 B12R0.119 CCOCCOCCCC(F)(F)F 7a_100000210136_100011216173 [0,2,0,0,0,0|2,0,0]=4 9164 B12R0.119 CCOCCOCCCS(=O)(=O)C 34a_100000210136_100000754308 [0,2,0,0,0,0|2,0,0]=4 9165 B12R0.119 CCOCCOCCCS(=O)(=O)C 34a_100000689940_100000210147 [0,2,0,0,0,0|2,0,0]=4 9166 B12R0.119 CCOCCOCCCS(=O)(=O)C 7a_100000210136_100000754308 [0,2,0,0,0,0|2,0,0]=4 9167 B12R0.119 CCOCCOCCCS(=O)(=O)C 7a_100000689940_100011215890 [0,2,0,0,0,0|2,0,0]=4 9168 B12R0.119 CCOCCOCCC[N+](C)(C)C 34a_100000210136_100016990835 [0,2,0,0,0,0|2,0,0]=4 9169 B12R0.119 CCOCCOCCC[N+](C)(C)C 7a_100000210136_100016990835 [0,2,0,0,0,0|2,0,0]=4 9170 B12R0.119 CCOCCOCCC[Si](C)(C)C 34a_100000210136_100011219597 [0,2,0,0,0,0|1,1,0]=4 9171 B12R0.119 CCOCCOCCC[Si](C)(C)C 7a_100000210136_100011219597 [0,2,0,0,0,0|1,1,0]=4 9172 B12R0.119 CCOCCOCCC[Si](C)(C)C 7a_200011215415_100011215890 [0,2,0,0,0,0|1,1,0]=4 9173 B12R0.119 CCOCCOCCNC(C)(C)C 2230a_100000715429_100011211534 [0,2,0,0,0,0|1,0,0]=3 9174 B12R0.119 CCOCCOCCNC(C)(C)C 34a_100102712874_100000210625 [0,2,0,0,0,0|1,0,0]=3 9175 B12R0.119 CCOCCOCCNC(F)(F)F 34a_100102712874_200103152311 [0,2,0,0,0,0|2,0,0]=4 9176 B12R0.119 CCOCCOCCNS(=O)(=O)C 40a_100102712874_100000738038 [0,2,0,0,0,0|2,0,0]=4 9177 B12R0.119 CCOCCOCCNS(=O)(=O)C 7a_100000210136_100000754112 [0,2,0,0,0,0|2,0,0]=4 9178 B12R0.119 CCOCCOCCOC(C)(C)C 34a_100000210240_100000210625 [0,2,0,0,0,0|0,0,0]=2 9179 B12R0.119 CCOCCOCCOC(C)(C)C 34a_100000693234_100000210147 [0,2,0,0,0,0|0,0,0]=2 9180 B12R0.119 CCOCCOCCOC(C)(C)C 34a_100011997631_100000210202 [0,2,0,0,0,0|0,0,0]=2 9181 B12R0.119 CCOCCOCCOC(C)(C)C 34a_100015890283_100011211534 [0,2,0,0,0,0|0,0,0]=2 9182 B12R0.119 CCOCCOCCOC(C)(C)C 7a_100000693234_100011215890 [0,2,0,0,0,0|0,0,0]=2 9183 B12R0.119 CCOCCOCCOC(C)(C)C 7a_100011997631_100000210202 [0,2,0,0,0,0|0,0,0]=2 9184 B12R0.119 CCOCCOCCOC(C)(C)C 7a_100015890283_100011211534 [0,2,0,0,0,0|0,0,0]=2 9185 B12R0.119 CCOCCOCCOC(F)(F)F 34a_100000210240_200103152311 [0,2,0,0,0,0|1,0,0]=3 9186 B12R0.119 CCOCCOCCOC(F)(F)F 34a_100000761981_100000210147 [0,2,0,0,0,0|1,0,0]=3 9187 B12R0.119 CCOCCOCCOC(F)(F)F 7a_100000210240_200000243211 [0,2,0,0,0,0|1,0,0]=3 9188 B12R0.119 CCOCCOCCOS(=O)(=O)C 34a_100000210136_200000036756 [0,2,0,0,0,0|1,0,0]=3 9189 B12R0.119 CCOCCOCCOS(=O)(=O)C 34a_100121572206_100015571617 [0,2,0,0,0,0|1,0,0]=3 9190 B12R0.119 CCOCCOCCOS(=O)(=O)C 7a_100000210136_200000036756 [0,2,0,0,0,0|1,0,0]=3 9191 B12R0.119 CCOCCOCCO[Si](C)(C)C 34a_100000210136_200000032530 [0,2,0,0,0,0|0,1,0]=3 9192 B12R0.119 CCOCCOCCO[Si](C)(C)C 7a_100000210136_200000032530 [0,2,0,0,0,0|0,1,0]=3 9193 B12R0.119 CCOCCOCCSC(C)(C)C 62a_100000211941_100011211534 [0,2,0,0,0,0|0,1,0]=3 9194 B12R0.119 CCOCCOCCSC(C)(C)C 62a_100011211534_100000211941 [0,2,0,0,0,0|0,1,0]=3 9195 B12R0.119 CCOCCOCCSC(F)(F)F 62a_100011211534_200103152311 [0,2,0,0,0,0|1,1,0]=4 9196 B12R0.119 CCOCCOCCSC(F)(F)F 62a_200000243211_100011211534 [0,2,0,0,0,0|1,1,0]=4 9197 B12R0.119 CCOCCSCCCC(C)(C)O 62a_100000210147_100009888830 [0,2,0,0,0,0|1,1,0]=4 9198 B12R0.119 CCOCCSCCCC(C)(C)O 62a_100009888830_100011215890 [0,2,0,0,0,0|1,1,0]=4 9199 B12R0.119 CCOCCSCCOS(=O)(=O)C 62a_100000210147_200000036756 [0,2,0,0,0,0|1,1,0]=4 9200 B12R0.119 CCOCCSCCOS(=O)(=O)C 62a_200000036756_100011215890 [0,2,0,0,0,0|1,1,0]=4 9201 B12R0.119 CCOCCSCCO[Si](C)(C)C 62a_100000210147_200000032530 [0,2,0,0,0,0|0,2,0]=4 9202 B12R0.119 CCOCCSCCO[Si](C)(C)C 62a_200000032530_100011215890 [0,2,0,0,0,0|0,2,0]=4 9203 B12R0.119 CCSCCNCCOC(C)(C)C 2230a_100000747557_100000757381 [0,2,0,0,0,0|1,1,0]=4 9204 B12R0.119 CCSCCOCCCC(C)(C)O 34a_100000212035_100009888830 [0,2,0,0,0,0|1,1,0]=4 9205 B12R0.119 CCSCCOCCCC(C)(C)O 7a_100000212035_100009888830 [0,2,0,0,0,0|1,1,0]=4 9206 B12R0.119 CCSCCOCCOC(C)(C)C 34a_100000693234_100000757381 [0,2,0,0,0,0|0,1,0]=3 9207 B12R0.119 CCSCCOCCOC(C)(C)C 7a_100000693234_100000757381 [0,2,0,0,0,0|0,1,0]=3 9208 B12R0.119 CCSCCOCCOC(F)(F)F 34a_100000761981_100000757381 [0,2,0,0,0,0|1,1,0]=4 9209 B12R0.119 CCSCCOCCOS(=O)(=O)C 34a_100000212035_200000036756 [0,2,0,0,0,0|1,1,0]=4 9210 B12R0.119 CCSCCOCCOS(=O)(=O)C 62a_100000210202_100015571617 [0,2,0,0,0,0|1,1,0]=4 9211 B12R0.119 CCSCCOCCOS(=O)(=O)C 62a_100015571617_100000210202 [0,2,0,0,0,0|1,1,0]=4 9212 B12R0.119 CCSCCOCCOS(=O)(=O)C 7a_100000212035_200000036756 [0,2,0,0,0,0|1,1,0]=4 9213 B12R0.119 CCSCCOCCO[Si](C)(C)C 34a_100000212035_200000032530 [0,2,0,0,0,0|0,2,0]=4 9214 B12R0.119 CCSCCOCCO[Si](C)(C)C 7a_100000212035_200000032530 [0,2,0,0,0,0|0,2,0]=4 9215 B12R0.119 COCCCOCCOC(C)(C)C 34a_100000693234_100000740836 [0,2,0,0,0,0|2,0,0]=4 9216 B12R0.119 COCCCOCCOC(C)(C)C 7a_100000693234_100000740836 [0,2,0,0,0,0|2,0,0]=4 9217 B12R0.268 CC(=CCCOCCOC(C)C)C 34a_100000211219_100011217483 [0,2,0,0,0,0|1,0,1]=4 9218 B12R0.268 CC(=CCCOCCOC(C)C)C 7a_100000211219_100011217483 [0,2,0,0,0,0|1,0,1]=4 9219 B12R0.268 CC(=O)CCCOCCOC(C)C 34a_100000211219_100000685027 [0,2,0,0,0,0|1,0,1]=4 9220 B12R0.268 CC(=O)CCCOCCOC(C)C 34a_100000759063_100000211751 [0,2,0,0,0,0|1,0,1]=4 9221 B12R0.268 CC(=O)CCCOCCOC(C)C 7a_100000211219_100011215641 [0,2,0,0,0,0|1,0,1]=4 9222 B12R0.268 CC(=O)CCCOCCOC(C)C 7a_100000759063_100000211751 [0,2,0,0,0,0|1,0,1]=4 9223 B12R0.268 CC(=O)NCCOCCOC(C)C 34a_100000158858_100000211751 [0,2,0,0,0,0|1,0,1]=4 9224 B12R0.268 CC(=O)NCCOCCOC(C)C 7a_100000211219_100000189650 [0,2,0,0,0,0|1,0,1]=4 9225 B12R0.268 CC(=O)OCCCCCOC(C)C 34a_100000212225_100000033007 [0,2,0,0,0,0|1,0,1]=4 9226 B12R0.268 CC(=O)OCCNCCOC(C)C 34a_100000701111_100009814007 [0,2,0,0,0,0|1,0,1]=4 9227 B12R0.268 CC(=O)OCCOCCCC(C)C 34a_100000210774_100009814007 [0,2,0,0,0,0|1,0,1]=4 9228 B12R0.268 CC(=O)OCCOCCCC(C)C 7a_100000210774_100009814007 [0,2,0,0,0,0|1,0,1]=4 9229 B12R0.268 CC(=O)OCCOCCNC(C)C 2230a_100138425928_200000083610 [0,2,0,0,0,0|1,0,1]=4 9230 B12R0.268 CC(=O)OCCOCCNC(C)C 34a_100000224655_100009814007 [0,2,0,0,0,0|1,0,1]=4 9231 B12R0.268 CC(=O)OCCOCCNC(C)C 34a_100138425928_200000083610 [0,2,0,0,0,0|1,0,1]=4 9232 B12R0.268 CC(=O)OCCOCCOC(C)C 34a_100000211219_100009814007 [0,2,0,0,0,0|0,0,1]=3 9233 B12R0.268 CC(=O)OCCOCCOC(C)C 34a_100000212225_200000083610 [0,2,0,0,0,0|0,0,1]=3 9234 B12R0.268 CC(=O)OCCOCCOC(C)C 7a_100000211219_100009814007 [0,2,0,0,0,0|0,0,1]=3 9235 B12R0.268 CC(=O)OCCOCCSC(C)C 34a_200011212901_100009814007 [0,2,0,0,0,0|0,1,1]=4 9236 B12R0.268 CC(=O)OCCOCCSC(C)C 62a_100000210206_200000083610 [0,2,0,0,0,0|0,1,1]=4 9237 B12R0.268 CC(=O)OCCOCCSC(C)C 62a_200000083610_100000210206 [0,2,0,0,0,0|0,1,1]=4 9238 B12R0.268 CC(=O)OCCOCCSC(C)C 7a_200011212901_100009814007 [0,2,0,0,0,0|0,1,1]=4 9239 B12R0.268 CC(=O)OCCSCCOC(C)C 62a_100000211751_100009814007 [0,2,0,0,0,0|0,1,1]=4 9240 B12R0.268 CC(=O)OCCSCCOC(C)C 62a_100009814007_100000211751 [0,2,0,0,0,0|0,1,1]=4 9241 B12R0.268 CC(C)CCCNCCOC(C)C 2230a_100000701111_100011214892 [0,2,0,0,0,0|2,0,0]=4 9242 B12R0.268 CC(C)CCCNCCOC(C)C 2230a_200000737386_100000211751 [0,2,0,0,0,0|2,0,0]=4 9243 B12R0.268 CC(C)CCCNCCOC(C)C 34a_100000701111_100011214892 [0,2,0,0,0,0|2,0,0]=4 9244 B12R0.268 CC(C)CCCNCCOC(C)C 34a_200000737386_100000211751 [0,2,0,0,0,0|2,0,0]=4 9245 B12R0.268 CC(C)CCCOCCCC(C)C 34a_100000210774_100011214892 [0,2,0,0,0,0|2,0,0]=4 9246 B12R0.268 CC(C)CCCOCCCC(C)C 7a_100000210774_100011214892 [0,2,0,0,0,0|2,0,0]=4 9247 B12R0.268 CC(C)CCCOCCCC(C)O 34a_100000210774_200000718107 [0,2,0,0,0,0|2,0,0]=4 9248 B12R0.268 CC(C)CCCOCCCC(C)O 7a_100000210774_200000718107 [0,2,0,0,0,0|2,0,0]=4 9249 B12R0.268 CC(C)CCCOCCNC(C)C 34a_100000224655_100011214892 [0,2,0,0,0,0|2,0,0]=4 9250 B12R0.268 CC(C)CCCOCCOC(C)C 34a_100000210774_100000211751 [0,2,0,0,0,0|1,0,0]=3 9251 B12R0.268 CC(C)CCCOCCOC(C)C 34a_100000211219_100011214892 [0,2,0,0,0,0|1,0,0]=3 9252 B12R0.268 CC(C)CCCOCCOC(C)C 7a_100000210774_100000211751 [0,2,0,0,0,0|1,0,0]=3 9253 B12R0.268 CC(C)CCCOCCOC(C)C 7a_100000211219_100011214892 [0,2,0,0,0,0|1,0,0]=3 9254 B12R0.268 CC(C)CCCOCCSC(C)C 34a_100000210774_100000730970 [0,2,0,0,0,0|1,1,0]=4 9255 B12R0.268 CC(C)CCCOCCSC(C)C 34a_200011212901_100011214892 [0,2,0,0,0,0|1,1,0]=4 9256 B12R0.268 CC(C)CCCOCCSC(C)C 7a_100000210774_100000730970 [0,2,0,0,0,0|1,1,0]=4 9257 B12R0.268 CC(C)CCCOCCSC(C)C 7a_200011212901_100011214892 [0,2,0,0,0,0|1,1,0]=4 9258 B12R0.268 CC(C)CCCSCCOC(C)C 62a_100000211751_100011214892 [0,2,0,0,0,0|1,1,0]=4 9259 B12R0.268 CC(C)CCCSCCOC(C)C 62a_100011214892_100000211751 [0,2,0,0,0,0|1,1,0]=4 9260 B12R0.268 CC(C)NCCCCCOC(C)C 34a_100011629493_100000210206 [0,2,0,0,0,0|2,0,0]=4 9261 B12R0.268 CC(C)NCCOCCOC(C)C 34a_100000224655_100000211751 [0,2,0,0,0,0|1,0,0]=3 9262 B12R0.268 CC(C)NCCOCCSC(C)C 34a_100000224655_100000730970 [0,2,0,0,0,0|1,1,0]=4 9263 B12R0.268 CC(C)OCCCNCOC(C)C 2230a_100000737246_100000709892 [0,2,0,0,0,0|2,0,0]=4 9264 B12R0.268 CC(C)OCCCNCOC(C)C 34a_100000737246_100000709892 [0,2,0,0,0,0|2,0,0]=4 9265 B12R0.268 CC(C)OCCNCCOC(C)C 2230a_100000701111_100000211751 [0,2,0,0,0,0|1,0,0]=3 9266 B12R0.268 CC(C)OCCNCCOC(C)C 34a_100000701111_100000211751 [0,2,0,0,0,0|1,0,0]=3 9267 B12R0.268 CC(C)OCCNCCSC(C)C 2230a_100000701111_100000730970 [0,2,0,0,0,0|1,1,0]=4 9268 B12R0.268 CC(C)OCCNCCSC(C)C 2230a_100000731138_100000211751 [0,2,0,0,0,0|1,1,0]=4 9269 B12R0.268 CC(C)OCCNCCSC(C)C 34a_100000701111_100000730970 [0,2,0,0,0,0|1,1,0]=4 9270 B12R0.268 CC(C)OCCNCCSC(C)C 34a_100000731138_100000211751 [0,2,0,0,0,0|1,1,0]=4 9271 B12R0.268 CC(C)OCCOCCCN(C)C 7a_100000211219_100000757444 [0,2,0,0,0,0|2,0,0]=4 9272 B12R0.268 CC(C)OCCOCCOC(=O)N 34a_100000211219_200011214921 [0,2,0,0,0,0|1,0,1]=4 9273 B12R0.268 CC(C)OCCOCCOC(=O)N 7a_100000211219_200011214921 [0,2,0,0,0,0|1,0,1]=4 9274 B12R0.268 CC(C)OCCOCCOC(=O)N 7a_100000766696_100000211751 [0,2,0,0,0,0|1,0,1]=4 9275 B12R0.268 CC(C)OCCOCCOC(C)C 34a_100000211219_100000211751 [0,2,0,0,0,0|0,0,0]=2 9276 B12R0.268 CC(C)OCCOCCOC(C)C 7a_100000211219_100000211751 [0,2,0,0,0,0|0,0,0]=2 9277 B12R0.268 CC(C)OCCOCCSC(C)C 34a_100000211219_100000730970 [0,2,0,0,0,0|0,1,0]=3 9278 B12R0.268 CC(C)OCCOCCSC(C)C 34a_200011212901_100000211751 [0,2,0,0,0,0|0,1,0]=3 9279 B12R0.268 CC(C)OCCOCCSC(C)C 7a_100000211219_100000730970 [0,2,0,0,0,0|0,1,0]=3 9280 B12R0.268 CC(C)OCCOCCSC(C)C 7a_200011212901_100000211751 [0,2,0,0,0,0|0,1,0]=3 9281 B12R0.268 CC(C)OCCSCCOC(C)C 62a_100000211751_100000211751 [0,2,0,0,0,0|0,1,0]=3 9282 B12R0.268 CC(C)OCCSCCSC(C)C 62a_100000211751_100000730970 [0,2,0,0,0,0|0,2,0]=4 9283 B12R0.268 CC(C)OCCSCCSC(C)C 62a_100000730970_100000211751 [0,2,0,0,0,0|0,2,0]=4 9284 B12R0.268 CC(C)SCCOCCSC(C)C 34a_200011212901_100000730970 [0,2,0,0,0,0|0,2,0]=4 9285 B12R0.268 CC(C)SCCOCCSC(C)C 7a_200011212901_100000730970 [0,2,0,0,0,0|0,2,0]=4 9286 B12R0.268 CC(O)CCCNCCOC(C)C 2230a_100000701111_200000718107 [0,2,0,0,0,0|2,0,0]=4 9287 B12R0.268 CC(O)CCCNCCOC(C)C 34a_100000701111_200000718107 [0,2,0,0,0,0|2,0,0]=4 9288 B12R0.268 CC(O)CCCOCCNC(C)C 34a_100000224655_200000718107 [0,2,0,0,0,0|2,0,0]=4 9289 B12R0.268 CC(O)CCCOCCOC(C)C 34a_100000211219_200000718107 [0,2,0,0,0,0|1,0,0]=3 9290 B12R0.268 CC(O)CCCOCCOC(C)C 7a_100000211219_200000718107 [0,2,0,0,0,0|1,0,0]=3 9291 B12R0.268 CC(O)CCCOCCSC(C)C 34a_200011212901_200000718107 [0,2,0,0,0,0|1,1,0]=4 9292 B12R0.268 CC(O)CCCOCCSC(C)C 7a_200011212901_200000718107 [0,2,0,0,0,0|1,1,0]=4 9293 B12R0.268 CC(O)CCCSCCOC(C)C 62a_100000211751_200000718107 [0,2,0,0,0,0|1,1,0]=4 9294 B12R0.268 CC(O)CCCSCCOC(C)C 62a_200000718107_100000211751 [0,2,0,0,0,0|1,1,0]=4 9295 B10R1.4 CC1CCCCC1OCF 34a_100000211207_100015361967 [1,0,0,1,0,0|2,0,0]=4 9296 B10R1.4 CC1CCCCC1OCF 7a_100000211207_100015361967 [1,0,0,1,0,0|2,0,0]=4 9297 B10R1.4 CC1CCNCC1OCF 34a_100000696640_100015361967 [1,0,0,1,0,0|2,0,0]=4 9298 B10R1.4 CCCC1COCCN1C 2230a_102495339903_200000210301 [1,0,0,1,0,0|2,0,0]=4 9299 B10R1.4 CCCC1COCCN1C 269982a_102495339903_200000210301 [1,0,0,1,0,0|2,0,0]=4 9300 B10R1.4 CCCC1COCCN1C 34a_102495339903_200000210301 [1,0,0,1,0,0|2,0,0]=4 9301 B10R1.4 CCCC1COCCN1[13CH3] 2230a_102495339903_200025704644 [1,0,0,1,0,0|2,0,0]=4 9302 B10R1.4 CCCC1COCCN1[13CH3] 269982a_102495339903_200025704644 [1,0,0,1,0,0|2,0,0]=4 9303 B10R1.4 CCCC1COCCN1[13CH3] 34a_102495339903_200025704644 [1,0,0,1,0,0|2,0,0]=4 9304 B10R1.4 CCNC1CCCCC1C 2230a_100000211402_100000210202 [1,0,0,1,0,0|2,0,0]=4 9305 B10R1.4 CCNC1CCCCC1C 269862a_100015525214_100000210921 [1,0,0,1,0,0|2,0,0]=4 9306 B10R1.4 CCNC1CCCCC1C 270004a_100015525214_100000210921 [1,0,0,1,0,0|2,0,0]=4 9307 B10R1.4 CCNC1CCCCC1C 34a_100000211402_100000210202 [1,0,0,1,0,0|2,0,0]=4 9308 B10R1.4 CCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000210202 [1,0,0,1,0,0|2,0,0]=4 9309 B10R1.4 CCOC1CCCCC1C 34a_100000211207_100000210202 [1,0,0,1,0,0|1,0,0]=3 9310 B10R1.4 CCOC1CCCCC1C 7a_100000211207_100000210202 [1,0,0,1,0,0|1,0,0]=3 9311 B10R1.4 CCOC1CCCCC1Cl 34a_100000038908_100000210202 [1,0,0,1,0,0|2,0,0]=4 9312 B10R1.4 CCOC1CCCCC1Cl 7a_100000038908_100000210202 [1,0,0,1,0,0|2,0,0]=4 9313 B10R1.4 CCOC1CCCCC1F 34a_100121572206_100015423560 [1,0,0,1,0,0|2,0,0]=4 9314 B10R1.4 CCOC1CCCCC1O 34a_100121572206_100000038908 [1,0,0,1,0,0|2,0,0]=4 9315 B10R1.4 CCOC1CCNCC1C 34a_100011998114_100000210202 [1,0,0,1,0,0|2,0,0]=4 9316 B10R1.4 CCOC1CNCCC1C 34a_100000696640_100000210202 [1,0,0,1,0,0|1,0,0]=3 9317 B10R1.4 CCOC1COCCC1=O 34a_100121572206_100012180262 [1,0,0,1,0,0|1,0,1]=4 9318 B10R1.4 CCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210202 [1,0,0,1,0,0|2,0,0]=4 9319 B10R1.4 CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210202 [1,0,0,1,0,0|2,0,0]=4 9320 B10R1.4 CCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000210202 [1,0,0,1,0,0|2,0,0]=4 9321 B10R1.4 CCO[C@H]1COCC[C@H]1N 34a_100016994285_100000210202 [1,0,0,1,0,0|1,0,0]=3 9322 B10R1.4 N[C@@H]1CCOC[C@@H]1OCF 34a_100016994285_100015361967 [1,0,0,1,0,0|2,0,0]=4 9323 B10R1.5 CCN1CCC[C@@H]1COC 34a_100011739246_200000210301 [1,0,0,1,0,0|2,0,0]=4 9324 B10R1.5 CCN1CCC[C@@H]1COC 7a_100011739246_200000210301 [1,0,0,1,0,0|2,0,0]=4 9325 B10R1.5 CCN1CCC[C@@H]1CO[13CH3] 34a_100011739246_200025704644 [1,0,0,1,0,0|2,0,0]=4 9326 B10R1.5 CCN1CCC[C@@H]1CO[13CH3] 7a_100011739246_200025704644 [1,0,0,1,0,0|2,0,0]=4 9327 B10R1.5 CCN1CCC[C@H]1COC 2230a_100020646714_100000210202 [1,0,0,1,0,0|2,0,0]=4 9328 B10R1.5 CCN1CCC[C@H]1COC 269982a_100020646714_100000204670 [1,0,0,1,0,0|2,0,0]=4 9329 B10R1.5 CCN1CCC[C@H]1COC 34a_100020646714_100000210202 [1,0,0,1,0,0|2,0,0]=4 9330 B10R1.5 CCNC1CCCC1CC 269862a_100015525214_100000749056 [1,0,0,1,0,0|2,0,0]=4 9331 B10R1.5 CCNC1CCCC1CC 270004a_100015525214_100000749056 [1,0,0,1,0,0|2,0,0]=4 9332 B10R1.17 CCCCN1CCOCC1 2230a_100015191051_100000210211 [1,0,0,1,0,0|1,0,0]=3 9333 B10R1.17 CCCCN1CCOCC1 269982a_100015191051_100000210211 [1,0,0,1,0,0|1,0,0]=3 9334 B10R1.17 CCCCN1CCOCC1 34a_100015191051_100000210210 [1,0,0,1,0,0|1,0,0]=3 9335 B10R1.17 CCCCN1CCSCC1 2230a_100000737611_100000210211 [1,0,0,1,0,0|1,1,0]=4 9336 B10R1.17 CCCCN1CCSCC1 269982a_100000737611_100000210211 [1,0,0,1,0,0|1,1,0]=4 9337 B10R1.17 CCCNC1CCOCC1 2230a_100000741149_100000210303 [1,0,0,1,0,0|2,0,0]=4 9338 B10R1.17 CCCNC1CCOCC1 270004a_100020643023_100011217826 [1,0,0,1,0,0|2,0,0]=4 9339 B10R1.17 CCCNC1CCOCC1 34a_100000741149_100000210303 [1,0,0,1,0,0|2,0,0]=4 9340 B10R1.17 CCCOC1CCCCO1 34a_100000033831_100000210303 [1,0,0,1,0,0|2,0,0]=4 9341 B10R1.17 CCCOC1CCOCC1 34a_100000744328_100000210303 [1,0,0,1,0,0|2,0,0]=4 9342 B10R1.17 CCCSC1CCOCC1 62a_100000210303_100011324220 [1,0,0,1,0,0|2,0,0]=4 9343 B10R1.17 CCNCC1CCCCC1 2230a_100000210473_100000210202 [1,0,0,1,0,0|2,0,0]=4 9344 B10R1.17 CCNCC1CCCCC1 2230a_100015525214_100000211423 [1,0,0,1,0,0|2,0,0]=4 9345 B10R1.17 CCNCC1CCCCC1 269862a_100015525214_100000211278 [1,0,0,1,0,0|2,0,0]=4 9346 B10R1.17 CCNCC1CCCCC1 34a_100000210473_100000210202 [1,0,0,1,0,0|2,0,0]=4 9347 B10R1.17 CCNCC1CCCCO1 2230a_100000174945_100000210202 [1,0,0,1,0,0|1,0,0]=3 9348 B10R1.17 CCNCC1CCCCO1 2230a_100015525214_100000211543 [1,0,0,1,0,0|1,0,0]=3 9349 B10R1.17 CCNCC1CCCCO1 34a_100000174945_100000210202 [1,0,0,1,0,0|1,0,0]=3 9350 B10R1.17 CCNCC1CCCOC1 2230a_100000720124_100000210202 [1,0,0,1,0,0|2,0,0]=4 9351 B10R1.17 CCNCC1CCCOC1 2230a_100015525214_100000741521 [1,0,0,1,0,0|2,0,0]=4 9352 B10R1.17 CCNCC1CCCOC1 34a_100000720124_100000210202 [1,0,0,1,0,0|2,0,0]=4 9353 B10R1.17 CCNCC1CCOCC1 2230a_100000746373_100000210202 [1,0,0,1,0,0|1,0,0]=3 9354 B10R1.17 CCNCC1CCOCC1 2230a_100015525214_100000754603 [1,0,0,1,0,0|1,0,0]=3 9355 B10R1.17 CCNCC1CCOCC1 269862a_100015525214_100000749017 [1,0,0,1,0,0|1,0,0]=3 9356 B10R1.17 CCNCC1CCOCC1 34a_100000746373_100000210202 [1,0,0,1,0,0|1,0,0]=3 9357 B10R1.17 CCNCC1CCSCC1 2230a_100015188806_100000210202 [1,0,0,1,0,0|1,1,0]=4 9358 B10R1.17 CCNCC1CCSCC1 269862a_100015525214_100000067145 [1,0,0,1,0,0|1,1,0]=4 9359 B10R1.17 CCNCC1CCSCC1 270004a_100015525214_100000067145 [1,0,0,1,0,0|1,1,0]=4 9360 B10R1.17 CCNCC1CCSCC1 34a_100015188806_100000210202 [1,0,0,1,0,0|1,1,0]=4 9361 B10R1.17 CCNC[C@H]1COCCO1 2230a_100010981119_100000210202 [1,0,0,1,0,0|1,0,0]=3 9362 B10R1.17 CCNC[C@H]1COCCO1 34a_100010981119_100000210202 [1,0,0,1,0,0|1,0,0]=3 9363 B10R1.17 CCOCC1CC=CCC1 34a_100000210713_100000210202 [1,0,0,1,0,0|1,0,1]=4 9364 B10R1.17 CCOCC1CCC=CO1 34a_100011217868_100000210202 [1,0,0,1,0,0|0,0,2]=4 9365 B10R1.17 CCOCC1CCCCC1 34a_100000212181_100000210202 [1,0,0,1,0,0|1,0,0]=3 9366 B10R1.17 CCOCC1CCCCC1 34a_100121572206_100000211423 [1,0,0,1,0,0|1,0,0]=3 9367 B10R1.17 CCOCC1CCCCC1 7a_100000212181_100000210202 [1,0,0,1,0,0|1,0,0]=3 9368 B10R1.17 CCOCC1CCCCN1 34a_100000210821_100000210202 [1,0,0,1,0,0|1,0,0]=3 9369 B10R1.17 CCOCC1CCCCO1 34a_100000211370_100000210202 [1,0,0,1,0,0|0,0,0]=2 9370 B10R1.17 CCOCC1CCCCO1 34a_100121572206_100000211543 [1,0,0,1,0,0|0,0,0]=2 9371 B10R1.17 CCOCC1CCCCO1 7a_100000211370_100000210202 [1,0,0,1,0,0|0,0,0]=2 9372 B10R1.17 CCOCC1CCCNC1 34a_100000211344_100000210202 [1,0,0,1,0,0|2,0,0]=4 9373 B10R1.17 CCOCC1CCCOC1 34a_100000741520_100000210202 [1,0,0,1,0,0|1,0,0]=3 9374 B10R1.17 CCOCC1CCCOC1 34a_100121572206_100000741521 [1,0,0,1,0,0|1,0,0]=3 9375 B10R1.17 CCOCC1CCNCC1 34a_100000738675_100000210202 [1,0,0,1,0,0|1,0,0]=3 9376 B10R1.17 CCOCC1CCOCC1 34a_100000749013_100000210202 [1,0,0,1,0,0|0,0,0]=2 9377 B10R1.17 CCOCC1CCOCC1 34a_100121572206_100000754603 [1,0,0,1,0,0|0,0,0]=2 9378 B10R1.17 CCOCC1CCSCC1 34a_100000070558_100000210202 [1,0,0,1,0,0|0,1,0]=3 9379 B10R1.17 CCOCC1CCSCC1 7a_100000070558_100000210202 [1,0,0,1,0,0|0,1,0]=3 9380 B10R1.17 CCOCN1CCCOC1 269982a_100000131196_100000739092 [1,0,0,1,0,0|2,0,0]=4 9381 B10R1.17 CCOCN1CCOCC1 269982a_100015191051_100000739092 [1,0,0,1,0,0|1,0,0]=3 9382 B10R1.17 CCOCN1CCSCC1 269982a_100000737611_100000739092 [1,0,0,1,0,0|1,1,0]=4 9383 B10R1.17 CCOC[C@@H]1CNCCO1 34a_100015189573_100000210202 [1,0,0,1,0,0|1,0,0]=3 9384 B10R1.17 CCOC[C@@H]1COCCN1 34a_100000717676_100000210202 [1,0,0,1,0,0|1,0,0]=3 9385 B10R1.17 CCOC[C@H]1COCCO1 34a_100009875890_100000210202 [1,0,0,1,0,0|0,0,0]=2 9386 B10R1.17 CCSCC1CCCCC1 62a_100000210202_100000211423 [1,0,0,1,0,0|1,1,0]=4 9387 B10R1.17 CCSCC1CCCCC1 62a_100000211423_100000210202 [1,0,0,1,0,0|1,1,0]=4 9388 B10R1.17 CCSCC1CCCCO1 62a_100000210202_100000211543 [1,0,0,1,0,0|0,1,0]=3 9389 B10R1.17 CCSCC1CCCCO1 62a_100000211543_100000210202 [1,0,0,1,0,0|0,1,0]=3 9390 B10R1.17 CCSCC1CCCOC1 62a_100000210202_100000741521 [1,0,0,1,0,0|1,1,0]=4 9391 B10R1.17 CCSCC1CCCOC1 62a_100000741521_100000210202 [1,0,0,1,0,0|1,1,0]=4 9392 B10R1.17 CCSCC1CCOCC1 62a_100000210202_100000749018 [1,0,0,1,0,0|0,1,0]=3 9393 B10R1.17 CCSCC1CCOCC1 62a_100000754603_100000210202 [1,0,0,1,0,0|0,1,0]=3 9394 B10R1.17 CNCCC1CCCCO1 2230a_100015183643_200000210301 [1,0,0,1,0,0|2,0,0]=4 9395 B10R1.17 CNCCC1CCCCO1 34a_100015183643_200000210301 [1,0,0,1,0,0|2,0,0]=4 9396 B10R1.17 CNCCC1CCOCC1 2230a_100000755988_200000210301 [1,0,0,1,0,0|2,0,0]=4 9397 B10R1.17 CNCCC1CCOCC1 2230a_106832991635_100011934994 [1,0,0,1,0,0|2,0,0]=4 9398 B10R1.17 CNCCC1CCOCC1 34a_100000755988_200000210301 [1,0,0,1,0,0|2,0,0]=4 9399 B10R1.17 CNCCC1CCOCC1 34a_100102657272_100011934994 [1,0,0,1,0,0|2,0,0]=4 9400 B10R1.17 CNCCC1CCOCC1 7a_106832991635_100011934994 [1,0,0,1,0,0|2,0,0]=4 9401 B10R1.17 CNCCN1CCOCC1 2230a_106832991635_100025781966 [1,0,0,1,0,0|2,0,0]=4 9402 B10R1.17 CNCCN1CCOCC1 7a_106832991635_100000211760 [1,0,0,1,0,0|2,0,0]=4 9403 B10R1.17 COCCC1CCCCC1 34a_100011217863_200000210301 [1,0,0,1,0,0|2,0,0]=4 9404 B10R1.17 COCCC1CCCCC1 34a_100138415774_100011209188 [1,0,0,1,0,0|2,0,0]=4 9405 B10R1.17 COCCC1CCCCC1 7a_100011217863_200000210301 [1,0,0,1,0,0|2,0,0]=4 9406 B10R1.17 COCCC1CCNCC1 34a_100015190746_200000210301 [1,0,0,1,0,0|2,0,0]=4 9407 B10R1.17 COCCC1CCOCC1 34a_100011933979_200000210301 [1,0,0,1,0,0|1,0,0]=3 9408 B10R1.17 COCCC1CCOCC1 34a_100138415774_100011934994 [1,0,0,1,0,0|1,0,0]=3 9409 B10R1.17 COCCC1CCOCC1 7a_100011933979_200000210301 [1,0,0,1,0,0|1,0,0]=3 9410 B10R1.17 COCCN1CCCCC1 34a_100138415774_100000739454 [1,0,0,1,0,0|2,0,0]=4 9411 B10R1.17 COCCN1CCOCC1 2230a_100015191051_100011201679 [1,0,0,1,0,0|1,0,0]=3 9412 B10R1.17 COCCN1CCOCC1 269982a_100015191051_100000233755 [1,0,0,1,0,0|1,0,0]=3 9413 B10R1.17 COCCN1CCOCC1 34a_100015191051_100011201679 [1,0,0,1,0,0|1,0,0]=3 9414 B10R1.17 COCCN1CCSCC1 2230a_100000737611_100011201679 [1,0,0,1,0,0|1,1,0]=4 9415 B10R1.17 COCCN1CCSCC1 269982a_100000737611_100000233755 [1,0,0,1,0,0|1,1,0]=4 9416 B10R1.17 COCCN1CCSCC1 7a_100000686052_200000210301 [1,0,0,1,0,0|1,1,0]=4 9417 B10R1.17 COCNC1CCOCC1 2230a_100000741149_100000766300 [1,0,0,1,0,0|2,0,0]=4 9418 B10R1.17 COCSC1CCOCC1 62a_100000766300_100011324220 [1,0,0,1,0,0|2,0,0]=4 9419 B10R1.17 CSCCC1CCOCC1 62a_100011934994_200000210301 [1,0,0,1,0,0|1,1,0]=4 9420 B10R1.17 CSCCC1CCOCC1 62a_200000210301_100011934994 [1,0,0,1,0,0|1,1,0]=4 9421 B10R1.17 CSCCN1CCOCC1 2230a_100015191051_100000751147 [1,0,0,1,0,0|1,1,0]=4 9422 B10R1.17 CSCCN1CCOCC1 269982a_100015191051_100000212216 [1,0,0,1,0,0|1,1,0]=4 9423 B10R1.17 CSCCN1CCOCC1 34a_100015191051_100000212216 [1,0,0,1,0,0|1,1,0]=4 9424 B10R1.17 CSCCN1CCOCC1 62a_200000210301_100000211760 [1,0,0,1,0,0|1,1,0]=4 9425 B10R1.17 FCCCN1CCOCC1 2230a_100015191051_100011934791 [1,0,0,1,0,0|2,0,0]=4 9426 B10R1.17 FCCCN1CCOCC1 269982a_100015191051_100011934791 [1,0,0,1,0,0|2,0,0]=4 9427 B10R1.17 FCCCN1CCOCC1 34a_100015191051_100011934791 [1,0,0,1,0,0|2,0,0]=4 9428 B10R1.17 FCNCC1CCCCO1 34a_100000174945_100015361967 [1,0,0,1,0,0|2,0,0]=4 9429 B10R1.17 FCNCC1CCOCC1 34a_100000746373_100015361967 [1,0,0,1,0,0|2,0,0]=4 9430 B10R1.17 FCNC[C@H]1COCCO1 34a_100010981119_100015361967 [1,0,0,1,0,0|2,0,0]=4 9431 B10R1.17 FCOCC1CCCCC1 34a_100000212181_100015361967 [1,0,0,1,0,0|2,0,0]=4 9432 B10R1.17 FCOCC1CCCCC1 7a_100000212181_100015361967 [1,0,0,1,0,0|2,0,0]=4 9433 B10R1.17 FCOCC1CCCCN1 34a_100000210821_100015361967 [1,0,0,1,0,0|2,0,0]=4 9434 B10R1.17 FCOCC1CCCCO1 34a_100000211370_100015361967 [1,0,0,1,0,0|1,0,0]=3 9435 B10R1.17 FCOCC1CCCCO1 7a_100000211370_100015361967 [1,0,0,1,0,0|1,0,0]=3 9436 B10R1.17 FCOCC1CCCOC1 34a_100000741520_100015361967 [1,0,0,1,0,0|2,0,0]=4 9437 B10R1.17 FCOCC1CCNCC1 34a_100000738675_100015361967 [1,0,0,1,0,0|2,0,0]=4 9438 B10R1.17 FCOCC1CCOCC1 34a_100000749013_100015361967 [1,0,0,1,0,0|1,0,0]=3 9439 B10R1.17 FCOCC1CCSCC1 34a_100000070558_100015361967 [1,0,0,1,0,0|1,1,0]=4 9440 B10R1.17 FCOCC1CCSCC1 7a_100000070558_100015361967 [1,0,0,1,0,0|1,1,0]=4 9441 B10R1.17 FCOC[C@@H]1CNCCO1 34a_100015189573_100015361967 [1,0,0,1,0,0|2,0,0]=4 9442 B10R1.17 FCOC[C@@H]1COCCN1 34a_100000717676_100015361967 [1,0,0,1,0,0|2,0,0]=4 9443 B10R1.17 FCOC[C@H]1COCCO1 34a_100009875890_100015361967 [1,0,0,1,0,0|1,0,0]=3 9444 B10R1.17 FCSCC1CCCCO1 62a_100000211543_100015361967 [1,0,0,1,0,0|1,1,0]=4 9445 B10R1.17 FCSCC1CCCCO1 62a_100015361967_100000211543 [1,0,0,1,0,0|1,1,0]=4 9446 B10R1.17 FCSCC1CCOCC1 62a_100000754603_100015361967 [1,0,0,1,0,0|1,1,0]=4 9447 B10R1.17 FCSCC1CCOCC1 62a_100015361967_100000749018 [1,0,0,1,0,0|1,1,0]=4 9448 B10R1.17 OCCCN1CCOCC1 2230a_100015191051_100000230001 [1,0,0,1,0,0|2,0,0]=4 9449 B10R1.17 OCCCN1CCOCC1 269982a_100015191051_100011215043 [1,0,0,1,0,0|2,0,0]=4 9450 B10R1.17 OCCCN1CCOCC1 34a_100015191051_100000230001 [1,0,0,1,0,0|2,0,0]=4 9451 B10R1.17 [13CH3]NCCC1CCCCO1 2230a_100015183643_200025704644 [1,0,0,1,0,0|2,0,0]=4 9452 B10R1.17 [13CH3]NCCC1CCCCO1 34a_100015183643_200025704644 [1,0,0,1,0,0|2,0,0]=4 9453 B10R1.17 [13CH3]NCCC1CCOCC1 2230a_100000755988_200025704644 [1,0,0,1,0,0|2,0,0]=4 9454 B10R1.17 [13CH3]NCCC1CCOCC1 34a_100000755988_200025704644 [1,0,0,1,0,0|2,0,0]=4 9455 B10R1.17 [13CH3]OCCC1CCCCC1 34a_100011217863_200025704644 [1,0,0,1,0,0|2,0,0]=4 9456 B10R1.17 [13CH3]OCCC1CCCCC1 7a_100011217863_200025704644 [1,0,0,1,0,0|2,0,0]=4 9457 B10R1.17 [13CH3]OCCC1CCNCC1 34a_100015190746_200025704644 [1,0,0,1,0,0|2,0,0]=4 9458 B10R1.17 [13CH3]OCCC1CCOCC1 34a_100011933979_200025704644 [1,0,0,1,0,0|1,0,0]=3 9459 B10R1.17 [13CH3]OCCC1CCOCC1 7a_100011933979_200025704644 [1,0,0,1,0,0|1,0,0]=3 9460 B10R1.17 [13CH3]OCCN1CCSCC1 7a_100000686052_200025704644 [1,0,0,1,0,0|1,1,0]=4 9461 B10R1.17 [13CH3]SCCC1CCOCC1 62a_100011934994_200025704644 [1,0,0,1,0,0|1,1,0]=4 9462 B10R1.17 [13CH3]SCCC1CCOCC1 62a_200025704644_100011934994 [1,0,0,1,0,0|1,1,0]=4 9463 B10R1.17 [13CH3]SCCN1CCOCC1 62a_200025704644_100000211760 [1,0,0,1,0,0|1,1,0]=4 9464 B10R1.20 CCC1CCCCC1OC 34a_100000210738_200000210301 [1,0,0,1,0,0|2,0,0]=4 9465 B10R1.20 CCC1CCCCC1OC 7a_100000210738_200000210301 [1,0,0,1,0,0|2,0,0]=4 9466 B10R1.20 CCC1CCCCC1O[13CH3] 34a_100000210738_200025704644 [1,0,0,1,0,0|2,0,0]=4 9467 B10R1.20 CCC1CCCCC1O[13CH3] 7a_100000210738_200025704644 [1,0,0,1,0,0|2,0,0]=4 9468 B10R1.20 CCC1CCCCN1CC 2230a_100000210034_100000210202 [1,0,0,1,0,0|2,0,0]=4 9469 B10R1.20 CCC1CCCCN1CC 269982a_100000210034_100000204670 [1,0,0,1,0,0|2,0,0]=4 9470 B10R1.20 CCC1CCCCN1CC 34a_100000210034_100000210202 [1,0,0,1,0,0|2,0,0]=4 9471 B10R1.20 CCN1CCOC[C@H]1CO 2230a_100000717676_100000210202 [1,0,0,1,0,0|2,0,0]=4 9472 B10R1.20 CCN1CCOC[C@H]1CO 269982a_100000717676_100000204670 [1,0,0,1,0,0|2,0,0]=4 9473 B10R1.20 CCN1CCOC[C@H]1CO 34a_100000717676_100000210202 [1,0,0,1,0,0|2,0,0]=4 9474 B10R1.20 CC[C@H]1COCCN1CC 2230a_100016988097_100000210202 [1,0,0,1,0,0|1,0,0]=3 9475 B10R1.20 CC[C@H]1COCCN1CC 269982a_100016988097_100000204670 [1,0,0,1,0,0|1,0,0]=3 9476 B10R1.20 CC[C@H]1COCCN1CC 34a_100016988097_100000210202 [1,0,0,1,0,0|1,0,0]=3 9477 B10R1.20 CC[C@H]1COCCN1CF 269982a_100016988097_100015361967 [1,0,0,1,0,0|2,0,0]=4 9478 B10R1.20 CC[C@H]1COCCN1CF 34a_100016988097_100015361967 [1,0,0,1,0,0|2,0,0]=4 9479 B10R1.20 CNC1CCOCC1OC 270004a_106832991635_100000095984 [1,0,0,1,0,0|2,0,0]=4 9480 B10R1.21 BrCCCOC1CCCC1 34a_100011217188_100000179811 [1,0,0,1,0,0|2,0,0]=4 9481 B10R1.21 BrCCCOC1CCOC1 34a_100011217188_100000690089 [1,0,0,1,0,0|1,0,0]=3 9482 B10R1.21 C#CCCOC1CCOC1 34a_100011215631_100000690089 [1,0,0,1,0,0|0,0,2]=4 9483 B10R1.21 C#CCCO[C@H]1CCOC1 34a_100000717292_100000688953 [1,0,0,1,0,0|0,0,2]=4 9484 B10R1.21 C/C=C/COC1CCOC1 34a_100016270725_100000690089 [1,0,0,1,0,0|0,0,2]=4 9485 B10R1.21 C/C=C/CO[C@H]1CCOC1 34a_100000717292_100102629194 [1,0,0,1,0,0|0,0,2]=4 9486 B10R1.21 C=CCCOC1CCOC1 34a_100011205117_100000690089 [1,0,0,1,0,0|0,0,2]=4 9487 B10R1.21 C=CCCO[C@H]1CCOC1 34a_100000717292_100000754431 [1,0,0,1,0,0|0,0,2]=4 9488 B10R1.21 CC#CCOC1CCOC1 34a_100000761923_100000690089 [1,0,0,1,0,0|0,0,2]=4 9489 B10R1.21 CC#CCO[C@H]1CCOC1 34a_100000717292_100000748600 [1,0,0,1,0,0|0,0,2]=4 9490 B10R1.21 CC=CCO[C@H]1CCOC1 34a_100000717292_100000070051 [1,0,0,1,0,0|0,0,2]=4 9491 B10R1.21 CCCCCN1CCCC1 2230a_100000188435_100000210326 [1,0,0,1,0,0|2,0,0]=4 9492 B10R1.21 CCCCCN1CCCC1 269982a_100000188435_100000210215 [1,0,0,1,0,0|2,0,0]=4 9493 B10R1.21 CCCCNC1CCCC1 2230a_100000102301_100000179811 [1,0,0,1,0,0|2,0,0]=4 9494 B10R1.21 CCCCNC1CCCC1 2230a_100000211070_100000210211 [1,0,0,1,0,0|2,0,0]=4 9495 B10R1.21 CCCCNC1CCCC1 270004a_100000102301_100000210133 [1,0,0,1,0,0|2,0,0]=4 9496 B10R1.21 CCCCNC1CCCC1 34a_100000211070_100000210210 [1,0,0,1,0,0|2,0,0]=4 9497 B10R1.21 CCCCNC1CCCC1 7a_106832991798_100000179811 [1,0,0,1,0,0|2,0,0]=4 9498 B10R1.21 CCCCNC1CCOC1 2230a_100000102301_100000731011 [1,0,0,1,0,0|1,0,0]=3 9499 B10R1.21 CCCCNC1CCOC1 270004a_100000102301_100000752484 [1,0,0,1,0,0|1,0,0]=3 9500 B10R1.21 CCCCNC1CCOC1 7a_106832991798_100000731011 [1,0,0,1,0,0|1,0,0]=3 9501 B10R1.21 CCCCNC1CCSC1 270004a_100000102301_100000212027 [1,0,0,1,0,0|1,1,0]=4 9502 B10R1.21 CCCCN[C@@H]1CCOC1 2230a_200015188469_100000210211 [1,0,0,1,0,0|1,0,0]=3 9503 B10R1.21 CCCCN[C@H]1CCOC1 2230a_100015188467_100000210211 [1,0,0,1,0,0|1,0,0]=3 9504 B10R1.21 CCCCN[C@H]1CCOC1 34a_100015188467_100000210210 [1,0,0,1,0,0|1,0,0]=3 9505 B10R1.21 CCCCOC1CCCC1 34a_100000210227_100000179811 [1,0,0,1,0,0|1,0,0]=3 9506 B10R1.21 CCCCOC1CCCC1 34a_100000210269_100000210210 [1,0,0,1,0,0|1,0,0]=3 9507 B10R1.21 CCCCOC1CCCC1 7a_100000210227_100000179811 [1,0,0,1,0,0|1,0,0]=3 9508 B10R1.21 CCCCOC1CCCC1 7a_100000210269_100000210211 [1,0,0,1,0,0|1,0,0]=3 9509 B10R1.21 CCCCOC1CCCO1 34a_100000085407_100000210210 [1,0,0,1,0,0|2,0,0]=4 9510 B10R1.21 CCCCOC1CCOC1 34a_100000210227_100000690089 [1,0,0,1,0,0|0,0,0]=2 9511 B10R1.21 CCCCOC1CCOC1 7a_100000210227_100000731011 [1,0,0,1,0,0|0,0,0]=2 9512 B10R1.21 CCCCOC1CCSC1 7a_100011232664_100000210211 [1,0,0,1,0,0|0,1,0]=3 9513 B10R1.21 CCCCO[C@H]1CCOC1 34a_100000717292_100000210210 [1,0,0,1,0,0|0,0,0]=2 9514 B10R1.21 CCCCSC1CCCC1 62a_100000210211_100000179811 [1,0,0,1,0,0|1,1,0]=4 9515 B10R1.21 CCCCSC1CCCC1 62a_100011217020_100000210210 [1,0,0,1,0,0|1,1,0]=4 9516 B10R1.21 CCCCSC1CCOC1 62a_100000210211_100000690089 [1,0,0,1,0,0|0,1,0]=3 9517 B10R1.21 CCCNCC1CCOC1 2230a_100000737293_100000210303 [1,0,0,1,0,0|2,0,0]=4 9518 B10R1.21 CCCNCC1CCOC1 34a_100000737293_100000210303 [1,0,0,1,0,0|2,0,0]=4 9519 B10R1.21 CCCOCC1CCOC1 34a_100000210258_100011261433 [1,0,0,1,0,0|2,0,0]=4 9520 B10R1.21 CCCOCC1CCOC1 34a_100000740260_100000210303 [1,0,0,1,0,0|2,0,0]=4 9521 B10R1.21 CCCSCC1CCOC1 62a_100000210303_100000702531 [1,0,0,1,0,0|2,0,0]=4 9522 B10R1.21 CCCSCC1CCOC1 62a_100000702531_100000210303 [1,0,0,1,0,0|2,0,0]=4 9523 B10R1.21 CCNCCC1CCCC1 2230a_100000739158_100000210202 [1,0,0,1,0,0|2,0,0]=4 9524 B10R1.21 CCNCCC1CCCC1 2230a_100015525214_100000760354 [1,0,0,1,0,0|2,0,0]=4 9525 B10R1.21 CCNCCC1CCCC1 34a_100000739158_100000210202 [1,0,0,1,0,0|2,0,0]=4 9526 B10R1.21 CCOCCC1CCCC1 34a_100000749090_100000210202 [1,0,0,1,0,0|1,0,0]=3 9527 B10R1.21 CCOCCC1CCCC1 34a_100121572206_100000760354 [1,0,0,1,0,0|1,0,0]=3 9528 B10R1.21 CCOCCC1CCCC1 7a_100000749090_100000210202 [1,0,0,1,0,0|1,0,0]=3 9529 B10R1.21 CCOCCC1CCNC1 34a_100016987287_100000210202 [1,0,0,1,0,0|1,0,0]=3 9530 B10R1.21 CCOCCC1CCOC1 34a_100011879284_100000210202 [1,0,0,1,0,0|0,0,0]=2 9531 B10R1.21 CCOCCN1CCCC1 2230a_100000188435_100011215890 [1,0,0,1,0,0|1,0,0]=3 9532 B10R1.21 CCOCCN1CCCC1 269982a_100000188435_100011215890 [1,0,0,1,0,0|1,0,0]=3 9533 B10R1.21 CCOCCN1CCSC1 2230a_100011215254_100011215890 [1,0,0,1,0,0|1,1,0]=4 9534 B10R1.21 CCOCCN1CCSC1 269982a_100011215254_100011215890 [1,0,0,1,0,0|1,1,0]=4 9535 B10R1.21 CCOCSC1CCCC1 62a_100000739092_100000179811 [1,0,0,1,0,0|1,1,0]=4 9536 B10R1.21 CCOCSC1CCCC1 62a_100011217020_100000739092 [1,0,0,1,0,0|1,1,0]=4 9537 B10R1.21 CCOCSC1CCOC1 62a_100000739092_100000690089 [1,0,0,1,0,0|0,1,0]=3 9538 B10R1.21 CCSCCC1CCCC1 62a_100000210202_100000760354 [1,0,0,1,0,0|1,1,0]=4 9539 B10R1.21 CCSCCC1CCCC1 62a_100000760354_100000210202 [1,0,0,1,0,0|1,1,0]=4 9540 B10R1.21 CCSCCN1CCCC1 2230a_100000188435_100000757381 [1,0,0,1,0,0|1,1,0]=4 9541 B10R1.21 CCSCCN1CCCC1 269982a_100000188435_100000757381 [1,0,0,1,0,0|1,1,0]=4 9542 B10R1.21 CCSCCN1CCCC1 62a_100000210202_100000004467 [1,0,0,1,0,0|1,1,0]=4 9543 B10R1.21 CCSCCN1CCCC1 62a_100000700749_100000210202 [1,0,0,1,0,0|1,1,0]=4 9544 B10R1.21 CNCCOC1CCCC1 34a_100000741755_200000210301 [1,0,0,1,0,0|2,0,0]=4 9545 B10R1.21 COCCCC1CCCC1 34a_100011215328_200000210301 [1,0,0,1,0,0|2,0,0]=4 9546 B10R1.21 COCCCC1CCCC1 34a_100138415774_100011713738 [1,0,0,1,0,0|2,0,0]=4 9547 B10R1.21 COCCCC1CCCC1 7a_100011215328_200000210301 [1,0,0,1,0,0|2,0,0]=4 9548 B10R1.21 COCCNC1CCCC1 2230a_100000209980_100000179811 [1,0,0,1,0,0|2,0,0]=4 9549 B10R1.21 COCCNC1CCCC1 2230a_100000211070_100011201679 [1,0,0,1,0,0|2,0,0]=4 9550 B10R1.21 COCCNC1CCCC1 270004a_100000209980_100000210133 [1,0,0,1,0,0|2,0,0]=4 9551 B10R1.21 COCCNC1CCCC1 34a_100000211070_100011201679 [1,0,0,1,0,0|2,0,0]=4 9552 B10R1.21 COCCNC1CCCC1 34a_200000200444_200000210301 [1,0,0,1,0,0|2,0,0]=4 9553 B10R1.21 COCCNC1CCOC1 2230a_100000209980_100000731011 [1,0,0,1,0,0|1,0,0]=3 9554 B10R1.21 COCCNC1CCOC1 270004a_100000209980_100000752484 [1,0,0,1,0,0|1,0,0]=3 9555 B10R1.21 COCCNC1CCSC1 270004a_100000209980_100000212027 [1,0,0,1,0,0|1,1,0]=4 9556 B10R1.21 COCCN[C@@H]1CCOC1 2230a_200015188469_100011201679 [1,0,0,1,0,0|1,0,0]=3 9557 B10R1.21 COCCN[C@H]1CCOC1 2230a_100015188467_100011201679 [1,0,0,1,0,0|1,0,0]=3 9558 B10R1.21 COCCN[C@H]1CCOC1 34a_100015188467_100011201679 [1,0,0,1,0,0|1,0,0]=3 9559 B10R1.21 COCCOC1CCCC1 34a_100000210237_100000179811 [1,0,0,1,0,0|1,0,0]=3 9560 B10R1.21 COCCOC1CCCC1 34a_100000210269_100011201679 [1,0,0,1,0,0|1,0,0]=3 9561 B10R1.21 COCCOC1CCCC1 34a_100000738311_200000210301 [1,0,0,1,0,0|1,0,0]=3 9562 B10R1.21 COCCOC1CCCC1 7a_100000210269_100000233755 [1,0,0,1,0,0|1,0,0]=3 9563 B10R1.21 COCCOC1CCCC1 7a_100000738311_200000210301 [1,0,0,1,0,0|1,0,0]=3 9564 B10R1.21 COCCOC1CCCO1 34a_100000085407_100011201679 [1,0,0,1,0,0|2,0,0]=4 9565 B10R1.21 COCCOC1CCOC1 34a_100000210237_100000690089 [1,0,0,1,0,0|0,0,0]=2 9566 B10R1.21 COCCOC1CCSC1 7a_100011232664_100000233755 [1,0,0,1,0,0|0,1,0]=3 9567 B10R1.21 COCCO[C@H]1CCOC1 34a_100000717292_100011201679 [1,0,0,1,0,0|0,0,0]=2 9568 B10R1.21 COCCSC1CCCC1 62a_100000233755_100000179811 [1,0,0,1,0,0|1,1,0]=4 9569 B10R1.21 COCCSC1CCCC1 62a_100011217020_100000233755 [1,0,0,1,0,0|1,1,0]=4 9570 B10R1.21 COCCSC1CCOC1 62a_100000233755_100000690089 [1,0,0,1,0,0|0,1,0]=3 9571 B10R1.21 COCNCC1CCOC1 2230a_100000737293_100000766300 [1,0,0,1,0,0|2,0,0]=4 9572 B10R1.21 COCSCC1CCOC1 62a_100000702531_100000766300 [1,0,0,1,0,0|2,0,0]=4 9573 B10R1.21 COCSCC1CCOC1 62a_100000766300_100000702531 [1,0,0,1,0,0|2,0,0]=4 9574 B10R1.21 CSCCNC1CCOC1 2230a_100020590264_100000731011 [1,0,0,1,0,0|1,1,0]=4 9575 B10R1.21 CSCCNC1CCOC1 270004a_100020590264_100000752484 [1,0,0,1,0,0|1,1,0]=4 9576 B10R1.21 CSCCN[C@@H]1CCOC1 2230a_200015188469_100000751147 [1,0,0,1,0,0|1,1,0]=4 9577 B10R1.21 CSCCN[C@H]1CCOC1 2230a_100015188467_100000751147 [1,0,0,1,0,0|1,1,0]=4 9578 B10R1.21 CSCCN[C@H]1CCOC1 34a_100015188467_100000212216 [1,0,0,1,0,0|1,1,0]=4 9579 B10R1.21 CSCCOC1CCCC1 34a_100000210269_100000212216 [1,0,0,1,0,0|1,1,0]=4 9580 B10R1.21 CSCCOC1CCCC1 34a_100000230434_100000179811 [1,0,0,1,0,0|1,1,0]=4 9581 B10R1.21 CSCCOC1CCCC1 7a_100000210269_100000212216 [1,0,0,1,0,0|1,1,0]=4 9582 B10R1.21 CSCCOC1CCCC1 7a_100000230434_100000179811 [1,0,0,1,0,0|1,1,0]=4 9583 B10R1.21 CSCCOC1CCOC1 34a_100000230434_100000690089 [1,0,0,1,0,0|0,1,0]=3 9584 B10R1.21 CSCCOC1CCOC1 7a_100000230434_100000731011 [1,0,0,1,0,0|0,1,0]=3 9585 B10R1.21 CSCCOC1CCSC1 7a_100011232664_100000212216 [1,0,0,1,0,0|0,2,0]=4 9586 B10R1.21 CSCCO[C@H]1CCOC1 34a_100000717292_100000212216 [1,0,0,1,0,0|0,1,0]=3 9587 B10R1.21 CSCCSC1CCOC1 62a_100000212216_100000690089 [1,0,0,1,0,0|0,2,0]=4 9588 B10R1.21 ClCCCOC1CCCC1 34a_100000230001_100000179811 [1,0,0,1,0,0|2,0,0]=4 9589 B10R1.21 ClCCCOC1CCOC1 34a_100000230001_100000690089 [1,0,0,1,0,0|1,0,0]=3 9590 B10R1.21 FCCCNC1CCOC1 2230a_100015189416_100000731011 [1,0,0,1,0,0|2,0,0]=4 9591 B10R1.21 FCCCNC1CCOC1 270004a_100015189416_100000752484 [1,0,0,1,0,0|2,0,0]=4 9592 B10R1.21 FCCCNC1CCOC1 34a_100015189416_100000690089 [1,0,0,1,0,0|2,0,0]=4 9593 B10R1.21 FCCCN[C@@H]1CCOC1 2230a_200015188469_100011934791 [1,0,0,1,0,0|2,0,0]=4 9594 B10R1.21 FCCCN[C@H]1CCOC1 2230a_100015188467_100011934791 [1,0,0,1,0,0|2,0,0]=4 9595 B10R1.21 FCCCN[C@H]1CCOC1 34a_100015188467_100011934791 [1,0,0,1,0,0|2,0,0]=4 9596 B10R1.21 FCCCOC1CCCC1 34a_100000210269_100011934791 [1,0,0,1,0,0|2,0,0]=4 9597 B10R1.21 FCCCOC1CCCC1 34a_100000759539_100000179811 [1,0,0,1,0,0|2,0,0]=4 9598 B10R1.21 FCCCOC1CCCC1 7a_100000210269_100011934791 [1,0,0,1,0,0|2,0,0]=4 9599 B10R1.21 FCCCOC1CCOC1 34a_100000759539_100000690089 [1,0,0,1,0,0|1,0,0]=3 9600 B10R1.21 FCCCOC1CCSC1 7a_100011232664_100011934791 [1,0,0,1,0,0|1,1,0]=4 9601 B10R1.21 FCCCO[C@H]1CCOC1 34a_100000717292_100011934791 [1,0,0,1,0,0|1,0,0]=3 9602 B10R1.21 FCCCSC1CCOC1 62a_100011934791_100000690089 [1,0,0,1,0,0|1,1,0]=4 9603 B10R1.21 FCOCCC1CCCC1 34a_100000749090_100015361967 [1,0,0,1,0,0|2,0,0]=4 9604 B10R1.21 FCOCCC1CCCC1 7a_100000749090_100015361967 [1,0,0,1,0,0|2,0,0]=4 9605 B10R1.21 FCOCCC1CCNC1 34a_100016987287_100015361967 [1,0,0,1,0,0|2,0,0]=4 9606 B10R1.21 FCOCCC1CCOC1 34a_100011879284_100015361967 [1,0,0,1,0,0|1,0,0]=3 9607 B10R1.21 NCCCOC1CCCC1 34a_100000182051_100000179811 [1,0,0,1,0,0|2,0,0]=4 9608 B10R1.21 NCCCOC1CCOC1 34a_100000182051_100000690089 [1,0,0,1,0,0|1,0,0]=3 9609 B10R1.21 NOCCOC1CCCC1 34a_100000700252_100000179811 [1,0,0,1,0,0|2,0,0]=4 9610 B10R1.21 NOCCOC1CCOC1 34a_100000700252_100000690089 [1,0,0,1,0,0|1,0,0]=3 9611 B10R1.21 OCCCNC1CCOC1 270004a_100000182051_100000752484 [1,0,0,1,0,0|2,0,0]=4 9612 B10R1.21 OCCCN[C@@H]1CCOC1 2230a_200015188469_100000230001 [1,0,0,1,0,0|2,0,0]=4 9613 B10R1.21 OCCCN[C@H]1CCOC1 2230a_100015188467_100000230001 [1,0,0,1,0,0|2,0,0]=4 9614 B10R1.21 OCCCN[C@H]1CCOC1 34a_100015188467_100000230001 [1,0,0,1,0,0|2,0,0]=4 9615 B10R1.21 OCCCOC1CCCC1 34a_100000210269_100000230001 [1,0,0,1,0,0|2,0,0]=4 9616 B10R1.21 OCCCOC1CCCC1 7a_100000210269_100011215043 [1,0,0,1,0,0|2,0,0]=4 9617 B10R1.21 OCCCOC1CCSC1 7a_100011232664_100011215043 [1,0,0,1,0,0|1,1,0]=4 9618 B10R1.21 OCCCO[C@H]1CCOC1 34a_100000717292_100000230001 [1,0,0,1,0,0|1,0,0]=3 9619 B10R1.21 OCCCSC1CCOC1 62a_100011215043_100000690089 [1,0,0,1,0,0|1,1,0]=4 9620 B10R1.21 [13CH3]NCCOC1CCCC1 34a_100000741755_200025704644 [1,0,0,1,0,0|2,0,0]=4 9621 B10R1.21 [13CH3]OCCCC1CCCC1 34a_100011215328_200025704644 [1,0,0,1,0,0|2,0,0]=4 9622 B10R1.21 [13CH3]OCCCC1CCCC1 7a_100011215328_200025704644 [1,0,0,1,0,0|2,0,0]=4 9623 B10R1.21 [13CH3]OCCNC1CCCC1 34a_200000200444_200025704644 [1,0,0,1,0,0|2,0,0]=4 9624 B10R1.21 [13CH3]OCCOC1CCCC1 34a_100000738311_200025704644 [1,0,0,1,0,0|1,0,0]=3 9625 B10R1.21 [13CH3]OCCOC1CCCC1 7a_100000738311_200025704644 [1,0,0,1,0,0|1,0,0]=3 9626 B10R1.29 CCCCN1CCC[C@@H]1C 2230a_100020605311_100000210211 [1,0,0,1,0,0|2,0,0]=4 9627 B10R1.29 CCCCN1CCC[C@@H]1C 269982a_100020605311_100000210211 [1,0,0,1,0,0|2,0,0]=4 9628 B10R1.29 CCCCN1CCC[C@H]1C 2230a_100015189458_100000210211 [1,0,0,1,0,0|2,0,0]=4 9629 B10R1.29 CCCCN1CCC[C@H]1C 269982a_100015189458_100000210211 [1,0,0,1,0,0|2,0,0]=4 9630 B10R1.29 CCCCN1CCC[C@H]1C 34a_100015189458_100000210210 [1,0,0,1,0,0|2,0,0]=4 9631 B10R1.29 CCCCN1CCSC1C 2230a_200011216479_100000210211 [1,0,0,1,0,0|1,1,0]=4 9632 B10R1.29 CCCCN1CCSC1C 269982a_200011216479_100000210211 [1,0,0,1,0,0|1,1,0]=4 9633 B10R1.29 CCCCN1CCSC1C 34a_200011216479_100000210210 [1,0,0,1,0,0|1,1,0]=4 9634 B10R1.29 CCCNC1CCOC1C 270004a_100020643023_100000691750 [1,0,0,1,0,0|2,0,0]=4 9635 B10R1.29 CCOCC1CCCN1C 34a_100000743107_100000210202 [1,0,0,1,0,0|2,0,0]=4 9636 B10R1.29 CCOCN1CCC[C@@H]1C 269982a_100020605311_100000739092 [1,0,0,1,0,0|2,0,0]=4 9637 B10R1.29 CCOCN1CCC[C@H]1C 269982a_100015189458_100000739092 [1,0,0,1,0,0|2,0,0]=4 9638 B10R1.29 CCOCN1CCSC1C 269982a_200011216479_100000739092 [1,0,0,1,0,0|1,1,0]=4 9639 B10R1.29 COCCN1CCC[C@@H]1C 2230a_100020605311_100011201679 [1,0,0,1,0,0|2,0,0]=4 9640 B10R1.29 COCCN1CCC[C@@H]1C 269982a_100020605311_100000233755 [1,0,0,1,0,0|2,0,0]=4 9641 B10R1.29 COCCN1CCC[C@H]1C 2230a_100015189458_100011201679 [1,0,0,1,0,0|2,0,0]=4 9642 B10R1.29 COCCN1CCC[C@H]1C 269982a_100015189458_100000233755 [1,0,0,1,0,0|2,0,0]=4 9643 B10R1.29 COCCN1CCC[C@H]1C 34a_100015189458_100011201679 [1,0,0,1,0,0|2,0,0]=4 9644 B10R1.29 COCCN1CCSC1C 2230a_200011216479_100011201679 [1,0,0,1,0,0|1,1,0]=4 9645 B10R1.29 COCCN1CCSC1C 269982a_200011216479_100000233755 [1,0,0,1,0,0|1,1,0]=4 9646 B10R1.29 COCCN1CCSC1C 34a_200011216479_100011201679 [1,0,0,1,0,0|1,1,0]=4 9647 B10R1.37 CCCCCN1CCC1C 269982a_100000755817_100000210215 [1,0,0,1,0,0|2,0,0]=4 9648 B10R1.37 CCCCCN1CCC1C 34a_100000755817_100000718602 [1,0,0,1,0,0|2,0,0]=4 9649 B10R1.37 CCOCCN1CCC1C 269982a_100000755817_100011215890 [1,0,0,1,0,0|1,0,0]=3 9650 B10R1.37 CCOCCN1CCC1C 34a_100000755817_100000210147 [1,0,0,1,0,0|1,0,0]=3 9651 B10R1.37 CCSCCN1CCC1C 269982a_100000755817_100000757381 [1,0,0,1,0,0|1,1,0]=4 9652 B10R1.37 CCSCCN1CCC1C 34a_100000755817_100000757381 [1,0,0,1,0,0|1,1,0]=4 9653 B10R1.56 CC1CC1COCCCF 34a_100000744939_100011934791 [1,0,0,1,0,0|2,0,0]=4 9654 B10R1.56 CC1CC1COCCCF 7a_100000744939_100011934791 [1,0,0,1,0,0|2,0,0]=4 9655 B10R1.56 CC1CC1COCCCO 34a_100000744939_100000230001 [1,0,0,1,0,0|2,0,0]=4 9656 B10R1.56 CC1CC1COCCCO 7a_100000744939_100011215043 [1,0,0,1,0,0|2,0,0]=4 9657 B10R1.56 CCCCOCC1CC1C 34a_100000744939_100000210210 [1,0,0,1,0,0|1,0,0]=3 9658 B10R1.56 CCCCOCC1CC1C 7a_100000744939_100000210211 [1,0,0,1,0,0|1,0,0]=3 9659 B10R1.56 CCOCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011215890 [1,0,0,1,0,0|2,0,0]=4 9660 B10R1.56 CCOCCN[C@@H]1C[C@H]1F 2230a_100025746932_100011215890 [1,0,0,1,0,0|2,0,0]=4 9661 B10R1.56 CCOCCN[C@@H]1C[C@H]1F 34a_100025746932_100000210147 [1,0,0,1,0,0|2,0,0]=4 9662 B10R1.56 COCCOCC1CC1C 34a_100000744939_100011201679 [1,0,0,1,0,0|1,0,0]=3 9663 B10R1.56 COCCOCC1CC1C 7a_100000744939_100000233755 [1,0,0,1,0,0|1,0,0]=3 9664 B10R1.56 CSCCOCC1CC1C 34a_100000744939_100000212216 [1,0,0,1,0,0|1,1,0]=4 9665 B10R1.56 CSCCOCC1CC1C 7a_100000744939_100000212216 [1,0,0,1,0,0|1,1,0]=4 9666 B10R1.57 BrCCCCOC1CCC1 34a_100011216708_100000749161 [1,0,0,1,0,0|2,0,0]=4 9667 B10R1.57 BrCCCCOC1COC1 34a_100011216708_100009818527 [1,0,0,1,0,0|2,0,0]=4 9668 B10R1.57 BrCCCOCC1CCC1 34a_100011217188_100000763275 [1,0,0,1,0,0|2,0,0]=4 9669 B10R1.57 BrCCCOCC1CCO1 34a_100011217188_100000103362 [1,0,0,1,0,0|1,0,0]=3 9670 B10R1.57 C#CCCOCC1CCO1 34a_100000039022_100000688953 [1,0,0,1,0,0|0,0,2]=4 9671 B10R1.57 C#CCCOCC1CCO1 34a_100011215631_100000103362 [1,0,0,1,0,0|0,0,2]=4 9672 B10R1.57 C/C=C/CCOC1CCC1 34a_100016278192_100000749161 [1,0,0,1,0,0|1,0,1]=4 9673 B10R1.57 C/C=C/CCOC1COC1 34a_100016278192_100009818527 [1,0,0,1,0,0|1,0,1]=4 9674 B10R1.57 C/C=C/COCC1CCO1 34a_100000039022_100102629194 [1,0,0,1,0,0|0,0,2]=4 9675 B10R1.57 C/C=C/COCC1CCO1 34a_100016270725_100000103362 [1,0,0,1,0,0|0,0,2]=4 9676 B10R1.57 C=CCCOCC1CCO1 34a_100000039022_100000754431 [1,0,0,1,0,0|0,0,2]=4 9677 B10R1.57 C=CCCOCC1CCO1 34a_100011205117_100000103362 [1,0,0,1,0,0|0,0,2]=4 9678 B10R1.57 C=COCCOC1CCC1 34a_100000033082_100000749161 [1,0,0,1,0,0|0,0,2]=4 9679 B10R1.57 C=COCCOC1CCC1 34a_100000748187_100000039644 [1,0,0,1,0,0|0,0,2]=4 9680 B10R1.57 C=COCCOC1COC1 34a_100000033082_100009818527 [1,0,0,1,0,0|0,0,2]=4 9681 B10R1.57 CC#CCCOC1CCC1 34a_100000750427_100000749161 [1,0,0,1,0,0|1,0,1]=4 9682 B10R1.57 CC#CCCOC1COC1 34a_100000750427_100009818527 [1,0,0,1,0,0|1,0,1]=4 9683 B10R1.57 CC#CCOCC1CCO1 34a_100000039022_100000748600 [1,0,0,1,0,0|0,0,2]=4 9684 B10R1.57 CC#CCOCC1CCO1 34a_100000761923_100000103362 [1,0,0,1,0,0|0,0,2]=4 9685 B10R1.57 CC/C=C\COC1CCC1 34a_100000748187_100103147603 [1,0,0,1,0,0|1,0,1]=4 9686 B10R1.57 CC/C=C\COC1CCC1 34a_100016268518_100000749161 [1,0,0,1,0,0|1,0,1]=4 9687 B10R1.57 CC/C=C\COC1COC1 34a_100016268518_100009818527 [1,0,0,1,0,0|1,0,1]=4 9688 B10R1.57 CC=CCOCC1CCO1 34a_100000039022_100000070051 [1,0,0,1,0,0|0,0,2]=4 9689 B10R1.57 CCC#CCOC1CCC1 34a_100000032950_100000749161 [1,0,0,1,0,0|1,0,1]=4 9690 B10R1.57 CCC#CCOC1CCC1 34a_100000748187_100009813939 [1,0,0,1,0,0|1,0,1]=4 9691 B10R1.57 CCC#CCOC1COC1 34a_100000032950_100009818527 [1,0,0,1,0,0|1,0,1]=4 9692 B10R1.57 CCCCCNC1CCC1 2230a_100000749019_100000210326 [1,0,0,1,0,0|2,0,0]=4 9693 B10R1.57 CCCCCNC1CCC1 270004a_100000209983_100000241760 [1,0,0,1,0,0|2,0,0]=4 9694 B10R1.57 CCCCCNC1CCC1 34a_100000749019_100000718602 [1,0,0,1,0,0|2,0,0]=4 9695 B10R1.57 CCCCCNC1COC1 2230a_100016991112_100000210326 [1,0,0,1,0,0|2,0,0]=4 9696 B10R1.57 CCCCCOC1CCC1 34a_100000210253_100000749161 [1,0,0,1,0,0|1,0,0]=3 9697 B10R1.57 CCCCCOC1CCC1 34a_100000748187_100000718602 [1,0,0,1,0,0|1,0,0]=3 9698 B10R1.57 CCCCCOC1COC1 34a_100000210253_100009818527 [1,0,0,1,0,0|1,0,0]=3 9699 B10R1.57 CCCCCOC1COC1 7a_100000210253_100009818527 [1,0,0,1,0,0|1,0,0]=3 9700 B10R1.57 CCCCCOC1CSC1 7a_100000072292_100000210326 [1,0,0,1,0,0|1,1,0]=4 9701 B10R1.57 CCCCCSC1CCC1 62a_100000210326_100000749161 [1,0,0,1,0,0|1,1,0]=4 9702 B10R1.57 CCCCCSC1COC1 62a_100000210326_100009818527 [1,0,0,1,0,0|1,1,0]=4 9703 B10R1.57 CCCCNCC1CCC1 2230a_100000102301_100000763275 [1,0,0,1,0,0|2,0,0]=4 9704 B10R1.57 CCCCNCC1CCC1 2230a_100000738700_100000210211 [1,0,0,1,0,0|2,0,0]=4 9705 B10R1.57 CCCCNCC1CCC1 269862a_100000102301_100000753134 [1,0,0,1,0,0|2,0,0]=4 9706 B10R1.57 CCCCNCC1CCC1 34a_100000738700_100000210210 [1,0,0,1,0,0|2,0,0]=4 9707 B10R1.57 CCCCNCC1CCC1 7a_106832991798_100000763275 [1,0,0,1,0,0|2,0,0]=4 9708 B10R1.57 CCCCNCC1CCO1 2230a_100000102301_100000103362 [1,0,0,1,0,0|1,0,0]=3 9709 B10R1.57 CCCCNCC1CCO1 7a_106832991798_100000103362 [1,0,0,1,0,0|1,0,0]=3 9710 B10R1.57 CCCCNC[C@@H]1CCO1 2230a_100020831831_100000210211 [1,0,0,1,0,0|1,0,0]=3 9711 B10R1.57 CCCCNC[C@@H]1CCO1 34a_100020831831_100000210210 [1,0,0,1,0,0|1,0,0]=3 9712 B10R1.57 CCCCOCC1CCC1 34a_100000210227_100000763275 [1,0,0,1,0,0|1,0,0]=3 9713 B10R1.57 CCCCOCC1CCC1 34a_100000760304_100000210210 [1,0,0,1,0,0|1,0,0]=3 9714 B10R1.57 CCCCOCC1CCC1 7a_100000210227_100000763275 [1,0,0,1,0,0|1,0,0]=3 9715 B10R1.57 CCCCOCC1CCO1 34a_100000039022_100000210210 [1,0,0,1,0,0|0,0,0]=2 9716 B10R1.57 CCCCOCC1CCO1 34a_100000210227_100000103362 [1,0,0,1,0,0|0,0,0]=2 9717 B10R1.57 CCCCOCC1CCO1 7a_100000210227_100000103362 [1,0,0,1,0,0|0,0,0]=2 9718 B10R1.57 CCCCOCC1CNC1 34a_100016987283_100000210210 [1,0,0,1,0,0|2,0,0]=4 9719 B10R1.57 CCCCOCC1COC1 34a_100000060846_100000210210 [1,0,0,1,0,0|2,0,0]=4 9720 B10R1.57 CCCCOCC1COC1 34a_100000210227_100010264016 [1,0,0,1,0,0|2,0,0]=4 9721 B10R1.57 CCCCOCC1COC1 7a_100000210227_100010264016 [1,0,0,1,0,0|2,0,0]=4 9722 B10R1.57 CCCCOCN1CCC1 269982a_100000754969_100011995733 [1,0,0,1,0,0|2,0,0]=4 9723 B10R1.57 CCCCSCC1CCC1 62a_100000210211_100000763275 [1,0,0,1,0,0|1,1,0]=4 9724 B10R1.57 CCCCSCC1CCC1 62a_100000763275_100000210210 [1,0,0,1,0,0|1,1,0]=4 9725 B10R1.57 CCCCSCC1CCO1 62a_100000103362_100000210210 [1,0,0,1,0,0|0,1,0]=3 9726 B10R1.57 CCCCSCC1CCO1 62a_100000210211_100000103362 [1,0,0,1,0,0|0,1,0]=3 9727 B10R1.57 CCOCCCN1CCC1 269982a_100000754969_100012232248 [1,0,0,1,0,0|2,0,0]=4 9728 B10R1.57 CCOCCNC1CCC1 2230a_100000749019_100011215890 [1,0,0,1,0,0|1,0,0]=3 9729 B10R1.57 CCOCCNC1CCC1 270004a_102516460346_100000241760 [1,0,0,1,0,0|1,0,0]=3 9730 B10R1.57 CCOCCNC1CCC1 34a_100000749019_100000210147 [1,0,0,1,0,0|1,0,0]=3 9731 B10R1.57 CCOCCNC1CCC1 34a_102516460346_100000749161 [1,0,0,1,0,0|1,0,0]=3 9732 B10R1.57 CCOCCNC1COC1 2230a_100016991112_100011215890 [1,0,0,1,0,0|1,0,0]=3 9733 B10R1.57 CCOCCNC1COC1 34a_102516460346_100009818527 [1,0,0,1,0,0|1,0,0]=3 9734 B10R1.57 CCOCCOC1CCC1 34a_100000210136_100000749161 [1,0,0,1,0,0|0,0,0]=2 9735 B10R1.57 CCOCCOC1CCC1 34a_100000748187_100000210147 [1,0,0,1,0,0|0,0,0]=2 9736 B10R1.57 CCOCCOC1COC1 34a_100000210136_100009818527 [1,0,0,1,0,0|0,0,0]=2 9737 B10R1.57 CCOCCOC1COC1 7a_100000210136_100009818527 [1,0,0,1,0,0|0,0,0]=2 9738 B10R1.57 CCOCCOC1CSC1 7a_100000072292_100011215890 [1,0,0,1,0,0|0,1,0]=3 9739 B10R1.57 CCOCCSC1CCC1 62a_100000210147_100000749161 [1,0,0,1,0,0|0,1,0]=3 9740 B10R1.57 CCOCCSC1COC1 62a_100000210147_100009818527 [1,0,0,1,0,0|0,1,0]=3 9741 B10R1.57 CCOCSCC1CCC1 62a_100000739092_100000763275 [1,0,0,1,0,0|1,1,0]=4 9742 B10R1.57 CCOCSCC1CCC1 62a_100000763275_100000739092 [1,0,0,1,0,0|1,1,0]=4 9743 B10R1.57 CCOCSCC1CCO1 62a_100000103362_100000739092 [1,0,0,1,0,0|0,1,0]=3 9744 B10R1.57 CCOCSCC1CCO1 62a_100000739092_100000103362 [1,0,0,1,0,0|0,1,0]=3 9745 B10R1.57 CCOCSCC1COC1 62a_100000739092_100010264016 [1,0,0,1,0,0|2,0,0]=4 9746 B10R1.57 CCOCSCC1COC1 62a_100010264016_100000739092 [1,0,0,1,0,0|2,0,0]=4 9747 B10R1.57 CCSCCNC1CCC1 2230a_100000749019_100000757381 [1,0,0,1,0,0|1,1,0]=4 9748 B10R1.57 CCSCCNC1CCC1 270004a_100000106463_100000241760 [1,0,0,1,0,0|1,1,0]=4 9749 B10R1.57 CCSCCNC1CCC1 34a_100000749019_100000757381 [1,0,0,1,0,0|1,1,0]=4 9750 B10R1.57 CCSCCNC1COC1 2230a_100016991112_100000757381 [1,0,0,1,0,0|1,1,0]=4 9751 B10R1.57 CCSCCOC1CCC1 34a_100000212035_100000749161 [1,0,0,1,0,0|0,1,0]=3 9752 B10R1.57 CCSCCOC1CCC1 34a_100000748187_100000757381 [1,0,0,1,0,0|0,1,0]=3 9753 B10R1.57 CCSCCOC1COC1 34a_100000212035_100009818527 [1,0,0,1,0,0|0,1,0]=3 9754 B10R1.57 CCSCCOC1COC1 7a_100000212035_100009818527 [1,0,0,1,0,0|0,1,0]=3 9755 B10R1.57 CCSCCOC1CSC1 7a_100000072292_100000757381 [1,0,0,1,0,0|0,2,0]=4 9756 B10R1.57 CCSCCSC1CCC1 62a_100000757381_100000749161 [1,0,0,1,0,0|0,2,0]=4 9757 B10R1.57 CCSCCSC1COC1 62a_100000757381_100009818527 [1,0,0,1,0,0|0,2,0]=4 9758 B10R1.57 CNCCCOC1CCC1 34a_100000213112_100000749161 [1,0,0,1,0,0|2,0,0]=4 9759 B10R1.57 CNCCCOC1COC1 34a_100000213112_100009818527 [1,0,0,1,0,0|2,0,0]=4 9760 B10R1.57 COCCCOC1CCC1 34a_100000740835_100000749161 [1,0,0,1,0,0|2,0,0]=4 9761 B10R1.57 COCCCOC1CCC1 34a_100000748187_100000740836 [1,0,0,1,0,0|2,0,0]=4 9762 B10R1.57 COCCCOC1COC1 34a_100000740835_100009818527 [1,0,0,1,0,0|2,0,0]=4 9763 B10R1.57 COCCNCC1CCC1 2230a_100000209980_100000763275 [1,0,0,1,0,0|2,0,0]=4 9764 B10R1.57 COCCNCC1CCC1 2230a_100000738700_100011201679 [1,0,0,1,0,0|2,0,0]=4 9765 B10R1.57 COCCNCC1CCC1 269862a_100000209980_100000753134 [1,0,0,1,0,0|2,0,0]=4 9766 B10R1.57 COCCNCC1CCC1 34a_100000738700_100011201679 [1,0,0,1,0,0|2,0,0]=4 9767 B10R1.57 COCCNCC1CCO1 2230a_100000209980_100000103362 [1,0,0,1,0,0|1,0,0]=3 9768 B10R1.57 COCCNC[C@@H]1CCO1 2230a_100020831831_100011201679 [1,0,0,1,0,0|1,0,0]=3 9769 B10R1.57 COCCNC[C@@H]1CCO1 34a_100020831831_100011201679 [1,0,0,1,0,0|1,0,0]=3 9770 B10R1.57 COCCOCC1CCC1 34a_100000210237_100000763275 [1,0,0,1,0,0|1,0,0]=3 9771 B10R1.57 COCCOCC1CCC1 34a_100000760304_100011201679 [1,0,0,1,0,0|1,0,0]=3 9772 B10R1.57 COCCOCC1CCO1 34a_100000039022_100011201679 [1,0,0,1,0,0|0,0,0]=2 9773 B10R1.57 COCCOCC1CCO1 34a_100000210237_100000103362 [1,0,0,1,0,0|0,0,0]=2 9774 B10R1.57 COCCOCC1CNC1 34a_100016987283_100011201679 [1,0,0,1,0,0|2,0,0]=4 9775 B10R1.57 COCCOCC1COC1 34a_100000060846_100011201679 [1,0,0,1,0,0|2,0,0]=4 9776 B10R1.57 COCCOCC1COC1 34a_100000210237_100010264016 [1,0,0,1,0,0|2,0,0]=4 9777 B10R1.57 COCCOCN1CCC1 269982a_100000754969_100000231047 [1,0,0,1,0,0|2,0,0]=4 9778 B10R1.57 COCCSCC1CCC1 62a_100000233755_100000763275 [1,0,0,1,0,0|1,1,0]=4 9779 B10R1.57 COCCSCC1CCC1 62a_100000763275_100000233755 [1,0,0,1,0,0|1,1,0]=4 9780 B10R1.57 COCCSCC1CCO1 62a_100000103362_100000233755 [1,0,0,1,0,0|0,1,0]=3 9781 B10R1.57 COCCSCC1CCO1 62a_100000233755_100000103362 [1,0,0,1,0,0|0,1,0]=3 9782 B10R1.57 CSCCCOC1CCC1 34a_100000690336_100000749161 [1,0,0,1,0,0|2,0,0]=4 9783 B10R1.57 CSCCCOC1COC1 34a_100000690336_100009818527 [1,0,0,1,0,0|2,0,0]=4 9784 B10R1.57 CSCCCOC1COC1 7a_100000690336_100009818527 [1,0,0,1,0,0|2,0,0]=4 9785 B10R1.57 CSCCNCC1CCO1 2230a_100020590264_100000103362 [1,0,0,1,0,0|1,1,0]=4 9786 B10R1.57 CSCCNC[C@@H]1CCO1 2230a_100020831831_100000751147 [1,0,0,1,0,0|1,1,0]=4 9787 B10R1.57 CSCCNC[C@@H]1CCO1 34a_100020831831_100000212216 [1,0,0,1,0,0|1,1,0]=4 9788 B10R1.57 CSCCOCC1CCC1 34a_100000230434_100000763275 [1,0,0,1,0,0|1,1,0]=4 9789 B10R1.57 CSCCOCC1CCC1 34a_100000760304_100000212216 [1,0,0,1,0,0|1,1,0]=4 9790 B10R1.57 CSCCOCC1CCC1 7a_100000230434_100000763275 [1,0,0,1,0,0|1,1,0]=4 9791 B10R1.57 CSCCOCC1CCO1 34a_100000039022_100000212216 [1,0,0,1,0,0|0,1,0]=3 9792 B10R1.57 CSCCOCC1CCO1 34a_100000230434_100000103362 [1,0,0,1,0,0|0,1,0]=3 9793 B10R1.57 CSCCOCC1CCO1 7a_100000230434_100000103362 [1,0,0,1,0,0|0,1,0]=3 9794 B10R1.57 CSCCSCC1CCO1 62a_100000103362_100000751147 [1,0,0,1,0,0|0,2,0]=4 9795 B10R1.57 CSCCSCC1CCO1 62a_100000212216_100000103362 [1,0,0,1,0,0|0,2,0]=4 9796 B10R1.57 ClCCCCOC1CCC1 34a_100000210776_100000749161 [1,0,0,1,0,0|2,0,0]=4 9797 B10R1.57 ClCCCCOC1COC1 34a_100000210776_100009818527 [1,0,0,1,0,0|2,0,0]=4 9798 B10R1.57 ClCCCCOC1COC1 7a_100000210776_100009818527 [1,0,0,1,0,0|2,0,0]=4 9799 B10R1.57 ClCCCOCC1CCC1 34a_100000230001_100000763275 [1,0,0,1,0,0|2,0,0]=4 9800 B10R1.57 ClCCCOCC1CCO1 34a_100000230001_100000103362 [1,0,0,1,0,0|1,0,0]=3 9801 B10R1.57 FCCCCOC1CCC1 34a_100000748187_100000729493 [1,0,0,1,0,0|2,0,0]=4 9802 B10R1.57 FCCCCOC1CCC1 34a_100011995726_100000749161 [1,0,0,1,0,0|2,0,0]=4 9803 B10R1.57 FCCCCOC1COC1 34a_100011995726_100009818527 [1,0,0,1,0,0|2,0,0]=4 9804 B10R1.57 FCCCCOC1COC1 7a_100011995726_100009818527 [1,0,0,1,0,0|2,0,0]=4 9805 B10R1.57 FCCCNCC1CCO1 2230a_100015189416_100000103362 [1,0,0,1,0,0|2,0,0]=4 9806 B10R1.57 FCCCNCC1CCO1 34a_100015189416_100000103362 [1,0,0,1,0,0|2,0,0]=4 9807 B10R1.57 FCCCNC[C@@H]1CCO1 2230a_100020831831_100011934791 [1,0,0,1,0,0|2,0,0]=4 9808 B10R1.57 FCCCNC[C@@H]1CCO1 34a_100020831831_100011934791 [1,0,0,1,0,0|2,0,0]=4 9809 B10R1.57 FCCCOCC1CCC1 34a_100000759539_100000763275 [1,0,0,1,0,0|2,0,0]=4 9810 B10R1.57 FCCCOCC1CCC1 34a_100000760304_100011934791 [1,0,0,1,0,0|2,0,0]=4 9811 B10R1.57 FCCCOCC1CCO1 34a_100000039022_100011934791 [1,0,0,1,0,0|1,0,0]=3 9812 B10R1.57 FCCCOCC1CCO1 34a_100000759539_100000103362 [1,0,0,1,0,0|1,0,0]=3 9813 B10R1.57 FCCCSCC1CCO1 62a_100000103362_100011934791 [1,0,0,1,0,0|1,1,0]=4 9814 B10R1.57 FCCCSCC1CCO1 62a_100011934791_100000103362 [1,0,0,1,0,0|1,1,0]=4 9815 B10R1.57 ICCCCOC1CCC1 34a_200012148704_100000749161 [1,0,0,1,0,0|2,0,0]=4 9816 B10R1.57 ICCCCOC1COC1 34a_200012148704_100009818527 [1,0,0,1,0,0|2,0,0]=4 9817 B10R1.57 NCCCCOC1CCC1 34a_100000750430_100000749161 [1,0,0,1,0,0|2,0,0]=4 9818 B10R1.57 NCCCCOC1COC1 34a_100000750430_100009818527 [1,0,0,1,0,0|2,0,0]=4 9819 B10R1.57 NCCCOCC1CCC1 34a_100000182051_100000763275 [1,0,0,1,0,0|2,0,0]=4 9820 B10R1.57 NCCCOCC1CCO1 34a_100000182051_100000103362 [1,0,0,1,0,0|1,0,0]=3 9821 B10R1.57 NOCCOCC1CCC1 34a_100000700252_100000763275 [1,0,0,1,0,0|2,0,0]=4 9822 B10R1.57 NOCCOCC1CCO1 34a_100000700252_100000103362 [1,0,0,1,0,0|1,0,0]=3 9823 B10R1.57 OCCCCOC1CCC1 34a_100000748187_100011216708 [1,0,0,1,0,0|2,0,0]=4 9824 B10R1.57 OCCCNC[C@@H]1CCO1 2230a_100020831831_100000230001 [1,0,0,1,0,0|2,0,0]=4 9825 B10R1.57 OCCCNC[C@@H]1CCO1 34a_100020831831_100000230001 [1,0,0,1,0,0|2,0,0]=4 9826 B10R1.57 OCCCOCC1CCC1 34a_100000760304_100000230001 [1,0,0,1,0,0|2,0,0]=4 9827 B10R1.57 OCCCOCC1CCO1 34a_100000039022_100000230001 [1,0,0,1,0,0|1,0,0]=3 9828 B10R1.57 OCCCSCC1CCO1 62a_100000103362_100011215043 [1,0,0,1,0,0|1,1,0]=4 9829 B10R1.57 OCCCSCC1CCO1 62a_100011215043_100000103362 [1,0,0,1,0,0|1,1,0]=4 9830 B10R1.85 CCCN1CCCOCC1 2230a_100000685342_100000210303 [1,0,0,1,0,0|2,0,0]=4 9831 B10R1.85 CCCN1CCCOCC1 269982a_100000685342_100000210303 [1,0,0,1,0,0|2,0,0]=4 9832 B10R1.85 CCCN1CCCOCC1 34a_100000685342_100000210303 [1,0,0,1,0,0|2,0,0]=4 9833 B10R1.85 CCNC1CCCCCC1 2230a_100000210984_100000210202 [1,0,0,1,0,0|2,0,0]=4 9834 B10R1.85 CCNC1CCCCCC1 270004a_100015525214_100000210131 [1,0,0,1,0,0|2,0,0]=4 9835 B10R1.85 CCNC1CCCCCC1 34a_100000210984_100000210202 [1,0,0,1,0,0|2,0,0]=4 9836 B10R1.85 CCNC1CCCNCC1 270004a_100015525214_100015187895 [1,0,0,1,0,0|2,0,0]=4 9837 B10R1.85 CCOC1CCCCCC1 34a_100000210887_100000210202 [1,0,0,1,0,0|1,0,0]=3 9838 B10R1.85 CCOC1CCCCCC1 34a_100121572206_100011217769 [1,0,0,1,0,0|1,0,0]=3 9839 B10R1.85 CCOC1CCCCCC1 7a_100000210887_100000210202 [1,0,0,1,0,0|1,0,0]=3 9840 B10R1.85 CCSC1CCCCCC1 62a_100000210202_100011217769 [1,0,0,1,0,0|1,1,0]=4 9841 B10R1.85 CCSC1CCCCCC1 62a_100011217769_100000210202 [1,0,0,1,0,0|1,1,0]=4 9842 B10R1.85 COCC1CCCCCC1 34a_100000699130_200000210301 [1,0,0,1,0,0|2,0,0]=4 9843 B10R1.85 COCC1CCCCCC1 34a_100138415774_200000696569 [1,0,0,1,0,0|2,0,0]=4 9844 B10R1.85 COCC1CCCCCC1 7a_100000699130_200000210301 [1,0,0,1,0,0|2,0,0]=4 9845 B10R1.85 COCN1CCCOCC1 2230a_100000685342_100000766300 [1,0,0,1,0,0|2,0,0]=4 9846 B10R1.85 COCN1CCCOCC1 269982a_100000685342_100000766300 [1,0,0,1,0,0|2,0,0]=4 9847 B10R1.85 FCOC1CCCCCC1 34a_100000210887_100015361967 [1,0,0,1,0,0|2,0,0]=4 9848 B10R1.85 FCOC1CCCCCC1 7a_100000210887_100015361967 [1,0,0,1,0,0|2,0,0]=4 9849 B10R1.85 [13CH3]OCC1CCCCCC1 34a_100000699130_200025704644 [1,0,0,1,0,0|2,0,0]=4 9850 B10R1.85 [13CH3]OCC1CCCCCC1 7a_100000699130_200025704644 [1,0,0,1,0,0|2,0,0]=4 9851 B10R1.161 CCN1CCCCCCC1 2230a_100000211400_100000210202 [1,0,0,1,0,0|2,0,0]=4 9852 B10R1.161 CCN1CCCCCCC1 269982a_100000211400_100000204670 [1,0,0,1,0,0|2,0,0]=4 9853 B10R1.161 CCN1CCCCCCC1 34a_100000211400_100000210202 [1,0,0,1,0,0|2,0,0]=4 9854 B10R1.161 COC1CCCCCCC1 34a_100000210054_200000210301 [1,0,0,1,0,0|2,0,0]=4 9855 B10R1.161 COC1CCCCCCC1 7a_100000210054_200000210301 [1,0,0,1,0,0|2,0,0]=4 9856 B10R1.161 [13CH3]OC1CCCCCCC1 34a_100000210054_200025704644 [1,0,0,1,0,0|2,0,0]=4 9857 B10R1.161 [13CH3]OC1CCCCCCC1 7a_100000210054_200025704644 [1,0,0,1,0,0|2,0,0]=4 9858 B10R1.177 BrCCCCOCC1CC1 34a_100011216708_100000742324 [1,0,0,1,0,0|2,0,0]=4 9859 B10R1.177 BrCCCCOCC1CO1 34a_100011216708_102125554688 [1,0,0,1,0,0|2,0,0]=4 9860 B10R1.177 BrCCCOCCC1CC1 34a_100011217188_100000694398 [1,0,0,1,0,0|2,0,0]=4 9861 B10R1.177 C/C=C/CCOCC1CC1 34a_100016278192_100000742324 [1,0,0,1,0,0|1,0,1]=4 9862 B10R1.177 C/C=C/CCOCC1CO1 34a_100016278192_102125554688 [1,0,0,1,0,0|1,0,1]=4 9863 B10R1.177 C=COCCOCC1CC1 34a_100000033082_100000742324 [1,0,0,1,0,0|0,0,2]=4 9864 B10R1.177 C=COCCOCC1CC1 34a_100000211283_100000039644 [1,0,0,1,0,0|0,0,2]=4 9865 B10R1.177 C=COCCOCC1CO1 34a_100000033082_102125554688 [1,0,0,1,0,0|0,0,2]=4 9866 B10R1.177 C=COCCOC[C@@H]1CO1 34a_100000757423_100000039644 [1,0,0,1,0,0|0,0,2]=4 9867 B10R1.177 CC#CCCOCC1CC1 34a_100000750427_100000742324 [1,0,0,1,0,0|1,0,1]=4 9868 B10R1.177 CC#CCCOCC1CO1 34a_100000750427_102125554688 [1,0,0,1,0,0|1,0,1]=4 9869 B10R1.177 CC/C=C\COCC1CC1 34a_100000211283_100103147603 [1,0,0,1,0,0|1,0,1]=4 9870 B10R1.177 CC/C=C\COCC1CC1 34a_100016268518_100000742324 [1,0,0,1,0,0|1,0,1]=4 9871 B10R1.177 CC/C=C\COCC1CO1 34a_100016268518_102125554688 [1,0,0,1,0,0|1,0,1]=4 9872 B10R1.177 CC/C=C\COC[C@@H]1CO1 34a_100000757423_100103147603 [1,0,0,1,0,0|1,0,1]=4 9873 B10R1.177 CCC#CCOCC1CC1 34a_100000032950_100000742324 [1,0,0,1,0,0|1,0,1]=4 9874 B10R1.177 CCC#CCOCC1CC1 34a_100000211283_100009813939 [1,0,0,1,0,0|1,0,1]=4 9875 B10R1.177 CCC#CCOCC1CO1 34a_100000032950_102125554688 [1,0,0,1,0,0|1,0,1]=4 9876 B10R1.177 CCC#CCOC[C@@H]1CO1 34a_100000757423_100009813939 [1,0,0,1,0,0|1,0,1]=4 9877 B10R1.177 CCCCCNCC1CC1 2230a_100000209983_100000742324 [1,0,0,1,0,0|2,0,0]=4 9878 B10R1.177 CCCCCNCC1CC1 2230a_100000735609_100000210326 [1,0,0,1,0,0|2,0,0]=4 9879 B10R1.177 CCCCCNCC1CC1 269862a_100000209983_100000741477 [1,0,0,1,0,0|2,0,0]=4 9880 B10R1.177 CCCCCNCC1CC1 34a_100000735609_100000718602 [1,0,0,1,0,0|2,0,0]=4 9881 B10R1.177 CCCCCNCC1CO1 2230a_100000209983_100011216344 [1,0,0,1,0,0|2,0,0]=4 9882 B10R1.177 CCCCCOCC1CC1 34a_100000210253_100000742324 [1,0,0,1,0,0|1,0,0]=3 9883 B10R1.177 CCCCCOCC1CC1 34a_100000211283_100000718602 [1,0,0,1,0,0|1,0,0]=3 9884 B10R1.177 CCCCCOCC1CC1 7a_100000210253_100000742324 [1,0,0,1,0,0|1,0,0]=3 9885 B10R1.177 CCCCCOCC1CO1 34a_100000210253_102125554688 [1,0,0,1,0,0|1,0,0]=3 9886 B10R1.177 CCCCCOCC1CO1 7a_100000210253_102125554688 [1,0,0,1,0,0|1,0,0]=3 9887 B10R1.177 CCCCCOCC1CS1 7a_100000210253_100000031435 [1,0,0,1,0,0|1,1,0]=4 9888 B10R1.177 CCCCCOC[C@@H]1CO1 34a_100000757423_100000718602 [1,0,0,1,0,0|1,0,0]=3 9889 B10R1.177 CCCCCOC[C@@H]1CO1 7a_100000210253_100000745022 [1,0,0,1,0,0|1,0,0]=3 9890 B10R1.177 CCCCCSCC1CC1 62a_100000210326_100000742324 [1,0,0,1,0,0|1,1,0]=4 9891 B10R1.177 CCCCCSCC1CC1 62a_100000756562_100000210326 [1,0,0,1,0,0|1,1,0]=4 9892 B10R1.177 CCCCCSCC1CO1 62a_100000210326_102125554688 [1,0,0,1,0,0|1,1,0]=4 9893 B10R1.177 CCCCCSCC1CO1 62a_102125554688_100000210326 [1,0,0,1,0,0|1,1,0]=4 9894 B10R1.177 CCCCCSC[C@@H]1CO1 62a_100000210326_100000745022 [1,0,0,1,0,0|1,1,0]=4 9895 B10R1.177 CCCCCSC[C@@H]1CO1 62a_100000745022_100000210326 [1,0,0,1,0,0|1,1,0]=4 9896 B10R1.177 CCCCNCCC1CC1 2230a_100000102301_100000694398 [1,0,0,1,0,0|2,0,0]=4 9897 B10R1.177 CCCCNCCC1CC1 34a_100000764129_100000210210 [1,0,0,1,0,0|2,0,0]=4 9898 B10R1.177 CCCCNCCC1CC1 7a_106832991798_100000764125 [1,0,0,1,0,0|2,0,0]=4 9899 B10R1.177 CCCCOCCC1CC1 34a_100000210227_100000694398 [1,0,0,1,0,0|1,0,0]=3 9900 B10R1.177 CCCCOCCC1CC1 34a_100000754188_100000210210 [1,0,0,1,0,0|1,0,0]=3 9901 B10R1.177 CCCCOCCC1CC1 7a_100000210227_100000764125 [1,0,0,1,0,0|1,0,0]=3 9902 B10R1.177 CCCCOCCC1CC1 7a_100000754188_100000210211 [1,0,0,1,0,0|1,0,0]=3 9903 B10R1.177 CCCCOCCC1CO1 34a_100000210227_100000732470 [1,0,0,1,0,0|2,0,0]=4 9904 B10R1.177 CCCCOCCC1CO1 7a_100000210227_100000732470 [1,0,0,1,0,0|2,0,0]=4 9905 B10R1.177 CCCCOCC[C@@H]1CO1 34a_100009820653_100000210210 [1,0,0,1,0,0|2,0,0]=4 9906 B10R1.177 CCCCOCNC1CC1 34a_100000212008_100011995733 [1,0,0,1,0,0|2,0,0]=4 9907 B10R1.177 CCCCOCSC1CC1 62a_100011995733_100000211595 [1,0,0,1,0,0|2,0,0]=4 9908 B10R1.177 CCCCSCCC1CC1 62a_100000210211_100000764125 [1,0,0,1,0,0|1,1,0]=4 9909 B10R1.177 CCCCSCCC1CC1 62a_100000764125_100000210210 [1,0,0,1,0,0|1,1,0]=4 9910 B10R1.177 CCOCCCNC1CC1 34a_100000210961_100000211595 [1,0,0,1,0,0|2,0,0]=4 9911 B10R1.177 CCOCCCNC1CC1 34a_100000212008_100012232248 [1,0,0,1,0,0|2,0,0]=4 9912 B10R1.177 CCOCCCOC1CC1 34a_100000757476_100000211595 [1,0,0,1,0,0|2,0,0]=4 9913 B10R1.177 CCOCCCSC1CC1 62a_100012232248_100000211595 [1,0,0,1,0,0|2,0,0]=4 9914 B10R1.177 CCOCCNCC1CC1 2230a_100000735609_100011215890 [1,0,0,1,0,0|1,0,0]=3 9915 B10R1.177 CCOCCNCC1CC1 2230a_102516460346_100000742324 [1,0,0,1,0,0|1,0,0]=3 9916 B10R1.177 CCOCCNCC1CC1 269862a_100011200944_100000741477 [1,0,0,1,0,0|1,0,0]=3 9917 B10R1.177 CCOCCNCC1CC1 34a_100000735609_100000210147 [1,0,0,1,0,0|1,0,0]=3 9918 B10R1.177 CCOCCNCC1CC1 34a_102516460346_100000742324 [1,0,0,1,0,0|1,0,0]=3 9919 B10R1.177 CCOCCNCC1CO1 2230a_102516460346_100011216344 [1,0,0,1,0,0|1,0,0]=3 9920 B10R1.177 CCOCCNCC1CO1 34a_102516460346_102125554688 [1,0,0,1,0,0|1,0,0]=3 9921 B10R1.177 CCOCCOCC1CC1 34a_100000210136_100000742324 [1,0,0,1,0,0|0,0,0]=2 9922 B10R1.177 CCOCCOCC1CC1 34a_100000211283_100000210147 [1,0,0,1,0,0|0,0,0]=2 9923 B10R1.177 CCOCCOCC1CC1 7a_100000210136_100000742324 [1,0,0,1,0,0|0,0,0]=2 9924 B10R1.177 CCOCCOCC1CO1 34a_100000210136_102125554688 [1,0,0,1,0,0|0,0,0]=2 9925 B10R1.177 CCOCCOCC1CO1 7a_100000210136_102125554688 [1,0,0,1,0,0|0,0,0]=2 9926 B10R1.177 CCOCCOCC1CS1 7a_100000210136_100000031435 [1,0,0,1,0,0|0,1,0]=3 9927 B10R1.177 CCOCCOC[C@@H]1CO1 34a_100000757423_100000210147 [1,0,0,1,0,0|0,0,0]=2 9928 B10R1.177 CCOCCOC[C@@H]1CO1 7a_100000210136_100000745022 [1,0,0,1,0,0|0,0,0]=2 9929 B10R1.177 CCOCCSCC1CC1 62a_100000210147_100000742324 [1,0,0,1,0,0|0,1,0]=3 9930 B10R1.177 CCOCCSCC1CC1 62a_100000756562_100011215890 [1,0,0,1,0,0|0,1,0]=3 9931 B10R1.177 CCOCCSCC1CO1 62a_100000210147_102125554688 [1,0,0,1,0,0|0,1,0]=3 9932 B10R1.177 CCOCCSCC1CO1 62a_102125554688_100011215890 [1,0,0,1,0,0|0,1,0]=3 9933 B10R1.177 CCOCCSCC1CS1 62a_100000031435_100011215890 [1,0,0,1,0,0|0,2,0]=4 9934 B10R1.177 CCOCCSCC1CS1 62a_100000210147_100000031435 [1,0,0,1,0,0|0,2,0]=4 9935 B10R1.177 CCOCCSC[C@@H]1CO1 62a_100000210147_100000745022 [1,0,0,1,0,0|0,1,0]=3 9936 B10R1.177 CCOCCSC[C@@H]1CO1 62a_100000745022_100011215890 [1,0,0,1,0,0|0,1,0]=3 9937 B10R1.177 CCOCSCCC1CC1 62a_100000739092_100000764125 [1,0,0,1,0,0|1,1,0]=4 9938 B10R1.177 CCOCSCCC1CC1 62a_100000764125_100000739092 [1,0,0,1,0,0|1,1,0]=4 9939 B10R1.177 CCOCSCCC1CO1 62a_100000732470_100000739092 [1,0,0,1,0,0|2,0,0]=4 9940 B10R1.177 CCOCSCCC1CO1 62a_100000739092_100000732470 [1,0,0,1,0,0|2,0,0]=4 9941 B10R1.177 CCSCCNCC1CC1 2230a_100000106463_100000742324 [1,0,0,1,0,0|1,1,0]=4 9942 B10R1.177 CCSCCNCC1CC1 2230a_100000735609_100000757381 [1,0,0,1,0,0|1,1,0]=4 9943 B10R1.177 CCSCCNCC1CC1 269862a_100000106463_100000741477 [1,0,0,1,0,0|1,1,0]=4 9944 B10R1.177 CCSCCNCC1CC1 34a_100000735609_100000757381 [1,0,0,1,0,0|1,1,0]=4 9945 B10R1.177 CCSCCNCC1CO1 2230a_100000106463_100011216344 [1,0,0,1,0,0|1,1,0]=4 9946 B10R1.177 CCSCCOCC1CC1 34a_100000211283_100000757381 [1,0,0,1,0,0|0,1,0]=3 9947 B10R1.177 CCSCCOCC1CC1 34a_100000212035_100000742324 [1,0,0,1,0,0|0,1,0]=3 9948 B10R1.177 CCSCCOCC1CC1 7a_100000212035_100000742324 [1,0,0,1,0,0|0,1,0]=3 9949 B10R1.177 CCSCCOCC1CO1 34a_100000212035_102125554688 [1,0,0,1,0,0|0,1,0]=3 9950 B10R1.177 CCSCCOCC1CO1 7a_100000212035_102125554688 [1,0,0,1,0,0|0,1,0]=3 9951 B10R1.177 CCSCCOCC1CS1 7a_100000212035_100000031435 [1,0,0,1,0,0|0,2,0]=4 9952 B10R1.177 CCSCCOC[C@@H]1CO1 34a_100000757423_100000757381 [1,0,0,1,0,0|0,1,0]=3 9953 B10R1.177 CCSCCOC[C@@H]1CO1 7a_100000212035_100000745022 [1,0,0,1,0,0|0,1,0]=3 9954 B10R1.177 CCSCCSCC1CC1 62a_100000756562_100000757381 [1,0,0,1,0,0|0,2,0]=4 9955 B10R1.177 CCSCCSCC1CC1 62a_100000757381_100000742324 [1,0,0,1,0,0|0,2,0]=4 9956 B10R1.177 CCSCCSCC1CO1 62a_100000757381_102125554688 [1,0,0,1,0,0|0,2,0]=4 9957 B10R1.177 CCSCCSCC1CO1 62a_102125554688_100000757381 [1,0,0,1,0,0|0,2,0]=4 9958 B10R1.177 CCSCCSC[C@@H]1CO1 62a_100000745022_100000757381 [1,0,0,1,0,0|0,2,0]=4 9959 B10R1.177 CCSCCSC[C@@H]1CO1 62a_100000757381_100000745022 [1,0,0,1,0,0|0,2,0]=4 9960 B10R1.177 CNCCCOCC1CC1 34a_100000213112_100000742324 [1,0,0,1,0,0|2,0,0]=4 9961 B10R1.177 CNCCCOCC1CO1 34a_100000213112_102125554688 [1,0,0,1,0,0|2,0,0]=4 9962 B10R1.177 COCCCOCC1CC1 34a_100000211283_100000740836 [1,0,0,1,0,0|2,0,0]=4 9963 B10R1.177 COCCCOCC1CC1 34a_100000740835_100000742324 [1,0,0,1,0,0|2,0,0]=4 9964 B10R1.177 COCCCOCC1CO1 34a_100000740835_102125554688 [1,0,0,1,0,0|2,0,0]=4 9965 B10R1.177 COCCCOC[C@@H]1CO1 34a_100000757423_100000740836 [1,0,0,1,0,0|2,0,0]=4 9966 B10R1.177 COCCNCCC1CC1 2230a_100000209980_100000694398 [1,0,0,1,0,0|2,0,0]=4 9967 B10R1.177 COCCNCCC1CC1 34a_100000764129_100011201679 [1,0,0,1,0,0|2,0,0]=4 9968 B10R1.177 COCCOCCC1CC1 34a_100000210237_100000694398 [1,0,0,1,0,0|1,0,0]=3 9969 B10R1.177 COCCOCCC1CC1 34a_100000754188_100011201679 [1,0,0,1,0,0|1,0,0]=3 9970 B10R1.177 COCCOCCC1CC1 7a_100000754188_100000233755 [1,0,0,1,0,0|1,0,0]=3 9971 B10R1.177 COCCOCCC1CO1 34a_100000210237_100000732470 [1,0,0,1,0,0|2,0,0]=4 9972 B10R1.177 COCCOCC[C@@H]1CO1 34a_100009820653_100011201679 [1,0,0,1,0,0|2,0,0]=4 9973 B10R1.177 COCCOCSC1CC1 62a_100000231047_100000211595 [1,0,0,1,0,0|2,0,0]=4 9974 B10R1.177 COCCSCCC1CC1 62a_100000233755_100000764125 [1,0,0,1,0,0|1,1,0]=4 9975 B10R1.177 COCCSCCC1CC1 62a_100000764125_100000233755 [1,0,0,1,0,0|1,1,0]=4 9976 B10R1.177 CSCCCOCC1CC1 34a_100000690336_100000742324 [1,0,0,1,0,0|2,0,0]=4 9977 B10R1.177 CSCCCOCC1CC1 7a_100000690336_100000742324 [1,0,0,1,0,0|2,0,0]=4 9978 B10R1.177 CSCCCOCC1CO1 34a_100000690336_102125554688 [1,0,0,1,0,0|2,0,0]=4 9979 B10R1.177 CSCCCOCC1CO1 7a_100000690336_102125554688 [1,0,0,1,0,0|2,0,0]=4 9980 B10R1.177 CSCCCOC[C@@H]1CO1 7a_100000690336_100000745022 [1,0,0,1,0,0|2,0,0]=4 9981 B10R1.177 CSCCOCCC1CC1 34a_100000230434_100000694398 [1,0,0,1,0,0|1,1,0]=4 9982 B10R1.177 CSCCOCCC1CC1 34a_100000754188_100000212216 [1,0,0,1,0,0|1,1,0]=4 9983 B10R1.177 CSCCOCCC1CC1 7a_100000230434_100000764125 [1,0,0,1,0,0|1,1,0]=4 9984 B10R1.177 CSCCOCCC1CC1 7a_100000754188_100000212216 [1,0,0,1,0,0|1,1,0]=4 9985 B10R1.177 ClCCCCOCC1CC1 34a_100000210776_100000742324 [1,0,0,1,0,0|2,0,0]=4 9986 B10R1.177 ClCCCCOCC1CC1 7a_100000210776_100000742324 [1,0,0,1,0,0|2,0,0]=4 9987 B10R1.177 ClCCCCOCC1CO1 34a_100000210776_102125554688 [1,0,0,1,0,0|2,0,0]=4 9988 B10R1.177 ClCCCCOCC1CO1 7a_100000210776_102125554688 [1,0,0,1,0,0|2,0,0]=4 9989 B10R1.177 ClCCCCOC[C@@H]1CO1 7a_100000210776_100000745022 [1,0,0,1,0,0|2,0,0]=4 9990 B10R1.177 ClCCCOCCC1CC1 34a_100000230001_100000694398 [1,0,0,1,0,0|2,0,0]=4 9991 B10R1.177 FCCCCOCC1CC1 34a_100000211283_100000729493 [1,0,0,1,0,0|2,0,0]=4 9992 B10R1.177 FCCCCOCC1CC1 34a_100011995726_100000742324 [1,0,0,1,0,0|2,0,0]=4 9993 B10R1.177 FCCCCOCC1CC1 7a_100011995726_100000742324 [1,0,0,1,0,0|2,0,0]=4 9994 B10R1.177 FCCCCOCC1CO1 34a_100011995726_102125554688 [1,0,0,1,0,0|2,0,0]=4 9995 B10R1.177 FCCCCOCC1CO1 7a_100011995726_102125554688 [1,0,0,1,0,0|2,0,0]=4 9996 B10R1.177 FCCCCOC[C@@H]1CO1 34a_100000757423_100000729493 [1,0,0,1,0,0|2,0,0]=4 9997 B10R1.177 FCCCCOC[C@@H]1CO1 7a_100011995726_100000745022 [1,0,0,1,0,0|2,0,0]=4 9998 B10R1.177 FCCCOCCC1CC1 34a_100000754188_100011934791 [1,0,0,1,0,0|2,0,0]=4 9999 B10R1.177 FCCCOCCC1CC1 34a_100000759539_100000694398 [1,0,0,1,0,0|2,0,0]=4 10000 B10R1.177 FCCCOCCC1CC1 7a_100000754188_100011934791 [1,0,0,1,0,0|2,0,0]=4 10001 B10R1.177 ICCCCOCC1CC1 34a_200012148704_100000742324 [1,0,0,1,0,0|2,0,0]=4 10002 B10R1.177 ICCCCOCC1CO1 34a_200012148704_102125554688 [1,0,0,1,0,0|2,0,0]=4 10003 B10R1.177 NCCCCOCC1CC1 34a_100000750430_100000742324 [1,0,0,1,0,0|2,0,0]=4 10004 B10R1.177 NCCCCOCC1CO1 34a_100000750430_102125554688 [1,0,0,1,0,0|2,0,0]=4 10005 B10R1.177 NCCCOCCC1CC1 34a_100000182051_100000694398 [1,0,0,1,0,0|2,0,0]=4 10006 B10R1.177 NOCCOCCC1CC1 34a_100000700252_100000694398 [1,0,0,1,0,0|2,0,0]=4 10007 B10R1.177 OCCCCOCC1CC1 34a_100000211283_100011216708 [1,0,0,1,0,0|2,0,0]=4 10008 B10R1.177 OCCCCOC[C@@H]1CO1 34a_100000757423_100011216708 [1,0,0,1,0,0|2,0,0]=4 10009 B10R1.177 OCCCOCCC1CC1 34a_100000754188_100000230001 [1,0,0,1,0,0|2,0,0]=4 10010 B10R1.177 OCCCOCCC1CC1 7a_100000754188_100011215043 [1,0,0,1,0,0|2,0,0]=4 10011 B12R1.8 BrCCCCOC1CCCOC1 34a_100011216708_100000693364 [0,1,0,1,0,0|2,0,0]=4 10012 B12R1.8 BrCCOCCC1CCCCC1 34a_100000211926_100011209188 [0,1,0,1,0,0|2,0,0]=4 10013 B12R1.8 BrCCOCCC1CCOCC1 34a_100000211926_100011934994 [0,1,0,1,0,0|1,0,0]=3 10014 B12R1.8 BrCCOCCN1CCCCC1 34a_100000211926_100000739454 [0,1,0,1,0,0|2,0,0]=4 10015 B12R1.8 C#CCOCCC1CCOCC1 34a_100000210247_100011934994 [0,1,0,1,0,0|1,0,1]=4 10016 B12R1.8 C#CCOCCC1CCOCC1 34a_100011933979_100000184674 [0,1,0,1,0,0|1,0,1]=4 10017 B12R1.8 C#CCOCCC1CCOCC1 7a_100011933979_100000038162 [0,1,0,1,0,0|1,0,1]=4 10018 B12R1.8 C#CCOCCN1CCOCC1 2230a_100015191051_100010402529 [0,1,0,1,0,0|1,0,1]=4 10019 B12R1.8 C#CCOCCN1CCOCC1 34a_100015191051_100010402529 [0,1,0,1,0,0|1,0,1]=4 10020 B12R1.8 C/C=C/CCOC1CCCOC1 34a_100016278192_100000693364 [0,1,0,1,0,0|1,0,1]=4 10021 B12R1.8 C=CCOCCC1CCOCC1 34a_100011933979_100015514636 [0,1,0,1,0,0|1,0,1]=4 10022 B12R1.8 C=CCOCCC1CCOCC1 34a_200000210373_100011934994 [0,1,0,1,0,0|1,0,1]=4 10023 B12R1.8 C=CCOCCC1CCOCC1 7a_100011933979_100015514636 [0,1,0,1,0,0|1,0,1]=4 10024 B12R1.8 C=COCCOC1CCCOC1 34a_100000033082_100000693364 [0,1,0,1,0,0|0,0,2]=4 10025 B12R1.8 C=COCCOC1CCCOC1 34a_100000754041_100000039644 [0,1,0,1,0,0|0,0,2]=4 10026 B12R1.8 C=COCCOC1CCOCC1 34a_100000744328_100000039644 [0,1,0,1,0,0|0,0,2]=4 10027 B12R1.8 CC#CCCOC1CCCOC1 34a_100000750427_100000693364 [0,1,0,1,0,0|1,0,1]=4 10028 B12R1.8 CC/C=C\CCN1CCOCC1 2230a_100015191051_100015370543 [0,1,0,1,0,0|2,0,0]=4 10029 B12R1.8 CC/C=C\CCN1CCOCC1 269982a_100015191051_100015370543 [0,1,0,1,0,0|2,0,0]=4 10030 B12R1.8 CC/C=C\CCN1CCOCC1 34a_100015191051_100015370543 [0,1,0,1,0,0|2,0,0]=4 10031 B12R1.8 CC/C=C\COC1CCCOC1 34a_100000754041_100103147603 [0,1,0,1,0,0|1,0,1]=4 10032 B12R1.8 CC/C=C\COC1CCCOC1 34a_100016268518_100000693364 [0,1,0,1,0,0|1,0,1]=4 10033 B12R1.8 CC/C=C\COC1CCOCC1 34a_100000744328_100103147603 [0,1,0,1,0,0|1,0,1]=4 10034 B12R1.8 CCC#CCOC1CCCOC1 34a_100000032950_100000693364 [0,1,0,1,0,0|1,0,1]=4 10035 B12R1.8 CCC#CCOC1CCCOC1 34a_100000754041_100009813939 [0,1,0,1,0,0|1,0,1]=4 10036 B12R1.8 CCC#CCOC1CCOCC1 34a_100000744328_100009813939 [0,1,0,1,0,0|1,0,1]=4 10037 B12R1.8 CCCCCCN1CCOCC1 2230a_100015191051_100000210314 [0,1,0,1,0,0|2,0,0]=4 10038 B12R1.8 CCCCCCN1CCOCC1 269982a_100015191051_100000210757 [0,1,0,1,0,0|2,0,0]=4 10039 B12R1.8 CCCCCCN1CCOCC1 34a_100015191051_100000210314 [0,1,0,1,0,0|2,0,0]=4 10040 B12R1.8 CCCCCNC1CCCOC1 2230a_100000719290_100000210326 [0,1,0,1,0,0|2,0,0]=4 10041 B12R1.8 CCCCCNC1CCCOC1 270004a_100000209983_100000753404 [0,1,0,1,0,0|2,0,0]=4 10042 B12R1.8 CCCCCNC1CCCOC1 34a_100000719290_100000718602 [0,1,0,1,0,0|2,0,0]=4 10043 B12R1.8 CCCCCNC1CCOCC1 2230a_100000741149_100000210326 [0,1,0,1,0,0|2,0,0]=4 10044 B12R1.8 CCCCCNC1CCOCC1 270004a_100000209983_100011217826 [0,1,0,1,0,0|2,0,0]=4 10045 B12R1.8 CCCCCNC1CCOCC1 34a_100000741149_100000718602 [0,1,0,1,0,0|2,0,0]=4 10046 B12R1.8 CCCCCOC1CC=CCC1 34a_100000073881_100000718602 [0,1,0,1,0,0|2,0,0]=4 10047 B12R1.8 CCCCCOC1CCCCC1 34a_100000210231_100000718602 [0,1,0,1,0,0|2,0,0]=4 10048 B12R1.8 CCCCCOC1CCCCC1 34a_100000210253_100000210327 [0,1,0,1,0,0|2,0,0]=4 10049 B12R1.8 CCCCCOC1CCCCC1 7a_100000210231_100000210326 [0,1,0,1,0,0|2,0,0]=4 10050 B12R1.8 CCCCCOC1CCCCC1 7a_100000210253_100000210327 [0,1,0,1,0,0|2,0,0]=4 10051 B12R1.8 CCCCCOC1CCCCO1 34a_100000033831_100000718602 [0,1,0,1,0,0|2,0,0]=4 10052 B12R1.8 CCCCCOC1CCCOC1 34a_100000210253_100000693364 [0,1,0,1,0,0|1,0,0]=3 10053 B12R1.8 CCCCCOC1CCCOC1 34a_100000754041_100000718602 [0,1,0,1,0,0|1,0,0]=3 10054 B12R1.8 CCCCCOC1CCCOC1 7a_100000210253_100000693364 [0,1,0,1,0,0|1,0,0]=3 10055 B12R1.8 CCCCCOC1CCCSC1 7a_100015962668_100000210326 [0,1,0,1,0,0|1,1,0]=4 10056 B12R1.8 CCCCCOC1CCOCC1 34a_100000744328_100000718602 [0,1,0,1,0,0|1,0,0]=3 10057 B12R1.8 CCCCCOC1CCOCC1 7a_100000210253_100000686592 [0,1,0,1,0,0|1,0,0]=3 10058 B12R1.8 CCCCCOC1CCSCC1 34a_100000210253_100000069128 [0,1,0,1,0,0|1,1,0]=4 10059 B12R1.8 CCCCCOC1CCSCC1 34a_100000731022_100000718602 [0,1,0,1,0,0|1,1,0]=4 10060 B12R1.8 CCCCCOC1CCSCC1 7a_100000210253_100011500858 [0,1,0,1,0,0|1,1,0]=4 10061 B12R1.8 CCCCCOC1CCSCC1 7a_100000731022_100000210326 [0,1,0,1,0,0|1,1,0]=4 10062 B12R1.8 CCCCCSC1CCCOC1 62a_100000210326_100000693364 [0,1,0,1,0,0|1,1,0]=4 10063 B12R1.8 CCCCCSC1CCOCC1 62a_100000210326_100011324220 [0,1,0,1,0,0|1,1,0]=4 10064 B12R1.8 CCCCNCC1CCOCC1 2230a_100000102301_100000754603 [0,1,0,1,0,0|2,0,0]=4 10065 B12R1.8 CCCCNCC1CCOCC1 2230a_100000746373_100000210211 [0,1,0,1,0,0|2,0,0]=4 10066 B12R1.8 CCCCNCC1CCOCC1 269862a_100000102301_100000749017 [0,1,0,1,0,0|2,0,0]=4 10067 B12R1.8 CCCCNCC1CCOCC1 34a_100000746373_100000210210 [0,1,0,1,0,0|2,0,0]=4 10068 B12R1.8 CCCCNCC1CCOCC1 7a_106832991798_100000754603 [0,1,0,1,0,0|2,0,0]=4 10069 B12R1.8 CCCCOCC1CCOCC1 34a_100000210227_100000754603 [0,1,0,1,0,0|2,0,0]=4 10070 B12R1.8 CCCCOCC1CCOCC1 34a_100000749013_100000210210 [0,1,0,1,0,0|2,0,0]=4 10071 B12R1.8 CCCCOCC1CCOCC1 7a_100000210227_100000754603 [0,1,0,1,0,0|2,0,0]=4 10072 B12R1.8 CCCCOCN1CCOCC1 2230a_100015191051_100011995733 [0,1,0,1,0,0|2,0,0]=4 10073 B12R1.8 CCCCOCN1CCOCC1 269982a_100015191051_100011995733 [0,1,0,1,0,0|2,0,0]=4 10074 B12R1.8 CCCCOCN1CCOCC1 34a_100015191051_100011995733 [0,1,0,1,0,0|2,0,0]=4 10075 B12R1.8 CCCCSCC1CCOCC1 62a_100000210211_100000749018 [0,1,0,1,0,0|2,0,0]=4 10076 B12R1.8 CCCCSCC1CCOCC1 62a_100000754603_100000210210 [0,1,0,1,0,0|2,0,0]=4 10077 B12R1.8 CCCNCCC1CCOCC1 2230a_100000755988_100000210303 [0,1,0,1,0,0|2,0,0]=4 10078 B12R1.8 CCCNCCC1CCOCC1 34a_100000755988_100000210303 [0,1,0,1,0,0|2,0,0]=4 10079 B12R1.8 CCCOCCC1CCCCC1 34a_100000210258_100011209188 [0,1,0,1,0,0|2,0,0]=4 10080 B12R1.8 CCCOCCC1CCCCC1 34a_100011217863_100000210303 [0,1,0,1,0,0|2,0,0]=4 10081 B12R1.8 CCCOCCC1CCCCC1 7a_100011217863_100000210303 [0,1,0,1,0,0|2,0,0]=4 10082 B12R1.8 CCCOCCC1CCNCC1 34a_100015190746_100000210303 [0,1,0,1,0,0|2,0,0]=4 10083 B12R1.8 CCCOCCC1CCOCC1 34a_100000210258_100011934994 [0,1,0,1,0,0|1,0,0]=3 10084 B12R1.8 CCCOCCC1CCOCC1 34a_100011933979_100000210303 [0,1,0,1,0,0|1,0,0]=3 10085 B12R1.8 CCCOCCC1CCOCC1 7a_100011933979_100000210303 [0,1,0,1,0,0|1,0,0]=3 10086 B12R1.8 CCCOCCN1CCCCC1 34a_100000210258_100000739454 [0,1,0,1,0,0|2,0,0]=4 10087 B12R1.8 CCCOCCN1CCOCC1 2230a_100015191051_100011215938 [0,1,0,1,0,0|1,0,0]=3 10088 B12R1.8 CCCOCCN1CCOCC1 269982a_100015191051_100011215938 [0,1,0,1,0,0|1,0,0]=3 10089 B12R1.8 CCCOCCN1CCOCC1 34a_100015191051_100011215938 [0,1,0,1,0,0|1,0,0]=3 10090 B12R1.8 CCCOCCN1CCSCC1 2230a_100000737611_100011215938 [0,1,0,1,0,0|1,1,0]=4 10091 B12R1.8 CCCOCCN1CCSCC1 269982a_100000737611_100011215938 [0,1,0,1,0,0|1,1,0]=4 10092 B12R1.8 CCCOCCN1CCSCC1 7a_100000686052_100000210303 [0,1,0,1,0,0|1,1,0]=4 10093 B12R1.8 CCCSCCC1CCOCC1 62a_100000210303_100011934994 [0,1,0,1,0,0|1,1,0]=4 10094 B12R1.8 CCCSCCC1CCOCC1 62a_100011934994_100000210303 [0,1,0,1,0,0|1,1,0]=4 10095 B12R1.8 CCCSCCN1CCOCC1 62a_100000210303_100000211760 [0,1,0,1,0,0|1,1,0]=4 10096 B12R1.8 CCNCCCN1CCOCC1 2230a_100015525214_100000748698 [0,1,0,1,0,0|2,0,0]=4 10097 B12R1.8 CCNCCOC1CCCCC1 2230a_100015525214_100011211530 [0,1,0,1,0,0|2,0,0]=4 10098 B12R1.8 CCNCCOC1CCCCC1 34a_100015206981_100000210202 [0,1,0,1,0,0|2,0,0]=4 10099 B12R1.8 CCNCCOC1CCCCO1 2230a_100015525214_100000744793 [0,1,0,1,0,0|2,0,0]=4 10100 B12R1.8 CCOCCCC1CCCCC1 34a_100000198086_100000210202 [0,1,0,1,0,0|2,0,0]=4 10101 B12R1.8 CCOCCCC1CCCCC1 34a_100121572206_100011713725 [0,1,0,1,0,0|2,0,0]=4 10102 B12R1.8 CCOCCCC1CCCCC1 7a_100000198086_100000210202 [0,1,0,1,0,0|2,0,0]=4 10103 B12R1.8 CCOCCCC1CCCCN1 34a_100011934581_100000210202 [0,1,0,1,0,0|2,0,0]=4 10104 B12R1.8 CCOCCCC1CCCNC1 34a_100150707839_100000210202 [0,1,0,1,0,0|2,0,0]=4 10105 B12R1.8 CCOCCCC1CCNCC1 34a_100016988962_100000210202 [0,1,0,1,0,0|2,0,0]=4 10106 B12R1.8 CCOCCCN1CCCCC1 34a_100000212458_100000210202 [0,1,0,1,0,0|2,0,0]=4 10107 B12R1.8 CCOCCCN1CCCCC1 34a_100121572206_100000690320 [0,1,0,1,0,0|2,0,0]=4 10108 B12R1.8 CCOCCCN1CCCOC1 2230a_100000131196_100012232248 [0,1,0,1,0,0|2,0,0]=4 10109 B12R1.8 CCOCCCN1CCCOC1 269982a_100000131196_100012232248 [0,1,0,1,0,0|2,0,0]=4 10110 B12R1.8 CCOCCCN1CCCOC1 34a_100000131196_100012232248 [0,1,0,1,0,0|2,0,0]=4 10111 B12R1.8 CCOCCCN1CCOCC1 2230a_100015191051_100012232248 [0,1,0,1,0,0|1,0,0]=3 10112 B12R1.8 CCOCCCN1CCOCC1 269982a_100015191051_100012232248 [0,1,0,1,0,0|1,0,0]=3 10113 B12R1.8 CCOCCCN1CCOCC1 34a_100000212840_100000210202 [0,1,0,1,0,0|1,0,0]=3 10114 B12R1.8 CCOCCCN1CCOCC1 34a_100015191051_100012232248 [0,1,0,1,0,0|1,0,0]=3 10115 B12R1.8 CCOCCCN1CCOCC1 34a_100121572206_100000748698 [0,1,0,1,0,0|1,0,0]=3 10116 B12R1.8 CCOCCCN1CCSCC1 2230a_100000737611_100012232248 [0,1,0,1,0,0|1,1,0]=4 10117 B12R1.8 CCOCCCN1CCSCC1 269982a_100000737611_100012232248 [0,1,0,1,0,0|1,1,0]=4 10118 B12R1.8 CCOCCNC1CCCCC1 2230a_100000182618_100011215890 [0,1,0,1,0,0|2,0,0]=4 10119 B12R1.8 CCOCCNC1CCCCC1 270004a_102516460346_100000210434 [0,1,0,1,0,0|2,0,0]=4 10120 B12R1.8 CCOCCNC1CCCCC1 34a_100000182618_100000210147 [0,1,0,1,0,0|2,0,0]=4 10121 B12R1.8 CCOCCNC1CCCCC1 34a_100000200466_100000210202 [0,1,0,1,0,0|2,0,0]=4 10122 B12R1.8 CCOCCNC1CCCCC1 34a_102516460346_100000210327 [0,1,0,1,0,0|2,0,0]=4 10123 B12R1.8 CCOCCNC1CCCOC1 2230a_100000719290_100011215890 [0,1,0,1,0,0|1,0,0]=3 10124 B12R1.8 CCOCCNC1CCCOC1 270004a_102516460346_100000753404 [0,1,0,1,0,0|1,0,0]=3 10125 B12R1.8 CCOCCNC1CCCOC1 34a_100000719290_100000210147 [0,1,0,1,0,0|1,0,0]=3 10126 B12R1.8 CCOCCNC1CCCOC1 34a_102516460346_100000693364 [0,1,0,1,0,0|1,0,0]=3 10127 B12R1.8 CCOCCNC1CCCSC1 270004a_102516460346_100000057913 [0,1,0,1,0,0|1,1,0]=4 10128 B12R1.8 CCOCCNC1CCNCC1 270004a_102516460346_100015192401 [0,1,0,1,0,0|2,0,0]=4 10129 B12R1.8 CCOCCNC1CCOCC1 2230a_100000741149_100011215890 [0,1,0,1,0,0|1,0,0]=3 10130 B12R1.8 CCOCCNC1CCOCC1 270004a_102516460346_100011217826 [0,1,0,1,0,0|1,0,0]=3 10131 B12R1.8 CCOCCNC1CCOCC1 34a_100000708129_100000210202 [0,1,0,1,0,0|1,0,0]=3 10132 B12R1.8 CCOCCNC1CCOCC1 34a_100000741149_100000210147 [0,1,0,1,0,0|1,0,0]=3 10133 B12R1.8 CCOCCNC1CCSCC1 2230a_100000748639_100011215890 [0,1,0,1,0,0|1,1,0]=4 10134 B12R1.8 CCOCCNC1CCSCC1 270004a_102516460346_100000203788 [0,1,0,1,0,0|1,1,0]=4 10135 B12R1.8 CCOCCNC1CCSCC1 34a_100000748639_100000210147 [0,1,0,1,0,0|1,1,0]=4 10136 B12R1.8 CCOCCNC1CCSCC1 34a_102516460346_100000069128 [0,1,0,1,0,0|1,1,0]=4 10137 B12R1.8 CCOCCOC1C=CCCC1 34a_100011215024_100000210147 [0,1,0,1,0,0|1,0,1]=4 10138 B12R1.8 CCOCCOC1C=CCCC1 7a_100000210136_100000751183 [0,1,0,1,0,0|1,0,1]=4 10139 B12R1.8 CCOCCOC1CC=CCC1 34a_100000073881_100000210147 [0,1,0,1,0,0|1,0,0]=3 10140 B12R1.8 CCOCCOC1CCCCC1 34a_100000210136_100000210327 [0,1,0,1,0,0|1,0,0]=3 10141 B12R1.8 CCOCCOC1CCCCC1 34a_100000210231_100000210147 [0,1,0,1,0,0|1,0,0]=3 10142 B12R1.8 CCOCCOC1CCCCC1 34a_100011249652_100000210202 [0,1,0,1,0,0|1,0,0]=3 10143 B12R1.8 CCOCCOC1CCCCC1 34a_100121572206_100011211530 [0,1,0,1,0,0|1,0,0]=3 10144 B12R1.8 CCOCCOC1CCCCC1 7a_100000210136_100000210327 [0,1,0,1,0,0|1,0,0]=3 10145 B12R1.8 CCOCCOC1CCCCC1 7a_100000210231_100011215890 [0,1,0,1,0,0|1,0,0]=3 10146 B12R1.8 CCOCCOC1CCCCC1 7a_100011249652_100000210202 [0,1,0,1,0,0|1,0,0]=3 10147 B12R1.8 CCOCCOC1CCCCO1 34a_100000033831_100000210147 [0,1,0,1,0,0|1,0,0]=3 10148 B12R1.8 CCOCCOC1CCCCO1 34a_100000034223_100000210202 [0,1,0,1,0,0|1,0,0]=3 10149 B12R1.8 CCOCCOC1CCCCO1 34a_100121572206_100000744793 [0,1,0,1,0,0|1,0,0]=3 10150 B12R1.8 CCOCCOC1CCCCO1 7a_100000034223_100000210202 [0,1,0,1,0,0|1,0,0]=3 10151 B12R1.8 CCOCCOC1CCCOC1 34a_100000210136_100000693364 [0,1,0,1,0,0|0,0,0]=2 10152 B12R1.8 CCOCCOC1CCCOC1 34a_100000754041_100000210147 [0,1,0,1,0,0|0,0,0]=2 10153 B12R1.8 CCOCCOC1CCCOC1 7a_100000210136_100000693364 [0,1,0,1,0,0|0,0,0]=2 10154 B12R1.8 CCOCCOC1CCCSC1 7a_100015962668_100011215890 [0,1,0,1,0,0|0,1,0]=3 10155 B12R1.8 CCOCCOC1CCOCC1 34a_100000744328_100000210147 [0,1,0,1,0,0|0,0,0]=2 10156 B12R1.8 CCOCCOC1CCOCC1 7a_100000210136_100000686592 [0,1,0,1,0,0|0,0,0]=2 10157 B12R1.8 CCOCCOC1CCSCC1 34a_100000210136_100000069128 [0,1,0,1,0,0|0,1,0]=3 10158 B12R1.8 CCOCCOC1CCSCC1 34a_100000731022_100000210147 [0,1,0,1,0,0|0,1,0]=3 10159 B12R1.8 CCOCCOC1CCSCC1 7a_100000210136_100011500858 [0,1,0,1,0,0|0,1,0]=3 10160 B12R1.8 CCOCCOC1CCSCC1 7a_100000731022_100011215890 [0,1,0,1,0,0|0,1,0]=3 10161 B12R1.8 CCOCCSC1CCCCC1 62a_100000210147_100000210327 [0,1,0,1,0,0|1,1,0]=4 10162 B12R1.8 CCOCCSC1CCCCC1 62a_100000210327_100011215890 [0,1,0,1,0,0|1,1,0]=4 10163 B12R1.8 CCOCCSC1CCCOC1 62a_100000210147_100000693364 [0,1,0,1,0,0|0,1,0]=3 10164 B12R1.8 CCOCCSC1CCOCC1 62a_100000210147_100011324220 [0,1,0,1,0,0|0,1,0]=3 10165 B12R1.8 CCOCCSC1CCSCC1 62a_100000210147_100000069128 [0,1,0,1,0,0|0,2,0]=4 10166 B12R1.8 CCOCSCC1CCCCC1 62a_100000211423_100000739092 [0,1,0,1,0,0|2,0,0]=4 10167 B12R1.8 CCOCSCC1CCCCC1 62a_100000739092_100000211423 [0,1,0,1,0,0|2,0,0]=4 10168 B12R1.8 CCOCSCC1CCCOC1 62a_100000739092_100000741521 [0,1,0,1,0,0|2,0,0]=4 10169 B12R1.8 CCOCSCC1CCCOC1 62a_100000741521_100000739092 [0,1,0,1,0,0|2,0,0]=4 10170 B12R1.8 CCOCSCC1CCOCC1 62a_100000739092_100000749018 [0,1,0,1,0,0|1,0,0]=3 10171 B12R1.8 CCOCSCC1CCOCC1 62a_100000754603_100000739092 [0,1,0,1,0,0|1,0,0]=3 10172 B12R1.8 CCSCCCN1CCOCC1 62a_100000210202_100000748698 [0,1,0,1,0,0|1,1,0]=4 10173 B12R1.8 CCSCCNC1CCCOC1 2230a_100000719290_100000757381 [0,1,0,1,0,0|1,1,0]=4 10174 B12R1.8 CCSCCNC1CCCOC1 270004a_100000106463_100000753404 [0,1,0,1,0,0|1,1,0]=4 10175 B12R1.8 CCSCCNC1CCCOC1 34a_100000719290_100000757381 [0,1,0,1,0,0|1,1,0]=4 10176 B12R1.8 CCSCCNC1CCOCC1 2230a_100000741149_100000757381 [0,1,0,1,0,0|1,1,0]=4 10177 B12R1.8 CCSCCNC1CCOCC1 270004a_100000106463_100011217826 [0,1,0,1,0,0|1,1,0]=4 10178 B12R1.8 CCSCCNC1CCOCC1 34a_100000741149_100000757381 [0,1,0,1,0,0|1,1,0]=4 10179 B12R1.8 CCSCCOC1CC=CCC1 34a_100000073881_100000757381 [0,1,0,1,0,0|1,1,0]=4 10180 B12R1.8 CCSCCOC1CCCCC1 34a_100000210231_100000757381 [0,1,0,1,0,0|1,1,0]=4 10181 B12R1.8 CCSCCOC1CCCCC1 34a_100000212035_100000210327 [0,1,0,1,0,0|1,1,0]=4 10182 B12R1.8 CCSCCOC1CCCCC1 62a_100000210202_100011211530 [0,1,0,1,0,0|1,1,0]=4 10183 B12R1.8 CCSCCOC1CCCCC1 62a_100011211530_100000210202 [0,1,0,1,0,0|1,1,0]=4 10184 B12R1.8 CCSCCOC1CCCCC1 7a_100000210231_100000757381 [0,1,0,1,0,0|1,1,0]=4 10185 B12R1.8 CCSCCOC1CCCCC1 7a_100000212035_100000210327 [0,1,0,1,0,0|1,1,0]=4 10186 B12R1.8 CCSCCOC1CCCCO1 34a_100000033831_100000757381 [0,1,0,1,0,0|1,1,0]=4 10187 B12R1.8 CCSCCOC1CCCCO1 62a_100000210202_100000744793 [0,1,0,1,0,0|1,1,0]=4 10188 B12R1.8 CCSCCOC1CCCCO1 62a_100000744793_100000210202 [0,1,0,1,0,0|1,1,0]=4 10189 B12R1.8 CCSCCOC1CCCOC1 34a_100000212035_100000693364 [0,1,0,1,0,0|0,1,0]=3 10190 B12R1.8 CCSCCOC1CCCOC1 34a_100000754041_100000757381 [0,1,0,1,0,0|0,1,0]=3 10191 B12R1.8 CCSCCOC1CCCOC1 7a_100000212035_100000693364 [0,1,0,1,0,0|0,1,0]=3 10192 B12R1.8 CCSCCOC1CCCSC1 7a_100015962668_100000757381 [0,1,0,1,0,0|0,2,0]=4 10193 B12R1.8 CCSCCOC1CCOCC1 34a_100000744328_100000757381 [0,1,0,1,0,0|0,1,0]=3 10194 B12R1.8 CCSCCOC1CCOCC1 7a_100000212035_100000686592 [0,1,0,1,0,0|0,1,0]=3 10195 B12R1.8 CCSCCOC1CCSCC1 34a_100000212035_100000069128 [0,1,0,1,0,0|0,2,0]=4 10196 B12R1.8 CCSCCOC1CCSCC1 34a_100000731022_100000757381 [0,1,0,1,0,0|0,2,0]=4 10197 B12R1.8 CCSCCOC1CCSCC1 7a_100000212035_100011500858 [0,1,0,1,0,0|0,2,0]=4 10198 B12R1.8 CCSCCOC1CCSCC1 7a_100000731022_100000757381 [0,1,0,1,0,0|0,2,0]=4 10199 B12R1.8 CCSCCSC1CCCOC1 62a_100000757381_100000693364 [0,1,0,1,0,0|0,2,0]=4 10200 B12R1.8 CCSCCSC1CCOCC1 62a_100000757381_100011324220 [0,1,0,1,0,0|0,2,0]=4 10201 B12R1.8 CNCCCOC1CCCOC1 34a_100000213112_100000693364 [0,1,0,1,0,0|2,0,0]=4 10202 B12R1.8 COCCCCN1CCOCC1 2230a_100015191051_100000730899 [0,1,0,1,0,0|2,0,0]=4 10203 B12R1.8 COCCCCN1CCOCC1 269982a_100015191051_100000730899 [0,1,0,1,0,0|2,0,0]=4 10204 B12R1.8 COCCCCN1CCOCC1 34a_100000723369_200000210301 [0,1,0,1,0,0|2,0,0]=4 10205 B12R1.8 COCCCCN1CCOCC1 34a_100015191051_100000755781 [0,1,0,1,0,0|2,0,0]=4 10206 B12R1.8 COCCCOC1CCCOC1 34a_100000740835_100000693364 [0,1,0,1,0,0|2,0,0]=4 10207 B12R1.8 COCCCOC1CCCOC1 34a_100000754041_100000740836 [0,1,0,1,0,0|2,0,0]=4 10208 B12R1.8 COCCCOC1CCOCC1 34a_100000744328_100000740836 [0,1,0,1,0,0|2,0,0]=4 10209 B12R1.8 COCNCCC1CCOCC1 2230a_100000755988_100000766300 [0,1,0,1,0,0|2,0,0]=4 10210 B12R1.8 COCSCCC1CCOCC1 62a_100000766300_100011934994 [0,1,0,1,0,0|1,1,0]=4 10211 B12R1.8 COCSCCC1CCOCC1 62a_100011934994_100000766300 [0,1,0,1,0,0|1,1,0]=4 10212 B12R1.8 COCSCCN1CCOCC1 62a_100000766300_100000211760 [0,1,0,1,0,0|1,1,0]=4 10213 B12R1.8 CSCCCOC1CCCOC1 34a_100000690336_100000693364 [0,1,0,1,0,0|2,0,0]=4 10214 B12R1.8 CSCCCOC1CCCOC1 7a_100000690336_100000693364 [0,1,0,1,0,0|2,0,0]=4 10215 B12R1.8 CSCCCOC1CCOCC1 7a_100000690336_100000686592 [0,1,0,1,0,0|2,0,0]=4 10216 B12R1.8 CSCNCCC1CCOCC1 2230a_100000755988_100011218213 [0,1,0,1,0,0|2,0,0]=4 10217 B12R1.8 CSCNCCC1CCOCC1 34a_100000755988_100011218213 [0,1,0,1,0,0|2,0,0]=4 10218 B12R1.8 CSCOCCC1CCCCC1 34a_100011217863_100011218213 [0,1,0,1,0,0|2,0,0]=4 10219 B12R1.8 CSCOCCC1CCNCC1 34a_100015190746_100011218213 [0,1,0,1,0,0|2,0,0]=4 10220 B12R1.8 CSCOCCC1CCOCC1 34a_100011933979_100011218213 [0,1,0,1,0,0|1,0,0]=3 10221 B12R1.8 CSCSCCC1CCOCC1 62a_100011218213_100011934994 [0,1,0,1,0,0|1,1,0]=4 10222 B12R1.8 CSCSCCC1CCOCC1 62a_100011934994_100011218213 [0,1,0,1,0,0|1,1,0]=4 10223 B12R1.8 CSCSCCN1CCOCC1 62a_100011218213_100000211760 [0,1,0,1,0,0|1,1,0]=4 10224 B12R1.8 ClCCCCOC1CCCOC1 34a_100000210776_100000693364 [0,1,0,1,0,0|2,0,0]=4 10225 B12R1.8 ClCCCCOC1CCCOC1 7a_100000210776_100000693364 [0,1,0,1,0,0|2,0,0]=4 10226 B12R1.8 ClCCCCOC1CCOCC1 7a_100000210776_100000686592 [0,1,0,1,0,0|2,0,0]=4 10227 B12R1.8 FCCCCCN1CCOCC1 2230a_100015191051_100000729378 [0,1,0,1,0,0|2,0,0]=4 10228 B12R1.8 FCCCCCN1CCOCC1 269982a_100015191051_100000729378 [0,1,0,1,0,0|2,0,0]=4 10229 B12R1.8 FCCCCCN1CCOCC1 34a_100015191051_100000729378 [0,1,0,1,0,0|2,0,0]=4 10230 B12R1.8 FCCCCOC1CCCOC1 34a_100000754041_100000729493 [0,1,0,1,0,0|2,0,0]=4 10231 B12R1.8 FCCCCOC1CCCOC1 34a_100011995726_100000693364 [0,1,0,1,0,0|2,0,0]=4 10232 B12R1.8 FCCCCOC1CCCOC1 7a_100011995726_100000693364 [0,1,0,1,0,0|2,0,0]=4 10233 B12R1.8 FCCCCOC1CCOCC1 34a_100000744328_100000729493 [0,1,0,1,0,0|2,0,0]=4 10234 B12R1.8 FCCCCOC1CCOCC1 7a_100011995726_100000686592 [0,1,0,1,0,0|2,0,0]=4 10235 B12R1.8 FCCNCCC1CCOCC1 2230a_100000755988_100011217306 [0,1,0,1,0,0|2,0,0]=4 10236 B12R1.8 FCCNCCC1CCOCC1 34a_100000724931_100011934994 [0,1,0,1,0,0|2,0,0]=4 10237 B12R1.8 FCCNCCC1CCOCC1 34a_100000755988_100011217306 [0,1,0,1,0,0|2,0,0]=4 10238 B12R1.8 FCCOCCC1CCCCC1 34a_100011217863_100011217306 [0,1,0,1,0,0|2,0,0]=4 10239 B12R1.8 FCCOCCC1CCCCC1 7a_100011217863_100011217306 [0,1,0,1,0,0|2,0,0]=4 10240 B12R1.8 FCCOCCC1CCNCC1 34a_100015190746_100011217306 [0,1,0,1,0,0|2,0,0]=4 10241 B12R1.8 FCCOCCC1CCOCC1 34a_100011933979_100011217306 [0,1,0,1,0,0|1,0,0]=3 10242 B12R1.8 FCCOCCC1CCOCC1 7a_100011933979_100011217306 [0,1,0,1,0,0|1,0,0]=3 10243 B12R1.8 FCCOCCN1CCSCC1 7a_100000686052_100011217306 [0,1,0,1,0,0|1,1,0]=4 10244 B12R1.8 FCCSCCC1CCOCC1 62a_100011217306_100011934994 [0,1,0,1,0,0|1,1,0]=4 10245 B12R1.8 FCCSCCC1CCOCC1 62a_100011934994_100011217306 [0,1,0,1,0,0|1,1,0]=4 10246 B12R1.8 FCCSCCN1CCOCC1 62a_100011217306_100000211760 [0,1,0,1,0,0|1,1,0]=4 10247 B12R1.8 FCOCCCN1CCOCC1 34a_100000212840_100015361967 [0,1,0,1,0,0|2,0,0]=4 10248 B12R1.8 FCOCCNC1CCOCC1 34a_100000708129_100015361967 [0,1,0,1,0,0|2,0,0]=4 10249 B12R1.8 FCOCCOC1CCCCC1 34a_100011249652_100015361967 [0,1,0,1,0,0|2,0,0]=4 10250 B12R1.8 FCOCCOC1CCCCC1 7a_100011249652_100015361967 [0,1,0,1,0,0|2,0,0]=4 10251 B12R1.8 FCOCCOC1CCCCO1 34a_100000034223_100015361967 [0,1,0,1,0,0|2,0,0]=4 10252 B12R1.8 FCOCCOC1CCCCO1 7a_100000034223_100015361967 [0,1,0,1,0,0|2,0,0]=4 10253 B12R1.8 ICCCCOC1CCCOC1 34a_200012148704_100000693364 [0,1,0,1,0,0|2,0,0]=4 10254 B12R1.8 N#CCOCCC1CCOCC1 7a_100011933979_100011215382 [0,1,0,1,0,0|1,0,1]=4 10255 B12R1.8 N#CCOCCN1CCOCC1 2230a_100015191051_200000047693 [0,1,0,1,0,0|1,0,1]=4 10256 B12R1.8 NCCCCOC1CCCOC1 34a_100000750430_100000693364 [0,1,0,1,0,0|2,0,0]=4 10257 B12R1.8 NCCOCCC1CCCCC1 34a_100000210304_100011209188 [0,1,0,1,0,0|2,0,0]=4 10258 B12R1.8 NCCOCCC1CCOCC1 34a_100000210304_100011934994 [0,1,0,1,0,0|1,0,0]=3 10259 B12R1.8 NCCOCCN1CCCCC1 34a_100000210304_100000739454 [0,1,0,1,0,0|2,0,0]=4 10260 B12R1.8 O=CCOCCC1CCOCC1 34a_100011933979_200009817547 [0,1,0,1,0,0|1,0,1]=4 10261 B12R1.8 O=CCOCCC1CCOCC1 7a_100011933979_200015260668 [0,1,0,1,0,0|1,0,1]=4 10262 B12R1.8 OCCCCCN1CCOCC1 2230a_100015191051_100000746330 [0,1,0,1,0,0|2,0,0]=4 10263 B12R1.8 OCCCCCN1CCOCC1 269982a_100015191051_100000746330 [0,1,0,1,0,0|2,0,0]=4 10264 B12R1.8 OCCCCCN1CCOCC1 34a_100015191051_100000746330 [0,1,0,1,0,0|2,0,0]=4 10265 B12R1.8 OCCCCOC1CCCOC1 34a_100000754041_100011216708 [0,1,0,1,0,0|2,0,0]=4 10266 B12R1.8 OCCCCOC1CCOCC1 34a_100000744328_100011216708 [0,1,0,1,0,0|2,0,0]=4 10267 B12R1.8 OCCNCCC1CCOCC1 2230a_100000755988_100000211926 [0,1,0,1,0,0|2,0,0]=4 10268 B12R1.8 OCCNCCC1CCOCC1 2230a_100016997473_100011934994 [0,1,0,1,0,0|2,0,0]=4 10269 B12R1.8 OCCNCCC1CCOCC1 34a_100000755988_100000211926 [0,1,0,1,0,0|2,0,0]=4 10270 B12R1.8 OCCNCCC1CCOCC1 34a_100016990907_100011934994 [0,1,0,1,0,0|2,0,0]=4 10271 B12R1.8 OCCNCCN1CCOCC1 2230a_100016997473_100025781966 [0,1,0,1,0,0|2,0,0]=4 10272 B12R1.8 OCCOCCC1CCCCC1 34a_100011217863_100000211926 [0,1,0,1,0,0|2,0,0]=4 10273 B12R1.8 OCCOCCC1CCCCC1 7a_100011217863_100000211926 [0,1,0,1,0,0|2,0,0]=4 10274 B12R1.8 OCCOCCC1CCNCC1 34a_100015190746_100000211926 [0,1,0,1,0,0|2,0,0]=4 10275 B12R1.8 OCCOCCC1CCOCC1 34a_100011933979_100000211926 [0,1,0,1,0,0|1,0,0]=3 10276 B12R1.8 OCCOCCC1CCOCC1 7a_100011933979_100000211926 [0,1,0,1,0,0|1,0,0]=3 10277 B12R1.8 OCCOCCN1CCOCC1 2230a_100015191051_100011215305 [0,1,0,1,0,0|1,0,0]=3 10278 B12R1.8 OCCOCCN1CCOCC1 269982a_100015191051_100011215305 [0,1,0,1,0,0|1,0,0]=3 10279 B12R1.8 OCCOCCN1CCOCC1 34a_100015191051_100000692535 [0,1,0,1,0,0|1,0,0]=3 10280 B12R1.8 OCCOCCN1CCSCC1 2230a_100000737611_100011215305 [0,1,0,1,0,0|1,1,0]=4 10281 B12R1.8 OCCOCCN1CCSCC1 269982a_100000737611_100011215305 [0,1,0,1,0,0|1,1,0]=4 10282 B12R1.8 OCCOCCN1CCSCC1 7a_100000686052_100000211926 [0,1,0,1,0,0|1,1,0]=4 10283 B12R1.8 OCCSCCC1CCOCC1 62a_100000211926_100011934994 [0,1,0,1,0,0|1,1,0]=4 10284 B12R1.8 OCCSCCC1CCOCC1 62a_100011934994_100000211926 [0,1,0,1,0,0|1,1,0]=4 10285 B12R1.8 OCCSCCN1CCOCC1 62a_100000211926_100000211760 [0,1,0,1,0,0|1,1,0]=4 10286 B12R1.8 [13CH3]OCCCCN1CCOCC1 34a_100000723369_200025704644 [0,1,0,1,0,0|2,0,0]=4 10287 B12R1.37 BrCCCCCOC1CCCC1 34a_100000746331_100000179811 [0,1,0,1,0,0|2,0,0]=4 10288 B12R1.37 BrCCCCCOC1CCCC1 7a_100000746331_100000179811 [0,1,0,1,0,0|2,0,0]=4 10289 B12R1.37 BrCCCCCOC1CCOC1 34a_100000746331_100000690089 [0,1,0,1,0,0|1,0,0]=3 10290 B12R1.37 BrCCCCCOC1CCOC1 7a_100000746331_100000731011 [0,1,0,1,0,0|1,0,0]=3 10291 B12R1.37 BrCCCCOCC1CCOC1 34a_100011216708_100011261433 [0,1,0,1,0,0|2,0,0]=4 10292 B12R1.37 BrCCCCOCC1OCCO1 34a_100011216708_100000755774 [0,1,0,1,0,0|2,0,0]=4 10293 B12R1.37 BrCCOCCCC1CCCC1 34a_100000211926_100011713738 [0,1,0,1,0,0|2,0,0]=4 10294 B12R1.37 BrCCOCCOC1CCCC1 34a_100000692535_100000179811 [0,1,0,1,0,0|1,0,0]=3 10295 B12R1.37 BrCCOCCOC1CCCC1 7a_100000692535_100000179811 [0,1,0,1,0,0|1,0,0]=3 10296 B12R1.37 BrCCOCCOC1CCOC1 34a_100000692535_100000690089 [0,1,0,1,0,0|0,0,0]=2 10297 B12R1.37 BrCCOCCOC1CCOC1 7a_100000692535_100000731011 [0,1,0,1,0,0|0,0,0]=2 10298 B12R1.37 C#CCCCCOC1CCOC1 34a_100000766709_100000690089 [0,1,0,1,0,0|1,0,1]=4 10299 B12R1.37 C#CCCCCOC1CCOC1 7a_100000766709_100000731011 [0,1,0,1,0,0|1,0,1]=4 10300 B12R1.37 C#CCCCCO[C@H]1CCOC1 34a_100000717292_100010269958 [0,1,0,1,0,0|1,0,1]=4 10301 B12R1.37 C#CCOCCNC1CCOC1 2230a_100000700922_100000731011 [0,1,0,1,0,0|1,0,1]=4 10302 B12R1.37 C#CCOCCNC1CCOC1 34a_100000700922_100000690089 [0,1,0,1,0,0|1,0,1]=4 10303 B12R1.37 C#CCOCCN[C@@H]1CCOC1 2230a_200015188469_100010402529 [0,1,0,1,0,0|1,0,1]=4 10304 B12R1.37 C#CCOCCN[C@H]1CCOC1 2230a_100015188467_100010402529 [0,1,0,1,0,0|1,0,1]=4 10305 B12R1.37 C#CCOCCN[C@H]1CCOC1 34a_100015188467_100010402529 [0,1,0,1,0,0|1,0,1]=4 10306 B12R1.37 C#CCOCCOC1CCCC1 34a_100000054580_100000179811 [0,1,0,1,0,0|1,0,1]=4 10307 B12R1.37 C#CCOCCOC1CCCC1 34a_100000210269_100010402529 [0,1,0,1,0,0|1,0,1]=4 10308 B12R1.37 C#CCOCCOC1CCCC1 34a_100000738311_100000184674 [0,1,0,1,0,0|1,0,1]=4 10309 B12R1.37 C#CCOCCOC1CCCC1 7a_100000054580_100000179811 [0,1,0,1,0,0|1,0,1]=4 10310 B12R1.37 C#CCOCCOC1CCCC1 7a_100000210269_100010402529 [0,1,0,1,0,0|1,0,1]=4 10311 B12R1.37 C#CCOCCOC1CCCC1 7a_100000738311_100000038162 [0,1,0,1,0,0|1,0,1]=4 10312 B12R1.37 C#CCOCCOC1CCOC1 34a_100000054580_100000690089 [0,1,0,1,0,0|0,0,1]=3 10313 B12R1.37 C#CCOCCOC1CCOC1 7a_100000054580_100000731011 [0,1,0,1,0,0|0,0,1]=3 10314 B12R1.37 C#CCOCCOC1CCSC1 7a_100011232664_100010402529 [0,1,0,1,0,0|0,1,1]=4 10315 B12R1.37 C#CCOCCO[C@H]1CCOC1 34a_100000717292_100010402529 [0,1,0,1,0,0|0,0,1]=3 10316 B12R1.37 C#CCOCCSC1CCOC1 62a_100010402529_100000690089 [0,1,0,1,0,0|0,1,1]=4 10317 B12R1.37 C/C=C/CCOCC1CCOC1 34a_100016278192_100011261433 [0,1,0,1,0,0|1,0,1]=4 10318 B12R1.37 C/C=C/CCOCC1OCCO1 34a_100016278192_100000755774 [0,1,0,1,0,0|1,0,1]=4 10319 B12R1.37 C=CCCCCOC1CCOC1 34a_100000766645_100000690089 [0,1,0,1,0,0|1,0,1]=4 10320 B12R1.37 C=CCCCCOC1CCOC1 7a_100000766645_100000731011 [0,1,0,1,0,0|1,0,1]=4 10321 B12R1.37 C=CCCCCO[C@H]1CCOC1 34a_100000717292_100011215482 [0,1,0,1,0,0|1,0,1]=4 10322 B12R1.37 C=CCOCCOC1CCCC1 34a_100000037705_100000179811 [0,1,0,1,0,0|1,0,1]=4 10323 B12R1.37 C=CCOCCOC1CCCC1 34a_100000738311_100015514636 [0,1,0,1,0,0|1,0,1]=4 10324 B12R1.37 C=CCOCCOC1CCCC1 7a_100000037705_100000179811 [0,1,0,1,0,0|1,0,1]=4 10325 B12R1.37 C=CCOCCOC1CCCC1 7a_100000738311_100015514636 [0,1,0,1,0,0|1,0,1]=4 10326 B12R1.37 C=CCOCCOC1CCOC1 34a_100000037705_100000690089 [0,1,0,1,0,0|0,0,1]=3 10327 B12R1.37 C=CCOCCOC1CCOC1 7a_100000037705_100000731011 [0,1,0,1,0,0|0,0,1]=3 10328 B12R1.37 C=COCCOCC1CCCO1 34a_100000210270_100000039644 [0,1,0,1,0,0|0,0,2]=4 10329 B12R1.37 C=COCCOCC1CCCO1 7a_100000210270_100000039644 [0,1,0,1,0,0|0,0,2]=4 10330 B12R1.37 C=COCCOCC1CCOC1 34a_100000033082_100011261433 [0,1,0,1,0,0|0,0,2]=4 10331 B12R1.37 C=COCCOCC1CCOC1 34a_100000740260_100000039644 [0,1,0,1,0,0|0,0,2]=4 10332 B12R1.37 C=COCCOCC1COCO1 34a_100011216627_100000039644 [0,1,0,1,0,0|0,0,2]=4 10333 B12R1.37 C=COCCOCC1OCCO1 34a_100000033082_100000755774 [0,1,0,1,0,0|0,0,2]=4 10334 B12R1.37 C=COCCOCC1OCCO1 34a_100000087154_100000039644 [0,1,0,1,0,0|0,0,2]=4 10335 B12R1.37 CC#CCCOCC1CCOC1 34a_100000750427_100011261433 [0,1,0,1,0,0|1,0,1]=4 10336 B12R1.37 CC#CCCOCC1OCCO1 34a_100000750427_100000755774 [0,1,0,1,0,0|1,0,1]=4 10337 B12R1.37 CC/C=C\CCN[C@@H]1CCOC1 2230a_200015188469_100015370543 [0,1,0,1,0,0|2,0,0]=4 10338 B12R1.37 CC/C=C\CCN[C@H]1CCOC1 2230a_100015188467_100015370543 [0,1,0,1,0,0|2,0,0]=4 10339 B12R1.37 CC/C=C\CCN[C@H]1CCOC1 34a_100015188467_100015370543 [0,1,0,1,0,0|2,0,0]=4 10340 B12R1.37 CC/C=C\CCOC1CCCC1 34a_100000210269_100015370543 [0,1,0,1,0,0|2,0,0]=4 10341 B12R1.37 CC/C=C\CCOC1CCCC1 34a_100016288707_100000179811 [0,1,0,1,0,0|2,0,0]=4 10342 B12R1.37 CC/C=C\CCOC1CCCC1 7a_100000210269_100015370543 [0,1,0,1,0,0|2,0,0]=4 10343 B12R1.37 CC/C=C\CCOC1CCCC1 7a_100016288707_100000179811 [0,1,0,1,0,0|2,0,0]=4 10344 B12R1.37 CC/C=C\CCOC1CCOC1 34a_100016288707_100000690089 [0,1,0,1,0,0|1,0,0]=3 10345 B12R1.37 CC/C=C\CCOC1CCOC1 7a_100016288707_100000731011 [0,1,0,1,0,0|1,0,0]=3 10346 B12R1.37 CC/C=C\CCOC1CCSC1 7a_100011232664_100015370543 [0,1,0,1,0,0|1,1,0]=4 10347 B12R1.37 CC/C=C\CCO[C@H]1CCOC1 34a_100000717292_100015370543 [0,1,0,1,0,0|1,0,0]=3 10348 B12R1.37 CC/C=C\CCSC1CCOC1 62a_100015370543_100000690089 [0,1,0,1,0,0|1,1,0]=4 10349 B12R1.37 CC/C=C\COCC1CCCO1 34a_100000210270_100103147603 [0,1,0,1,0,0|1,0,1]=4 10350 B12R1.37 CC/C=C\COCC1CCCO1 7a_100000210270_100103147603 [0,1,0,1,0,0|1,0,1]=4 10351 B12R1.37 CC/C=C\COCC1CCOC1 34a_100000740260_100103147603 [0,1,0,1,0,0|1,0,1]=4 10352 B12R1.37 CC/C=C\COCC1CCOC1 34a_100016268518_100011261433 [0,1,0,1,0,0|1,0,1]=4 10353 B12R1.37 CC/C=C\COCC1COCO1 34a_100011216627_100103147603 [0,1,0,1,0,0|1,0,1]=4 10354 B12R1.37 CC/C=C\COCC1OCCO1 34a_100000087154_100103147603 [0,1,0,1,0,0|1,0,1]=4 10355 B12R1.37 CC/C=C\COCC1OCCO1 34a_100016268518_100000755774 [0,1,0,1,0,0|1,0,1]=4 10356 B12R1.37 CC=C=CCCOC1CCOC1 34a_100011020354_100000690089 [0,1,0,1,0,0|1,0,1]=4 10357 B12R1.37 CC=CCCCOC1CCOC1 34a_100020645299_100000690089 [0,1,0,1,0,0|1,0,1]=4 10358 B12R1.37 CCC#CCCOC1CCCC1 34a_100000036655_100000179811 [0,1,0,1,0,0|2,0,0]=4 10359 B12R1.37 CCC#CCCOC1CCCC1 7a_100000036655_100000179811 [0,1,0,1,0,0|2,0,0]=4 10360 B12R1.37 CCC#CCCOC1CCOC1 34a_100000036655_100000690089 [0,1,0,1,0,0|1,0,0]=3 10361 B12R1.37 CCC#CCCOC1CCOC1 7a_100000036655_100000731011 [0,1,0,1,0,0|1,0,0]=3 10362 B12R1.37 CCC#CCOCC1CCCO1 34a_100000210270_100009813939 [0,1,0,1,0,0|1,0,1]=4 10363 B12R1.37 CCC#CCOCC1CCCO1 7a_100000210270_100009813939 [0,1,0,1,0,0|1,0,1]=4 10364 B12R1.37 CCC#CCOCC1CCOC1 34a_100000032950_100011261433 [0,1,0,1,0,0|1,0,1]=4 10365 B12R1.37 CCC#CCOCC1CCOC1 34a_100000740260_100009813939 [0,1,0,1,0,0|1,0,1]=4 10366 B12R1.37 CCC#CCOCC1COCO1 34a_100011216627_100009813939 [0,1,0,1,0,0|1,0,1]=4 10367 B12R1.37 CCC#CCOCC1OCCO1 34a_100000032950_100000755774 [0,1,0,1,0,0|1,0,1]=4 10368 B12R1.37 CCC#CCOCC1OCCO1 34a_100000087154_100009813939 [0,1,0,1,0,0|1,0,1]=4 10369 B12R1.37 CCC/C=C/COC1CCOC1 34a_100016278788_100000690089 [0,1,0,1,0,0|1,0,1]=4 10370 B12R1.37 CCC/C=C/COC1CCOC1 7a_100016278788_100000731011 [0,1,0,1,0,0|1,0,1]=4 10371 B12R1.37 CCCC#CCOC1CCOC1 34a_100000034806_100000690089 [0,1,0,1,0,0|1,0,1]=4 10372 B12R1.37 CCCC#CCOC1CCOC1 7a_100000034806_100000731011 [0,1,0,1,0,0|1,0,1]=4 10373 B12R1.37 CCCCCCNC1CCOC1 2230a_100000210581_100000731011 [0,1,0,1,0,0|2,0,0]=4 10374 B12R1.37 CCCCCCNC1CCOC1 270004a_100000210581_100000752484 [0,1,0,1,0,0|2,0,0]=4 10375 B12R1.37 CCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210314 [0,1,0,1,0,0|2,0,0]=4 10376 B12R1.37 CCCCCCN[C@H]1CCOC1 2230a_100015188467_100000210314 [0,1,0,1,0,0|2,0,0]=4 10377 B12R1.37 CCCCCCN[C@H]1CCOC1 34a_100015188467_100000210314 [0,1,0,1,0,0|2,0,0]=4 10378 B12R1.37 CCCCCCOC1CCCC1 34a_100000210259_100000179811 [0,1,0,1,0,0|2,0,0]=4 10379 B12R1.37 CCCCCCOC1CCCC1 34a_100000210269_100000210314 [0,1,0,1,0,0|2,0,0]=4 10380 B12R1.37 CCCCCCOC1CCCC1 7a_100000210259_100000179811 [0,1,0,1,0,0|2,0,0]=4 10381 B12R1.37 CCCCCCOC1CCCC1 7a_100000210269_100000210314 [0,1,0,1,0,0|2,0,0]=4 10382 B12R1.37 CCCCCCOC1CCOC1 34a_100000210259_100000690089 [0,1,0,1,0,0|1,0,0]=3 10383 B12R1.37 CCCCCCOC1CCOC1 7a_100000210259_100000731011 [0,1,0,1,0,0|1,0,0]=3 10384 B12R1.37 CCCCCCOC1CCSC1 7a_100011232664_100000210314 [0,1,0,1,0,0|1,1,0]=4 10385 B12R1.37 CCCCCCO[C@H]1CCOC1 34a_100000717292_100000210314 [0,1,0,1,0,0|1,0,0]=3 10386 B12R1.37 CCCCCCSC1CCOC1 62a_100000210314_100000690089 [0,1,0,1,0,0|1,1,0]=4 10387 B12R1.37 CCCCCNCC1CCCO1 2230a_100000209983_100000203698 [0,1,0,1,0,0|2,0,0]=4 10388 B12R1.37 CCCCCNCC1CCOC1 2230a_100000209983_100000702531 [0,1,0,1,0,0|2,0,0]=4 10389 B12R1.37 CCCCCNCC1CCOC1 2230a_100000737293_100000210326 [0,1,0,1,0,0|2,0,0]=4 10390 B12R1.37 CCCCCNCC1CCOC1 34a_100000737293_100000718602 [0,1,0,1,0,0|2,0,0]=4 10391 B12R1.37 CCCCCNCC1OCCO1 2230a_100000036311_100000210326 [0,1,0,1,0,0|2,0,0]=4 10392 B12R1.37 CCCCCNCC1OCCO1 2230a_100000209983_100000755774 [0,1,0,1,0,0|2,0,0]=4 10393 B12R1.37 CCCCCNCC1OCCO1 34a_100000036311_100000718602 [0,1,0,1,0,0|2,0,0]=4 10394 B12R1.37 CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210326 [0,1,0,1,0,0|2,0,0]=4 10395 B12R1.37 CCCCCNC[C@@H]1CCCO1 34a_100020590478_100000718602 [0,1,0,1,0,0|2,0,0]=4 10396 B12R1.37 CCCCCOCC1CCCC1 34a_100000210253_100000740388 [0,1,0,1,0,0|2,0,0]=4 10397 B12R1.37 CCCCCOCC1CCCC1 34a_100000742336_100000718602 [0,1,0,1,0,0|2,0,0]=4 10398 B12R1.37 CCCCCOCC1CCCC1 7a_100000210253_100000740388 [0,1,0,1,0,0|2,0,0]=4 10399 B12R1.37 CCCCCOCC1CCCC1 7a_100000742336_100000210326 [0,1,0,1,0,0|2,0,0]=4 10400 B12R1.37 CCCCCOCC1CCCO1 34a_100000210270_100000718602 [0,1,0,1,0,0|1,0,0]=3 10401 B12R1.37 CCCCCOCC1CCCO1 7a_100000210253_100000203698 [0,1,0,1,0,0|1,0,0]=3 10402 B12R1.37 CCCCCOCC1CCCO1 7a_100000210270_100000210326 [0,1,0,1,0,0|1,0,0]=3 10403 B12R1.37 CCCCCOCC1CCNC1 34a_100000748654_100000718602 [0,1,0,1,0,0|2,0,0]=4 10404 B12R1.37 CCCCCOCC1CCOC1 34a_100000210253_100011261433 [0,1,0,1,0,0|1,0,0]=3 10405 B12R1.37 CCCCCOCC1CCOC1 34a_100000740260_100000718602 [0,1,0,1,0,0|1,0,0]=3 10406 B12R1.37 CCCCCOCC1CCOC1 7a_100000210253_100000702531 [0,1,0,1,0,0|1,0,0]=3 10407 B12R1.37 CCCCCOCC1COCO1 34a_100011216627_100000718602 [0,1,0,1,0,0|1,0,0]=3 10408 B12R1.37 CCCCCOCC1OCCO1 34a_100000087154_100000718602 [0,1,0,1,0,0|1,0,0]=3 10409 B12R1.37 CCCCCOCC1OCCO1 34a_100000210253_100000755774 [0,1,0,1,0,0|1,0,0]=3 10410 B12R1.37 CCCCCOCC1OCCO1 7a_100000210253_100000755774 [0,1,0,1,0,0|1,0,0]=3 10411 B12R1.37 CCCCCOC[C@H]1CCCN1 34a_100000745186_100000718602 [0,1,0,1,0,0|2,0,0]=4 10412 B12R1.37 CCCCCSCC1CCCO1 62a_100000203698_100000210326 [0,1,0,1,0,0|1,1,0]=4 10413 B12R1.37 CCCCCSCC1CCCO1 62a_100000210326_100000203698 [0,1,0,1,0,0|1,1,0]=4 10414 B12R1.37 CCCCCSCC1CCOC1 62a_100000210326_100000702531 [0,1,0,1,0,0|1,1,0]=4 10415 B12R1.37 CCCCCSCC1CCOC1 62a_100000702531_100000210326 [0,1,0,1,0,0|1,1,0]=4 10416 B12R1.37 CCCCCSCC1OCCO1 62a_100000210326_100000755774 [0,1,0,1,0,0|1,1,0]=4 10417 B12R1.37 CCCCCSCC1OCCO1 62a_100000755774_100000210326 [0,1,0,1,0,0|1,1,0]=4 10418 B12R1.37 CCCCOCCC1CCOC1 34a_100011879284_100000210210 [0,1,0,1,0,0|2,0,0]=4 10419 B12R1.37 CCCCOCN[C@@H]1CCOC1 2230a_200015188469_100011995733 [0,1,0,1,0,0|2,0,0]=4 10420 B12R1.37 CCCCOCN[C@H]1CCOC1 2230a_100015188467_100011995733 [0,1,0,1,0,0|2,0,0]=4 10421 B12R1.37 CCCCOCN[C@H]1CCOC1 34a_100015188467_100011995733 [0,1,0,1,0,0|2,0,0]=4 10422 B12R1.37 CCCCOCOC1CCCC1 34a_100000210269_100011995733 [0,1,0,1,0,0|2,0,0]=4 10423 B12R1.37 CCCCOCO[C@H]1CCOC1 34a_100000717292_100011995733 [0,1,0,1,0,0|1,0,0]=3 10424 B12R1.37 CCCCOCSC1CCOC1 62a_100011995733_100000690089 [0,1,0,1,0,0|1,1,0]=4 10425 B12R1.37 CCCNCCOC1CCCC1 34a_100000741755_100000210303 [0,1,0,1,0,0|2,0,0]=4 10426 B12R1.37 CCCOCCCC1CCCC1 34a_100000210258_100011713738 [0,1,0,1,0,0|2,0,0]=4 10427 B12R1.37 CCCOCCCC1CCCC1 34a_100011215328_100000210303 [0,1,0,1,0,0|2,0,0]=4 10428 B12R1.37 CCCOCCCC1CCCC1 7a_100011215328_100000210303 [0,1,0,1,0,0|2,0,0]=4 10429 B12R1.37 CCCOCCNC1CCCC1 2230a_100000211070_100011215938 [0,1,0,1,0,0|2,0,0]=4 10430 B12R1.37 CCCOCCNC1CCCC1 2230a_100161115042_100000179811 [0,1,0,1,0,0|2,0,0]=4 10431 B12R1.37 CCCOCCNC1CCCC1 270004a_100161115042_100000210133 [0,1,0,1,0,0|2,0,0]=4 10432 B12R1.37 CCCOCCNC1CCCC1 34a_100000211070_100011215938 [0,1,0,1,0,0|2,0,0]=4 10433 B12R1.37 CCCOCCNC1CCCC1 34a_100161115042_100000179811 [0,1,0,1,0,0|2,0,0]=4 10434 B12R1.37 CCCOCCNC1CCCC1 34a_200000200444_100000210303 [0,1,0,1,0,0|2,0,0]=4 10435 B12R1.37 CCCOCCNC1CCOC1 2230a_100161115042_100000731011 [0,1,0,1,0,0|1,0,0]=3 10436 B12R1.37 CCCOCCNC1CCOC1 270004a_100161115042_100000752484 [0,1,0,1,0,0|1,0,0]=3 10437 B12R1.37 CCCOCCNC1CCOC1 34a_100161115042_100000690089 [0,1,0,1,0,0|1,0,0]=3 10438 B12R1.37 CCCOCCNC1CCSC1 270004a_100161115042_100000212027 [0,1,0,1,0,0|1,1,0]=4 10439 B12R1.37 CCCOCCN[C@@H]1CCOC1 2230a_200015188469_100011215938 [0,1,0,1,0,0|1,0,0]=3 10440 B12R1.37 CCCOCCN[C@H]1CCOC1 2230a_100015188467_100011215938 [0,1,0,1,0,0|1,0,0]=3 10441 B12R1.37 CCCOCCN[C@H]1CCOC1 34a_100015188467_100011215938 [0,1,0,1,0,0|1,0,0]=3 10442 B12R1.37 CCCOCCOC1CCCC1 34a_100000210269_100011215938 [0,1,0,1,0,0|1,0,0]=3 10443 B12R1.37 CCCOCCOC1CCCC1 34a_100000738311_100000210303 [0,1,0,1,0,0|1,0,0]=3 10444 B12R1.37 CCCOCCOC1CCCC1 34a_100000752267_100000179811 [0,1,0,1,0,0|1,0,0]=3 10445 B12R1.37 CCCOCCOC1CCCC1 7a_100000210269_100011215938 [0,1,0,1,0,0|1,0,0]=3 10446 B12R1.37 CCCOCCOC1CCCC1 7a_100000738311_100000210303 [0,1,0,1,0,0|1,0,0]=3 10447 B12R1.37 CCCOCCOC1CCCC1 7a_100000752267_100000179811 [0,1,0,1,0,0|1,0,0]=3 10448 B12R1.37 CCCOCCOC1CCCO1 34a_100000085407_100011215938 [0,1,0,1,0,0|2,0,0]=4 10449 B12R1.37 CCCOCCOC1CCOC1 34a_100000752267_100000690089 [0,1,0,1,0,0|0,0,0]=2 10450 B12R1.37 CCCOCCOC1CCOC1 7a_100000752267_100000731011 [0,1,0,1,0,0|0,0,0]=2 10451 B12R1.37 CCCOCCOC1CCSC1 7a_100011232664_100011215938 [0,1,0,1,0,0|0,1,0]=3 10452 B12R1.37 CCCOCCO[C@H]1CCOC1 34a_100000717292_100011215938 [0,1,0,1,0,0|0,0,0]=2 10453 B12R1.37 CCCOCCSC1CCCC1 62a_100011215938_100000179811 [0,1,0,1,0,0|1,1,0]=4 10454 B12R1.37 CCCOCCSC1CCCC1 62a_100011217020_100011215938 [0,1,0,1,0,0|1,1,0]=4 10455 B12R1.37 CCCOCCSC1CCOC1 62a_100011215938_100000690089 [0,1,0,1,0,0|0,1,0]=3 10456 B12R1.37 CCCSCCNC1CCOC1 2230a_100020603323_100000731011 [0,1,0,1,0,0|1,1,0]=4 10457 B12R1.37 CCCSCCNC1CCOC1 270004a_100020603323_100000752484 [0,1,0,1,0,0|1,1,0]=4 10458 B12R1.37 CCCSCCOC1CCCC1 34a_200000230433_100000179811 [0,1,0,1,0,0|1,1,0]=4 10459 B12R1.37 CCCSCCOC1CCCC1 7a_200000230433_100000179811 [0,1,0,1,0,0|1,1,0]=4 10460 B12R1.37 CCCSCCOC1CCOC1 34a_200000230433_100000690089 [0,1,0,1,0,0|0,1,0]=3 10461 B12R1.37 CCCSCCOC1CCOC1 7a_200000230433_100000731011 [0,1,0,1,0,0|0,1,0]=3 10462 B12R1.37 CCNCCCCC1OCCO1 2230a_100015525214_100000034956 [0,1,0,1,0,0|2,0,0]=4 10463 B12R1.37 CCNCCCOC1CCCC1 34a_100000747560_100000210202 [0,1,0,1,0,0|2,0,0]=4 10464 B12R1.37 CCOCCCCC1OCCO1 34a_100121572206_200009813554 [0,1,0,1,0,0|1,0,0]=3 10465 B12R1.37 CCOCCCNC1CCCC1 2230a_100000210961_100000179811 [0,1,0,1,0,0|2,0,0]=4 10466 B12R1.37 CCOCCCNC1CCCC1 2230a_100000211070_100012232248 [0,1,0,1,0,0|2,0,0]=4 10467 B12R1.37 CCOCCCNC1CCCC1 270004a_100000210961_100000210133 [0,1,0,1,0,0|2,0,0]=4 10468 B12R1.37 CCOCCCNC1CCCC1 34a_100000210961_100000179811 [0,1,0,1,0,0|2,0,0]=4 10469 B12R1.37 CCOCCCNC1CCCC1 34a_100000211070_100012232248 [0,1,0,1,0,0|2,0,0]=4 10470 B12R1.37 CCOCCCNC1CCOC1 2230a_100000210961_100000731011 [0,1,0,1,0,0|1,0,0]=3 10471 B12R1.37 CCOCCCNC1CCOC1 270004a_100000210961_100000752484 [0,1,0,1,0,0|1,0,0]=3 10472 B12R1.37 CCOCCCNC1CCOC1 34a_100000210961_100000690089 [0,1,0,1,0,0|1,0,0]=3 10473 B12R1.37 CCOCCCNC1CCSC1 270004a_100000210961_100000212027 [0,1,0,1,0,0|1,1,0]=4 10474 B12R1.37 CCOCCCN[C@@H]1CCOC1 2230a_200015188469_100012232248 [0,1,0,1,0,0|1,0,0]=3 10475 B12R1.37 CCOCCCN[C@H]1CCOC1 2230a_100015188467_100012232248 [0,1,0,1,0,0|1,0,0]=3 10476 B12R1.37 CCOCCCN[C@H]1CCOC1 34a_100015188467_100012232248 [0,1,0,1,0,0|1,0,0]=3 10477 B12R1.37 CCOCCCOC1CCCC1 34a_100000210269_100012232248 [0,1,0,1,0,0|1,0,0]=3 10478 B12R1.37 CCOCCCOC1CCCC1 34a_100000757476_100000179811 [0,1,0,1,0,0|1,0,0]=3 10479 B12R1.37 CCOCCCOC1CCCC1 7a_100000210269_100012232248 [0,1,0,1,0,0|1,0,0]=3 10480 B12R1.37 CCOCCCOC1CCCC1 7a_100000757476_100000179811 [0,1,0,1,0,0|1,0,0]=3 10481 B12R1.37 CCOCCCOC1CCCO1 34a_100000085407_100012232248 [0,1,0,1,0,0|2,0,0]=4 10482 B12R1.37 CCOCCCOC1CCOC1 34a_100000757476_100000690089 [0,1,0,1,0,0|0,0,0]=2 10483 B12R1.37 CCOCCCOC1CCOC1 7a_100000757476_100000731011 [0,1,0,1,0,0|0,0,0]=2 10484 B12R1.37 CCOCCCOC1CCSC1 7a_100011232664_100012232248 [0,1,0,1,0,0|0,1,0]=3 10485 B12R1.37 CCOCCCO[C@H]1CCOC1 34a_100000717292_100012232248 [0,1,0,1,0,0|0,0,0]=2 10486 B12R1.37 CCOCCCSC1CCCC1 62a_100011217020_100012232248 [0,1,0,1,0,0|1,1,0]=4 10487 B12R1.37 CCOCCCSC1CCCC1 62a_100012232248_100000179811 [0,1,0,1,0,0|1,1,0]=4 10488 B12R1.37 CCOCCCSC1CCOC1 62a_100012232248_100000690089 [0,1,0,1,0,0|0,1,0]=3 10489 B12R1.37 CCOCCNCC1CCCC1 2230a_100000737975_100011215890 [0,1,0,1,0,0|2,0,0]=4 10490 B12R1.37 CCOCCNCC1CCCC1 2230a_102516460346_100000740388 [0,1,0,1,0,0|2,0,0]=4 10491 B12R1.37 CCOCCNCC1CCCC1 269862a_100011200944_100000746403 [0,1,0,1,0,0|2,0,0]=4 10492 B12R1.37 CCOCCNCC1CCCC1 34a_100000737975_100000210147 [0,1,0,1,0,0|2,0,0]=4 10493 B12R1.37 CCOCCNCC1CCCC1 34a_102516460346_100000740388 [0,1,0,1,0,0|2,0,0]=4 10494 B12R1.37 CCOCCNCC1CCCO1 2230a_102516460346_100000203698 [0,1,0,1,0,0|1,0,0]=3 10495 B12R1.37 CCOCCNCC1CCOC1 2230a_100000737293_100011215890 [0,1,0,1,0,0|1,0,0]=3 10496 B12R1.37 CCOCCNCC1CCOC1 2230a_102516460346_100000702531 [0,1,0,1,0,0|1,0,0]=3 10497 B12R1.37 CCOCCNCC1CCOC1 34a_100000737293_100000210147 [0,1,0,1,0,0|1,0,0]=3 10498 B12R1.37 CCOCCNCC1CCOC1 34a_102516460346_100011261433 [0,1,0,1,0,0|1,0,0]=3 10499 B12R1.37 CCOCCNCC1OCCO1 2230a_100000036311_100011215890 [0,1,0,1,0,0|1,0,0]=3 10500 B12R1.37 CCOCCNCC1OCCO1 2230a_102516460346_100000755774 [0,1,0,1,0,0|1,0,0]=3 10501 B12R1.37 CCOCCNCC1OCCO1 34a_100000036311_100000210147 [0,1,0,1,0,0|1,0,0]=3 10502 B12R1.37 CCOCCNCC1OCCO1 34a_102516460346_100000755774 [0,1,0,1,0,0|1,0,0]=3 10503 B12R1.37 CCOCCNC[C@@H]1CCCO1 2230a_100020590478_100011215890 [0,1,0,1,0,0|1,0,0]=3 10504 B12R1.37 CCOCCNC[C@@H]1CCCO1 34a_100020590478_100000210147 [0,1,0,1,0,0|1,0,0]=3 10505 B12R1.37 CCOCCNN=C1CCOC1 4a_100000732670_100000752484 [0,1,0,1,0,0|1,0,1]=4 10506 B12R1.37 CCOCCOCC1=NCCN1 34a_100000210136_100000737910 [0,1,0,1,0,0|1,0,1]=4 10507 B12R1.37 CCOCCOCC1=NCCN1 7a_100000210136_100000737910 [0,1,0,1,0,0|1,0,1]=4 10508 B12R1.37 CCOCCOCC1CC=CC1 34a_100000688395_100000210147 [0,1,0,1,0,0|1,0,1]=4 10509 B12R1.37 CCOCCOCC1CCCC1 34a_100000210136_100000740388 [0,1,0,1,0,0|1,0,0]=3 10510 B12R1.37 CCOCCOCC1CCCC1 34a_100000742336_100000210147 [0,1,0,1,0,0|1,0,0]=3 10511 B12R1.37 CCOCCOCC1CCCC1 7a_100000210136_100000740388 [0,1,0,1,0,0|1,0,0]=3 10512 B12R1.37 CCOCCOCC1CCCC1 7a_100000742336_100011215890 [0,1,0,1,0,0|1,0,0]=3 10513 B12R1.37 CCOCCOCC1CCCO1 34a_100000210270_100000210147 [0,1,0,1,0,0|0,0,0]=2 10514 B12R1.37 CCOCCOCC1CCCO1 7a_100000210136_100000203698 [0,1,0,1,0,0|0,0,0]=2 10515 B12R1.37 CCOCCOCC1CCCO1 7a_100000210270_100011215890 [0,1,0,1,0,0|0,0,0]=2 10516 B12R1.37 CCOCCOCC1CCNC1 34a_100000748654_100000210147 [0,1,0,1,0,0|1,0,0]=3 10517 B12R1.37 CCOCCOCC1CCOC1 34a_100000210136_100011261433 [0,1,0,1,0,0|0,0,0]=2 10518 B12R1.37 CCOCCOCC1CCOC1 34a_100000740260_100000210147 [0,1,0,1,0,0|0,0,0]=2 10519 B12R1.37 CCOCCOCC1CCOC1 7a_100000210136_100000702531 [0,1,0,1,0,0|0,0,0]=2 10520 B12R1.37 CCOCCOCC1COCO1 34a_100011216627_100000210147 [0,1,0,1,0,0|0,0,0]=2 10521 B12R1.37 CCOCCOCC1OCCO1 34a_100000087154_100000210147 [0,1,0,1,0,0|0,0,0]=2 10522 B12R1.37 CCOCCOCC1OCCO1 34a_100000210136_100000755774 [0,1,0,1,0,0|0,0,0]=2 10523 B12R1.37 CCOCCOCC1OCCO1 7a_100000210136_100000755774 [0,1,0,1,0,0|0,0,0]=2 10524 B12R1.37 CCOCCOC[C@H]1CCCN1 34a_100000745186_100000210147 [0,1,0,1,0,0|1,0,0]=3 10525 B12R1.37 CCOCCSCC1CCCC1 62a_100000210147_100000740388 [0,1,0,1,0,0|1,1,0]=4 10526 B12R1.37 CCOCCSCC1CCCC1 62a_100000740388_100011215890 [0,1,0,1,0,0|1,1,0]=4 10527 B12R1.37 CCOCCSCC1CCCO1 62a_100000203698_100011215890 [0,1,0,1,0,0|0,1,0]=3 10528 B12R1.37 CCOCCSCC1CCCO1 62a_100000210147_100000203698 [0,1,0,1,0,0|0,1,0]=3 10529 B12R1.37 CCOCCSCC1CCOC1 62a_100000210147_100000702531 [0,1,0,1,0,0|0,1,0]=3 10530 B12R1.37 CCOCCSCC1CCOC1 62a_100000702531_100011215890 [0,1,0,1,0,0|0,1,0]=3 10531 B12R1.37 CCOCCSCC1OCCO1 62a_100000210147_100000755774 [0,1,0,1,0,0|0,1,0]=3 10532 B12R1.37 CCOCCSCC1OCCO1 62a_100000755774_100011215890 [0,1,0,1,0,0|0,1,0]=3 10533 B12R1.37 CCOCSCCC1CCCC1 62a_100000739092_100000760354 [0,1,0,1,0,0|2,0,0]=4 10534 B12R1.37 CCOCSCCC1CCCC1 62a_100000760354_100000739092 [0,1,0,1,0,0|2,0,0]=4 10535 B12R1.37 CCOCSCCC1OCCO1 62a_100000739092_100000740749 [0,1,0,1,0,0|2,0,0]=4 10536 B12R1.37 CCSCCCCC1OCCO1 62a_100000210202_100000034956 [0,1,0,1,0,0|1,1,0]=4 10537 B12R1.37 CCSCCCOC1CCCC1 34a_100011216438_100000179811 [0,1,0,1,0,0|1,1,0]=4 10538 B12R1.37 CCSCCCOC1CCCC1 7a_100011216438_100000179811 [0,1,0,1,0,0|1,1,0]=4 10539 B12R1.37 CCSCCCOC1CCOC1 34a_100011216438_100000690089 [0,1,0,1,0,0|0,1,0]=3 10540 B12R1.37 CCSCCCOC1CCOC1 7a_100011216438_100000731011 [0,1,0,1,0,0|0,1,0]=3 10541 B12R1.37 CCSCCNCC1CCCO1 2230a_100000106463_100000203698 [0,1,0,1,0,0|1,1,0]=4 10542 B12R1.37 CCSCCNCC1CCOC1 2230a_100000106463_100000702531 [0,1,0,1,0,0|1,1,0]=4 10543 B12R1.37 CCSCCNCC1CCOC1 2230a_100000737293_100000757381 [0,1,0,1,0,0|1,1,0]=4 10544 B12R1.37 CCSCCNCC1CCOC1 34a_100000737293_100000757381 [0,1,0,1,0,0|1,1,0]=4 10545 B12R1.37 CCSCCNCC1OCCO1 2230a_100000036311_100000757381 [0,1,0,1,0,0|1,1,0]=4 10546 B12R1.37 CCSCCNCC1OCCO1 2230a_100000106463_100000755774 [0,1,0,1,0,0|1,1,0]=4 10547 B12R1.37 CCSCCNCC1OCCO1 34a_100000036311_100000757381 [0,1,0,1,0,0|1,1,0]=4 10548 B12R1.37 CCSCCNC[C@@H]1CCCO1 2230a_100020590478_100000757381 [0,1,0,1,0,0|1,1,0]=4 10549 B12R1.37 CCSCCNC[C@@H]1CCCO1 34a_100020590478_100000757381 [0,1,0,1,0,0|1,1,0]=4 10550 B12R1.37 CCSCCOCC1CCCC1 34a_100000212035_100000740388 [0,1,0,1,0,0|1,1,0]=4 10551 B12R1.37 CCSCCOCC1CCCC1 34a_100000742336_100000757381 [0,1,0,1,0,0|1,1,0]=4 10552 B12R1.37 CCSCCOCC1CCCC1 7a_100000212035_100000740388 [0,1,0,1,0,0|1,1,0]=4 10553 B12R1.37 CCSCCOCC1CCCC1 7a_100000742336_100000757381 [0,1,0,1,0,0|1,1,0]=4 10554 B12R1.37 CCSCCOCC1CCCO1 34a_100000210270_100000757381 [0,1,0,1,0,0|0,1,0]=3 10555 B12R1.37 CCSCCOCC1CCCO1 7a_100000210270_100000757381 [0,1,0,1,0,0|0,1,0]=3 10556 B12R1.37 CCSCCOCC1CCCO1 7a_100000212035_100000203698 [0,1,0,1,0,0|0,1,0]=3 10557 B12R1.37 CCSCCOCC1CCNC1 34a_100000748654_100000757381 [0,1,0,1,0,0|1,1,0]=4 10558 B12R1.37 CCSCCOCC1CCOC1 34a_100000212035_100011261433 [0,1,0,1,0,0|0,1,0]=3 10559 B12R1.37 CCSCCOCC1CCOC1 34a_100000740260_100000757381 [0,1,0,1,0,0|0,1,0]=3 10560 B12R1.37 CCSCCOCC1CCOC1 7a_100000212035_100000702531 [0,1,0,1,0,0|0,1,0]=3 10561 B12R1.37 CCSCCOCC1COCO1 34a_100011216627_100000757381 [0,1,0,1,0,0|0,1,0]=3 10562 B12R1.37 CCSCCOCC1OCCO1 34a_100000087154_100000757381 [0,1,0,1,0,0|0,1,0]=3 10563 B12R1.37 CCSCCOCC1OCCO1 34a_100000212035_100000755774 [0,1,0,1,0,0|0,1,0]=3 10564 B12R1.37 CCSCCOCC1OCCO1 7a_100000212035_100000755774 [0,1,0,1,0,0|0,1,0]=3 10565 B12R1.37 CCSCCOC[C@H]1CCCN1 34a_100000745186_100000757381 [0,1,0,1,0,0|1,1,0]=4 10566 B12R1.37 CCSCCSCC1CCCO1 62a_100000203698_100000757381 [0,1,0,1,0,0|0,2,0]=4 10567 B12R1.37 CCSCCSCC1CCCO1 62a_100000757381_100000203698 [0,1,0,1,0,0|0,2,0]=4 10568 B12R1.37 CCSCCSCC1CCOC1 62a_100000702531_100000757381 [0,1,0,1,0,0|0,2,0]=4 10569 B12R1.37 CCSCCSCC1CCOC1 62a_100000757381_100000702531 [0,1,0,1,0,0|0,2,0]=4 10570 B12R1.37 CCSCCSCC1OCCO1 62a_100000755774_100000757381 [0,1,0,1,0,0|0,2,0]=4 10571 B12R1.37 CCSCCSCC1OCCO1 62a_100000757381_100000755774 [0,1,0,1,0,0|0,2,0]=4 10572 B12R1.37 CNCCCOCC1CCOC1 34a_100000213112_100011261433 [0,1,0,1,0,0|2,0,0]=4 10573 B12R1.37 CNCCCOCC1OCCO1 34a_100000213112_100000755774 [0,1,0,1,0,0|2,0,0]=4 10574 B12R1.37 COCCCCN[C@@H]1CCOC1 2230a_200015188469_100000730899 [0,1,0,1,0,0|2,0,0]=4 10575 B12R1.37 COCCCCN[C@H]1CCOC1 2230a_100015188467_100000730899 [0,1,0,1,0,0|2,0,0]=4 10576 B12R1.37 COCCCCN[C@H]1CCOC1 34a_100015188467_100000755781 [0,1,0,1,0,0|2,0,0]=4 10577 B12R1.37 COCCCCOC1CCCC1 34a_100000210269_100000755781 [0,1,0,1,0,0|2,0,0]=4 10578 B12R1.37 COCCCCOC1CCCC1 34a_100000740925_100000179811 [0,1,0,1,0,0|2,0,0]=4 10579 B12R1.37 COCCCCOC1CCCC1 7a_100000210269_100000730899 [0,1,0,1,0,0|2,0,0]=4 10580 B12R1.37 COCCCCOC1CCOC1 34a_100000740925_100000690089 [0,1,0,1,0,0|1,0,0]=3 10581 B12R1.37 COCCCCOC1CCSC1 7a_100011232664_100000730899 [0,1,0,1,0,0|1,1,0]=4 10582 B12R1.37 COCCCCO[C@H]1CCOC1 34a_100000717292_100000755781 [0,1,0,1,0,0|1,0,0]=3 10583 B12R1.37 COCCCCSC1CCOC1 62a_100000730899_100000690089 [0,1,0,1,0,0|1,1,0]=4 10584 B12R1.37 COCCCOCC1CCCO1 34a_100000210270_100000740836 [0,1,0,1,0,0|2,0,0]=4 10585 B12R1.37 COCCCOCC1CCCO1 7a_100000210270_100000740836 [0,1,0,1,0,0|2,0,0]=4 10586 B12R1.37 COCCCOCC1CCOC1 34a_100000740260_100000740836 [0,1,0,1,0,0|2,0,0]=4 10587 B12R1.37 COCCCOCC1CCOC1 34a_100000740835_100011261433 [0,1,0,1,0,0|2,0,0]=4 10588 B12R1.37 COCCCOCC1COCO1 34a_100011216627_100000740836 [0,1,0,1,0,0|2,0,0]=4 10589 B12R1.37 COCCCOCC1OCCO1 34a_100000087154_100000740836 [0,1,0,1,0,0|2,0,0]=4 10590 B12R1.37 COCCCOCC1OCCO1 34a_100000740835_100000755774 [0,1,0,1,0,0|2,0,0]=4 10591 B12R1.37 CSCCCCOC1CCCC1 34a_100011217163_100000179811 [0,1,0,1,0,0|2,0,0]=4 10592 B12R1.37 CSCCCCOC1CCCC1 7a_100011217163_100000179811 [0,1,0,1,0,0|2,0,0]=4 10593 B12R1.37 CSCCCCOC1CCOC1 34a_100011217163_100000690089 [0,1,0,1,0,0|1,0,0]=3 10594 B12R1.37 CSCCCCOC1CCOC1 7a_100011217163_100000731011 [0,1,0,1,0,0|1,0,0]=3 10595 B12R1.37 CSCCCOCC1CCCO1 7a_100000690336_100000203698 [0,1,0,1,0,0|2,0,0]=4 10596 B12R1.37 CSCCCOCC1CCOC1 34a_100000690336_100011261433 [0,1,0,1,0,0|2,0,0]=4 10597 B12R1.37 CSCCCOCC1CCOC1 7a_100000690336_100000702531 [0,1,0,1,0,0|2,0,0]=4 10598 B12R1.37 CSCCCOCC1OCCO1 34a_100000690336_100000755774 [0,1,0,1,0,0|2,0,0]=4 10599 B12R1.37 CSCCCOCC1OCCO1 7a_100000690336_100000755774 [0,1,0,1,0,0|2,0,0]=4 10600 B12R1.37 CSCNCCOC1CCCC1 34a_100000741755_100011218213 [0,1,0,1,0,0|2,0,0]=4 10601 B12R1.37 CSCOCCCC1CCCC1 34a_100011215328_100011218213 [0,1,0,1,0,0|2,0,0]=4 10602 B12R1.37 CSCOCCNC1CCCC1 34a_200000200444_100011218213 [0,1,0,1,0,0|2,0,0]=4 10603 B12R1.37 CSCOCCOC1CCCC1 34a_100000738311_100011218213 [0,1,0,1,0,0|1,0,0]=3 10604 B12R1.37 ClCCCCCOC1CCCC1 34a_100000746330_100000179811 [0,1,0,1,0,0|2,0,0]=4 10605 B12R1.37 ClCCCCCOC1CCCC1 7a_100000746330_100000179811 [0,1,0,1,0,0|2,0,0]=4 10606 B12R1.37 ClCCCCCOC1CCOC1 34a_100000746330_100000690089 [0,1,0,1,0,0|1,0,0]=3 10607 B12R1.37 ClCCCCCOC1CCOC1 7a_100000746330_100000731011 [0,1,0,1,0,0|1,0,0]=3 10608 B12R1.37 ClCCCCOCC1CCCO1 7a_100000210776_100000203698 [0,1,0,1,0,0|2,0,0]=4 10609 B12R1.37 ClCCCCOCC1CCOC1 34a_100000210776_100011261433 [0,1,0,1,0,0|2,0,0]=4 10610 B12R1.37 ClCCCCOCC1CCOC1 7a_100000210776_100000702531 [0,1,0,1,0,0|2,0,0]=4 10611 B12R1.37 ClCCCCOCC1OCCO1 34a_100000210776_100000755774 [0,1,0,1,0,0|2,0,0]=4 10612 B12R1.37 ClCCCCOCC1OCCO1 7a_100000210776_100000755774 [0,1,0,1,0,0|2,0,0]=4 10613 B12R1.37 ClCCOCCOC1CCCC1 34a_100011215305_100000179811 [0,1,0,1,0,0|1,0,0]=3 10614 B12R1.37 ClCCOCCOC1CCCC1 7a_100011215305_100000179811 [0,1,0,1,0,0|1,0,0]=3 10615 B12R1.37 ClCCOCCOC1CCOC1 34a_100011215305_100000690089 [0,1,0,1,0,0|0,0,0]=2 10616 B12R1.37 ClCCOCCOC1CCOC1 7a_100011215305_100000731011 [0,1,0,1,0,0|0,0,0]=2 10617 B12R1.37 FCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000729378 [0,1,0,1,0,0|2,0,0]=4 10618 B12R1.37 FCCCCCN[C@H]1CCOC1 2230a_100015188467_100000729378 [0,1,0,1,0,0|2,0,0]=4 10619 B12R1.37 FCCCCCN[C@H]1CCOC1 34a_100015188467_100000729378 [0,1,0,1,0,0|2,0,0]=4 10620 B12R1.37 FCCCCCOC1CCCC1 34a_100000210269_100000729378 [0,1,0,1,0,0|2,0,0]=4 10621 B12R1.37 FCCCCCOC1CCCC1 7a_100000210269_100000729378 [0,1,0,1,0,0|2,0,0]=4 10622 B12R1.37 FCCCCCOC1CCSC1 7a_100011232664_100000729378 [0,1,0,1,0,0|1,1,0]=4 10623 B12R1.37 FCCCCCO[C@H]1CCOC1 34a_100000717292_100000729378 [0,1,0,1,0,0|1,0,0]=3 10624 B12R1.37 FCCCCCSC1CCOC1 62a_100000729378_100000690089 [0,1,0,1,0,0|1,1,0]=4 10625 B12R1.37 FCCCCOCC1CCCO1 34a_100000210270_100000729493 [0,1,0,1,0,0|2,0,0]=4 10626 B12R1.37 FCCCCOCC1CCCO1 7a_100000210270_100000729493 [0,1,0,1,0,0|2,0,0]=4 10627 B12R1.37 FCCCCOCC1CCCO1 7a_100011995726_100000203698 [0,1,0,1,0,0|2,0,0]=4 10628 B12R1.37 FCCCCOCC1CCOC1 34a_100000740260_100000729493 [0,1,0,1,0,0|2,0,0]=4 10629 B12R1.37 FCCCCOCC1CCOC1 34a_100011995726_100011261433 [0,1,0,1,0,0|2,0,0]=4 10630 B12R1.37 FCCCCOCC1CCOC1 7a_100011995726_100000702531 [0,1,0,1,0,0|2,0,0]=4 10631 B12R1.37 FCCCCOCC1COCO1 34a_100011216627_100000729493 [0,1,0,1,0,0|2,0,0]=4 10632 B12R1.37 FCCCCOCC1OCCO1 34a_100000087154_100000729493 [0,1,0,1,0,0|2,0,0]=4 10633 B12R1.37 FCCCCOCC1OCCO1 34a_100011995726_100000755774 [0,1,0,1,0,0|2,0,0]=4 10634 B12R1.37 FCCCCOCC1OCCO1 7a_100011995726_100000755774 [0,1,0,1,0,0|2,0,0]=4 10635 B12R1.37 FCCNCCOC1CCCC1 34a_100000741755_100011217306 [0,1,0,1,0,0|2,0,0]=4 10636 B12R1.37 FCCOCCCC1CCCC1 34a_100011215328_100011217306 [0,1,0,1,0,0|2,0,0]=4 10637 B12R1.37 FCCOCCCC1CCCC1 7a_100011215328_100011217306 [0,1,0,1,0,0|2,0,0]=4 10638 B12R1.37 FCCOCCNC1CCCC1 34a_200000200444_100011217306 [0,1,0,1,0,0|2,0,0]=4 10639 B12R1.37 FCCOCCOC1CCCC1 34a_100000738311_100011217306 [0,1,0,1,0,0|1,0,0]=3 10640 B12R1.37 FCCOCCOC1CCCC1 34a_200015357709_100000179811 [0,1,0,1,0,0|1,0,0]=3 10641 B12R1.37 FCCOCCOC1CCCC1 7a_100000738311_100011217306 [0,1,0,1,0,0|1,0,0]=3 10642 B12R1.37 FCCOCCOC1CCCC1 7a_200015357709_100000179811 [0,1,0,1,0,0|1,0,0]=3 10643 B12R1.37 FCCOCCOC1CCOC1 34a_200015357709_100000690089 [0,1,0,1,0,0|0,0,0]=2 10644 B12R1.37 FCCOCCOC1CCOC1 7a_200015357709_100000731011 [0,1,0,1,0,0|0,0,0]=2 10645 B12R1.37 ICCCCCOC1CCCC1 34a_200012148887_100000179811 [0,1,0,1,0,0|2,0,0]=4 10646 B12R1.37 ICCCCCOC1CCCC1 7a_200012148887_100000179811 [0,1,0,1,0,0|2,0,0]=4 10647 B12R1.37 ICCCCCOC1CCOC1 34a_200012148887_100000690089 [0,1,0,1,0,0|1,0,0]=3 10648 B12R1.37 ICCCCCOC1CCOC1 7a_200012148887_100000731011 [0,1,0,1,0,0|1,0,0]=3 10649 B12R1.37 ICCCCOCC1CCOC1 34a_200012148704_100011261433 [0,1,0,1,0,0|2,0,0]=4 10650 B12R1.37 ICCCCOCC1OCCO1 34a_200012148704_100000755774 [0,1,0,1,0,0|2,0,0]=4 10651 B12R1.37 ICCOCCOC1CCCC1 34a_100012149058_100000179811 [0,1,0,1,0,0|1,0,0]=3 10652 B12R1.37 ICCOCCOC1CCCC1 7a_100012149058_100000179811 [0,1,0,1,0,0|1,0,0]=3 10653 B12R1.37 ICCOCCOC1CCOC1 34a_100012149058_100000690089 [0,1,0,1,0,0|0,0,0]=2 10654 B12R1.37 ICCOCCOC1CCOC1 7a_100012149058_100000731011 [0,1,0,1,0,0|0,0,0]=2 10655 B12R1.37 N#CCOCCN[C@@H]1CCOC1 2230a_200015188469_200000047693 [0,1,0,1,0,0|1,0,1]=4 10656 B12R1.37 N#CCOCCN[C@H]1CCOC1 2230a_100015188467_200000047693 [0,1,0,1,0,0|1,0,1]=4 10657 B12R1.37 N#CCOCCOC1CCCC1 7a_100000210269_200000047693 [0,1,0,1,0,0|1,0,1]=4 10658 B12R1.37 N#CCOCCOC1CCCC1 7a_100000738311_100011215382 [0,1,0,1,0,0|1,0,1]=4 10659 B12R1.37 N#CCOCCOC1CCSC1 7a_100011232664_200000047693 [0,1,0,1,0,0|0,1,1]=4 10660 B12R1.37 N#CCOCCSC1CCOC1 62a_200000047693_100000690089 [0,1,0,1,0,0|0,1,1]=4 10661 B12R1.37 NCCCCCOC1CCCC1 34a_100000762737_100000179811 [0,1,0,1,0,0|2,0,0]=4 10662 B12R1.37 NCCCCCOC1CCOC1 34a_100000762737_100000690089 [0,1,0,1,0,0|1,0,0]=3 10663 B12R1.37 NCCCCOCC1CCOC1 34a_100000750430_100011261433 [0,1,0,1,0,0|2,0,0]=4 10664 B12R1.37 NCCCCOCC1OCCO1 34a_100000750430_100000755774 [0,1,0,1,0,0|2,0,0]=4 10665 B12R1.37 NCCOCCCC1CCCC1 34a_100000210304_100011713738 [0,1,0,1,0,0|2,0,0]=4 10666 B12R1.37 NCCOCCOC1CCCC1 34a_100000211614_100000179811 [0,1,0,1,0,0|1,0,0]=3 10667 B12R1.37 NCCOCCOC1CCOC1 34a_100000211614_100000690089 [0,1,0,1,0,0|0,0,0]=2 10668 B12R1.37 O=CCOCCOC1CCCC1 34a_100000738311_200009817547 [0,1,0,1,0,0|1,0,1]=4 10669 B12R1.37 O=CCOCCOC1CCCC1 7a_100000738311_200015260668 [0,1,0,1,0,0|1,0,1]=4 10670 B12R1.37 OCCCCCNC1CCOC1 2230a_100000762737_100000731011 [0,1,0,1,0,0|2,0,0]=4 10671 B12R1.37 OCCCCCNC1CCOC1 270004a_100000762737_100000752484 [0,1,0,1,0,0|2,0,0]=4 10672 B12R1.37 OCCCCCNC1CCOC1 34a_100000762737_100000690089 [0,1,0,1,0,0|2,0,0]=4 10673 B12R1.37 OCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000746330 [0,1,0,1,0,0|2,0,0]=4 10674 B12R1.37 OCCCCCN[C@H]1CCOC1 2230a_100015188467_100000746330 [0,1,0,1,0,0|2,0,0]=4 10675 B12R1.37 OCCCCCN[C@H]1CCOC1 34a_100015188467_100000746330 [0,1,0,1,0,0|2,0,0]=4 10676 B12R1.37 OCCCCCOC1CCCC1 34a_100000210269_100000746330 [0,1,0,1,0,0|2,0,0]=4 10677 B12R1.37 OCCCCCOC1CCCC1 7a_100000210269_100000746330 [0,1,0,1,0,0|2,0,0]=4 10678 B12R1.37 OCCCCCOC1CCSC1 7a_100011232664_100000746330 [0,1,0,1,0,0|1,1,0]=4 10679 B12R1.37 OCCCCCO[C@H]1CCOC1 34a_100000717292_100000746330 [0,1,0,1,0,0|1,0,0]=3 10680 B12R1.37 OCCCCCSC1CCOC1 62a_100000746330_100000690089 [0,1,0,1,0,0|1,1,0]=4 10681 B12R1.37 OCCCCOCC1CCCO1 34a_100000210270_100011216708 [0,1,0,1,0,0|2,0,0]=4 10682 B12R1.37 OCCCCOCC1CCCO1 7a_100000210270_100000210776 [0,1,0,1,0,0|2,0,0]=4 10683 B12R1.37 OCCCCOCC1CCOC1 34a_100000740260_100011216708 [0,1,0,1,0,0|2,0,0]=4 10684 B12R1.37 OCCCCOCC1COCO1 34a_100011216627_100011216708 [0,1,0,1,0,0|2,0,0]=4 10685 B12R1.37 OCCCCOCC1OCCO1 34a_100000087154_100011216708 [0,1,0,1,0,0|2,0,0]=4 10686 B12R1.37 OCCNCCOC1CCCC1 34a_100000741755_100000211926 [0,1,0,1,0,0|2,0,0]=4 10687 B12R1.37 OCCOCCCC1CCCC1 34a_100011215328_100000211926 [0,1,0,1,0,0|2,0,0]=4 10688 B12R1.37 OCCOCCCC1CCCC1 7a_100011215328_100000211926 [0,1,0,1,0,0|2,0,0]=4 10689 B12R1.37 OCCOCCNC1CCCC1 2230a_100000211070_100011215305 [0,1,0,1,0,0|2,0,0]=4 10690 B12R1.37 OCCOCCNC1CCCC1 2230a_100000211614_100000179811 [0,1,0,1,0,0|2,0,0]=4 10691 B12R1.37 OCCOCCNC1CCCC1 270004a_100000211614_100000210133 [0,1,0,1,0,0|2,0,0]=4 10692 B12R1.37 OCCOCCNC1CCCC1 34a_100000211070_100000692535 [0,1,0,1,0,0|2,0,0]=4 10693 B12R1.37 OCCOCCNC1CCCC1 34a_100000211614_100000179811 [0,1,0,1,0,0|2,0,0]=4 10694 B12R1.37 OCCOCCNC1CCCC1 34a_200000200444_100000211926 [0,1,0,1,0,0|2,0,0]=4 10695 B12R1.37 OCCOCCNC1CCOC1 2230a_100000211614_100000731011 [0,1,0,1,0,0|1,0,0]=3 10696 B12R1.37 OCCOCCNC1CCOC1 270004a_100000211614_100000752484 [0,1,0,1,0,0|1,0,0]=3 10697 B12R1.37 OCCOCCNC1CCOC1 34a_100000211614_100000690089 [0,1,0,1,0,0|1,0,0]=3 10698 B12R1.37 OCCOCCNC1CCSC1 270004a_100000211614_100000212027 [0,1,0,1,0,0|1,1,0]=4 10699 B12R1.37 OCCOCCN[C@@H]1CCOC1 2230a_200015188469_100011215305 [0,1,0,1,0,0|1,0,0]=3 10700 B12R1.37 OCCOCCN[C@H]1CCOC1 2230a_100015188467_100011215305 [0,1,0,1,0,0|1,0,0]=3 10701 B12R1.37 OCCOCCN[C@H]1CCOC1 34a_100015188467_100000692535 [0,1,0,1,0,0|1,0,0]=3 10702 B12R1.37 OCCOCCOC1CCCC1 34a_100000210269_100000692535 [0,1,0,1,0,0|1,0,0]=3 10703 B12R1.37 OCCOCCOC1CCCC1 34a_100000738311_100000211926 [0,1,0,1,0,0|1,0,0]=3 10704 B12R1.37 OCCOCCOC1CCCC1 7a_100000210269_100011215305 [0,1,0,1,0,0|1,0,0]=3 10705 B12R1.37 OCCOCCOC1CCCC1 7a_100000738311_100000211926 [0,1,0,1,0,0|1,0,0]=3 10706 B12R1.37 OCCOCCOC1CCCO1 34a_100000085407_100000692535 [0,1,0,1,0,0|2,0,0]=4 10707 B12R1.37 OCCOCCOC1CCSC1 7a_100011232664_100011215305 [0,1,0,1,0,0|0,1,0]=3 10708 B12R1.37 OCCOCCO[C@H]1CCOC1 34a_100000717292_100000692535 [0,1,0,1,0,0|0,0,0]=2 10709 B12R1.37 OCCOCCSC1CCCC1 62a_100011215305_100000179811 [0,1,0,1,0,0|1,1,0]=4 10710 B12R1.37 OCCOCCSC1CCCC1 62a_100011217020_100011215305 [0,1,0,1,0,0|1,1,0]=4 10711 B12R1.37 OCCOCCSC1CCOC1 62a_100011215305_100000690089 [0,1,0,1,0,0|0,1,0]=3 10712 B12R1.37 OCCSCCNC1CCOC1 2230a_100011219999_100000731011 [0,1,0,1,0,0|1,1,0]=4 10713 B12R1.37 OCCSCCNC1CCOC1 270004a_100011219999_100000752484 [0,1,0,1,0,0|1,1,0]=4 10714 B12R1.45 CCCOC[C@H]1CCCN1CC 34a_100011739246_100000210303 [0,1,0,1,0,0|2,0,0]=4 10715 B12R1.45 CCCOC[C@H]1CCCN1CC 7a_100011739246_100000210303 [0,1,0,1,0,0|2,0,0]=4 10716 B12R1.45 CCN1CCC[C@@H]1COCCF 34a_100011739246_100011217306 [0,1,0,1,0,0|2,0,0]=4 10717 B12R1.45 CCN1CCC[C@@H]1COCCF 7a_100011739246_100011217306 [0,1,0,1,0,0|2,0,0]=4 10718 B12R1.45 CCN1CCC[C@@H]1COCCO 34a_100011739246_100000211926 [0,1,0,1,0,0|2,0,0]=4 10719 B12R1.45 CCN1CCC[C@@H]1COCCO 7a_100011739246_100000211926 [0,1,0,1,0,0|2,0,0]=4 10720 B12R1.45 CCN1CCC[C@@H]1COCSC 34a_100011739246_100011218213 [0,1,0,1,0,0|2,0,0]=4 10721 B12R1.45 CCOCCN1CCCC1CC 2230a_100000754278_100011215890 [0,1,0,1,0,0|2,0,0]=4 10722 B12R1.45 CCOCCN1CCCC1CC 269982a_100000754278_100011215890 [0,1,0,1,0,0|2,0,0]=4 10723 B12R1.45 CCOCCN1CCCC1CC 34a_100000754278_100000210147 [0,1,0,1,0,0|2,0,0]=4 10724 B12R1.45 CCOCCN1CCC[C@@H]1CO 2230a_100000745186_100011215890 [0,1,0,1,0,0|2,0,0]=4 10725 B12R1.45 CCOCCN1CCC[C@@H]1CO 269982a_100000745186_100011215890 [0,1,0,1,0,0|2,0,0]=4 10726 B12R1.45 CCOCCN1CCC[C@@H]1CO 34a_100000745186_100000210147 [0,1,0,1,0,0|2,0,0]=4 10727 B12R1.121 CCC1CCCCC1OCCF 34a_100000210738_100011217306 [0,1,0,1,0,0|2,0,0]=4 10728 B12R1.121 CCC1CCCCC1OCCF 7a_100000210738_100011217306 [0,1,0,1,0,0|2,0,0]=4 10729 B12R1.121 CCC1CCCCC1OCCO 34a_100000210738_100000211926 [0,1,0,1,0,0|2,0,0]=4 10730 B12R1.121 CCC1CCCCC1OCCO 7a_100000210738_100000211926 [0,1,0,1,0,0|2,0,0]=4 10731 B12R1.121 CCC1CCCCC1OCSC 34a_100000210738_100011218213 [0,1,0,1,0,0|2,0,0]=4 10732 B12R1.121 CCCOC1CCCCC1CC 34a_100000210738_100000210303 [0,1,0,1,0,0|2,0,0]=4 10733 B12R1.121 CCCOC1CCCCC1CC 7a_100000210738_100000210303 [0,1,0,1,0,0|2,0,0]=4 10734 B12R1.121 CCOCC1CCCCN1CC 34a_100000225091_100000210202 [0,1,0,1,0,0|2,0,0]=4 10735 B12R1.121 CCOCC1CCCCN1CC 7a_100000225091_100000210202 [0,1,0,1,0,0|2,0,0]=4 10736 B12R1.121 CCOCN1CCCCC1CC 269982a_100000210034_100000739092 [0,1,0,1,0,0|2,0,0]=4 10737 B12R1.169 CCCC1CCCCC1OCC 34a_100011217265_100000210202 [0,1,0,1,0,0|2,0,0]=4 10738 B12R1.169 CCCC1CCCCC1OCC 7a_100011217265_100000210202 [0,1,0,1,0,0|2,0,0]=4 10739 B12R1.169 CCCC1COCCN1CCC 2230a_102495339903_100000210303 [0,1,0,1,0,0|2,0,0]=4 10740 B12R1.169 CCCC1COCCN1CCC 269982a_102495339903_100000210303 [0,1,0,1,0,0|2,0,0]=4 10741 B12R1.169 CCCC1COCCN1CCC 34a_102495339903_100000210303 [0,1,0,1,0,0|2,0,0]=4 10742 B12R1.169 CCCC1COCCN1CCF 2230a_102495339903_100011217306 [0,1,0,1,0,0|2,0,0]=4 10743 B12R1.169 CCCC1COCCN1CCF 269982a_102495339903_100011217306 [0,1,0,1,0,0|2,0,0]=4 10744 B12R1.169 CCCC1COCCN1CCF 34a_102495339903_100011217306 [0,1,0,1,0,0|2,0,0]=4 10745 B12R1.169 CCCC1COCCN1CCO 2230a_102495339903_100000211926 [0,1,0,1,0,0|2,0,0]=4 10746 B12R1.169 CCCC1COCCN1CCO 269982a_102495339903_100000211926 [0,1,0,1,0,0|2,0,0]=4 10747 B12R1.169 CCCC1COCCN1CCO 34a_102495339903_100000211926 [0,1,0,1,0,0|2,0,0]=4 10748 B12R1.169 CCCC1COCCN1COC 2230a_102495339903_100000766300 [0,1,0,1,0,0|2,0,0]=4 10749 B12R1.169 CCCC1COCCN1COC 269982a_102495339903_100000766300 [0,1,0,1,0,0|2,0,0]=4 10750 B12R1.169 CCCC1COCCN1CSC 2230a_102495339903_100011218213 [0,1,0,1,0,0|2,0,0]=4 10751 B12R1.169 CCCC1COCCN1CSC 269982a_102495339903_100011218213 [0,1,0,1,0,0|2,0,0]=4 10752 B12R1.169 CCCC1COCCN1CSC 34a_102495339903_100011218213 [0,1,0,1,0,0|2,0,0]=4 10753 B12R1.169 CCNC1CCCCC1OCC 270004a_100015525214_200000031474 [0,1,0,1,0,0|2,0,0]=4 10754 B12R1.267 CCCCCN1CCOC[C@@H]1C 2230a_100009815349_100000210326 [0,1,0,1,0,0|2,0,0]=4 10755 B12R1.267 CCCCCN1CCOC[C@@H]1C 269982a_100009815349_100000210215 [0,1,0,1,0,0|2,0,0]=4 10756 B12R1.267 CCCCCN1CCOC[C@@H]1C 34a_100009815349_100000718602 [0,1,0,1,0,0|2,0,0]=4 10757 B12R1.267 CCOCCC1CCCCN1C 34a_100121572206_100000211948 [0,1,0,1,0,0|2,0,0]=4 10758 B12R1.267 CCOCCN1CCCCC1C 2230a_100000211376_100011215890 [0,1,0,1,0,0|2,0,0]=4 10759 B12R1.267 CCOCCN1CCCCC1C 269982a_100000211376_100011215890 [0,1,0,1,0,0|2,0,0]=4 10760 B12R1.267 CCOCCN1CCCCC1C 34a_100000211376_100000210147 [0,1,0,1,0,0|2,0,0]=4 10761 B12R1.267 CCOCCN1CCCCC1C 34a_100011305533_100000210202 [0,1,0,1,0,0|2,0,0]=4 10762 B12R1.267 CCOCCN1CCOC[C@@H]1C 2230a_100009815349_100011215890 [0,1,0,1,0,0|1,0,0]=3 10763 B12R1.267 CCOCCN1CCOC[C@@H]1C 269982a_100009815349_100011215890 [0,1,0,1,0,0|1,0,0]=3 10764 B12R1.267 CCOCCN1CCOC[C@@H]1C 34a_100009815349_100000210147 [0,1,0,1,0,0|1,0,0]=3 10765 B12R1.267 CCSCCN1CCOC[C@@H]1C 2230a_100009815349_100000757381 [0,1,0,1,0,0|1,1,0]=4 10766 B12R1.267 CCSCCN1CCOC[C@@H]1C 269982a_100009815349_100000757381 [0,1,0,1,0,0|1,1,0]=4 10767 B12R1.267 CCSCCN1CCOC[C@@H]1C 34a_100009815349_100000757381 [0,1,0,1,0,0|1,1,0]=4 10768 B12R1.271 C#CCOCCOCC1CC1C 34a_100000744939_100010402529 [0,1,0,1,0,0|1,0,1]=4 10769 B12R1.271 C#CCOCCOCC1CC1C 7a_100000744939_100010402529 [0,1,0,1,0,0|1,0,1]=4 10770 B12R1.271 CC/C=C\CCOCC1CC1C 34a_100000744939_100015370543 [0,1,0,1,0,0|2,0,0]=4 10771 B12R1.271 CC/C=C\CCOCC1CC1C 7a_100000744939_100015370543 [0,1,0,1,0,0|2,0,0]=4 10772 B12R1.271 CC1CC1COCCCCCF 34a_100000744939_100000729378 [0,1,0,1,0,0|2,0,0]=4 10773 B12R1.271 CC1CC1COCCCCCF 7a_100000744939_100000729378 [0,1,0,1,0,0|2,0,0]=4 10774 B12R1.271 CC1CC1COCCCCCO 34a_100000744939_100000746330 [0,1,0,1,0,0|2,0,0]=4 10775 B12R1.271 CC1CC1COCCCCCO 7a_100000744939_100000746330 [0,1,0,1,0,0|2,0,0]=4 10776 B12R1.271 CC1CC1COCCOCC#N 7a_100000744939_200000047693 [0,1,0,1,0,0|1,0,1]=4 10777 B12R1.271 CC1CC1COCCOCCO 34a_100000744939_100000692535 [0,1,0,1,0,0|1,0,0]=3 10778 B12R1.271 CC1CC1COCCOCCO 7a_100000744939_100011215305 [0,1,0,1,0,0|1,0,0]=3 10779 B12R1.271 CCCCCCOCC1CC1C 34a_100000744939_100000210314 [0,1,0,1,0,0|2,0,0]=4 10780 B12R1.271 CCCCCCOCC1CC1C 7a_100000744939_100000210314 [0,1,0,1,0,0|2,0,0]=4 10781 B12R1.271 CCCCOCOCC1CC1C 34a_100000744939_100011995733 [0,1,0,1,0,0|2,0,0]=4 10782 B12R1.271 CCCOCCOCC1CC1C 34a_100000744939_100011215938 [0,1,0,1,0,0|1,0,0]=3 10783 B12R1.271 CCCOCCOCC1CC1C 7a_100000744939_100011215938 [0,1,0,1,0,0|1,0,0]=3 10784 B12R1.271 CCOCCCOCC1CC1C 34a_100000744939_100012232248 [0,1,0,1,0,0|1,0,0]=3 10785 B12R1.271 CCOCCCOCC1CC1C 7a_100000744939_100012232248 [0,1,0,1,0,0|1,0,0]=3 10786 B12R1.271 COCCCCOCC1CC1C 34a_100000744939_100000755781 [0,1,0,1,0,0|2,0,0]=4 10787 B12R1.271 COCCCCOCC1CC1C 7a_100000744939_100000730899 [0,1,0,1,0,0|2,0,0]=4 10788 B12R1.272 BrCCCCCOCC1CCC1 34a_100000746331_100000763275 [0,1,0,1,0,0|2,0,0]=4 10789 B12R1.272 BrCCCCCOCC1CCC1 7a_100000746331_100000763275 [0,1,0,1,0,0|2,0,0]=4 10790 B12R1.272 BrCCCCCOCC1CCO1 34a_100000746331_100000103362 [0,1,0,1,0,0|1,0,0]=3 10791 B12R1.272 BrCCCCCOCC1CCO1 7a_100000746331_100000103362 [0,1,0,1,0,0|1,0,0]=3 10792 B12R1.272 BrCCOCCOCC1CCC1 34a_100000692535_100000763275 [0,1,0,1,0,0|1,0,0]=3 10793 B12R1.272 BrCCOCCOCC1CCC1 7a_100000692535_100000763275 [0,1,0,1,0,0|1,0,0]=3 10794 B12R1.272 BrCCOCCOCC1CCO1 34a_100000692535_100000103362 [0,1,0,1,0,0|0,0,0]=2 10795 B12R1.272 BrCCOCCOCC1CCO1 7a_100000692535_100000103362 [0,1,0,1,0,0|0,0,0]=2 10796 B12R1.272 BrCCOCCOCC1COC1 34a_100000692535_100010264016 [0,1,0,1,0,0|2,0,0]=4 10797 B12R1.272 BrCCOCCOCC1COC1 7a_100000692535_100010264016 [0,1,0,1,0,0|2,0,0]=4 10798 B12R1.272 C#CCCCCOCC1CCO1 34a_100000039022_100010269958 [0,1,0,1,0,0|1,0,1]=4 10799 B12R1.272 C#CCCCCOCC1CCO1 34a_100000766709_100000103362 [0,1,0,1,0,0|1,0,1]=4 10800 B12R1.272 C#CCCCCOCC1CCO1 7a_100000766709_100000103362 [0,1,0,1,0,0|1,0,1]=4 10801 B12R1.272 C#CCOCCNCC1CCO1 2230a_100000700922_100000103362 [0,1,0,1,0,0|1,0,1]=4 10802 B12R1.272 C#CCOCCNCC1CCO1 34a_100000700922_100000103362 [0,1,0,1,0,0|1,0,1]=4 10803 B12R1.272 C#CCOCCNC[C@@H]1CCO1 2230a_100020831831_100010402529 [0,1,0,1,0,0|1,0,1]=4 10804 B12R1.272 C#CCOCCNC[C@@H]1CCO1 34a_100020831831_100010402529 [0,1,0,1,0,0|1,0,1]=4 10805 B12R1.272 C#CCOCCOCC1CCC1 34a_100000054580_100000763275 [0,1,0,1,0,0|1,0,1]=4 10806 B12R1.272 C#CCOCCOCC1CCC1 34a_100000760304_100010402529 [0,1,0,1,0,0|1,0,1]=4 10807 B12R1.272 C#CCOCCOCC1CCC1 7a_100000054580_100000763275 [0,1,0,1,0,0|1,0,1]=4 10808 B12R1.272 C#CCOCCOCC1CCO1 34a_100000039022_100010402529 [0,1,0,1,0,0|0,0,1]=3 10809 B12R1.272 C#CCOCCOCC1CCO1 34a_100000054580_100000103362 [0,1,0,1,0,0|0,0,1]=3 10810 B12R1.272 C#CCOCCOCC1CCO1 7a_100000054580_100000103362 [0,1,0,1,0,0|0,0,1]=3 10811 B12R1.272 C#CCOCCSCC1CCO1 62a_100000103362_100010402529 [0,1,0,1,0,0|0,1,1]=4 10812 B12R1.272 C#CCOCCSCC1CCO1 62a_100010402529_100000103362 [0,1,0,1,0,0|0,1,1]=4 10813 B12R1.272 C=CCCCCOCC1CCO1 34a_100000039022_100011215482 [0,1,0,1,0,0|1,0,1]=4 10814 B12R1.272 C=CCCCCOCC1CCO1 34a_100000766645_100000103362 [0,1,0,1,0,0|1,0,1]=4 10815 B12R1.272 C=CCCCCOCC1CCO1 7a_100000766645_100000103362 [0,1,0,1,0,0|1,0,1]=4 10816 B12R1.272 C=CCOCCOCC1CCC1 34a_100000037705_100000763275 [0,1,0,1,0,0|1,0,1]=4 10817 B12R1.272 C=CCOCCOCC1CCC1 7a_100000037705_100000763275 [0,1,0,1,0,0|1,0,1]=4 10818 B12R1.272 C=CCOCCOCC1CCO1 34a_100000037705_100000103362 [0,1,0,1,0,0|0,0,1]=3 10819 B12R1.272 C=CCOCCOCC1CCO1 7a_100000037705_100000103362 [0,1,0,1,0,0|0,0,1]=3 10820 B12R1.272 CC/C=C\CCNC[C@@H]1CCO1 2230a_100020831831_100015370543 [0,1,0,1,0,0|2,0,0]=4 10821 B12R1.272 CC/C=C\CCNC[C@@H]1CCO1 34a_100020831831_100015370543 [0,1,0,1,0,0|2,0,0]=4 10822 B12R1.272 CC/C=C\CCOCC1CCC1 34a_100000760304_100015370543 [0,1,0,1,0,0|2,0,0]=4 10823 B12R1.272 CC/C=C\CCOCC1CCC1 34a_100016288707_100000763275 [0,1,0,1,0,0|2,0,0]=4 10824 B12R1.272 CC/C=C\CCOCC1CCC1 7a_100016288707_100000763275 [0,1,0,1,0,0|2,0,0]=4 10825 B12R1.272 CC/C=C\CCOCC1CCO1 34a_100000039022_100015370543 [0,1,0,1,0,0|1,0,0]=3 10826 B12R1.272 CC/C=C\CCOCC1CCO1 34a_100016288707_100000103362 [0,1,0,1,0,0|1,0,0]=3 10827 B12R1.272 CC/C=C\CCOCC1CCO1 7a_100016288707_100000103362 [0,1,0,1,0,0|1,0,0]=3 10828 B12R1.272 CC/C=C\CCSCC1CCO1 62a_100000103362_100015370543 [0,1,0,1,0,0|1,1,0]=4 10829 B12R1.272 CC/C=C\CCSCC1CCO1 62a_100015370543_100000103362 [0,1,0,1,0,0|1,1,0]=4 10830 B12R1.272 CC=C=CCCOCC1CCO1 34a_100011020354_100000103362 [0,1,0,1,0,0|1,0,1]=4 10831 B12R1.272 CC=CCCCOCC1CCO1 34a_100020645299_100000103362 [0,1,0,1,0,0|1,0,1]=4 10832 B12R1.272 CCC#CCCOCC1CCC1 34a_100000036655_100000763275 [0,1,0,1,0,0|2,0,0]=4 10833 B12R1.272 CCC#CCCOCC1CCC1 7a_100000036655_100000763275 [0,1,0,1,0,0|2,0,0]=4 10834 B12R1.272 CCC#CCCOCC1CCO1 34a_100000036655_100000103362 [0,1,0,1,0,0|1,0,0]=3 10835 B12R1.272 CCC#CCCOCC1CCO1 7a_100000036655_100000103362 [0,1,0,1,0,0|1,0,0]=3 10836 B12R1.272 CCC/C=C/COCC1CCO1 34a_100016278788_100000103362 [0,1,0,1,0,0|1,0,1]=4 10837 B12R1.272 CCC/C=C/COCC1CCO1 7a_100016278788_100000103362 [0,1,0,1,0,0|1,0,1]=4 10838 B12R1.272 CCCC#CCOCC1CCO1 34a_100000034806_100000103362 [0,1,0,1,0,0|1,0,1]=4 10839 B12R1.272 CCCC#CCOCC1CCO1 7a_100000034806_100000103362 [0,1,0,1,0,0|1,0,1]=4 10840 B12R1.272 CCCCCCNCC1CCO1 2230a_100000210581_100000103362 [0,1,0,1,0,0|2,0,0]=4 10841 B12R1.272 CCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210314 [0,1,0,1,0,0|2,0,0]=4 10842 B12R1.272 CCCCCCNC[C@@H]1CCO1 34a_100020831831_100000210314 [0,1,0,1,0,0|2,0,0]=4 10843 B12R1.272 CCCCCCOCC1CCC1 34a_100000210259_100000763275 [0,1,0,1,0,0|2,0,0]=4 10844 B12R1.272 CCCCCCOCC1CCC1 34a_100000760304_100000210314 [0,1,0,1,0,0|2,0,0]=4 10845 B12R1.272 CCCCCCOCC1CCC1 7a_100000210259_100000763275 [0,1,0,1,0,0|2,0,0]=4 10846 B12R1.272 CCCCCCOCC1CCO1 34a_100000039022_100000210314 [0,1,0,1,0,0|1,0,0]=3 10847 B12R1.272 CCCCCCOCC1CCO1 34a_100000210259_100000103362 [0,1,0,1,0,0|1,0,0]=3 10848 B12R1.272 CCCCCCOCC1CCO1 7a_100000210259_100000103362 [0,1,0,1,0,0|1,0,0]=3 10849 B12R1.272 CCCCCCSCC1CCO1 62a_100000103362_100000210757 [0,1,0,1,0,0|1,1,0]=4 10850 B12R1.272 CCCCCCSCC1CCO1 62a_100000210314_100000103362 [0,1,0,1,0,0|1,1,0]=4 10851 B12R1.272 CCCCCOCCC1COC1 34a_100009855314_100000718602 [0,1,0,1,0,0|2,0,0]=4 10852 B12R1.272 CCCCOCNC[C@@H]1CCO1 2230a_100020831831_100011995733 [0,1,0,1,0,0|2,0,0]=4 10853 B12R1.272 CCCCOCNC[C@@H]1CCO1 34a_100020831831_100011995733 [0,1,0,1,0,0|2,0,0]=4 10854 B12R1.272 CCCCOCOCC1CCC1 34a_100000760304_100011995733 [0,1,0,1,0,0|2,0,0]=4 10855 B12R1.272 CCCCOCOCC1CCO1 34a_100000039022_100011995733 [0,1,0,1,0,0|1,0,0]=3 10856 B12R1.272 CCCCOCSCC1CCO1 62a_100000103362_100011995733 [0,1,0,1,0,0|1,1,0]=4 10857 B12R1.272 CCCCOCSCC1CCO1 62a_100011995733_100000103362 [0,1,0,1,0,0|1,1,0]=4 10858 B12R1.272 CCCOCCNCC1CCC1 2230a_100000738700_100011215938 [0,1,0,1,0,0|2,0,0]=4 10859 B12R1.272 CCCOCCNCC1CCC1 2230a_100161115042_100000763275 [0,1,0,1,0,0|2,0,0]=4 10860 B12R1.272 CCCOCCNCC1CCC1 269862a_100161115042_100000753134 [0,1,0,1,0,0|2,0,0]=4 10861 B12R1.272 CCCOCCNCC1CCC1 34a_100000738700_100011215938 [0,1,0,1,0,0|2,0,0]=4 10862 B12R1.272 CCCOCCNCC1CCC1 34a_100161115042_100000763275 [0,1,0,1,0,0|2,0,0]=4 10863 B12R1.272 CCCOCCNCC1CCO1 2230a_100161115042_100000103362 [0,1,0,1,0,0|1,0,0]=3 10864 B12R1.272 CCCOCCNCC1CCO1 34a_100161115042_100000103362 [0,1,0,1,0,0|1,0,0]=3 10865 B12R1.272 CCCOCCNC[C@@H]1CCO1 2230a_100020831831_100011215938 [0,1,0,1,0,0|1,0,0]=3 10866 B12R1.272 CCCOCCNC[C@@H]1CCO1 34a_100020831831_100011215938 [0,1,0,1,0,0|1,0,0]=3 10867 B12R1.272 CCCOCCOCC1CCC1 34a_100000752267_100000763275 [0,1,0,1,0,0|1,0,0]=3 10868 B12R1.272 CCCOCCOCC1CCC1 34a_100000760304_100011215938 [0,1,0,1,0,0|1,0,0]=3 10869 B12R1.272 CCCOCCOCC1CCC1 7a_100000752267_100000763275 [0,1,0,1,0,0|1,0,0]=3 10870 B12R1.272 CCCOCCOCC1CCO1 34a_100000039022_100011215938 [0,1,0,1,0,0|0,0,0]=2 10871 B12R1.272 CCCOCCOCC1CCO1 34a_100000752267_100000103362 [0,1,0,1,0,0|0,0,0]=2 10872 B12R1.272 CCCOCCOCC1CCO1 7a_100000752267_100000103362 [0,1,0,1,0,0|0,0,0]=2 10873 B12R1.272 CCCOCCOCC1CNC1 34a_100016987283_100011215938 [0,1,0,1,0,0|2,0,0]=4 10874 B12R1.272 CCCOCCOCC1COC1 34a_100000060846_100011215938 [0,1,0,1,0,0|2,0,0]=4 10875 B12R1.272 CCCOCCOCC1COC1 34a_100000752267_100010264016 [0,1,0,1,0,0|2,0,0]=4 10876 B12R1.272 CCCOCCOCC1COC1 7a_100000752267_100010264016 [0,1,0,1,0,0|2,0,0]=4 10877 B12R1.272 CCCOCCSCC1CCC1 62a_100000763275_100011215938 [0,1,0,1,0,0|1,1,0]=4 10878 B12R1.272 CCCOCCSCC1CCC1 62a_100011215938_100000763275 [0,1,0,1,0,0|1,1,0]=4 10879 B12R1.272 CCCOCCSCC1CCO1 62a_100000103362_100011215938 [0,1,0,1,0,0|0,1,0]=3 10880 B12R1.272 CCCOCCSCC1CCO1 62a_100011215938_100000103362 [0,1,0,1,0,0|0,1,0]=3 10881 B12R1.272 CCCSCCNCC1CCO1 2230a_100020603323_100000103362 [0,1,0,1,0,0|1,1,0]=4 10882 B12R1.272 CCCSCCOCC1CCC1 34a_200000230433_100000763275 [0,1,0,1,0,0|1,1,0]=4 10883 B12R1.272 CCCSCCOCC1CCC1 7a_200000230433_100000763275 [0,1,0,1,0,0|1,1,0]=4 10884 B12R1.272 CCCSCCOCC1CCO1 34a_200000230433_100000103362 [0,1,0,1,0,0|0,1,0]=3 10885 B12R1.272 CCCSCCOCC1CCO1 7a_200000230433_100000103362 [0,1,0,1,0,0|0,1,0]=3 10886 B12R1.272 CCOCCCNCC1CCC1 2230a_100000210961_100000763275 [0,1,0,1,0,0|2,0,0]=4 10887 B12R1.272 CCOCCCNCC1CCC1 2230a_100000738700_100012232248 [0,1,0,1,0,0|2,0,0]=4 10888 B12R1.272 CCOCCCNCC1CCC1 269862a_100000210961_100000753134 [0,1,0,1,0,0|2,0,0]=4 10889 B12R1.272 CCOCCCNCC1CCC1 34a_100000210961_100000763275 [0,1,0,1,0,0|2,0,0]=4 10890 B12R1.272 CCOCCCNCC1CCC1 34a_100000738700_100012232248 [0,1,0,1,0,0|2,0,0]=4 10891 B12R1.272 CCOCCCNCC1CCO1 2230a_100000210961_100000103362 [0,1,0,1,0,0|1,0,0]=3 10892 B12R1.272 CCOCCCNCC1CCO1 34a_100000210961_100000103362 [0,1,0,1,0,0|1,0,0]=3 10893 B12R1.272 CCOCCCNC[C@@H]1CCO1 2230a_100020831831_100012232248 [0,1,0,1,0,0|1,0,0]=3 10894 B12R1.272 CCOCCCNC[C@@H]1CCO1 34a_100020831831_100012232248 [0,1,0,1,0,0|1,0,0]=3 10895 B12R1.272 CCOCCCOCC1CCC1 34a_100000757476_100000763275 [0,1,0,1,0,0|1,0,0]=3 10896 B12R1.272 CCOCCCOCC1CCC1 34a_100000760304_100012232248 [0,1,0,1,0,0|1,0,0]=3 10897 B12R1.272 CCOCCCOCC1CCC1 7a_100000757476_100000763275 [0,1,0,1,0,0|1,0,0]=3 10898 B12R1.272 CCOCCCOCC1CCO1 34a_100000039022_100012232248 [0,1,0,1,0,0|0,0,0]=2 10899 B12R1.272 CCOCCCOCC1CCO1 34a_100000757476_100000103362 [0,1,0,1,0,0|0,0,0]=2 10900 B12R1.272 CCOCCCOCC1CCO1 7a_100000757476_100000103362 [0,1,0,1,0,0|0,0,0]=2 10901 B12R1.272 CCOCCCOCC1CNC1 34a_100016987283_100012232248 [0,1,0,1,0,0|2,0,0]=4 10902 B12R1.272 CCOCCCOCC1COC1 34a_100000060846_100012232248 [0,1,0,1,0,0|2,0,0]=4 10903 B12R1.272 CCOCCCOCC1COC1 34a_100000757476_100010264016 [0,1,0,1,0,0|2,0,0]=4 10904 B12R1.272 CCOCCCOCC1COC1 7a_100000757476_100010264016 [0,1,0,1,0,0|2,0,0]=4 10905 B12R1.272 CCOCCCSCC1CCC1 62a_100000763275_100012232248 [0,1,0,1,0,0|1,1,0]=4 10906 B12R1.272 CCOCCCSCC1CCC1 62a_100012232248_100000763275 [0,1,0,1,0,0|1,1,0]=4 10907 B12R1.272 CCOCCCSCC1CCO1 62a_100000103362_100012232248 [0,1,0,1,0,0|0,1,0]=3 10908 B12R1.272 CCOCCCSCC1CCO1 62a_100012232248_100000103362 [0,1,0,1,0,0|0,1,0]=3 10909 B12R1.272 CCOCCOCCC1COC1 34a_100009855314_100000210147 [0,1,0,1,0,0|1,0,0]=3 10910 B12R1.272 CCOCCOCCN1CCC1 269982a_100000754969_100011211534 [0,1,0,1,0,0|1,0,0]=3 10911 B12R1.272 CCSCCCOCC1CCC1 34a_100011216438_100000763275 [0,1,0,1,0,0|1,1,0]=4 10912 B12R1.272 CCSCCCOCC1CCC1 7a_100011216438_100000763275 [0,1,0,1,0,0|1,1,0]=4 10913 B12R1.272 CCSCCCOCC1CCO1 34a_100011216438_100000103362 [0,1,0,1,0,0|0,1,0]=3 10914 B12R1.272 CCSCCCOCC1CCO1 7a_100011216438_100000103362 [0,1,0,1,0,0|0,1,0]=3 10915 B12R1.272 CCSCCOCCC1COC1 34a_100009855314_100000757381 [0,1,0,1,0,0|1,1,0]=4 10916 B12R1.272 COCCCCNC[C@@H]1CCO1 2230a_100020831831_100000730899 [0,1,0,1,0,0|2,0,0]=4 10917 B12R1.272 COCCCCNC[C@@H]1CCO1 34a_100020831831_100000755781 [0,1,0,1,0,0|2,0,0]=4 10918 B12R1.272 COCCCCOCC1CCC1 34a_100000740925_100000763275 [0,1,0,1,0,0|2,0,0]=4 10919 B12R1.272 COCCCCOCC1CCC1 34a_100000760304_100000755781 [0,1,0,1,0,0|2,0,0]=4 10920 B12R1.272 COCCCCOCC1CCO1 34a_100000039022_100000755781 [0,1,0,1,0,0|1,0,0]=3 10921 B12R1.272 COCCCCOCC1CCO1 34a_100000740925_100000103362 [0,1,0,1,0,0|1,0,0]=3 10922 B12R1.272 COCCCCSCC1CCO1 62a_100000103362_100000730899 [0,1,0,1,0,0|1,1,0]=4 10923 B12R1.272 COCCCCSCC1CCO1 62a_100000730899_100000103362 [0,1,0,1,0,0|1,1,0]=4 10924 B12R1.272 CSCCCCOCC1CCC1 34a_100011217163_100000763275 [0,1,0,1,0,0|2,0,0]=4 10925 B12R1.272 CSCCCCOCC1CCC1 7a_100011217163_100000763275 [0,1,0,1,0,0|2,0,0]=4 10926 B12R1.272 CSCCCCOCC1CCO1 34a_100011217163_100000103362 [0,1,0,1,0,0|1,0,0]=3 10927 B12R1.272 CSCCCCOCC1CCO1 7a_100011217163_100000103362 [0,1,0,1,0,0|1,0,0]=3 10928 B12R1.272 ClCCCCCOCC1CCC1 34a_100000746330_100000763275 [0,1,0,1,0,0|2,0,0]=4 10929 B12R1.272 ClCCCCCOCC1CCC1 7a_100000746330_100000763275 [0,1,0,1,0,0|2,0,0]=4 10930 B12R1.272 ClCCCCCOCC1CCO1 34a_100000746330_100000103362 [0,1,0,1,0,0|1,0,0]=3 10931 B12R1.272 ClCCCCCOCC1CCO1 7a_100000746330_100000103362 [0,1,0,1,0,0|1,0,0]=3 10932 B12R1.272 ClCCOCCOCC1CCC1 34a_100011215305_100000763275 [0,1,0,1,0,0|1,0,0]=3 10933 B12R1.272 ClCCOCCOCC1CCC1 7a_100011215305_100000763275 [0,1,0,1,0,0|1,0,0]=3 10934 B12R1.272 ClCCOCCOCC1CCO1 34a_100011215305_100000103362 [0,1,0,1,0,0|0,0,0]=2 10935 B12R1.272 ClCCOCCOCC1CCO1 7a_100011215305_100000103362 [0,1,0,1,0,0|0,0,0]=2 10936 B12R1.272 ClCCOCCOCC1COC1 34a_100011215305_100010264016 [0,1,0,1,0,0|2,0,0]=4 10937 B12R1.272 ClCCOCCOCC1COC1 7a_100011215305_100010264016 [0,1,0,1,0,0|2,0,0]=4 10938 B12R1.272 FCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000729378 [0,1,0,1,0,0|2,0,0]=4 10939 B12R1.272 FCCCCCNC[C@@H]1CCO1 34a_100020831831_100000729378 [0,1,0,1,0,0|2,0,0]=4 10940 B12R1.272 FCCCCCOCC1CCC1 34a_100000760304_100000729378 [0,1,0,1,0,0|2,0,0]=4 10941 B12R1.272 FCCCCCOCC1CCO1 34a_100000039022_100000729378 [0,1,0,1,0,0|1,0,0]=3 10942 B12R1.272 FCCCCCSCC1CCO1 62a_100000103362_100000729378 [0,1,0,1,0,0|1,1,0]=4 10943 B12R1.272 FCCCCCSCC1CCO1 62a_100000729378_100000103362 [0,1,0,1,0,0|1,1,0]=4 10944 B12R1.272 FCCOCCOCC1CCC1 34a_200015357709_100000763275 [0,1,0,1,0,0|1,0,0]=3 10945 B12R1.272 FCCOCCOCC1CCC1 7a_200015357709_100000763275 [0,1,0,1,0,0|1,0,0]=3 10946 B12R1.272 FCCOCCOCC1CCO1 34a_200015357709_100000103362 [0,1,0,1,0,0|0,0,0]=2 10947 B12R1.272 FCCOCCOCC1CCO1 7a_200015357709_100000103362 [0,1,0,1,0,0|0,0,0]=2 10948 B12R1.272 FCCOCCOCC1COC1 34a_200015357709_100010264016 [0,1,0,1,0,0|2,0,0]=4 10949 B12R1.272 FCCOCCOCC1COC1 7a_200015357709_100010264016 [0,1,0,1,0,0|2,0,0]=4 10950 B12R1.272 ICCCCCOCC1CCC1 34a_200012148887_100000763275 [0,1,0,1,0,0|2,0,0]=4 10951 B12R1.272 ICCCCCOCC1CCC1 7a_200012148887_100000763275 [0,1,0,1,0,0|2,0,0]=4 10952 B12R1.272 ICCCCCOCC1CCO1 34a_200012148887_100000103362 [0,1,0,1,0,0|1,0,0]=3 10953 B12R1.272 ICCCCCOCC1CCO1 7a_200012148887_100000103362 [0,1,0,1,0,0|1,0,0]=3 10954 B12R1.272 ICCOCCOCC1CCC1 34a_100012149058_100000763275 [0,1,0,1,0,0|1,0,0]=3 10955 B12R1.272 ICCOCCOCC1CCC1 7a_100012149058_100000763275 [0,1,0,1,0,0|1,0,0]=3 10956 B12R1.272 ICCOCCOCC1CCO1 34a_100012149058_100000103362 [0,1,0,1,0,0|0,0,0]=2 10957 B12R1.272 ICCOCCOCC1CCO1 7a_100012149058_100000103362 [0,1,0,1,0,0|0,0,0]=2 10958 B12R1.272 ICCOCCOCC1COC1 34a_100012149058_100010264016 [0,1,0,1,0,0|2,0,0]=4 10959 B12R1.272 ICCOCCOCC1COC1 7a_100012149058_100010264016 [0,1,0,1,0,0|2,0,0]=4 10960 B12R1.272 N#CCOCCNC[C@@H]1CCO1 2230a_100020831831_200000047693 [0,1,0,1,0,0|1,0,1]=4 10961 B12R1.272 N#CCOCCSCC1CCO1 62a_100000103362_200000047693 [0,1,0,1,0,0|0,1,1]=4 10962 B12R1.272 N#CCOCCSCC1CCO1 62a_200000047693_100000103362 [0,1,0,1,0,0|0,1,1]=4 10963 B12R1.272 NCCCCCOCC1CCC1 34a_100000762737_100000763275 [0,1,0,1,0,0|2,0,0]=4 10964 B12R1.272 NCCCCCOCC1CCO1 34a_100000762737_100000103362 [0,1,0,1,0,0|1,0,0]=3 10965 B12R1.272 NCCOCCOCC1CCC1 34a_100000211614_100000763275 [0,1,0,1,0,0|1,0,0]=3 10966 B12R1.272 NCCOCCOCC1CCO1 34a_100000211614_100000103362 [0,1,0,1,0,0|0,0,0]=2 10967 B12R1.272 NCCOCCOCC1COC1 34a_100000211614_100010264016 [0,1,0,1,0,0|2,0,0]=4 10968 B12R1.272 OCCCCCNCC1CCO1 2230a_100000762737_100000103362 [0,1,0,1,0,0|2,0,0]=4 10969 B12R1.272 OCCCCCNCC1CCO1 34a_100000762737_100000103362 [0,1,0,1,0,0|2,0,0]=4 10970 B12R1.272 OCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000746330 [0,1,0,1,0,0|2,0,0]=4 10971 B12R1.272 OCCCCCNC[C@@H]1CCO1 34a_100020831831_100000746330 [0,1,0,1,0,0|2,0,0]=4 10972 B12R1.272 OCCCCCOCC1CCC1 34a_100000760304_100000746330 [0,1,0,1,0,0|2,0,0]=4 10973 B12R1.272 OCCCCCOCC1CCO1 34a_100000039022_100000746330 [0,1,0,1,0,0|1,0,0]=3 10974 B12R1.272 OCCCCCSCC1CCO1 62a_100000103362_100000746330 [0,1,0,1,0,0|1,1,0]=4 10975 B12R1.272 OCCCCCSCC1CCO1 62a_100000746330_100000103362 [0,1,0,1,0,0|1,1,0]=4 10976 B12R1.272 OCCOCCNCC1CCC1 2230a_100000211614_100000763275 [0,1,0,1,0,0|2,0,0]=4 10977 B12R1.272 OCCOCCNCC1CCC1 2230a_100000738700_100011215305 [0,1,0,1,0,0|2,0,0]=4 10978 B12R1.272 OCCOCCNCC1CCC1 269862a_100000211614_100000753134 [0,1,0,1,0,0|2,0,0]=4 10979 B12R1.272 OCCOCCNCC1CCC1 34a_100000211614_100000763275 [0,1,0,1,0,0|2,0,0]=4 10980 B12R1.272 OCCOCCNCC1CCC1 34a_100000738700_100000692535 [0,1,0,1,0,0|2,0,0]=4 10981 B12R1.272 OCCOCCNCC1CCO1 2230a_100000211614_100000103362 [0,1,0,1,0,0|1,0,0]=3 10982 B12R1.272 OCCOCCNCC1CCO1 34a_100000211614_100000103362 [0,1,0,1,0,0|1,0,0]=3 10983 B12R1.272 OCCOCCNC[C@@H]1CCO1 2230a_100020831831_100011215305 [0,1,0,1,0,0|1,0,0]=3 10984 B12R1.272 OCCOCCNC[C@@H]1CCO1 34a_100020831831_100000692535 [0,1,0,1,0,0|1,0,0]=3 10985 B12R1.272 OCCOCCOCC1CCC1 34a_100000760304_100000692535 [0,1,0,1,0,0|1,0,0]=3 10986 B12R1.272 OCCOCCOCC1CCO1 34a_100000039022_100000692535 [0,1,0,1,0,0|0,0,0]=2 10987 B12R1.272 OCCOCCOCC1CNC1 34a_100016987283_100000692535 [0,1,0,1,0,0|2,0,0]=4 10988 B12R1.272 OCCOCCOCC1COC1 34a_100000060846_100000692535 [0,1,0,1,0,0|2,0,0]=4 10989 B12R1.272 OCCOCCSCC1CCC1 62a_100000763275_100011215305 [0,1,0,1,0,0|1,1,0]=4 10990 B12R1.272 OCCOCCSCC1CCC1 62a_100011215305_100000763275 [0,1,0,1,0,0|1,1,0]=4 10991 B12R1.272 OCCOCCSCC1CCO1 62a_100000103362_100011215305 [0,1,0,1,0,0|0,1,0]=3 10992 B12R1.272 OCCOCCSCC1CCO1 62a_100011215305_100000103362 [0,1,0,1,0,0|0,1,0]=3 10993 B12R1.272 OCCSCCNCC1CCO1 2230a_100011219999_100000103362 [0,1,0,1,0,0|1,1,0]=4 10994 B12R1.320 CCCN1CCCC1COCC 34a_200000694710_100000210202 [0,1,0,1,0,0|2,0,0]=4 10995 B12R1.320 CCCN1CCCC1COCC 7a_200000694710_100000210202 [0,1,0,1,0,0|2,0,0]=4 10996 B12R1.329 CCCOC1CCCCCCC1 34a_100000210054_100000210303 [0,1,0,1,0,0|2,0,0]=4 10997 B12R1.329 CCCOC1CCCCCCC1 7a_100000210054_100000210303 [0,1,0,1,0,0|2,0,0]=4 10998 B12R1.329 CCOCC1CCCCCCC1 34a_100011216312_100000210202 [0,1,0,1,0,0|2,0,0]=4 10999 B12R1.329 CCOCC1CCCCCCC1 7a_100011216312_100000210202 [0,1,0,1,0,0|2,0,0]=4 11000 B12R1.329 CCOCN1CCCCCCC1 269982a_100000211400_100000739092 [0,1,0,1,0,0|2,0,0]=4 11001 B12R1.329 CSCOC1CCCCCCC1 34a_100000210054_100011218213 [0,1,0,1,0,0|2,0,0]=4 11002 B12R1.329 FCCOC1CCCCCCC1 34a_100000210054_100011217306 [0,1,0,1,0,0|2,0,0]=4 11003 B12R1.329 FCCOC1CCCCCCC1 7a_100000210054_100011217306 [0,1,0,1,0,0|2,0,0]=4 11004 B12R1.329 OCCOC1CCCCCCC1 34a_100000210054_100000211926 [0,1,0,1,0,0|2,0,0]=4 11005 B12R1.329 OCCOC1CCCCCCC1 7a_100000210054_100000211926 [0,1,0,1,0,0|2,0,0]=4 11006 B12R1.372 C/C=C/CCOC1COCC1O 34a_100016278192_200000725654 [0,1,0,1,0,0|1,0,1]=4 11007 B12R1.372 C=COCCOC1COCC1O 34a_100000033082_200000725654 [0,1,0,1,0,0|0,0,2]=4 11008 B12R1.372 C=COCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000039644 [0,1,0,1,0,0|0,0,2]=4 11009 B12R1.372 CC#CCCOC1COCC1O 34a_100000750427_200000725654 [0,1,0,1,0,0|1,0,1]=4 11010 B12R1.372 CC/C=C\COC1COCC1O 34a_100016268518_200000725654 [0,1,0,1,0,0|1,0,1]=4 11011 B12R1.372 CC/C=C\CO[C@H]1COC[C@@H]1N 34a_100015191717_100103147603 [0,1,0,1,0,0|1,0,1]=4 11012 B12R1.372 CC1SCCN1CCOCCO 2230a_200011216479_100011215305 [0,1,0,1,0,0|1,1,0]=4 11013 B12R1.372 CC1SCCN1CCOCCO 269982a_200011216479_100011215305 [0,1,0,1,0,0|1,1,0]=4 11014 B12R1.372 CC1SCCN1CCOCCO 34a_200011216479_100000692535 [0,1,0,1,0,0|1,1,0]=4 11015 B12R1.372 CCC#CCOC1COCC1O 34a_100000032950_200000725654 [0,1,0,1,0,0|1,0,1]=4 11016 B12R1.372 CCC#CCO[C@H]1COC[C@@H]1N 34a_100015191717_100009813939 [0,1,0,1,0,0|1,0,1]=4 11017 B12R1.372 CCCCCNC1CCOC1C 270004a_100000209983_100000691750 [0,1,0,1,0,0|2,0,0]=4 11018 B12R1.372 CCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000210326 [0,1,0,1,0,0|2,0,0]=4 11019 B12R1.372 CCCCCOC1CCCC1C 34a_100011216460_100000718602 [0,1,0,1,0,0|2,0,0]=4 11020 B12R1.372 CCCCCOC1CCCC1C 7a_100011216460_100000210326 [0,1,0,1,0,0|2,0,0]=4 11021 B12R1.372 CCCCCOC1CCOC1=O 34a_100000210253_100000211211 [0,1,0,1,0,0|1,0,1]=4 11022 B12R1.372 CCCCCOC1CCOC1=O 7a_100000210253_100000211211 [0,1,0,1,0,0|1,0,1]=4 11023 B12R1.372 CCCCCOC1COCC1O 34a_100000210253_200000725654 [0,1,0,1,0,0|1,0,0]=3 11024 B12R1.372 CCCCCOC1COCC1O 7a_100000210253_200000725654 [0,1,0,1,0,0|1,0,0]=3 11025 B12R1.372 CCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000718602 [0,1,0,1,0,0|2,0,0]=4 11026 B12R1.372 CCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000718602 [0,1,0,1,0,0|2,0,0]=4 11027 B12R1.372 CCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000718602 [0,1,0,1,0,0|2,0,0]=4 11028 B12R1.372 CCCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000718602 [0,1,0,1,0,0|1,0,0]=3 11029 B12R1.372 CCCCCSC1COCC1O 62a_100000210326_200000725654 [0,1,0,1,0,0|1,1,0]=4 11030 B12R1.372 CCCCCSC1COCC1O 62a_200000725654_100000210326 [0,1,0,1,0,0|1,1,0]=4 11031 B12R1.372 CCCOCCN1CCC[C@@H]1C 2230a_100020605311_100011215938 [0,1,0,1,0,0|2,0,0]=4 11032 B12R1.372 CCCOCCN1CCC[C@@H]1C 269982a_100020605311_100011215938 [0,1,0,1,0,0|2,0,0]=4 11033 B12R1.372 CCCOCCN1CCC[C@H]1C 2230a_100015189458_100011215938 [0,1,0,1,0,0|2,0,0]=4 11034 B12R1.372 CCCOCCN1CCC[C@H]1C 269982a_100015189458_100011215938 [0,1,0,1,0,0|2,0,0]=4 11035 B12R1.372 CCCOCCN1CCC[C@H]1C 34a_100015189458_100011215938 [0,1,0,1,0,0|2,0,0]=4 11036 B12R1.372 CCCOCCN1CCSC1C 2230a_200011216479_100011215938 [0,1,0,1,0,0|1,1,0]=4 11037 B12R1.372 CCCOCCN1CCSC1C 269982a_200011216479_100011215938 [0,1,0,1,0,0|1,1,0]=4 11038 B12R1.372 CCCOCCN1CCSC1C 34a_200011216479_100011215938 [0,1,0,1,0,0|1,1,0]=4 11039 B12R1.372 CCOCCCN1CCC[C@@H]1C 2230a_100020605311_100012232248 [0,1,0,1,0,0|2,0,0]=4 11040 B12R1.372 CCOCCCN1CCC[C@@H]1C 269982a_100020605311_100012232248 [0,1,0,1,0,0|2,0,0]=4 11041 B12R1.372 CCOCCCN1CCC[C@H]1C 2230a_100015189458_100012232248 [0,1,0,1,0,0|2,0,0]=4 11042 B12R1.372 CCOCCCN1CCC[C@H]1C 269982a_100015189458_100012232248 [0,1,0,1,0,0|2,0,0]=4 11043 B12R1.372 CCOCCCN1CCC[C@H]1C 34a_100015189458_100012232248 [0,1,0,1,0,0|2,0,0]=4 11044 B12R1.372 CCOCCCN1CCSC1C 2230a_200011216479_100012232248 [0,1,0,1,0,0|1,1,0]=4 11045 B12R1.372 CCOCCCN1CCSC1C 269982a_200011216479_100012232248 [0,1,0,1,0,0|1,1,0]=4 11046 B12R1.372 CCOCCCN1CCSC1C 34a_200011216479_100012232248 [0,1,0,1,0,0|1,1,0]=4 11047 B12R1.372 CCOCCNC1CCCC1C 269862a_100011200944_100000752053 [0,1,0,1,0,0|2,0,0]=4 11048 B12R1.372 CCOCCNC1CCOC1=O 2230a_102516460346_100000211211 [0,1,0,1,0,0|1,0,1]=4 11049 B12R1.372 CCOCCNC1CCOC1=O 34a_102516460346_100000211211 [0,1,0,1,0,0|1,0,1]=4 11050 B12R1.372 CCOCCNC1CCOC1C 270004a_102516460346_100000691750 [0,1,0,1,0,0|1,0,0]=3 11051 B12R1.372 CCOCCNC1COCC1O 34a_102516460346_200000725654 [0,1,0,1,0,0|1,0,0]=3 11052 B12R1.372 CCOCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100011215890 [0,1,0,1,0,0|1,0,0]=3 11053 B12R1.372 CCOCCOC1CCCC1=O 34a_100000210136_100000709159 [0,1,0,1,0,0|1,0,1]=4 11054 B12R1.372 CCOCCOC1CCCC1=O 34a_200000719330_100000210147 [0,1,0,1,0,0|1,0,1]=4 11055 B12R1.372 CCOCCOC1CCCC1=O 7a_100000210136_100000211823 [0,1,0,1,0,0|1,0,1]=4 11056 B12R1.372 CCOCCOC1CCCC1C 34a_100011216460_100000210147 [0,1,0,1,0,0|1,0,0]=3 11057 B12R1.372 CCOCCOC1CCCC1C 7a_100011216460_100011215890 [0,1,0,1,0,0|1,0,0]=3 11058 B12R1.372 CCOCCOC1CCOC1=O 34a_100000210136_100000211211 [0,1,0,1,0,0|0,0,1]=3 11059 B12R1.372 CCOCCOC1CCOC1=O 7a_100000210136_100000211211 [0,1,0,1,0,0|0,0,1]=3 11060 B12R1.372 CCOCCOC1COCC1O 34a_100000210136_200000725654 [0,1,0,1,0,0|0,0,0]=2 11061 B12R1.372 CCOCCOC1COCC1O 7a_100000210136_200000725654 [0,1,0,1,0,0|0,0,0]=2 11062 B12R1.372 CCOCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210147 [0,1,0,1,0,0|1,0,0]=3 11063 B12R1.372 CCOCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210147 [0,1,0,1,0,0|1,0,0]=3 11064 B12R1.372 CCOCCO[C@H]1CCNC1=O 34a_100000688343_100000210147 [0,1,0,1,0,0|1,0,1]=4 11065 B12R1.372 CCOCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000210147 [0,1,0,1,0,0|1,0,0]=3 11066 B12R1.372 CCOCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000210147 [0,1,0,1,0,0|0,0,0]=2 11067 B12R1.372 CCOCCSC1CCOC1=O 62a_100000210147_100000211211 [0,1,0,1,0,0|0,1,1]=4 11068 B12R1.372 CCOCCSC1CCOC1=O 62a_100000211211_100011215890 [0,1,0,1,0,0|0,1,1]=4 11069 B12R1.372 CCOCCSC1COCC1O 62a_100000210147_200000725654 [0,1,0,1,0,0|0,1,0]=3 11070 B12R1.372 CCOCCSC1COCC1O 62a_200000725654_100011215890 [0,1,0,1,0,0|0,1,0]=3 11071 B12R1.372 CCOCCS[C@@H]1CCC[C@H]1O 62a_100000210147_200016002552 [0,1,0,1,0,0|1,1,0]=4 11072 B12R1.372 CCOCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011215890 [0,1,0,1,0,0|1,1,0]=4 11073 B12R1.372 CCSCCNC1CCOC1C 270004a_100000106463_100000691750 [0,1,0,1,0,0|1,1,0]=4 11074 B12R1.372 CCSCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000757381 [0,1,0,1,0,0|1,1,0]=4 11075 B12R1.372 CCSCCOC1CCCC1C 34a_100011216460_100000757381 [0,1,0,1,0,0|1,1,0]=4 11076 B12R1.372 CCSCCOC1CCCC1C 7a_100011216460_100000757381 [0,1,0,1,0,0|1,1,0]=4 11077 B12R1.372 CCSCCOC1CCOC1=O 34a_100000212035_100000211211 [0,1,0,1,0,0|0,1,1]=4 11078 B12R1.372 CCSCCOC1CCOC1=O 7a_100000212035_100000211211 [0,1,0,1,0,0|0,1,1]=4 11079 B12R1.372 CCSCCOC1COCC1O 34a_100000212035_200000725654 [0,1,0,1,0,0|0,1,0]=3 11080 B12R1.372 CCSCCOC1COCC1O 7a_100000212035_200000725654 [0,1,0,1,0,0|0,1,0]=3 11081 B12R1.372 CCSCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000757381 [0,1,0,1,0,0|1,1,0]=4 11082 B12R1.372 CCSCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000757381 [0,1,0,1,0,0|1,1,0]=4 11083 B12R1.372 CCSCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000757381 [0,1,0,1,0,0|1,1,0]=4 11084 B12R1.372 CCSCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000757381 [0,1,0,1,0,0|0,1,0]=3 11085 B12R1.372 CCSCCSC1COCC1O 62a_100000757381_200000725654 [0,1,0,1,0,0|0,2,0]=4 11086 B12R1.372 CCSCCSC1COCC1O 62a_200000725654_100000757381 [0,1,0,1,0,0|0,2,0]=4 11087 B12R1.372 CNCCCOC1COCC1O 34a_100000213112_200000725654 [0,1,0,1,0,0|2,0,0]=4 11088 B12R1.372 COCCCOC1COCC1O 34a_100000740835_200000725654 [0,1,0,1,0,0|2,0,0]=4 11089 B12R1.372 COCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000740836 [0,1,0,1,0,0|2,0,0]=4 11090 B12R1.372 CSCCCOC1COCC1O 34a_100000690336_200000725654 [0,1,0,1,0,0|2,0,0]=4 11091 B12R1.372 CSCCCOC1COCC1O 7a_100000690336_200000725654 [0,1,0,1,0,0|2,0,0]=4 11092 B12R1.372 C[C@@H]1CCCN1CCOCCO 2230a_100015189458_100011215305 [0,1,0,1,0,0|2,0,0]=4 11093 B12R1.372 C[C@@H]1CCCN1CCOCCO 269982a_100015189458_100011215305 [0,1,0,1,0,0|2,0,0]=4 11094 B12R1.372 C[C@@H]1CCCN1CCOCCO 34a_100015189458_100000692535 [0,1,0,1,0,0|2,0,0]=4 11095 B12R1.372 C[C@H]1CCCN1CCOCCO 2230a_100020605311_100011215305 [0,1,0,1,0,0|2,0,0]=4 11096 B12R1.372 C[C@H]1CCCN1CCOCCO 269982a_100020605311_100011215305 [0,1,0,1,0,0|2,0,0]=4 11097 B12R1.372 NCCCCOC1COCC1O 34a_100000750430_200000725654 [0,1,0,1,0,0|2,0,0]=4 11098 B12R1.372 N[C@H]1COC[C@@H]1OCCCCF 34a_100015191717_100000729493 [0,1,0,1,0,0|2,0,0]=4 11099 B12R1.372 N[C@H]1COC[C@@H]1OCCCCO 34a_100015191717_100011216708 [0,1,0,1,0,0|2,0,0]=4 11100 B12R1.372 OC1COCC1OCCCCBr 34a_100011216708_200000725654 [0,1,0,1,0,0|2,0,0]=4 11101 B12R1.372 OC1COCC1OCCCCCl 34a_100000210776_200000725654 [0,1,0,1,0,0|2,0,0]=4 11102 B12R1.372 OC1COCC1OCCCCCl 7a_100000210776_200000725654 [0,1,0,1,0,0|2,0,0]=4 11103 B12R1.372 OC1COCC1OCCCCF 34a_100011995726_200000725654 [0,1,0,1,0,0|2,0,0]=4 11104 B12R1.372 OC1COCC1OCCCCF 7a_100011995726_200000725654 [0,1,0,1,0,0|2,0,0]=4 11105 B12R1.372 OC1COCC1OCCCCI 34a_200012148704_200000725654 [0,1,0,1,0,0|2,0,0]=4 11106 B12R1.375 BrCCCCCOCCC1CC1 34a_100000746331_100000694398 [0,1,0,1,0,0|2,0,0]=4 11107 B12R1.375 BrCCCCCOCCC1CC1 7a_100000746331_100000764125 [0,1,0,1,0,0|2,0,0]=4 11108 B12R1.375 BrCCOCCOCCC1CC1 34a_100000692535_100000694398 [0,1,0,1,0,0|1,0,0]=3 11109 B12R1.375 BrCCOCCOCCC1CC1 7a_100000692535_100000764125 [0,1,0,1,0,0|1,0,0]=3 11110 B12R1.375 BrCCOCCOCCC1CO1 34a_100000692535_100000732470 [0,1,0,1,0,0|2,0,0]=4 11111 B12R1.375 BrCCOCCOCCC1CO1 7a_100000692535_100000732470 [0,1,0,1,0,0|2,0,0]=4 11112 B12R1.375 C#CCOCCOCCC1CC1 34a_100000054580_100000694398 [0,1,0,1,0,0|1,0,1]=4 11113 B12R1.375 C#CCOCCOCCC1CC1 34a_100000754188_100010402529 [0,1,0,1,0,0|1,0,1]=4 11114 B12R1.375 C#CCOCCOCCC1CC1 7a_100000054580_100000764125 [0,1,0,1,0,0|1,0,1]=4 11115 B12R1.375 C#CCOCCOCCC1CC1 7a_100000754188_100010402529 [0,1,0,1,0,0|1,0,1]=4 11116 B12R1.375 C=CCOCCOCCC1CC1 34a_100000037705_100000694398 [0,1,0,1,0,0|1,0,1]=4 11117 B12R1.375 C=CCOCCOCCC1CC1 7a_100000037705_100000764125 [0,1,0,1,0,0|1,0,1]=4 11118 B12R1.375 C=COCCOCCOC1CC1 34a_100000039918_100000211595 [0,1,0,1,0,0|0,0,2]=4 11119 B12R1.375 CC/C=C\CCOCCC1CC1 34a_100000754188_100015370543 [0,1,0,1,0,0|2,0,0]=4 11120 B12R1.375 CC/C=C\CCOCCC1CC1 34a_100016288707_100000694398 [0,1,0,1,0,0|2,0,0]=4 11121 B12R1.375 CC/C=C\CCOCCC1CC1 7a_100000754188_100015370543 [0,1,0,1,0,0|2,0,0]=4 11122 B12R1.375 CC/C=C\CCOCCC1CC1 7a_100016288707_100000764125 [0,1,0,1,0,0|2,0,0]=4 11123 B12R1.375 CCC#CCCOCCC1CC1 34a_100000036655_100000694398 [0,1,0,1,0,0|2,0,0]=4 11124 B12R1.375 CCC#CCCOCCC1CC1 7a_100000036655_100000764125 [0,1,0,1,0,0|2,0,0]=4 11125 B12R1.375 CCCCCCCCOC1CC1 34a_100000210232_100000211595 [0,1,0,1,0,0|2,0,0]=4 11126 B12R1.375 CCCCCCOCCC1CC1 34a_100000210259_100000694398 [0,1,0,1,0,0|2,0,0]=4 11127 B12R1.375 CCCCCCOCCC1CC1 34a_100000754188_100000210314 [0,1,0,1,0,0|2,0,0]=4 11128 B12R1.375 CCCCCCOCCC1CC1 7a_100000210259_100000764125 [0,1,0,1,0,0|2,0,0]=4 11129 B12R1.375 CCCCCCOCCC1CC1 7a_100000754188_100000210314 [0,1,0,1,0,0|2,0,0]=4 11130 B12R1.375 CCCCCNCCOC1CC1 34a_100000224656_100000211595 [0,1,0,1,0,0|2,0,0]=4 11131 B12R1.375 CCCCCOCCCC1CO1 34a_100000210253_100000733510 [0,1,0,1,0,0|2,0,0]=4 11132 B12R1.375 CCCCCOCCCC1CO1 7a_100000210253_100000733510 [0,1,0,1,0,0|2,0,0]=4 11133 B12R1.375 CCCCCOCCNC1CC1 34a_100000738766_100000718602 [0,1,0,1,0,0|2,0,0]=4 11134 B12R1.375 CCCCCOCCOC1CC1 34a_100011215259_100000211595 [0,1,0,1,0,0|1,0,0]=3 11135 B12R1.375 CCCCOCOCCC1CC1 34a_100000754188_100011995733 [0,1,0,1,0,0|2,0,0]=4 11136 B12R1.375 CCCOCCNCCC1CC1 2230a_100161115042_100000694398 [0,1,0,1,0,0|2,0,0]=4 11137 B12R1.375 CCCOCCNCCC1CC1 34a_100000764129_100011215938 [0,1,0,1,0,0|2,0,0]=4 11138 B12R1.375 CCCOCCNCCC1CC1 34a_100161115042_100000694398 [0,1,0,1,0,0|2,0,0]=4 11139 B12R1.375 CCCOCCOCCC1CC1 34a_100000752267_100000694398 [0,1,0,1,0,0|1,0,0]=3 11140 B12R1.375 CCCOCCOCCC1CC1 34a_100000754188_100011215938 [0,1,0,1,0,0|1,0,0]=3 11141 B12R1.375 CCCOCCOCCC1CC1 7a_100000752267_100000764125 [0,1,0,1,0,0|1,0,0]=3 11142 B12R1.375 CCCOCCOCCC1CC1 7a_100000754188_100011215938 [0,1,0,1,0,0|1,0,0]=3 11143 B12R1.375 CCCOCCOCCC1CO1 34a_100000752267_100000732470 [0,1,0,1,0,0|2,0,0]=4 11144 B12R1.375 CCCOCCOCCC1CO1 7a_100000752267_100000732470 [0,1,0,1,0,0|2,0,0]=4 11145 B12R1.375 CCCOCCOCC[C@@H]1CO1 34a_100009820653_100011215938 [0,1,0,1,0,0|2,0,0]=4 11146 B12R1.375 CCCOCCSCCC1CC1 62a_100000764125_100011215938 [0,1,0,1,0,0|1,1,0]=4 11147 B12R1.375 CCCOCCSCCC1CC1 62a_100011215938_100000764125 [0,1,0,1,0,0|1,1,0]=4 11148 B12R1.375 CCCSCCOCCC1CC1 34a_200000230433_100000694398 [0,1,0,1,0,0|1,1,0]=4 11149 B12R1.375 CCCSCCOCCC1CC1 7a_200000230433_100000764125 [0,1,0,1,0,0|1,1,0]=4 11150 B12R1.375 CCOCCCNCCC1CC1 2230a_100000210961_100000694398 [0,1,0,1,0,0|2,0,0]=4 11151 B12R1.375 CCOCCCNCCC1CC1 34a_100000210961_100000694398 [0,1,0,1,0,0|2,0,0]=4 11152 B12R1.375 CCOCCCNCCC1CC1 34a_100000764129_100012232248 [0,1,0,1,0,0|2,0,0]=4 11153 B12R1.375 CCOCCCOCCC1CC1 34a_100000754188_100012232248 [0,1,0,1,0,0|1,0,0]=3 11154 B12R1.375 CCOCCCOCCC1CC1 34a_100000757476_100000694398 [0,1,0,1,0,0|1,0,0]=3 11155 B12R1.375 CCOCCCOCCC1CC1 7a_100000754188_100012232248 [0,1,0,1,0,0|1,0,0]=3 11156 B12R1.375 CCOCCCOCCC1CC1 7a_100000757476_100000764125 [0,1,0,1,0,0|1,0,0]=3 11157 B12R1.375 CCOCCCOCCC1CO1 34a_100000757476_100000732470 [0,1,0,1,0,0|2,0,0]=4 11158 B12R1.375 CCOCCCOCCC1CO1 7a_100000757476_100000732470 [0,1,0,1,0,0|2,0,0]=4 11159 B12R1.375 CCOCCCOCC[C@@H]1CO1 34a_100009820653_100012232248 [0,1,0,1,0,0|2,0,0]=4 11160 B12R1.375 CCOCCCSCCC1CC1 62a_100000764125_100012232248 [0,1,0,1,0,0|1,1,0]=4 11161 B12R1.375 CCOCCCSCCC1CC1 62a_100012232248_100000764125 [0,1,0,1,0,0|1,1,0]=4 11162 B12R1.375 CCOCCNCCCC1CO1 2230a_102516460346_100000733510 [0,1,0,1,0,0|2,0,0]=4 11163 B12R1.375 CCOCCNCCCC1CO1 34a_102516460346_100000733510 [0,1,0,1,0,0|2,0,0]=4 11164 B12R1.375 CCOCCOCC#CC1CC1 34a_100000083941_100000210147 [0,1,0,1,0,0|1,0,1]=4 11165 B12R1.375 CCOCCOCC#CC1CC1 34a_100000210136_100009895102 [0,1,0,1,0,0|1,0,1]=4 11166 B12R1.375 CCOCCOCC#CC1CC1 7a_100000083941_100011215890 [0,1,0,1,0,0|1,0,1]=4 11167 B12R1.375 CCOCCOCC#CC1CC1 7a_100000210136_100009895102 [0,1,0,1,0,0|1,0,1]=4 11168 B12R1.375 CCOCCOCCCC1CO1 34a_100000210136_100000733510 [0,1,0,1,0,0|1,0,0]=3 11169 B12R1.375 CCOCCOCCCC1CO1 7a_100000210136_100000733510 [0,1,0,1,0,0|1,0,0]=3 11170 B12R1.375 CCOCCOCCNC1CC1 34a_100000212008_100011211534 [0,1,0,1,0,0|1,0,0]=3 11171 B12R1.375 CCOCCOCCNC1CC1 34a_100000738766_100000210147 [0,1,0,1,0,0|1,0,0]=3 11172 B12R1.375 CCOCCOCCNC1CC1 34a_100102712874_100000211595 [0,1,0,1,0,0|1,0,0]=3 11173 B12R1.375 CCOCCOCCOC1CC1 34a_100000210240_100000211595 [0,1,0,1,0,0|0,0,0]=2 11174 B12R1.375 CCOCCOCCSC1CC1 62a_100011211534_100000211595 [0,1,0,1,0,0|0,1,0]=3 11175 B12R1.375 CCOCCSCCCC1CO1 62a_100000210147_100000733510 [0,1,0,1,0,0|1,1,0]=4 11176 B12R1.375 CCOCCSCCCC1CO1 62a_100000733510_100011215890 [0,1,0,1,0,0|1,1,0]=4 11177 B12R1.375 CCSCCCOCCC1CC1 34a_100011216438_100000694398 [0,1,0,1,0,0|1,1,0]=4 11178 B12R1.375 CCSCCCOCCC1CC1 7a_100011216438_100000764125 [0,1,0,1,0,0|1,1,0]=4 11179 B12R1.375 CCSCCOCCCC1CO1 34a_100000212035_100000733510 [0,1,0,1,0,0|1,1,0]=4 11180 B12R1.375 CCSCCOCCCC1CO1 7a_100000212035_100000733510 [0,1,0,1,0,0|1,1,0]=4 11181 B12R1.375 CCSCCOCCNC1CC1 34a_100000738766_100000757381 [0,1,0,1,0,0|1,1,0]=4 11182 B12R1.375 COCCCCOCCC1CC1 34a_100000740925_100000694398 [0,1,0,1,0,0|2,0,0]=4 11183 B12R1.375 COCCCCOCCC1CC1 34a_100000754188_100000755781 [0,1,0,1,0,0|2,0,0]=4 11184 B12R1.375 COCCCCOCCC1CC1 7a_100000754188_100000730899 [0,1,0,1,0,0|2,0,0]=4 11185 B12R1.375 CSCCCCOCCC1CC1 34a_100011217163_100000694398 [0,1,0,1,0,0|2,0,0]=4 11186 B12R1.375 CSCCCCOCCC1CC1 7a_100011217163_100000764125 [0,1,0,1,0,0|2,0,0]=4 11187 B12R1.375 ClCCCCCOCCC1CC1 34a_100000746330_100000694398 [0,1,0,1,0,0|2,0,0]=4 11188 B12R1.375 ClCCCCCOCCC1CC1 7a_100000746330_100000764125 [0,1,0,1,0,0|2,0,0]=4 11189 B12R1.375 ClCCOCCOCCC1CC1 34a_100011215305_100000694398 [0,1,0,1,0,0|1,0,0]=3 11190 B12R1.375 ClCCOCCOCCC1CC1 7a_100011215305_100000764125 [0,1,0,1,0,0|1,0,0]=3 11191 B12R1.375 ClCCOCCOCCC1CO1 34a_100011215305_100000732470 [0,1,0,1,0,0|2,0,0]=4 11192 B12R1.375 ClCCOCCOCCC1CO1 7a_100011215305_100000732470 [0,1,0,1,0,0|2,0,0]=4 11193 B12R1.375 FCCCCCOCCC1CC1 34a_100000754188_100000729378 [0,1,0,1,0,0|2,0,0]=4 11194 B12R1.375 FCCCCCOCCC1CC1 7a_100000754188_100000729378 [0,1,0,1,0,0|2,0,0]=4 11195 B12R1.375 FCCOCCOCCC1CC1 34a_200015357709_100000694398 [0,1,0,1,0,0|1,0,0]=3 11196 B12R1.375 FCCOCCOCCC1CC1 7a_200015357709_100000764125 [0,1,0,1,0,0|1,0,0]=3 11197 B12R1.375 FCCOCCOCCC1CO1 34a_200015357709_100000732470 [0,1,0,1,0,0|2,0,0]=4 11198 B12R1.375 FCCOCCOCCC1CO1 7a_200015357709_100000732470 [0,1,0,1,0,0|2,0,0]=4 11199 B12R1.375 ICCCCCOCCC1CC1 34a_200012148887_100000694398 [0,1,0,1,0,0|2,0,0]=4 11200 B12R1.375 ICCCCCOCCC1CC1 7a_200012148887_100000764125 [0,1,0,1,0,0|2,0,0]=4 11201 B12R1.375 ICCOCCOCCC1CC1 34a_100012149058_100000694398 [0,1,0,1,0,0|1,0,0]=3 11202 B12R1.375 ICCOCCOCCC1CC1 7a_100012149058_100000764125 [0,1,0,1,0,0|1,0,0]=3 11203 B12R1.375 ICCOCCOCCC1CO1 34a_100012149058_100000732470 [0,1,0,1,0,0|2,0,0]=4 11204 B12R1.375 ICCOCCOCCC1CO1 7a_100012149058_100000732470 [0,1,0,1,0,0|2,0,0]=4 11205 B12R1.375 N#CCOCCOCCC1CC1 7a_100000754188_200000047693 [0,1,0,1,0,0|1,0,1]=4 11206 B12R1.375 NCCCCCOCCC1CC1 34a_100000762737_100000694398 [0,1,0,1,0,0|2,0,0]=4 11207 B12R1.375 NCCOCCOCCC1CC1 34a_100000211614_100000694398 [0,1,0,1,0,0|1,0,0]=3 11208 B12R1.375 NCCOCCOCCC1CO1 34a_100000211614_100000732470 [0,1,0,1,0,0|2,0,0]=4 11209 B12R1.375 OCCCCCOCCC1CC1 34a_100000754188_100000746330 [0,1,0,1,0,0|2,0,0]=4 11210 B12R1.375 OCCCCCOCCC1CC1 7a_100000754188_100000746330 [0,1,0,1,0,0|2,0,0]=4 11211 B12R1.375 OCCOCCNCCC1CC1 2230a_100000211614_100000694398 [0,1,0,1,0,0|2,0,0]=4 11212 B12R1.375 OCCOCCNCCC1CC1 34a_100000211614_100000694398 [0,1,0,1,0,0|2,0,0]=4 11213 B12R1.375 OCCOCCNCCC1CC1 34a_100000764129_100000692535 [0,1,0,1,0,0|2,0,0]=4 11214 B12R1.375 OCCOCCOCCC1CC1 34a_100000754188_100000692535 [0,1,0,1,0,0|1,0,0]=3 11215 B12R1.375 OCCOCCOCCC1CC1 7a_100000754188_100011215305 [0,1,0,1,0,0|1,0,0]=3 11216 B12R1.375 OCCOCCOCC[C@@H]1CO1 34a_100009820653_100000692535 [0,1,0,1,0,0|2,0,0]=4 11217 B12R1.375 OCCOCCSCCC1CC1 62a_100000764125_100011215305 [0,1,0,1,0,0|1,1,0]=4 11218 B12R1.375 OCCOCCSCCC1CC1 62a_100011215305_100000764125 [0,1,0,1,0,0|1,1,0]=4 11219 B12R1.458 CCOCCN1CCC1COC 2230a_100015195929_100011215890 [0,1,0,1,0,0|2,0,0]=4 11220 B12R1.458 CCOCCN1CCC1COC 269982a_100015195929_100011215890 [0,1,0,1,0,0|2,0,0]=4 11221 B12R1.458 CCOCCN1CCC1COC 34a_100015195929_100000210147 [0,1,0,1,0,0|2,0,0]=4 11222 B12R1.1414 BrCCOCC1CCCCCC1 34a_100000211926_200000696569 [0,1,0,1,0,0|2,0,0]=4 11223 B12R1.1414 CCCCCN1CCCOCC1 2230a_100000685342_100000210326 [0,1,0,1,0,0|2,0,0]=4 11224 B12R1.1414 CCCCCN1CCCOCC1 269982a_100000685342_100000210215 [0,1,0,1,0,0|2,0,0]=4 11225 B12R1.1414 CCCCCN1CCCOCC1 34a_100000685342_100000718602 [0,1,0,1,0,0|2,0,0]=4 11226 B12R1.1414 CCCOCC1CCCCCC1 34a_100000210258_200000696569 [0,1,0,1,0,0|2,0,0]=4 11227 B12R1.1414 CCCOCC1CCCCCC1 34a_100000699130_100000210303 [0,1,0,1,0,0|2,0,0]=4 11228 B12R1.1414 CCCOCC1CCCCCC1 7a_100000699130_100000210303 [0,1,0,1,0,0|2,0,0]=4 11229 B12R1.1414 CCOCCN1CCCCCC1 2230a_100000185865_100011215890 [0,1,0,1,0,0|2,0,0]=4 11230 B12R1.1414 CCOCCN1CCCCCC1 269982a_100000185865_100011215890 [0,1,0,1,0,0|2,0,0]=4 11231 B12R1.1414 CCOCCN1CCCCCC1 34a_100000185865_100000210147 [0,1,0,1,0,0|2,0,0]=4 11232 B12R1.1414 CCOCCN1CCCCCC1 34a_100000238007_100000210202 [0,1,0,1,0,0|2,0,0]=4 11233 B12R1.1414 CCOCCN1CCCOCC1 2230a_100000685342_100011215890 [0,1,0,1,0,0|1,0,0]=3 11234 B12R1.1414 CCOCCN1CCCOCC1 269982a_100000685342_100011215890 [0,1,0,1,0,0|1,0,0]=3 11235 B12R1.1414 CCOCCN1CCCOCC1 34a_100000685342_100000210147 [0,1,0,1,0,0|1,0,0]=3 11236 B12R1.1414 CCOCSC1CCCCCC1 62a_100000739092_100011217769 [0,1,0,1,0,0|2,0,0]=4 11237 B12R1.1414 CCOCSC1CCCCCC1 62a_100011217769_100000739092 [0,1,0,1,0,0|2,0,0]=4 11238 B12R1.1414 CCSCCN1CCCOCC1 2230a_100000685342_100000757381 [0,1,0,1,0,0|1,1,0]=4 11239 B12R1.1414 CCSCCN1CCCOCC1 269982a_100000685342_100000757381 [0,1,0,1,0,0|1,1,0]=4 11240 B12R1.1414 CCSCCN1CCCOCC1 34a_100000685342_100000757381 [0,1,0,1,0,0|1,1,0]=4 11241 B12R1.1414 CSCOCC1CCCCCC1 34a_100000699130_100011218213 [0,1,0,1,0,0|2,0,0]=4 11242 B12R1.1414 FCCOCC1CCCCCC1 34a_100000699130_100011217306 [0,1,0,1,0,0|2,0,0]=4 11243 B12R1.1414 FCCOCC1CCCCCC1 7a_100000699130_100011217306 [0,1,0,1,0,0|2,0,0]=4 11244 B12R1.1414 NCCOCC1CCCCCC1 34a_100000210304_200000696569 [0,1,0,1,0,0|2,0,0]=4 11245 B12R1.1414 OCCOCC1CCCCCC1 34a_100000699130_100000211926 [0,1,0,1,0,0|2,0,0]=4 11246 B12R1.1414 OCCOCC1CCCCCC1 7a_100000699130_100000211926 [0,1,0,1,0,0|2,0,0]=4 11247 B12R1.28 CCCCCN1CCOC(C1)C 2230a_100000729577_100000210326 [0,1,0,1,0,0|2,0,0]=4 11248 B12R1.28 CCCCCN1CCOC(C1)C 269982a_100000729577_100000210215 [0,1,0,1,0,0|2,0,0]=4 11249 B12R1.28 CCCCCN1CCOC(C1)C 34a_100000729577_100000718602 [0,1,0,1,0,0|2,0,0]=4 11250 B12R1.28 CCCCCN1CCOC(C1)O 2230a_100000688207_100000210326 [0,1,0,1,0,0|2,0,0]=4 11251 B12R1.28 CCCCCN1CCOC(C1)O 269982a_100000688207_100000210215 [0,1,0,1,0,0|2,0,0]=4 11252 B12R1.28 CCOCCN1CCCC(C1)C 34a_100121572206_100000766211 [0,1,0,1,0,0|2,0,0]=4 11253 B12R1.28 CCOCCN1CCCC(C1)F 2230a_100000697950_100011215890 [0,1,0,1,0,0|2,0,0]=4 11254 B12R1.28 CCOCCN1CCCC(C1)F 269982a_100000697950_100011215890 [0,1,0,1,0,0|2,0,0]=4 11255 B12R1.28 CCOCCN1CCCC(C1)F 34a_100000697950_100000210147 [0,1,0,1,0,0|2,0,0]=4 11256 B12R1.28 CCOCCN1CCCC(C1)O 2230a_100000211013_100011215890 [0,1,0,1,0,0|2,0,0]=4 11257 B12R1.28 CCOCCN1CCCC(C1)O 269982a_100000211013_100011215890 [0,1,0,1,0,0|2,0,0]=4 11258 B12R1.28 CCOCCN1CCC[C@@H](C1)C 2230a_100000717927_100011215890 [0,1,0,1,0,0|2,0,0]=4 11259 B12R1.28 CCOCCN1CCC[C@@H](C1)C 269982a_100000717927_100011215890 [0,1,0,1,0,0|2,0,0]=4 11260 B12R1.28 CCOCCN1CCC[C@@H](C1)C 34a_100000717927_100000210147 [0,1,0,1,0,0|2,0,0]=4 11261 B12R1.28 CCOCCN1CCOC(=O)C1 2230a_100000131268_100011215890 [0,1,0,1,0,0|1,0,1]=4 11262 B12R1.28 CCOCCN1CCOC(C1)C 2230a_100000729577_100011215890 [0,1,0,1,0,0|1,0,0]=3 11263 B12R1.28 CCOCCN1CCOC(C1)C 269982a_100000729577_100011215890 [0,1,0,1,0,0|1,0,0]=3 11264 B12R1.28 CCOCCN1CCOC(C1)C 34a_100000729577_100000210147 [0,1,0,1,0,0|1,0,0]=3 11265 B12R1.28 CCOCCN1CCOC(C1)O 2230a_100000688207_100011215890 [0,1,0,1,0,0|1,0,0]=3 11266 B12R1.28 CCOCCN1CCOC(C1)O 269982a_100000688207_100011215890 [0,1,0,1,0,0|1,0,0]=3 11267 B12R1.28 CCSCCN1CCOC(C1)C 2230a_100000729577_100000757381 [0,1,0,1,0,0|1,1,0]=4 11268 B12R1.28 CCSCCN1CCOC(C1)C 269982a_100000729577_100000757381 [0,1,0,1,0,0|1,1,0]=4 11269 B12R1.28 CCSCCN1CCOC(C1)C 34a_100000729577_100000757381 [0,1,0,1,0,0|1,1,0]=4 11270 B12R1.28 CCSCCN1CCOC(C1)O 2230a_100000688207_100000757381 [0,1,0,1,0,0|1,1,0]=4 11271 B12R1.28 CCSCCN1CCOC(C1)O 269982a_100000688207_100000757381 [0,1,0,1,0,0|1,1,0]=4 11272 B12R1.32 CCCC(C)CN1CCOCC1 2230a_100015191051_100011216630 [0,1,0,1,0,0|2,0,0]=4 11273 B12R1.32 CCCC(C)CN1CCOCC1 269982a_100015191051_100011216630 [0,1,0,1,0,0|2,0,0]=4 11274 B12R1.32 CCCC(C)CN1CCOCC1 270004a_100015191051_100000243154 [0,1,0,1,0,0|2,0,0]=4 11275 B12R1.32 CCCC(C)CN1CCOCC1 34a_100015191051_100011216630 [0,1,0,1,0,0|2,0,0]=4 11276 B12R1.32 CCNC(C)CN1CCOCC1 2230a_100000739823_100000210202 [0,1,0,1,0,0|2,0,0]=4 11277 B12R1.32 CCOC(=O)CN1CCOCC1 2230a_100015191051_100000188475 [0,1,0,1,0,0|1,0,1]=4 11278 B12R1.32 CCOC(=O)CN1CCOCC1 269982a_100015191051_100000188475 [0,1,0,1,0,0|1,0,1]=4 11279 B12R1.32 CCOC(=O)CN1CCOCC1 34a_100015191051_100000188475 [0,1,0,1,0,0|1,0,1]=4 11280 B12R1.51 CC(CCN)COC1CCOC1 34a_106354213184_100000690089 [0,1,0,1,0,0|2,0,0]=4 11281 B12R1.51 CCCC(C)CN[C@@H]1CCOC1 2230a_200015188469_100011216630 [0,1,0,1,0,0|2,0,0]=4 11282 B12R1.51 CCCC(C)CN[C@@H]1CCOC1 270004a_200015188469_100000243154 [0,1,0,1,0,0|2,0,0]=4 11283 B12R1.51 CCCC(C)CN[C@H]1CCOC1 2230a_100015188467_100011216630 [0,1,0,1,0,0|2,0,0]=4 11284 B12R1.51 CCCC(C)CN[C@H]1CCOC1 270004a_100015188467_100000243154 [0,1,0,1,0,0|2,0,0]=4 11285 B12R1.51 CCCC(C)CN[C@H]1CCOC1 34a_100015188467_100011216630 [0,1,0,1,0,0|2,0,0]=4 11286 B12R1.51 CCCC(C)COC1CCCC1 34a_100000210269_100011216630 [0,1,0,1,0,0|2,0,0]=4 11287 B12R1.51 CCCC(C)COC1CCCC1 34a_100000688023_100000179811 [0,1,0,1,0,0|2,0,0]=4 11288 B12R1.51 CCCC(C)COC1CCCC1 7a_100000210269_100011216630 [0,1,0,1,0,0|2,0,0]=4 11289 B12R1.51 CCCC(C)COC1CCCC1 7a_100000688023_100000179811 [0,1,0,1,0,0|2,0,0]=4 11290 B12R1.51 CCCC(C)COC1CCOC1 34a_100000688023_100000690089 [0,1,0,1,0,0|1,0,0]=3 11291 B12R1.51 CCCC(C)COC1CCOC1 7a_100000688023_100000731011 [0,1,0,1,0,0|1,0,0]=3 11292 B12R1.51 CCCC(C)COC1CCSC1 7a_100011232664_100011216630 [0,1,0,1,0,0|1,1,0]=4 11293 B12R1.51 CCCC(C)CO[C@H]1CCOC1 34a_100000717292_100011216630 [0,1,0,1,0,0|1,0,0]=3 11294 B12R1.51 CCCC(C)CSC1CCOC1 62a_100011216630_100000690089 [0,1,0,1,0,0|1,1,0]=4 11295 B12R1.51 CCC[C@H](N)COC1CCCC1 34a_100000732646_100000179811 [0,1,0,1,0,0|2,0,0]=4 11296 B12R1.51 CCC[C@H](N)COC1CCOC1 34a_100000732646_100000690089 [0,1,0,1,0,0|1,0,0]=3 11297 B12R1.51 CCNC(=O)CO[C@H]1CCOC1 34a_100000717292_100000183381 [0,1,0,1,0,0|1,0,1]=4 11298 B12R1.51 CCOC(=O)CN[C@@H]1CCOC1 2230a_200015188469_100000188475 [0,1,0,1,0,0|1,0,1]=4 11299 B12R1.51 CCOC(=O)CN[C@H]1CCOC1 2230a_100015188467_100000188475 [0,1,0,1,0,0|1,0,1]=4 11300 B12R1.51 CCOC(=O)CN[C@H]1CCOC1 34a_100015188467_100000188475 [0,1,0,1,0,0|1,0,1]=4 11301 B12R1.51 CCOC(=O)COC1CCCC1 34a_100000210269_100000188475 [0,1,0,1,0,0|1,0,1]=4 11302 B12R1.51 CCOC(=O)COC1CCCC1 7a_100000210269_100000188475 [0,1,0,1,0,0|1,0,1]=4 11303 B12R1.51 CCOC(=O)COC1CCSC1 7a_100011232664_100000188475 [0,1,0,1,0,0|0,1,1]=4 11304 B12R1.51 CCOC(=O)CO[C@H]1CCOC1 34a_100000717292_100000188475 [0,1,0,1,0,0|0,0,1]=3 11305 B12R1.51 CCOC(=O)CSC1CCOC1 62a_100000188475_100000690089 [0,1,0,1,0,0|0,1,1]=4 11306 B12R1.51 COCC(N)COC1CCOC1 34a_100000724102_100000690089 [0,1,0,1,0,0|2,0,0]=4 11307 B12R1.51 COCC(O)CO[C@H]1CCOC1 34a_100000717292_100011215053 [0,1,0,1,0,0|2,0,0]=4 11308 B12R1.62 C=C1CC(C1)COCCOCC 34a_100011011225_100000210147 [0,1,0,1,0,0|1,0,1]=4 11309 B12R1.62 CCCCCOCC1CC(C1)Cl 34a_100009874164_100000718602 [0,1,0,1,0,0|2,0,0]=4 11310 B12R1.62 CCOCCNCC1CC(C1)O 2230a_100016992100_100011215890 [0,1,0,1,0,0|2,0,0]=4 11311 B12R1.62 CCOCCOCC1CC(=O)C1 34a_100000101936_100000210147 [0,1,0,1,0,0|1,0,1]=4 11312 B12R1.62 CCOCCOCC1CC(=O)C1 7a_100000210136_100009874392 [0,1,0,1,0,0|1,0,1]=4 11313 B12R1.62 CCOCCOCC1CC(C1)Cl 34a_100009874164_100000210147 [0,1,0,1,0,0|1,0,0]=3 11314 B12R1.62 CCSCCOCC1CC(C1)Cl 34a_100009874164_100000757381 [0,1,0,1,0,0|1,1,0]=4 11315 B12R1.310 CCCC(C)COCCC1CC1 34a_100000688023_100000694398 [0,1,0,1,0,0|2,0,0]=4 11316 B12R1.310 CCCC(C)COCCC1CC1 34a_100000754188_100011216630 [0,1,0,1,0,0|2,0,0]=4 11317 B12R1.310 CCCC(C)COCCC1CC1 7a_100000688023_100000764125 [0,1,0,1,0,0|2,0,0]=4 11318 B12R1.310 CCCC(C)COCCC1CC1 7a_100000754188_100011216630 [0,1,0,1,0,0|2,0,0]=4 11319 B12R1.310 CCC[C@H](N)COCCC1CC1 34a_100000732646_100000694398 [0,1,0,1,0,0|2,0,0]=4 11320 B12R1.310 CCOC(=O)COCCC1CC1 34a_100000754188_100000188475 [0,1,0,1,0,0|1,0,1]=4 11321 B12R1.310 CCOC(=O)COCCC1CC1 7a_100000754188_100000188475 [0,1,0,1,0,0|1,0,1]=4 11322 B12R1.315 CC(CCN)COCC1CCO1 34a_106354213184_100000103362 [0,1,0,1,0,0|2,0,0]=4 11323 B12R1.315 CCCC(C)CNC[C@@H]1CCO1 2230a_100020831831_100011216630 [0,1,0,1,0,0|2,0,0]=4 11324 B12R1.315 CCCC(C)CNC[C@@H]1CCO1 270004a_100020831831_100000243154 [0,1,0,1,0,0|2,0,0]=4 11325 B12R1.315 CCCC(C)CNC[C@@H]1CCO1 34a_100020831831_100011216630 [0,1,0,1,0,0|2,0,0]=4 11326 B12R1.315 CCCC(C)COCC1CCC1 34a_100000688023_100000763275 [0,1,0,1,0,0|2,0,0]=4 11327 B12R1.315 CCCC(C)COCC1CCC1 34a_100000760304_100011216630 [0,1,0,1,0,0|2,0,0]=4 11328 B12R1.315 CCCC(C)COCC1CCC1 7a_100000688023_100000763275 [0,1,0,1,0,0|2,0,0]=4 11329 B12R1.315 CCCC(C)COCC1CCO1 34a_100000039022_100011216630 [0,1,0,1,0,0|1,0,0]=3 11330 B12R1.315 CCCC(C)COCC1CCO1 34a_100000688023_100000103362 [0,1,0,1,0,0|1,0,0]=3 11331 B12R1.315 CCCC(C)COCC1CCO1 7a_100000688023_100000103362 [0,1,0,1,0,0|1,0,0]=3 11332 B12R1.315 CCCC(C)CSCC1CCO1 62a_100000103362_100011216630 [0,1,0,1,0,0|1,1,0]=4 11333 B12R1.315 CCCC(C)CSCC1CCO1 62a_100011216630_100000103362 [0,1,0,1,0,0|1,1,0]=4 11334 B12R1.315 CCC[C@H](N)COCC1CCC1 34a_100000732646_100000763275 [0,1,0,1,0,0|2,0,0]=4 11335 B12R1.315 CCC[C@H](N)COCC1CCO1 34a_100000732646_100000103362 [0,1,0,1,0,0|1,0,0]=3 11336 B12R1.315 CCNC(=O)COCC1CCO1 34a_100000039022_100000183381 [0,1,0,1,0,0|1,0,1]=4 11337 B12R1.315 CCOC(=O)CNC[C@@H]1CCO1 2230a_100020831831_100000188475 [0,1,0,1,0,0|1,0,1]=4 11338 B12R1.315 CCOC(=O)CNC[C@@H]1CCO1 34a_100020831831_100000188475 [0,1,0,1,0,0|1,0,1]=4 11339 B12R1.315 CCOC(=O)COCC1CCC1 34a_100000760304_100000188475 [0,1,0,1,0,0|1,0,1]=4 11340 B12R1.315 CCOC(=O)COCC1CCO1 34a_100000039022_100000188475 [0,1,0,1,0,0|0,0,1]=3 11341 B12R1.315 CCOC(=O)CSCC1CCO1 62a_100000103362_100000188475 [0,1,0,1,0,0|0,1,1]=4 11342 B12R1.315 CCOC(=O)CSCC1CCO1 62a_100000188475_100000103362 [0,1,0,1,0,0|0,1,1]=4 11343 B12R1.315 COCC(N)COCC1CCO1 34a_100000724102_100000103362 [0,1,0,1,0,0|2,0,0]=4 11344 B12R1.315 COCC(O)COCC1CCO1 34a_100000039022_100011215053 [0,1,0,1,0,0|2,0,0]=4 11345 B12R1.340 CCOCN1CC[C@@H](C1)OCC 269982a_100011787710_100000739092 [0,1,0,1,0,0|2,0,0]=4 11346 B12R1.923 CCCCCOC[C@H](N)C1CC1 34a_100020623730_100000718602 [0,1,0,1,0,0|2,0,0]=4 11347 B12R1.923 CCOCCNCC(O)C1CC1 2230a_100000751198_100011215890 [0,1,0,1,0,0|2,0,0]=4 11348 B12R1.923 CCOCCNCC(O)C1CC1 34a_100000751198_100000210147 [0,1,0,1,0,0|2,0,0]=4 11349 B12R1.923 CCOCCOCC(=O)C1CC1 34a_100000210136_100000746382 [0,1,0,1,0,0|1,0,1]=4 11350 B12R1.923 CCOCCOCC(=O)C1CC1 34a_100000686663_100000210147 [0,1,0,1,0,0|1,0,1]=4 11351 B12R1.923 CCOCCOCC(=O)C1CC1 7a_100000210136_100000746382 [0,1,0,1,0,0|1,0,1]=4 11352 B12R1.923 CCOCCOC[C@H](N)C1CC1 34a_100020623730_100000210147 [0,1,0,1,0,0|1,0,0]=3 11353 B12R1.923 CCSCCOC[C@H](N)C1CC1 34a_100020623730_100000757381 [0,1,0,1,0,0|1,1,0]=4 11354 B12R1.1419 CCCCCN1CC(C1)OCC 269982a_100000732654_100000210215 [0,1,0,1,0,0|2,0,0]=4 11355 B12R1.1419 CCCCCN1CC(C1)OCC 34a_100000732654_100000718602 [0,1,0,1,0,0|2,0,0]=4 11356 B12R1.1419 CCOC1CN(C1)CCSCC 269982a_100000732654_100000757381 [0,1,0,1,0,0|1,1,0]=4 11357 B12R1.1419 CCOC1CN(C1)CCSCC 34a_100000732654_100000757381 [0,1,0,1,0,0|1,1,0]=4 11358 B12R1.1419 CCOCCN1CC(C1)OCC 269982a_100000732654_100011215890 [0,1,0,1,0,0|1,0,0]=3 11359 B12R1.1419 CCOCCN1CC(C1)OCC 34a_100000732654_100000210147 [0,1,0,1,0,0|1,0,0]=3 11360 B12R1.1505 CCCC(C)COCC1CC1C 34a_100000744939_100011216630 [0,1,0,1,0,0|2,0,0]=4 11361 B12R1.1505 CCCC(C)COCC1CC1C 7a_100000744939_100011216630 [0,1,0,1,0,0|2,0,0]=4 11362 B12R1.1505 CCOC(=O)COCC1CC1C 34a_100000744939_100000188475 [0,1,0,1,0,0|1,0,1]=4 11363 B12R1.1505 CCOC(=O)COCC1CC1C 7a_100000744939_100000188475 [0,1,0,1,0,0|1,0,1]=4 11364 B12R1.1996 CCCCCOCC1(CCC1)C 34a_100000210253_100000726658 [0,1,0,1,0,0|2,0,0]=4 11365 B12R1.1996 CCCCCOCC1(CCC1)C 7a_100000210253_100000726658 [0,1,0,1,0,0|2,0,0]=4 11366 B12R1.1996 CCOCCNCC1(CCC1)C 2230a_100000706607_100011215890 [0,1,0,1,0,0|2,0,0]=4 11367 B12R1.1996 CCOCCNCC1(CCC1)C 2230a_102516460346_100000726658 [0,1,0,1,0,0|2,0,0]=4 11368 B12R1.1996 CCOCCNCC1(CCC1)C 34a_102516460346_100000726658 [0,1,0,1,0,0|2,0,0]=4 11369 B12R1.1996 CCOCCNCC1(CCC1)O 2230a_100000752638_100011215890 [0,1,0,1,0,0|2,0,0]=4 11370 B12R1.1996 CCOCCOCC1(CCC1)C 34a_100000210136_100000726658 [0,1,0,1,0,0|1,0,0]=3 11371 B12R1.1996 CCOCCOCC1(CCC1)C 7a_100000210136_100000726658 [0,1,0,1,0,0|1,0,0]=3 11372 B12R1.1996 CCOCCOCC1(COC1)C 34a_100000210136_100009817586 [0,1,0,1,0,0|2,0,0]=4 11373 B12R1.1996 CCOCCOCC1(COC1)C 7a_100000210136_100009817586 [0,1,0,1,0,0|2,0,0]=4 11374 B12R1.1996 CCOCCOCC1(CSC1)C 34a_100000732658_100000210147 [0,1,0,1,0,0|2,0,0]=4 11375 B12R1.1996 CCOCCOCC1(CSC1)C 7a_100000732658_100011215890 [0,1,0,1,0,0|2,0,0]=4 11376 B12R1.1996 CCOCCSCC1(CCC1)C 62a_100000210147_100000726658 [0,1,0,1,0,0|1,1,0]=4 11377 B12R1.1996 CCOCCSCC1(CCC1)C 62a_100000726658_100011215890 [0,1,0,1,0,0|1,1,0]=4 11378 B12R1.1996 CCSCCOCC1(CCC1)C 34a_100000212035_100000726658 [0,1,0,1,0,0|1,1,0]=4 11379 B12R1.1996 CCSCCOCC1(CCC1)C 7a_100000212035_100000726658 [0,1,0,1,0,0|1,1,0]=4 11380 B12R1.1 C=C1CCN(CC1)CCOCC 2230a_100000752442_100011215890 [0,1,0,1,0,0|2,0,0]=4 11381 B12R1.1 C=C1CCN(CC1)CCOCC 269982a_100000752442_100011215890 [0,1,0,1,0,0|2,0,0]=4 11382 B12R1.1 C=C1CCN(CC1)CCOCC 34a_100000752442_100000210147 [0,1,0,1,0,0|2,0,0]=4 11383 B12R1.1 CCOCCC1CCC(CC1)N 34a_100000070672_100000210202 [0,1,0,1,0,0|2,0,0]=4 11384 B12R1.1 CCOCCN1CCC(CC1)C 2230a_100000188429_100011215890 [0,1,0,1,0,0|2,0,0]=4 11385 B12R1.1 CCOCCN1CCC(CC1)C 269982a_100000188429_100011215890 [0,1,0,1,0,0|2,0,0]=4 11386 B12R1.1 CCOCCN1CCC(CC1)C 34a_100000188429_100000210147 [0,1,0,1,0,0|2,0,0]=4 11387 B12R1.1 CCOCCN1CCC(CC1)F 2230a_100015193889_100011215890 [0,1,0,1,0,0|2,0,0]=4 11388 B12R1.1 CCOCCN1CCC(CC1)F 269982a_100015193889_100011215890 [0,1,0,1,0,0|2,0,0]=4 11389 B12R1.1 CCOCCN1CCC(CC1)F 34a_100015193889_100000210147 [0,1,0,1,0,0|2,0,0]=4 11390 B12R1.1 CCOCCN1CCC(CC1)O 2230a_100025773856_100011215890 [0,1,0,1,0,0|2,0,0]=4 11391 B12R1.1 CCOCCN1CCC(CC1)O 269982a_100025773856_100011215890 [0,1,0,1,0,0|2,0,0]=4 11392 B12R1.1 CCOCCN1CCN(CC1)C 2230a_100000188432_100011215890 [0,1,0,1,0,0|2,0,0]=4 11393 B12R1.1 CCOCCN1CCN(CC1)C 2230a_100000752772_200000210301 [0,1,0,1,0,0|2,0,0]=4 11394 B12R1.1 CCOCCN1CCN(CC1)C 269982a_100000188432_100011215890 [0,1,0,1,0,0|2,0,0]=4 11395 B12R1.1 CCOCCN1CCN(CC1)C 269982a_100000752772_200000210301 [0,1,0,1,0,0|2,0,0]=4 11396 B12R1.1 CCOCCN1CCN(CC1)[13CH3] 2230a_100000752772_200025704644 [0,1,0,1,0,0|2,0,0]=4 11397 B12R1.1 CCOCCN1CCN(CC1)[13CH3] 269982a_100000752772_200025704644 [0,1,0,1,0,0|2,0,0]=4 11398 B12R1.1 CCOCCN1CCS(=O)CC1 2230a_100000752083_100011215890 [0,1,0,1,0,0|1,1,0]=4 11399 B12R1.1 CCOCCN1CCS(=O)CC1 269982a_100000752083_100011215890 [0,1,0,1,0,0|1,1,0]=4 11400 B12R1.7 CCCCCOC1CCC(=O)C1 34a_100012614533_100000718602 [0,1,0,1,0,0|2,0,0]=4 11401 B12R1.7 CCCCCOC1CCC(C1)C 34a_100000698185_100000718602 [0,1,0,1,0,0|2,0,0]=4 11402 B12R1.7 CCCCCOC1CCN(C1)C 7a_100000210253_200012183744 [0,1,0,1,0,0|2,0,0]=4 11403 B12R1.7 CCOCCNC1CCC(C1)C 270004a_102516460346_100011215218 [0,1,0,1,0,0|2,0,0]=4 11404 B12R1.7 CCOCCNC1CCC(C1)O 270004a_102516460346_100012614533 [0,1,0,1,0,0|2,0,0]=4 11405 B12R1.7 CCOCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100011215890 [0,1,0,1,0,0|2,0,0]=4 11406 B12R1.7 CCOCCOC1CCC(=O)C1 34a_100012614533_100000210147 [0,1,0,1,0,0|1,0,0]=3 11407 B12R1.7 CCOCCOC1CCC(C1)C 34a_100000698185_100000210147 [0,1,0,1,0,0|1,0,0]=3 11408 B12R1.7 CCOCCOC1CCN(C1)C 7a_100000210136_200012183744 [0,1,0,1,0,0|1,0,0]=3 11409 B12R1.7 CCOCCOC1CNC(=O)C1 34a_100000690082_100000210147 [0,1,0,1,0,0|1,0,1]=4 11410 B12R1.7 CCOCCOC1COC(=O)O1 34a_100000210136_100000032252 [0,1,0,1,0,0|1,0,1]=4 11411 B12R1.7 CCOCCSC1CCN(C1)C 62a_100000210147_200012183744 [0,1,0,1,0,0|1,1,0]=4 11412 B12R1.7 CCSCCOC1CCC(=O)C1 34a_100012614533_100000757381 [0,1,0,1,0,0|1,1,0]=4 11413 B12R1.7 CCSCCOC1CCC(C1)C 34a_100000698185_100000757381 [0,1,0,1,0,0|1,1,0]=4 11414 B12R1.7 CCSCCOC1CCN(C1)C 7a_100000212035_200012183744 [0,1,0,1,0,0|1,1,0]=4 11415 B12R1.27 CCC(=O)CCC1CCOCC1 1458a_100000210414_100011934994 [0,1,0,1,0,0|2,0,0]=4 11416 B12R1.27 CCC(=O)CCN1CCOCC1 1458a_100000210414_100000753993 [0,1,0,1,0,0|2,0,0]=4 11417 B12R1.27 CCC(=O)CCN1CCOCC1 1458a_100000749337_100000210202 [0,1,0,1,0,0|2,0,0]=4 11418 B12R1.27 CCN(C)CCC1CCOCC1 2230a_100000225621_100011934994 [0,1,0,1,0,0|2,0,0]=4 11419 B12R1.27 CCN(C)CCC1CCOCC1 269982a_100000225621_100011934994 [0,1,0,1,0,0|2,0,0]=4 11420 B12R1.27 CCN(C)CCN1CCOCC1 2230a_100000225621_100025781966 [0,1,0,1,0,0|2,0,0]=4 11421 B12R1.27 CCN(C)CCN1CCOCC1 2230a_100000225678_100000210202 [0,1,0,1,0,0|2,0,0]=4 11422 B12R1.27 CCN(C)CCN1CCOCC1 2230a_100000226056_200000210301 [0,1,0,1,0,0|2,0,0]=4 11423 B12R1.27 CCN(C)CCN1CCOCC1 269982a_100000225621_100000753993 [0,1,0,1,0,0|2,0,0]=4 11424 B12R1.27 CCN(C)CCN1CCOCC1 269982a_100000225678_100000204670 [0,1,0,1,0,0|2,0,0]=4 11425 B12R1.27 CCN(C)CCN1CCOCC1 269982a_100000226056_200000210301 [0,1,0,1,0,0|2,0,0]=4 11426 B12R1.27 CCN([13CH3])CCN1CCOCC1 2230a_100000226056_200025704644 [0,1,0,1,0,0|2,0,0]=4 11427 B12R1.27 CCN([13CH3])CCN1CCOCC1 269982a_100000226056_200025704644 [0,1,0,1,0,0|2,0,0]=4 11428 B12R1.356 CCC(C)CCNCC1CCO1 2230a_100020591266_100000103362 [0,1,0,1,0,0|2,0,0]=4 11429 B12R1.356 CCC(C)CCOCC1CCC1 7a_100011215188_100000763275 [0,1,0,1,0,0|2,0,0]=4 11430 B12R1.356 CCC(C)CCOCC1CCO1 7a_100011215188_100000103362 [0,1,0,1,0,0|1,0,0]=3 11431 B12R1.356 CNC(=O)CCOCC1CCO1 34a_100000039022_100012179268 [0,1,0,1,0,0|2,0,0]=4 11432 B12R1.356 CNC(=O)CCOCC1CCO1 34a_100000754576_100000103362 [0,1,0,1,0,0|2,0,0]=4 11433 B12R1.356 COC(=O)CCOCC1CCO1 34a_100000039022_100000742370 [0,1,0,1,0,0|2,0,0]=4 11434 B12R1.356 COC(C)CCOCC1CCO1 7a_100000764861_100000103362 [0,1,0,1,0,0|2,0,0]=4 11435 B12R1.360 CCC(C)CCOCCC1CC1 7a_100011215188_100000764125 [0,1,0,1,0,0|2,0,0]=4 11436 B12R1.382 CCOCC1CCCN(C1)CC 7a_200000227639_100000210202 [0,1,0,1,0,0|2,0,0]=4 11437 B12R1.477 CCC(C)CCNC1CCOC1 2230a_100020591266_100000731011 [0,1,0,1,0,0|2,0,0]=4 11438 B12R1.477 CCC(C)CCNC1CCOC1 270004a_100020591266_100000752484 [0,1,0,1,0,0|2,0,0]=4 11439 B12R1.477 CCC(C)CCOC1CCCC1 7a_100011215188_100000179811 [0,1,0,1,0,0|2,0,0]=4 11440 B12R1.477 CCC(C)CCOC1CCOC1 7a_100011215188_100000731011 [0,1,0,1,0,0|1,0,0]=3 11441 B12R1.477 CNC(=O)CCOC1CCOC1 34a_100000754576_100000690089 [0,1,0,1,0,0|2,0,0]=4 11442 B12R1.477 CNC(=O)CCO[C@H]1CCOC1 34a_100000717292_100012179268 [0,1,0,1,0,0|2,0,0]=4 11443 B12R1.477 COC(=O)CCO[C@H]1CCOC1 34a_100000717292_100000742370 [0,1,0,1,0,0|2,0,0]=4 11444 B12R1.477 COC(C)CCOC1CCOC1 7a_100000764861_100000731011 [0,1,0,1,0,0|2,0,0]=4 11445 B12R1.1761 CCOCCNC1CN(C1)CC 2230a_200015199589_100011215890 [0,1,0,1,0,0|2,0,0]=4 11446 B12R1.30 CCCCC(C)N1CCOCC1 2230a_100015191051_200011215066 [0,1,0,1,0,0|2,0,0]=4 11447 B12R1.30 CCCCC(C)N1CCOCC1 269982a_100015191051_200011215066 [0,1,0,1,0,0|2,0,0]=4 11448 B12R1.30 CCCCC(C)N1CCOCC1 270004a_100015191051_100000210087 [0,1,0,1,0,0|2,0,0]=4 11449 B12R1.30 CCCCC(C)N1CCOCC1 34a_100015191051_200011215066 [0,1,0,1,0,0|2,0,0]=4 11450 B12R1.30 CCOCC(=O)C1CCOCC1 1458a_100000211967_100011324220 [0,1,0,1,0,0|1,0,1]=4 11451 B12R1.30 CCOCC(=O)C1CCOCC1 34a_100121572206_100000689883 [0,1,0,1,0,0|1,0,1]=4 11452 B12R1.30 CCOCC(=O)N1CCOCC1 11a_100015191051_100000211967 [0,1,0,1,0,0|1,0,1]=4 11453 B12R1.30 CCOCC(=O)N1CCOCC1 1626a_100015191051_100000211967 [0,1,0,1,0,0|1,0,1]=4 11454 B12R1.30 CCOCC(=O)N1CCOCC1 240690a_100015191051_100000211967 [0,1,0,1,0,0|1,0,1]=4 11455 B12R1.30 CCOCC(=O)N1CCOCC1 34a_100121572206_100000183410 [0,1,0,1,0,0|1,0,1]=4 11456 B12R1.30 CCOCC(=O)N1CCOCC1 527a_100015191051_100000211967 [0,1,0,1,0,0|1,0,1]=4 11457 B12R1.30 CCOCC(=O)N1CCOCC1 7a_100000752472_100000210202 [0,1,0,1,0,0|1,0,1]=4 11458 B12R1.30 CCOCC(C)N1CCNCC1 34a_100000751876_100000210202 [0,1,0,1,0,0|2,0,0]=4 11459 B12R1.30 CCOCN(C)C1CCOCC1 269982a_100020587155_100000739092 [0,1,0,1,0,0|2,0,0]=4 11460 B12R1.30 CCOC[C@H](N)C1CCCCC1 34a_100009817630_100000210202 [0,1,0,1,0,0|2,0,0]=4 11461 B12R1.30 CCSCC(C)N1CCOCC1 270004a_100015191051_200011216171 [0,1,0,1,0,0|1,1,0]=4 11462 B12R1.53 CC(CCCCl)OC1CCOC1 34a_200000718107_100000690089 [0,1,0,1,0,0|2,0,0]=4 11463 B12R1.53 CC(CCCCl)OC1CCOC1 7a_200000718107_100000731011 [0,1,0,1,0,0|2,0,0]=4 11464 B12R1.53 CCC#CC(C)OC1CCOC1 34a_100000033903_100000690089 [0,1,0,1,0,0|1,0,1]=4 11465 B12R1.53 CCC#CC(C)OC1CCOC1 7a_100000033903_100000731011 [0,1,0,1,0,0|1,0,1]=4 11466 B12R1.53 CCCCC(C)NC1CCOC1 2230a_100000126638_100000731011 [0,1,0,1,0,0|2,0,0]=4 11467 B12R1.53 CCCCC(C)NC1CCOC1 270004a_100000126638_100000752484 [0,1,0,1,0,0|2,0,0]=4 11468 B12R1.53 CCCCC(C)N[C@@H]1CCOC1 2230a_200015188469_200011215066 [0,1,0,1,0,0|2,0,0]=4 11469 B12R1.53 CCCCC(C)N[C@@H]1CCOC1 270004a_200015188469_100000210087 [0,1,0,1,0,0|2,0,0]=4 11470 B12R1.53 CCCCC(C)N[C@H]1CCOC1 2230a_100015188467_200011215066 [0,1,0,1,0,0|2,0,0]=4 11471 B12R1.53 CCCCC(C)N[C@H]1CCOC1 270004a_100015188467_100000210087 [0,1,0,1,0,0|2,0,0]=4 11472 B12R1.53 CCCCC(C)N[C@H]1CCOC1 34a_100015188467_200011215066 [0,1,0,1,0,0|2,0,0]=4 11473 B12R1.53 CCCCC(C)OC1CCCC1 34a_100000210269_200011215066 [0,1,0,1,0,0|2,0,0]=4 11474 B12R1.53 CCCCC(C)OC1CCCC1 34a_100000687866_100000179811 [0,1,0,1,0,0|2,0,0]=4 11475 B12R1.53 CCCCC(C)OC1CCCC1 7a_100000210269_200011215066 [0,1,0,1,0,0|2,0,0]=4 11476 B12R1.53 CCCCC(C)OC1CCCC1 7a_100000687866_100000179811 [0,1,0,1,0,0|2,0,0]=4 11477 B12R1.53 CCCCC(C)OC1CCOC1 34a_100000687866_100000690089 [0,1,0,1,0,0|1,0,0]=3 11478 B12R1.53 CCCCC(C)OC1CCOC1 7a_100000687866_100000731011 [0,1,0,1,0,0|1,0,0]=3 11479 B12R1.53 CCCCC(C)OC1CCSC1 7a_100011232664_200011215066 [0,1,0,1,0,0|1,1,0]=4 11480 B12R1.53 CCCCC(C)O[C@H]1CCOC1 34a_100000717292_200011215066 [0,1,0,1,0,0|1,0,0]=3 11481 B12R1.53 CCCCC(C)SC1CCOC1 62a_200011215066_100000690089 [0,1,0,1,0,0|1,1,0]=4 11482 B12R1.53 CCOCC(=O)CC1CCOC1 1458a_100000211967_100000702531 [0,1,0,1,0,0|1,0,1]=4 11483 B12R1.53 CCOCC(=O)N[C@@H]1CCOC1 240690a_200015188469_100000211967 [0,1,0,1,0,0|1,0,1]=4 11484 B12R1.53 CCOCC(=O)N[C@@H]1CCOC1 527a_200015188469_100000211967 [0,1,0,1,0,0|1,0,1]=4 11485 B12R1.53 CCOCC(=O)N[C@H]1CCOC1 11a_100015188467_100000211967 [0,1,0,1,0,0|1,0,1]=4 11486 B12R1.53 CCOCC(=O)N[C@H]1CCOC1 1626a_100015188467_100000211967 [0,1,0,1,0,0|1,0,1]=4 11487 B12R1.53 CCOCC(=O)N[C@H]1CCOC1 240690a_100015188467_100000211967 [0,1,0,1,0,0|1,0,1]=4 11488 B12R1.53 CCOCC(=O)N[C@H]1CCOC1 527a_100015188467_100000211967 [0,1,0,1,0,0|1,0,1]=4 11489 B12R1.53 CCOCC(C)OC1CCCC1 34a_100000718985_100000179811 [0,1,0,1,0,0|1,0,0]=3 11490 B12R1.53 CCOCC(C)OC1CCCC1 7a_100000718985_100000179811 [0,1,0,1,0,0|1,0,0]=3 11491 B12R1.53 CCOCC(C)OC1CCOC1 34a_100000718985_100000690089 [0,1,0,1,0,0|0,0,0]=2 11492 B12R1.53 CCOCC(C)OC1CCOC1 7a_100000718985_100000731011 [0,1,0,1,0,0|0,0,0]=2 11493 B12R1.53 CCOCN(C)CC1CCOC1 269982a_100000684583_100000739092 [0,1,0,1,0,0|2,0,0]=4 11494 B12R1.53 CCSCC(C)N[C@@H]1CCOC1 270004a_200015188469_200011216171 [0,1,0,1,0,0|1,1,0]=4 11495 B12R1.53 CCSCC(C)N[C@H]1CCOC1 270004a_100015188467_200011216171 [0,1,0,1,0,0|1,1,0]=4 11496 B12R1.321 CCOCN1CCOC[C@@H](C1)O 269982a_100016073750_100000739092 [0,1,0,1,0,0|2,0,0]=4 11497 B12R1.463 CC(CCCCl)OCC1CCO1 34a_200000718107_100000103362 [0,1,0,1,0,0|2,0,0]=4 11498 B12R1.463 CC(CCCCl)OCC1CCO1 7a_200000718107_100000103362 [0,1,0,1,0,0|2,0,0]=4 11499 B12R1.463 CCC#CC(C)OCC1CCO1 34a_100000033903_100000103362 [0,1,0,1,0,0|1,0,1]=4 11500 B12R1.463 CCC#CC(C)OCC1CCO1 7a_100000033903_100000103362 [0,1,0,1,0,0|1,0,1]=4 11501 B12R1.463 CCCCC(C)NCC1CCO1 2230a_100000126638_100000103362 [0,1,0,1,0,0|2,0,0]=4 11502 B12R1.463 CCCCC(C)NC[C@@H]1CCO1 2230a_100020831831_200011215066 [0,1,0,1,0,0|2,0,0]=4 11503 B12R1.463 CCCCC(C)NC[C@@H]1CCO1 270004a_100020831831_100000210087 [0,1,0,1,0,0|2,0,0]=4 11504 B12R1.463 CCCCC(C)NC[C@@H]1CCO1 34a_100020831831_200011215066 [0,1,0,1,0,0|2,0,0]=4 11505 B12R1.463 CCCCC(C)OCC1CCC1 34a_100000687866_100000763275 [0,1,0,1,0,0|2,0,0]=4 11506 B12R1.463 CCCCC(C)OCC1CCC1 34a_100000760304_200011215066 [0,1,0,1,0,0|2,0,0]=4 11507 B12R1.463 CCCCC(C)OCC1CCC1 7a_100000687866_100000763275 [0,1,0,1,0,0|2,0,0]=4 11508 B12R1.463 CCCCC(C)OCC1CCO1 34a_100000039022_200011215066 [0,1,0,1,0,0|1,0,0]=3 11509 B12R1.463 CCCCC(C)OCC1CCO1 34a_100000687866_100000103362 [0,1,0,1,0,0|1,0,0]=3 11510 B12R1.463 CCCCC(C)OCC1CCO1 7a_100000687866_100000103362 [0,1,0,1,0,0|1,0,0]=3 11511 B12R1.463 CCCCC(C)SCC1CCO1 62a_100000103362_200011215066 [0,1,0,1,0,0|1,1,0]=4 11512 B12R1.463 CCCCC(C)SCC1CCO1 62a_200011215066_100000103362 [0,1,0,1,0,0|1,1,0]=4 11513 B12R1.463 CCOCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000211967 [0,1,0,1,0,0|1,0,1]=4 11514 B12R1.463 CCOCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000211967 [0,1,0,1,0,0|1,0,1]=4 11515 B12R1.463 CCOCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000211967 [0,1,0,1,0,0|1,0,1]=4 11516 B12R1.463 CCOCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000211967 [0,1,0,1,0,0|1,0,1]=4 11517 B12R1.463 CCOCC(C)OCC1CCC1 34a_100000718985_100000763275 [0,1,0,1,0,0|1,0,0]=3 11518 B12R1.463 CCOCC(C)OCC1CCC1 7a_100000718985_100000763275 [0,1,0,1,0,0|1,0,0]=3 11519 B12R1.463 CCOCC(C)OCC1CCO1 34a_100000718985_100000103362 [0,1,0,1,0,0|0,0,0]=2 11520 B12R1.463 CCOCC(C)OCC1CCO1 7a_100000718985_100000103362 [0,1,0,1,0,0|0,0,0]=2 11521 B12R1.463 CCOCC(C)OCC1COC1 34a_100000718985_100010264016 [0,1,0,1,0,0|2,0,0]=4 11522 B12R1.463 CCOCC(C)OCC1COC1 7a_100000718985_100010264016 [0,1,0,1,0,0|2,0,0]=4 11523 B12R1.463 CCSCC(C)NC[C@@H]1CCO1 270004a_100020831831_200011216171 [0,1,0,1,0,0|1,1,0]=4 11524 B12R1.464 CCCCC(C)OCCC1CC1 34a_100000687866_100000694398 [0,1,0,1,0,0|2,0,0]=4 11525 B12R1.464 CCCCC(C)OCCC1CC1 34a_100000754188_200011215066 [0,1,0,1,0,0|2,0,0]=4 11526 B12R1.464 CCCCC(C)OCCC1CC1 7a_100000687866_100000764125 [0,1,0,1,0,0|2,0,0]=4 11527 B12R1.464 CCCCC(C)OCCC1CC1 7a_100000754188_200011215066 [0,1,0,1,0,0|2,0,0]=4 11528 B12R1.464 CCOCC(C)OCCC1CC1 34a_100000718985_100000694398 [0,1,0,1,0,0|1,0,0]=3 11529 B12R1.464 CCOCC(C)OCCC1CC1 7a_100000718985_100000764125 [0,1,0,1,0,0|1,0,0]=3 11530 B12R1.464 CCOCC(C)OCCC1CO1 34a_100000718985_100000732470 [0,1,0,1,0,0|2,0,0]=4 11531 B12R1.464 CCOCC(C)OCCC1CO1 7a_100000718985_100000732470 [0,1,0,1,0,0|2,0,0]=4 11532 B12R1.549 CCCCC(C)OCC1CC1C 34a_100000744939_200011215066 [0,1,0,1,0,0|2,0,0]=4 11533 B12R1.549 CCCCC(C)OCC1CC1C 7a_100000744939_200011215066 [0,1,0,1,0,0|2,0,0]=4 11534 B12R1.561 CCCCCOC(C)C1CCC1 34a_100000766398_100000718602 [0,1,0,1,0,0|2,0,0]=4 11535 B12R1.561 CCCCCOC(C)C1CCC1 7a_100000766398_100000210326 [0,1,0,1,0,0|2,0,0]=4 11536 B12R1.561 CCOCCCC(=O)C1CCO1 1458a_100000089072_100012232248 [0,1,0,1,0,0|1,0,1]=4 11537 B12R1.561 CCOCCNC(=O)C1CCO1 11a_100011200944_100000089072 [0,1,0,1,0,0|1,0,1]=4 11538 B12R1.561 CCOCCNC(=O)C1CCO1 1626a_102516460346_100000089072 [0,1,0,1,0,0|1,0,1]=4 11539 B12R1.561 CCOCCNC(=O)C1CCO1 240690a_100011200944_100000089072 [0,1,0,1,0,0|1,0,1]=4 11540 B12R1.561 CCOCCNC(=O)C1CCO1 527a_100011200944_100000089072 [0,1,0,1,0,0|1,0,1]=4 11541 B12R1.561 CCOCCNC(C)C1CCC1 2230a_100016994624_100011215890 [0,1,0,1,0,0|2,0,0]=4 11542 B12R1.561 CCOCCNC(C)C1CCC1 269862a_100011200944_100000760154 [0,1,0,1,0,0|2,0,0]=4 11543 B12R1.561 CCOCCNC(C)C1CCC1 34a_100016994624_100000210147 [0,1,0,1,0,0|2,0,0]=4 11544 B12R1.561 CCOCCOC(C)C1CCC1 34a_100000766398_100000210147 [0,1,0,1,0,0|1,0,0]=3 11545 B12R1.561 CCOCCOC(C)C1CCC1 7a_100000766398_100011215890 [0,1,0,1,0,0|1,0,0]=3 11546 B12R1.561 CCSCCOC(C)C1CCC1 34a_100000766398_100000757381 [0,1,0,1,0,0|1,1,0]=4 11547 B12R1.561 CCSCCOC(C)C1CCC1 7a_100000766398_100000757381 [0,1,0,1,0,0|1,1,0]=4 11548 B12R1.563 CCOCCNC(C)CC1CC1 270004a_102516460346_200000686933 [0,1,0,1,0,0|2,0,0]=4 11549 B12R1.567 CCOCCN1C(CCC1C)C 2230a_100000687148_100011215890 [0,1,0,1,0,0|2,0,0]=4 11550 B12R1.567 CCOCCN1C(CCC1C)C 269982a_100000687148_100011215890 [0,1,0,1,0,0|2,0,0]=4 11551 B12R1.567 CCOCCN1C(CCC1C)C 34a_100000687148_100000210147 [0,1,0,1,0,0|2,0,0]=4 11552 B12R1.1758 CCCCCNC1(CCOC1)C 2230a_100000693475_100000210326 [0,1,0,1,0,0|2,0,0]=4 11553 B12R1.1758 CCCCCOC1(CCCC1)C 34a_100000751722_100000718602 [0,1,0,1,0,0|2,0,0]=4 11554 B12R1.1758 CCCCCOC1(CCCC1)C 7a_100000751722_100000210326 [0,1,0,1,0,0|2,0,0]=4 11555 B12R1.1758 CCOCCNC1(CCOC1)C 2230a_100000693475_100011215890 [0,1,0,1,0,0|1,0,0]=3 11556 B12R1.1758 CCOCCOC1(CCCC1)C 34a_100000751722_100000210147 [0,1,0,1,0,0|1,0,0]=3 11557 B12R1.1758 CCOCCOC1(CCCC1)C 7a_100000751722_100011215890 [0,1,0,1,0,0|1,0,0]=3 11558 B12R1.1758 CCSCCNC1(CCOC1)C 2230a_100000693475_100000757381 [0,1,0,1,0,0|1,1,0]=4 11559 B12R1.1758 CCSCCOC1(CCCC1)C 34a_100000751722_100000757381 [0,1,0,1,0,0|1,1,0]=4 11560 B12R1.1758 CCSCCOC1(CCCC1)C 7a_100000751722_100000757381 [0,1,0,1,0,0|1,1,0]=4 11561 B12R1.35 CCCCCC(=O)C1CCOC1 1458a_100000212188_100000690089 [0,1,0,1,0,0|2,0,0]=4 11562 B12R1.35 CCCCCC(=O)C1CCOC1 1458a_100011219752_100000210326 [0,1,0,1,0,0|2,0,0]=4 11563 B12R1.35 CCCCCN(C)C1CCOC1 2230a_100000223495_100000731011 [0,1,0,1,0,0|2,0,0]=4 11564 B12R1.35 CCCCCN(C)C1CCOC1 2230a_100016988252_100000210326 [0,1,0,1,0,0|2,0,0]=4 11565 B12R1.35 CCCCCN(C)C1CCOC1 269982a_100000223495_100000731011 [0,1,0,1,0,0|2,0,0]=4 11566 B12R1.35 CCCCCN(C)C1CCOC1 269982a_100016988252_100000210215 [0,1,0,1,0,0|2,0,0]=4 11567 B12R1.35 CCCCCN(C)C1CCOC1 270004a_100000223495_100000752484 [0,1,0,1,0,0|2,0,0]=4 11568 B12R1.35 CCCCCN(C)C1CCOC1 34a_100016988252_100000718602 [0,1,0,1,0,0|2,0,0]=4 11569 B12R1.35 CCOCCC(=O)C1CCCC1 1458a_100000210718_100011215890 [0,1,0,1,0,0|2,0,0]=4 11570 B12R1.35 CCOCCC(=O)C1CCCC1 1458a_100000749530_100000179811 [0,1,0,1,0,0|2,0,0]=4 11571 B12R1.35 CCOCCC(=O)C1CCOC1 1458a_100000749530_100000690089 [0,1,0,1,0,0|1,0,0]=3 11572 B12R1.35 CCOCCC(=O)C1CCOC1 1458a_100011219752_100011215890 [0,1,0,1,0,0|1,0,0]=3 11573 B12R1.35 CCOCCN(C)C1CCCC1 2230a_100000207505_100011215890 [0,1,0,1,0,0|2,0,0]=4 11574 B12R1.35 CCOCCN(C)C1CCCC1 269982a_100000207505_100011215890 [0,1,0,1,0,0|2,0,0]=4 11575 B12R1.35 CCOCCN(C)C1CCCC1 34a_100000207505_100000210147 [0,1,0,1,0,0|2,0,0]=4 11576 B12R1.35 CCOCCN(C)C1CCOC1 2230a_100016988252_100011215890 [0,1,0,1,0,0|1,0,0]=3 11577 B12R1.35 CCOCCN(C)C1CCOC1 269982a_100016988252_100011215890 [0,1,0,1,0,0|1,0,0]=3 11578 B12R1.35 CCOCCN(C)C1CCOC1 34a_100016988252_100000210147 [0,1,0,1,0,0|1,0,0]=3 11579 B12R1.35 CCSCCC(=O)C1CCOC1 1458a_100000230768_100000690089 [0,1,0,1,0,0|1,1,0]=4 11580 B12R1.35 CCSCCC(=O)C1CCOC1 1458a_100011219752_100000757381 [0,1,0,1,0,0|1,1,0]=4 11581 B12R1.35 CCSCCN(C)C1CCOC1 2230a_100016988252_100000757381 [0,1,0,1,0,0|1,1,0]=4 11582 B12R1.35 CCSCCN(C)C1CCOC1 269982a_100016988252_100000757381 [0,1,0,1,0,0|1,1,0]=4 11583 B12R1.35 CCSCCN(C)C1CCOC1 34a_100016988252_100000757381 [0,1,0,1,0,0|1,1,0]=4 11584 B12R1.481 CCOCCC(=O)C1CC1CC 1458a_200011661523_100011215890 [0,1,0,1,0,0|2,0,0]=4 11585 B12R1.483 CCCCCC(=O)CC1CCO1 1458a_100000212188_100000103362 [0,1,0,1,0,0|2,0,0]=4 11586 B12R1.483 CCCCCN(C)CC1CCO1 2230a_100000223495_100000103362 [0,1,0,1,0,0|2,0,0]=4 11587 B12R1.483 CCCCCN(C)CC1CCO1 269982a_100000223495_100000103362 [0,1,0,1,0,0|2,0,0]=4 11588 B12R1.483 CCOCCC(=O)CC1CCC1 1458a_100000749530_100000763275 [0,1,0,1,0,0|2,0,0]=4 11589 B12R1.483 CCOCCC(=O)CC1CCC1 1458a_100000763092_100011215890 [0,1,0,1,0,0|2,0,0]=4 11590 B12R1.483 CCOCCC(=O)CC1CCO1 1458a_100000749530_100000103362 [0,1,0,1,0,0|1,0,0]=3 11591 B12R1.483 CCOCCN(C)CC1CCC1 2230a_200000750244_100011215890 [0,1,0,1,0,0|2,0,0]=4 11592 B12R1.483 CCOCCN(C)CC1CCC1 269982a_200000750244_100011215890 [0,1,0,1,0,0|2,0,0]=4 11593 B12R1.483 CCOCCN(C)CC1CCC1 34a_200000750244_100000210147 [0,1,0,1,0,0|2,0,0]=4 11594 B12R1.483 CCSCCC(=O)CC1CCO1 1458a_100000230768_100000103362 [0,1,0,1,0,0|1,1,0]=4 11595 B12R1.484 CCOCCC(=O)CCC1CC1 1458a_100000749530_100000694398 [0,1,0,1,0,0|2,0,0]=4 11596 B12R1.484 CCOCCC(=O)CCC1CC1 1458a_100000756386_100011215890 [0,1,0,1,0,0|2,0,0]=4 11597 B12R1.75 CCC1CCCCC1OC(C)C 34a_100000210738_100000210206 [0,1,0,1,0,0|2,0,0]=4 11598 B12R1.75 CCC1CCCCC1OC(C)C 7a_100000210738_100000210206 [0,1,0,1,0,0|2,0,0]=4 11599 B12R1.75 CCN1CCOCC1CC(C)C 2230a_100000755734_100000210202 [0,1,0,1,0,0|2,0,0]=4 11600 B12R1.75 CCN1CCOCC1CC(C)C 269982a_100000755734_100000204670 [0,1,0,1,0,0|2,0,0]=4 11601 B12R1.75 CCN1CCOCC1CC(C)C 34a_100000755734_100000210202 [0,1,0,1,0,0|2,0,0]=4 11602 B12R1.81 CCN1CCC[C@@H]1COC(C)C 34a_100011739246_100000210206 [0,1,0,1,0,0|2,0,0]=4 11603 B12R1.81 CCN1CCC[C@@H]1COC(C)C 7a_100011739246_100000210206 [0,1,0,1,0,0|2,0,0]=4 11604 B12R1.130 CC(C)OCCN1CCC[C@@H]1C 2230a_100020605311_100000211751 [0,1,0,1,0,0|2,0,0]=4 11605 B12R1.130 CC(C)OCCN1CCC[C@@H]1C 269982a_100020605311_100000211751 [0,1,0,1,0,0|2,0,0]=4 11606 B12R1.130 CC(C)OCCN1CCC[C@H]1C 2230a_100015189458_100000211751 [0,1,0,1,0,0|2,0,0]=4 11607 B12R1.130 CC(C)OCCN1CCC[C@H]1C 269982a_100015189458_100000211751 [0,1,0,1,0,0|2,0,0]=4 11608 B12R1.130 CC(C)OCCN1CCC[C@H]1C 34a_100015189458_100000211751 [0,1,0,1,0,0|2,0,0]=4 11609 B12R1.130 CC(C)OCCN1CCSC1C 2230a_200011216479_100000211751 [0,1,0,1,0,0|1,1,0]=4 11610 B12R1.130 CC(C)OCCN1CCSC1C 269982a_200011216479_100000211751 [0,1,0,1,0,0|1,1,0]=4 11611 B12R1.130 CC(C)OCCN1CCSC1C 34a_200011216479_100000211751 [0,1,0,1,0,0|1,1,0]=4 11612 B12R1.143 CC(=O)OCCOCC1CC1C 34a_100000744939_100009814007 [0,1,0,1,0,0|1,0,1]=4 11613 B12R1.143 CC(=O)OCCOCC1CC1C 7a_100000744939_100009814007 [0,1,0,1,0,0|1,0,1]=4 11614 B12R1.143 CC(C)CCCOCC1CC1C 34a_100000744939_100011214892 [0,1,0,1,0,0|2,0,0]=4 11615 B12R1.143 CC(C)CCCOCC1CC1C 7a_100000744939_100011214892 [0,1,0,1,0,0|2,0,0]=4 11616 B12R1.143 CC(C)OCCOCC1CC1C 34a_100000744939_100000211751 [0,1,0,1,0,0|1,0,0]=3 11617 B12R1.143 CC(C)OCCOCC1CC1C 7a_100000744939_100000211751 [0,1,0,1,0,0|1,0,0]=3 11618 B12R1.143 CC(C)SCCOCC1CC1C 34a_100000744939_100000730970 [0,1,0,1,0,0|1,1,0]=4 11619 B12R1.143 CC(C)SCCOCC1CC1C 7a_100000744939_100000730970 [0,1,0,1,0,0|1,1,0]=4 11620 B12R1.143 CC(O)CCCOCC1CC1C 34a_100000744939_200000718107 [0,1,0,1,0,0|2,0,0]=4 11621 B12R1.143 CC(O)CCCOCC1CC1C 7a_100000744939_200000718107 [0,1,0,1,0,0|2,0,0]=4 11622 B12R1.252 CC(=O)OCCN1CCOCC1 269982a_100015191051_100009814007 [0,1,0,1,0,0|1,0,1]=4 11623 B12R1.252 CC(=O)OCCN1CCOCC1 34a_100015191051_100009814007 [0,1,0,1,0,0|1,0,1]=4 11624 B12R1.252 CC(C)CCCN1CCOCC1 2230a_100015191051_100011214892 [0,1,0,1,0,0|2,0,0]=4 11625 B12R1.252 CC(C)CCCN1CCOCC1 269982a_100015191051_100011214892 [0,1,0,1,0,0|2,0,0]=4 11626 B12R1.252 CC(C)CCCN1CCOCC1 34a_100015191051_100011214892 [0,1,0,1,0,0|2,0,0]=4 11627 B12R1.252 CC(C)NCCC1CCOCC1 2230a_100000755988_100000210206 [0,1,0,1,0,0|2,0,0]=4 11628 B12R1.252 CC(C)NCCC1CCOCC1 2230a_100138425928_100011934994 [0,1,0,1,0,0|2,0,0]=4 11629 B12R1.252 CC(C)NCCC1CCOCC1 34a_100000755988_100000210206 [0,1,0,1,0,0|2,0,0]=4 11630 B12R1.252 CC(C)NCCC1CCOCC1 34a_100138425928_100011934994 [0,1,0,1,0,0|2,0,0]=4 11631 B12R1.252 CC(C)NCCN1CCOCC1 2230a_100138425928_100025781966 [0,1,0,1,0,0|2,0,0]=4 11632 B12R1.252 CC(C)OCCC1CCCCC1 34a_100000212225_100011209188 [0,1,0,1,0,0|2,0,0]=4 11633 B12R1.252 CC(C)OCCC1CCCCC1 34a_100011217863_100000210206 [0,1,0,1,0,0|2,0,0]=4 11634 B12R1.252 CC(C)OCCC1CCCCC1 7a_100011217863_100000210206 [0,1,0,1,0,0|2,0,0]=4 11635 B12R1.252 CC(C)OCCC1CCNCC1 34a_100015190746_100000210206 [0,1,0,1,0,0|2,0,0]=4 11636 B12R1.252 CC(C)OCCC1CCOCC1 34a_100000212225_100011934994 [0,1,0,1,0,0|1,0,0]=3 11637 B12R1.252 CC(C)OCCC1CCOCC1 34a_100011933979_100000210206 [0,1,0,1,0,0|1,0,0]=3 11638 B12R1.252 CC(C)OCCC1CCOCC1 7a_100011933979_100000210206 [0,1,0,1,0,0|1,0,0]=3 11639 B12R1.252 CC(C)OCCN1CCCCC1 34a_100000212225_100000739454 [0,1,0,1,0,0|2,0,0]=4 11640 B12R1.252 CC(C)OCCN1CCOCC1 2230a_100015191051_100000211751 [0,1,0,1,0,0|1,0,0]=3 11641 B12R1.252 CC(C)OCCN1CCOCC1 269982a_100015191051_100000211751 [0,1,0,1,0,0|1,0,0]=3 11642 B12R1.252 CC(C)OCCN1CCOCC1 34a_100015191051_100000211751 [0,1,0,1,0,0|1,0,0]=3 11643 B12R1.252 CC(C)OCCN1CCSCC1 2230a_100000737611_100000211751 [0,1,0,1,0,0|1,1,0]=4 11644 B12R1.252 CC(C)OCCN1CCSCC1 269982a_100000737611_100000211751 [0,1,0,1,0,0|1,1,0]=4 11645 B12R1.252 CC(C)OCCN1CCSCC1 7a_100000686052_100000210206 [0,1,0,1,0,0|1,1,0]=4 11646 B12R1.252 CC(C)OCNC1CCOCC1 2230a_100000741149_100000709892 [0,1,0,1,0,0|2,0,0]=4 11647 B12R1.252 CC(C)OCNC1CCOCC1 34a_100000741149_100000709892 [0,1,0,1,0,0|2,0,0]=4 11648 B12R1.252 CC(C)OCOC1CCOCC1 34a_100000744328_100000709892 [0,1,0,1,0,0|2,0,0]=4 11649 B12R1.252 CC(C)OCSC1CCOCC1 62a_100000709892_100011324220 [0,1,0,1,0,0|2,0,0]=4 11650 B12R1.252 CC(C)SCCC1CCOCC1 62a_100000210206_100011934994 [0,1,0,1,0,0|1,1,0]=4 11651 B12R1.252 CC(C)SCCC1CCOCC1 62a_100011934994_100000210206 [0,1,0,1,0,0|1,1,0]=4 11652 B12R1.252 CC(C)SCCN1CCOCC1 2230a_100015191051_100000730970 [0,1,0,1,0,0|1,1,0]=4 11653 B12R1.252 CC(C)SCCN1CCOCC1 269982a_100015191051_100000730970 [0,1,0,1,0,0|1,1,0]=4 11654 B12R1.252 CC(C)SCCN1CCOCC1 34a_100015191051_100000730970 [0,1,0,1,0,0|1,1,0]=4 11655 B12R1.252 CC(C)SCCN1CCOCC1 62a_100000210206_100000211760 [0,1,0,1,0,0|1,1,0]=4 11656 B12R1.252 CC(O)CCCN1CCOCC1 2230a_100015191051_200000718107 [0,1,0,1,0,0|2,0,0]=4 11657 B12R1.252 CC(O)CCCN1CCOCC1 269982a_100015191051_200000718107 [0,1,0,1,0,0|2,0,0]=4 11658 B12R1.252 CC(O)CCCN1CCOCC1 34a_100015191051_200000718107 [0,1,0,1,0,0|2,0,0]=4 11659 B12R1.255 CC(=CCCO[C@H]1CCOC1)C 34a_100000717292_100011217483 [0,1,0,1,0,0|1,0,1]=4 11660 B12R1.255 CC(=O)CCCOC1CCOC1 34a_100000759063_100000690089 [0,1,0,1,0,0|1,0,1]=4 11661 B12R1.255 CC(=O)CCCOC1CCOC1 7a_100000759063_100000731011 [0,1,0,1,0,0|1,0,1]=4 11662 B12R1.255 CC(=O)CCCO[C@H]1CCOC1 34a_100000717292_100000685027 [0,1,0,1,0,0|1,0,1]=4 11663 B12R1.255 CC(=O)NCCOC1CCOC1 34a_100000158858_100000690089 [0,1,0,1,0,0|1,0,1]=4 11664 B12R1.255 CC(=O)OCCN[C@H]1CCOC1 34a_100015188467_100009814007 [0,1,0,1,0,0|1,0,1]=4 11665 B12R1.255 CC(=O)OCCOC1CCCC1 34a_100000210269_100009814007 [0,1,0,1,0,0|1,0,1]=4 11666 B12R1.255 CC(=O)OCCOC1CCCC1 7a_100000210269_100009814007 [0,1,0,1,0,0|1,0,1]=4 11667 B12R1.255 CC(=O)OCCOC1CCSC1 7a_100011232664_100009814007 [0,1,0,1,0,0|0,1,1]=4 11668 B12R1.255 CC(=O)OCCO[C@H]1CCOC1 34a_100000717292_100009814007 [0,1,0,1,0,0|0,0,1]=3 11669 B12R1.255 CC(=O)OCCSC1CCOC1 62a_100009814007_100000690089 [0,1,0,1,0,0|0,1,1]=4 11670 B12R1.255 CC(C)CCCNC1CCOC1 2230a_200000737386_100000731011 [0,1,0,1,0,0|2,0,0]=4 11671 B12R1.255 CC(C)CCCNC1CCOC1 270004a_200000737386_100000752484 [0,1,0,1,0,0|2,0,0]=4 11672 B12R1.255 CC(C)CCCNC1CCOC1 34a_200000737386_100000690089 [0,1,0,1,0,0|2,0,0]=4 11673 B12R1.255 CC(C)CCCN[C@@H]1CCOC1 2230a_200015188469_100011214892 [0,1,0,1,0,0|2,0,0]=4 11674 B12R1.255 CC(C)CCCN[C@H]1CCOC1 2230a_100015188467_100011214892 [0,1,0,1,0,0|2,0,0]=4 11675 B12R1.255 CC(C)CCCN[C@H]1CCOC1 34a_100015188467_100011214892 [0,1,0,1,0,0|2,0,0]=4 11676 B12R1.255 CC(C)CCCOC1CCCC1 34a_100000210269_100011214892 [0,1,0,1,0,0|2,0,0]=4 11677 B12R1.255 CC(C)CCCOC1CCCC1 34a_100000210774_100000179811 [0,1,0,1,0,0|2,0,0]=4 11678 B12R1.255 CC(C)CCCOC1CCCC1 7a_100000210269_100011214892 [0,1,0,1,0,0|2,0,0]=4 11679 B12R1.255 CC(C)CCCOC1CCCC1 7a_100000210774_100000179811 [0,1,0,1,0,0|2,0,0]=4 11680 B12R1.255 CC(C)CCCOC1CCOC1 34a_100000210774_100000690089 [0,1,0,1,0,0|1,0,0]=3 11681 B12R1.255 CC(C)CCCOC1CCOC1 7a_100000210774_100000731011 [0,1,0,1,0,0|1,0,0]=3 11682 B12R1.255 CC(C)CCCOC1CCSC1 7a_100011232664_100011214892 [0,1,0,1,0,0|1,1,0]=4 11683 B12R1.255 CC(C)CCCO[C@H]1CCOC1 34a_100000717292_100011214892 [0,1,0,1,0,0|1,0,0]=3 11684 B12R1.255 CC(C)CCCSC1CCOC1 62a_100011214892_100000690089 [0,1,0,1,0,0|1,1,0]=4 11685 B12R1.255 CC(C)NCCOC1CCCC1 34a_100000224655_100000179811 [0,1,0,1,0,0|2,0,0]=4 11686 B12R1.255 CC(C)NCCOC1CCCC1 34a_100000741755_100000210206 [0,1,0,1,0,0|2,0,0]=4 11687 B12R1.255 CC(C)NCCOC1CCOC1 34a_100000224655_100000690089 [0,1,0,1,0,0|1,0,0]=3 11688 B12R1.255 CC(C)OCCCC1CCCC1 34a_100000212225_100011713738 [0,1,0,1,0,0|2,0,0]=4 11689 B12R1.255 CC(C)OCCCC1CCCC1 34a_100011215328_100000210206 [0,1,0,1,0,0|2,0,0]=4 11690 B12R1.255 CC(C)OCCCC1CCCC1 7a_100011215328_100000210206 [0,1,0,1,0,0|2,0,0]=4 11691 B12R1.255 CC(C)OCCNC1CCCC1 2230a_100000211070_100000211751 [0,1,0,1,0,0|2,0,0]=4 11692 B12R1.255 CC(C)OCCNC1CCCC1 2230a_100000701111_100000179811 [0,1,0,1,0,0|2,0,0]=4 11693 B12R1.255 CC(C)OCCNC1CCCC1 270004a_100000701111_100000210133 [0,1,0,1,0,0|2,0,0]=4 11694 B12R1.255 CC(C)OCCNC1CCCC1 34a_100000211070_100000211751 [0,1,0,1,0,0|2,0,0]=4 11695 B12R1.255 CC(C)OCCNC1CCCC1 34a_100000701111_100000179811 [0,1,0,1,0,0|2,0,0]=4 11696 B12R1.255 CC(C)OCCNC1CCCC1 34a_200000200444_100000210206 [0,1,0,1,0,0|2,0,0]=4 11697 B12R1.255 CC(C)OCCNC1CCOC1 2230a_100000701111_100000731011 [0,1,0,1,0,0|1,0,0]=3 11698 B12R1.255 CC(C)OCCNC1CCOC1 270004a_100000701111_100000752484 [0,1,0,1,0,0|1,0,0]=3 11699 B12R1.255 CC(C)OCCNC1CCOC1 34a_100000701111_100000690089 [0,1,0,1,0,0|1,0,0]=3 11700 B12R1.255 CC(C)OCCNC1CCSC1 270004a_100000701111_100000212027 [0,1,0,1,0,0|1,1,0]=4 11701 B12R1.255 CC(C)OCCN[C@@H]1CCOC1 2230a_200015188469_100000211751 [0,1,0,1,0,0|1,0,0]=3 11702 B12R1.255 CC(C)OCCN[C@H]1CCOC1 2230a_100015188467_100000211751 [0,1,0,1,0,0|1,0,0]=3 11703 B12R1.255 CC(C)OCCN[C@H]1CCOC1 34a_100015188467_100000211751 [0,1,0,1,0,0|1,0,0]=3 11704 B12R1.255 CC(C)OCCOC1CCCC1 34a_100000210269_100000211751 [0,1,0,1,0,0|1,0,0]=3 11705 B12R1.255 CC(C)OCCOC1CCCC1 34a_100000211219_100000179811 [0,1,0,1,0,0|1,0,0]=3 11706 B12R1.255 CC(C)OCCOC1CCCC1 34a_100000738311_100000210206 [0,1,0,1,0,0|1,0,0]=3 11707 B12R1.255 CC(C)OCCOC1CCCC1 7a_100000210269_100000211751 [0,1,0,1,0,0|1,0,0]=3 11708 B12R1.255 CC(C)OCCOC1CCCC1 7a_100000211219_100000179811 [0,1,0,1,0,0|1,0,0]=3 11709 B12R1.255 CC(C)OCCOC1CCCC1 7a_100000738311_100000210206 [0,1,0,1,0,0|1,0,0]=3 11710 B12R1.255 CC(C)OCCOC1CCCO1 34a_100000085407_100000211751 [0,1,0,1,0,0|2,0,0]=4 11711 B12R1.255 CC(C)OCCOC1CCOC1 34a_100000211219_100000690089 [0,1,0,1,0,0|0,0,0]=2 11712 B12R1.255 CC(C)OCCOC1CCOC1 7a_100000211219_100000731011 [0,1,0,1,0,0|0,0,0]=2 11713 B12R1.255 CC(C)OCCOC1CCSC1 7a_100011232664_100000211751 [0,1,0,1,0,0|0,1,0]=3 11714 B12R1.255 CC(C)OCCO[C@H]1CCOC1 34a_100000717292_100000211751 [0,1,0,1,0,0|0,0,0]=2 11715 B12R1.255 CC(C)OCCSC1CCCC1 62a_100000211751_100000179811 [0,1,0,1,0,0|1,1,0]=4 11716 B12R1.255 CC(C)OCCSC1CCCC1 62a_100011217020_100000211751 [0,1,0,1,0,0|1,1,0]=4 11717 B12R1.255 CC(C)OCCSC1CCOC1 62a_100000211751_100000690089 [0,1,0,1,0,0|0,1,0]=3 11718 B12R1.255 CC(C)OCNCC1CCOC1 2230a_100000737293_100000709892 [0,1,0,1,0,0|2,0,0]=4 11719 B12R1.255 CC(C)OCNCC1CCOC1 34a_100000737293_100000709892 [0,1,0,1,0,0|2,0,0]=4 11720 B12R1.255 CC(C)OCOCC1CCOC1 34a_100000740260_100000709892 [0,1,0,1,0,0|2,0,0]=4 11721 B12R1.255 CC(C)OCSCC1CCOC1 62a_100000702531_100000709892 [0,1,0,1,0,0|2,0,0]=4 11722 B12R1.255 CC(C)OCSCC1CCOC1 62a_100000709892_100000702531 [0,1,0,1,0,0|2,0,0]=4 11723 B12R1.255 CC(C)SCCNC1CCOC1 2230a_100000731138_100000731011 [0,1,0,1,0,0|1,1,0]=4 11724 B12R1.255 CC(C)SCCNC1CCOC1 270004a_100000731138_100000752484 [0,1,0,1,0,0|1,1,0]=4 11725 B12R1.255 CC(C)SCCNC1CCOC1 34a_100000731138_100000690089 [0,1,0,1,0,0|1,1,0]=4 11726 B12R1.255 CC(C)SCCN[C@@H]1CCOC1 2230a_200015188469_100000730970 [0,1,0,1,0,0|1,1,0]=4 11727 B12R1.255 CC(C)SCCN[C@H]1CCOC1 2230a_100015188467_100000730970 [0,1,0,1,0,0|1,1,0]=4 11728 B12R1.255 CC(C)SCCN[C@H]1CCOC1 34a_100015188467_100000730970 [0,1,0,1,0,0|1,1,0]=4 11729 B12R1.255 CC(C)SCCOC1CCCC1 34a_100000210269_100000730970 [0,1,0,1,0,0|1,1,0]=4 11730 B12R1.255 CC(C)SCCOC1CCCC1 34a_200011212901_100000179811 [0,1,0,1,0,0|1,1,0]=4 11731 B12R1.255 CC(C)SCCOC1CCCC1 7a_100000210269_100000730970 [0,1,0,1,0,0|1,1,0]=4 11732 B12R1.255 CC(C)SCCOC1CCCC1 7a_200011212901_100000179811 [0,1,0,1,0,0|1,1,0]=4 11733 B12R1.255 CC(C)SCCOC1CCOC1 34a_200011212901_100000690089 [0,1,0,1,0,0|0,1,0]=3 11734 B12R1.255 CC(C)SCCOC1CCOC1 7a_200011212901_100000731011 [0,1,0,1,0,0|0,1,0]=3 11735 B12R1.255 CC(C)SCCOC1CCSC1 7a_100011232664_100000730970 [0,1,0,1,0,0|0,2,0]=4 11736 B12R1.255 CC(C)SCCO[C@H]1CCOC1 34a_100000717292_100000730970 [0,1,0,1,0,0|0,1,0]=3 11737 B12R1.255 CC(C)SCCSC1CCOC1 62a_100000730970_100000690089 [0,1,0,1,0,0|0,2,0]=4 11738 B12R1.255 CC(O)CCCN[C@@H]1CCOC1 2230a_200015188469_200000718107 [0,1,0,1,0,0|2,0,0]=4 11739 B12R1.255 CC(O)CCCN[C@H]1CCOC1 2230a_100015188467_200000718107 [0,1,0,1,0,0|2,0,0]=4 11740 B12R1.255 CC(O)CCCN[C@H]1CCOC1 34a_100015188467_200000718107 [0,1,0,1,0,0|2,0,0]=4 11741 B12R1.255 CC(O)CCCOC1CCCC1 34a_100000210269_200000718107 [0,1,0,1,0,0|2,0,0]=4 11742 B12R1.255 CC(O)CCCOC1CCCC1 7a_100000210269_200000718107 [0,1,0,1,0,0|2,0,0]=4 11743 B12R1.255 CC(O)CCCOC1CCSC1 7a_100011232664_200000718107 [0,1,0,1,0,0|1,1,0]=4 11744 B12R1.255 CC(O)CCCO[C@H]1CCOC1 34a_100000717292_200000718107 [0,1,0,1,0,0|1,0,0]=3 11745 B12R1.255 CC(O)CCCSC1CCOC1 62a_200000718107_100000690089 [0,1,0,1,0,0|1,1,0]=4 11746 B12R1.255 NC(=O)OCCOC1CCOC1 7a_100000766696_100000731011 [0,1,0,1,0,0|1,0,1]=4 11747 B12R1.255 NC(=O)OCCO[C@H]1CCOC1 34a_100000717292_200011214921 [0,1,0,1,0,0|1,0,1]=4 11748 B12R1.257 CC(=CCCOCC1CCO1)C 34a_100000039022_100011217483 [0,1,0,1,0,0|1,0,1]=4 11749 B12R1.257 CC(=O)CCCOCC1CCO1 34a_100000039022_100000685027 [0,1,0,1,0,0|1,0,1]=4 11750 B12R1.257 CC(=O)CCCOCC1CCO1 34a_100000759063_100000103362 [0,1,0,1,0,0|1,0,1]=4 11751 B12R1.257 CC(=O)CCCOCC1CCO1 7a_100000759063_100000103362 [0,1,0,1,0,0|1,0,1]=4 11752 B12R1.257 CC(=O)NCCOCC1CCO1 34a_100000158858_100000103362 [0,1,0,1,0,0|1,0,1]=4 11753 B12R1.257 CC(=O)OCCNC[C@@H]1CCO1 34a_100020831831_100009814007 [0,1,0,1,0,0|1,0,1]=4 11754 B12R1.257 CC(=O)OCCOCC1CCC1 34a_100000760304_100009814007 [0,1,0,1,0,0|1,0,1]=4 11755 B12R1.257 CC(=O)OCCOCC1CCO1 34a_100000039022_100009814007 [0,1,0,1,0,0|0,0,1]=3 11756 B12R1.257 CC(=O)OCCSCC1CCO1 62a_100000103362_100009814007 [0,1,0,1,0,0|0,1,1]=4 11757 B12R1.257 CC(=O)OCCSCC1CCO1 62a_100009814007_100000103362 [0,1,0,1,0,0|0,1,1]=4 11758 B12R1.257 CC(C)CCCNCC1CCO1 2230a_200000737386_100000103362 [0,1,0,1,0,0|2,0,0]=4 11759 B12R1.257 CC(C)CCCNCC1CCO1 34a_200000737386_100000103362 [0,1,0,1,0,0|2,0,0]=4 11760 B12R1.257 CC(C)CCCNC[C@@H]1CCO1 2230a_100020831831_100011214892 [0,1,0,1,0,0|2,0,0]=4 11761 B12R1.257 CC(C)CCCNC[C@@H]1CCO1 34a_100020831831_100011214892 [0,1,0,1,0,0|2,0,0]=4 11762 B12R1.257 CC(C)CCCOCC1CCC1 34a_100000210774_100000763275 [0,1,0,1,0,0|2,0,0]=4 11763 B12R1.257 CC(C)CCCOCC1CCC1 34a_100000760304_100011214892 [0,1,0,1,0,0|2,0,0]=4 11764 B12R1.257 CC(C)CCCOCC1CCC1 7a_100000210774_100000763275 [0,1,0,1,0,0|2,0,0]=4 11765 B12R1.257 CC(C)CCCOCC1CCO1 34a_100000039022_100011214892 [0,1,0,1,0,0|1,0,0]=3 11766 B12R1.257 CC(C)CCCOCC1CCO1 34a_100000210774_100000103362 [0,1,0,1,0,0|1,0,0]=3 11767 B12R1.257 CC(C)CCCOCC1CCO1 7a_100000210774_100000103362 [0,1,0,1,0,0|1,0,0]=3 11768 B12R1.257 CC(C)CCCSCC1CCO1 62a_100000103362_100011214892 [0,1,0,1,0,0|1,1,0]=4 11769 B12R1.257 CC(C)CCCSCC1CCO1 62a_100011214892_100000103362 [0,1,0,1,0,0|1,1,0]=4 11770 B12R1.257 CC(C)NCCOCC1CCC1 34a_100000224655_100000763275 [0,1,0,1,0,0|2,0,0]=4 11771 B12R1.257 CC(C)NCCOCC1CCO1 34a_100000224655_100000103362 [0,1,0,1,0,0|1,0,0]=3 11772 B12R1.257 CC(C)OCCNCC1CCC1 2230a_100000701111_100000763275 [0,1,0,1,0,0|2,0,0]=4 11773 B12R1.257 CC(C)OCCNCC1CCC1 2230a_100000738700_100000211751 [0,1,0,1,0,0|2,0,0]=4 11774 B12R1.257 CC(C)OCCNCC1CCC1 269862a_100000701111_100000753134 [0,1,0,1,0,0|2,0,0]=4 11775 B12R1.257 CC(C)OCCNCC1CCC1 34a_100000701111_100000763275 [0,1,0,1,0,0|2,0,0]=4 11776 B12R1.257 CC(C)OCCNCC1CCC1 34a_100000738700_100000211751 [0,1,0,1,0,0|2,0,0]=4 11777 B12R1.257 CC(C)OCCNCC1CCO1 2230a_100000701111_100000103362 [0,1,0,1,0,0|1,0,0]=3 11778 B12R1.257 CC(C)OCCNCC1CCO1 34a_100000701111_100000103362 [0,1,0,1,0,0|1,0,0]=3 11779 B12R1.257 CC(C)OCCNC[C@@H]1CCO1 2230a_100020831831_100000211751 [0,1,0,1,0,0|1,0,0]=3 11780 B12R1.257 CC(C)OCCNC[C@@H]1CCO1 34a_100020831831_100000211751 [0,1,0,1,0,0|1,0,0]=3 11781 B12R1.257 CC(C)OCCOCC1CCC1 34a_100000211219_100000763275 [0,1,0,1,0,0|1,0,0]=3 11782 B12R1.257 CC(C)OCCOCC1CCC1 34a_100000760304_100000211751 [0,1,0,1,0,0|1,0,0]=3 11783 B12R1.257 CC(C)OCCOCC1CCC1 7a_100000211219_100000763275 [0,1,0,1,0,0|1,0,0]=3 11784 B12R1.257 CC(C)OCCOCC1CCO1 34a_100000039022_100000211751 [0,1,0,1,0,0|0,0,0]=2 11785 B12R1.257 CC(C)OCCOCC1CCO1 34a_100000211219_100000103362 [0,1,0,1,0,0|0,0,0]=2 11786 B12R1.257 CC(C)OCCOCC1CCO1 7a_100000211219_100000103362 [0,1,0,1,0,0|0,0,0]=2 11787 B12R1.257 CC(C)OCCOCC1CNC1 34a_100016987283_100000211751 [0,1,0,1,0,0|2,0,0]=4 11788 B12R1.257 CC(C)OCCOCC1COC1 34a_100000060846_100000211751 [0,1,0,1,0,0|2,0,0]=4 11789 B12R1.257 CC(C)OCCOCC1COC1 34a_100000211219_100010264016 [0,1,0,1,0,0|2,0,0]=4 11790 B12R1.257 CC(C)OCCOCC1COC1 7a_100000211219_100010264016 [0,1,0,1,0,0|2,0,0]=4 11791 B12R1.257 CC(C)OCCSCC1CCC1 62a_100000211751_100000763275 [0,1,0,1,0,0|1,1,0]=4 11792 B12R1.257 CC(C)OCCSCC1CCC1 62a_100000763275_100000211751 [0,1,0,1,0,0|1,1,0]=4 11793 B12R1.257 CC(C)OCCSCC1CCO1 62a_100000103362_100000211751 [0,1,0,1,0,0|0,1,0]=3 11794 B12R1.257 CC(C)OCCSCC1CCO1 62a_100000211751_100000103362 [0,1,0,1,0,0|0,1,0]=3 11795 B12R1.257 CC(C)SCCNCC1CCO1 2230a_100000731138_100000103362 [0,1,0,1,0,0|1,1,0]=4 11796 B12R1.257 CC(C)SCCNCC1CCO1 34a_100000731138_100000103362 [0,1,0,1,0,0|1,1,0]=4 11797 B12R1.257 CC(C)SCCNC[C@@H]1CCO1 2230a_100020831831_100000730970 [0,1,0,1,0,0|1,1,0]=4 11798 B12R1.257 CC(C)SCCNC[C@@H]1CCO1 34a_100020831831_100000730970 [0,1,0,1,0,0|1,1,0]=4 11799 B12R1.257 CC(C)SCCOCC1CCC1 34a_100000760304_100000730970 [0,1,0,1,0,0|1,1,0]=4 11800 B12R1.257 CC(C)SCCOCC1CCC1 34a_200011212901_100000763275 [0,1,0,1,0,0|1,1,0]=4 11801 B12R1.257 CC(C)SCCOCC1CCC1 7a_200011212901_100000763275 [0,1,0,1,0,0|1,1,0]=4 11802 B12R1.257 CC(C)SCCOCC1CCO1 34a_100000039022_100000730970 [0,1,0,1,0,0|0,1,0]=3 11803 B12R1.257 CC(C)SCCOCC1CCO1 34a_200011212901_100000103362 [0,1,0,1,0,0|0,1,0]=3 11804 B12R1.257 CC(C)SCCOCC1CCO1 7a_200011212901_100000103362 [0,1,0,1,0,0|0,1,0]=3 11805 B12R1.257 CC(C)SCCSCC1CCO1 62a_100000103362_100000730970 [0,1,0,1,0,0|0,2,0]=4 11806 B12R1.257 CC(C)SCCSCC1CCO1 62a_100000730970_100000103362 [0,1,0,1,0,0|0,2,0]=4 11807 B12R1.257 CC(O)CCCNC[C@@H]1CCO1 2230a_100020831831_200000718107 [0,1,0,1,0,0|2,0,0]=4 11808 B12R1.257 CC(O)CCCNC[C@@H]1CCO1 34a_100020831831_200000718107 [0,1,0,1,0,0|2,0,0]=4 11809 B12R1.257 CC(O)CCCOCC1CCC1 34a_100000760304_200000718107 [0,1,0,1,0,0|2,0,0]=4 11810 B12R1.257 CC(O)CCCOCC1CCO1 34a_100000039022_200000718107 [0,1,0,1,0,0|1,0,0]=3 11811 B12R1.257 CC(O)CCCSCC1CCO1 62a_100000103362_200000718107 [0,1,0,1,0,0|1,1,0]=4 11812 B12R1.257 CC(O)CCCSCC1CCO1 62a_200000718107_100000103362 [0,1,0,1,0,0|1,1,0]=4 11813 B12R1.257 NC(=O)OCCOCC1CCO1 34a_100000039022_200011214921 [0,1,0,1,0,0|1,0,1]=4 11814 B12R1.257 NC(=O)OCCOCC1CCO1 7a_100000766696_100000103362 [0,1,0,1,0,0|1,0,1]=4 11815 B12R1.283 CCCC1COCCN1C(C)C 2230a_102495339903_100000210206 [0,1,0,1,0,0|2,0,0]=4 11816 B12R1.283 CCCC1COCCN1C(C)C 269982a_102495339903_100000210206 [0,1,0,1,0,0|2,0,0]=4 11817 B12R1.283 CCCC1COCCN1C(C)C 34a_102495339903_100000210206 [0,1,0,1,0,0|2,0,0]=4 11818 B12R1.283 CCOC1CCCCC1C(C)C 34a_100011709184_100000210202 [0,1,0,1,0,0|2,0,0]=4 11819 B12R1.283 CCOC1CCCCC1C(C)C 7a_100011709184_100000210202 [0,1,0,1,0,0|2,0,0]=4 11820 B12R1.390 CC(=O)OCCOCCC1CC1 34a_100000754188_100009814007 [0,1,0,1,0,0|1,0,1]=4 11821 B12R1.390 CC(=O)OCCOCCC1CC1 7a_100000754188_100009814007 [0,1,0,1,0,0|1,0,1]=4 11822 B12R1.390 CC(C)CCCOCCC1CC1 34a_100000210774_100000694398 [0,1,0,1,0,0|2,0,0]=4 11823 B12R1.390 CC(C)CCCOCCC1CC1 34a_100000754188_100011214892 [0,1,0,1,0,0|2,0,0]=4 11824 B12R1.390 CC(C)CCCOCCC1CC1 7a_100000210774_100000764125 [0,1,0,1,0,0|2,0,0]=4 11825 B12R1.390 CC(C)CCCOCCC1CC1 7a_100000754188_100011214892 [0,1,0,1,0,0|2,0,0]=4 11826 B12R1.390 CC(C)NCCOCCC1CC1 34a_100000224655_100000694398 [0,1,0,1,0,0|2,0,0]=4 11827 B12R1.390 CC(C)OCCNCCC1CC1 2230a_100000701111_100000694398 [0,1,0,1,0,0|2,0,0]=4 11828 B12R1.390 CC(C)OCCNCCC1CC1 34a_100000701111_100000694398 [0,1,0,1,0,0|2,0,0]=4 11829 B12R1.390 CC(C)OCCNCCC1CC1 34a_100000764129_100000211751 [0,1,0,1,0,0|2,0,0]=4 11830 B12R1.390 CC(C)OCCOCCC1CC1 34a_100000211219_100000694398 [0,1,0,1,0,0|1,0,0]=3 11831 B12R1.390 CC(C)OCCOCCC1CC1 34a_100000754188_100000211751 [0,1,0,1,0,0|1,0,0]=3 11832 B12R1.390 CC(C)OCCOCCC1CC1 7a_100000211219_100000764125 [0,1,0,1,0,0|1,0,0]=3 11833 B12R1.390 CC(C)OCCOCCC1CC1 7a_100000754188_100000211751 [0,1,0,1,0,0|1,0,0]=3 11834 B12R1.390 CC(C)OCCOCCC1CO1 34a_100000211219_100000732470 [0,1,0,1,0,0|2,0,0]=4 11835 B12R1.390 CC(C)OCCOCCC1CO1 7a_100000211219_100000732470 [0,1,0,1,0,0|2,0,0]=4 11836 B12R1.390 CC(C)OCCOCC[C@@H]1CO1 34a_100009820653_100000211751 [0,1,0,1,0,0|2,0,0]=4 11837 B12R1.390 CC(C)OCCSCCC1CC1 62a_100000211751_100000764125 [0,1,0,1,0,0|1,1,0]=4 11838 B12R1.390 CC(C)OCCSCCC1CC1 62a_100000764125_100000211751 [0,1,0,1,0,0|1,1,0]=4 11839 B12R1.390 CC(C)SCCOCCC1CC1 34a_100000754188_100000730970 [0,1,0,1,0,0|1,1,0]=4 11840 B12R1.390 CC(C)SCCOCCC1CC1 34a_200011212901_100000694398 [0,1,0,1,0,0|1,1,0]=4 11841 B12R1.390 CC(C)SCCOCCC1CC1 7a_100000754188_100000730970 [0,1,0,1,0,0|1,1,0]=4 11842 B12R1.390 CC(C)SCCOCCC1CC1 7a_200011212901_100000764125 [0,1,0,1,0,0|1,1,0]=4 11843 B12R1.390 CC(O)CCCOCCC1CC1 34a_100000754188_200000718107 [0,1,0,1,0,0|2,0,0]=4 11844 B12R1.390 CC(O)CCCOCCC1CC1 7a_100000754188_200000718107 [0,1,0,1,0,0|2,0,0]=4 11845 B12R1.459 CCOCCN1CCCC1(C)C 2230a_100000761399_100011215890 [0,1,0,1,0,0|2,0,0]=4 11846 B12R1.459 CCOCCN1CCCC1(C)C 269982a_100000761399_100011215890 [0,1,0,1,0,0|2,0,0]=4 11847 B12R1.459 CCOCCN1CCCC1(C)C 34a_100000761399_100000210147 [0,1,0,1,0,0|2,0,0]=4 11848 B12R1.459 CCOCCN1CCSC1(C)C 2230a_100011217261_100011215890 [0,1,0,1,0,0|1,1,0]=4 11849 B12R1.459 CCOCCN1CCSC1(C)C 269982a_100011217261_100011215890 [0,1,0,1,0,0|1,1,0]=4 11850 B12R1.459 CCOCCN1CCSC1(C)C 34a_100011217261_100000210147 [0,1,0,1,0,0|1,1,0]=4 11851 B12R1.1343 CC(C)OCC1CCCCCC1 34a_100000212225_200000696569 [0,1,0,1,0,0|2,0,0]=4 11852 B12R1.1343 CC(C)OCC1CCCCCC1 34a_100000699130_100000210206 [0,1,0,1,0,0|2,0,0]=4 11853 B12R1.1343 CC(C)OCC1CCCCCC1 7a_100000699130_100000210206 [0,1,0,1,0,0|2,0,0]=4 11854 B12R1.1343 CC(C)OCN1CCCOCC1 2230a_100000685342_100000709892 [0,1,0,1,0,0|2,0,0]=4 11855 B12R1.1343 CC(C)OCN1CCCOCC1 269982a_100000685342_100000709892 [0,1,0,1,0,0|2,0,0]=4 11856 B12R1.1343 CC(C)OCN1CCCOCC1 34a_100000685342_100000709892 [0,1,0,1,0,0|2,0,0]=4 11857 B12R1.1392 CC(C)OC1CCCCCCC1 34a_100000210054_100000210206 [0,1,0,1,0,0|2,0,0]=4 11858 B12R1.1392 CC(C)OC1CCCCCCC1 7a_100000210054_100000210206 [0,1,0,1,0,0|2,0,0]=4 11859 B12R1.1995 C=COCCOCC1OC1(C)C 34a_200010283642_100000039644 [0,1,0,1,0,0|0,0,2]=4 11860 B12R1.1995 C=COCCOCC1OC1(C)C 7a_200010283642_100000039644 [0,1,0,1,0,0|0,0,2]=4 11861 B12R1.1995 CC/C=C\COCC1OC1(C)C 34a_200010283642_100103147603 [0,1,0,1,0,0|1,0,1]=4 11862 B12R1.1995 CC/C=C\COCC1OC1(C)C 7a_200010283642_100103147603 [0,1,0,1,0,0|1,0,1]=4 11863 B12R1.1995 CC1(OC1COCCCCF)C 34a_200010283642_100000729493 [0,1,0,1,0,0|2,0,0]=4 11864 B12R1.1995 CC1(OC1COCCCCF)C 7a_200010283642_100000729493 [0,1,0,1,0,0|2,0,0]=4 11865 B12R1.1995 CC1(OC1COCCCCO)C 34a_200010283642_100011216708 [0,1,0,1,0,0|2,0,0]=4 11866 B12R1.1995 CC1(OC1COCCCCO)C 7a_200010283642_100000210776 [0,1,0,1,0,0|2,0,0]=4 11867 B12R1.1995 CCC#CCOCC1OC1(C)C 34a_200010283642_100009813939 [0,1,0,1,0,0|1,0,1]=4 11868 B12R1.1995 CCC#CCOCC1OC1(C)C 7a_200010283642_100009813939 [0,1,0,1,0,0|1,0,1]=4 11869 B12R1.1995 CCCCCOCC1CC1(C)C 34a_100000728257_100000718602 [0,1,0,1,0,0|2,0,0]=4 11870 B12R1.1995 CCCCCOCC1CC1(C)C 7a_100000728257_100000210326 [0,1,0,1,0,0|2,0,0]=4 11871 B12R1.1995 CCCCCOCC1OC1(C)C 34a_200010283642_100000718602 [0,1,0,1,0,0|1,0,0]=3 11872 B12R1.1995 CCCCCOCC1OC1(C)C 7a_200010283642_100000210326 [0,1,0,1,0,0|1,0,0]=3 11873 B12R1.1995 CCOCCOCC1CC1(C)C 34a_100000728257_100000210147 [0,1,0,1,0,0|1,0,0]=3 11874 B12R1.1995 CCOCCOCC1CC1(C)C 7a_100000728257_100011215890 [0,1,0,1,0,0|1,0,0]=3 11875 B12R1.1995 CCOCCOCC1CC1(F)F 34a_100000056500_100000210147 [0,1,0,1,0,0|2,0,0]=4 11876 B12R1.1995 CCOCCOCC1CC1(F)F 34a_100000210136_100009817841 [0,1,0,1,0,0|2,0,0]=4 11877 B12R1.1995 CCOCCOCC1CC1(F)F 7a_100000056500_100011215890 [0,1,0,1,0,0|2,0,0]=4 11878 B12R1.1995 CCOCCOCC1CC1(F)F 7a_100000210136_100009817841 [0,1,0,1,0,0|2,0,0]=4 11879 B12R1.1995 CCOCCOCC1OC1(C)C 34a_200010283642_100000210147 [0,1,0,1,0,0|0,0,0]=2 11880 B12R1.1995 CCOCCOCC1OC1(C)C 7a_200010283642_100011215890 [0,1,0,1,0,0|0,0,0]=2 11881 B12R1.1995 CCSCCOCC1CC1(C)C 34a_100000728257_100000757381 [0,1,0,1,0,0|1,1,0]=4 11882 B12R1.1995 CCSCCOCC1CC1(C)C 7a_100000728257_100000757381 [0,1,0,1,0,0|1,1,0]=4 11883 B12R1.1995 CCSCCOCC1OC1(C)C 34a_200010283642_100000757381 [0,1,0,1,0,0|0,1,0]=3 11884 B12R1.1995 CCSCCOCC1OC1(C)C 7a_200010283642_100000757381 [0,1,0,1,0,0|0,1,0]=3 11885 B12R1.1995 COCCCOCC1OC1(C)C 34a_200010283642_100000740836 [0,1,0,1,0,0|2,0,0]=4 11886 B12R1.1995 COCCCOCC1OC1(C)C 7a_200010283642_100000740836 [0,1,0,1,0,0|2,0,0]=4 11887 B12R2.2 C1CC(CO1)N2CCSCC2 2230a_100000737611_100000731011 [0,0,0,2,0,0|1,1,0]=4 11888 B12R2.2 C1CC(CO1)N2CCSCC2 269982a_100000737611_100000731011 [0,0,0,2,0,0|1,1,0]=4 11889 B12R2.2 C1CC(CO1)N2CCSCC2 270004a_100000737611_100000752484 [0,0,0,2,0,0|1,1,0]=4 11890 B12R2.2 C1CCC(C1)N2CCOCC2 2230a_100015191051_100000179811 [0,0,0,2,0,0|2,0,0]=4 11891 B12R2.2 C1CCC(C1)N2CCOCC2 269982a_100015191051_100000179811 [0,0,0,2,0,0|2,0,0]=4 11892 B12R2.2 C1CCC(C1)N2CCOCC2 270004a_100015191051_100000210133 [0,0,0,2,0,0|2,0,0]=4 11893 B12R2.2 C1CCC(C1)N2CCOCC2 34a_100015191051_100000179811 [0,0,0,2,0,0|2,0,0]=4 11894 B12R2.2 C1CN(CCO1)C2CCOC2 2230a_100015191051_100000731011 [0,0,0,2,0,0|1,0,0]=3 11895 B12R2.2 C1CN(CCO1)C2CCOC2 269982a_100015191051_100000731011 [0,0,0,2,0,0|1,0,0]=3 11896 B12R2.2 C1CN(CCO1)C2CCOC2 270004a_100015191051_100000752484 [0,0,0,2,0,0|1,0,0]=3 11897 B12R2.2 C1CN(CCO1)C2CCOC2 34a_100015191051_100000690089 [0,0,0,2,0,0|1,0,0]=3 11898 B12R2.2 C1CN(CCO1)C2CCSC2 270004a_100015191051_100000212027 [0,0,0,2,0,0|1,1,0]=4 11899 B12R2.10 CC1SCCN1C2CCOC2 2230a_200011216479_100000731011 [0,0,0,2,0,0|1,1,0]=4 11900 B12R2.10 CC1SCCN1C2CCOC2 269982a_200011216479_100000731011 [0,0,0,2,0,0|1,1,0]=4 11901 B12R2.10 CC1SCCN1C2CCOC2 270004a_200011216479_100000752484 [0,0,0,2,0,0|1,1,0]=4 11902 B12R2.10 CC1SCCN1C2CCOC2 34a_200011216479_100000690089 [0,0,0,2,0,0|1,1,0]=4 11903 B12R2.10 C[C@@H]1CCCN1C2CCOC2 2230a_100015189458_100000731011 [0,0,0,2,0,0|2,0,0]=4 11904 B12R2.10 C[C@@H]1CCCN1C2CCOC2 269982a_100015189458_100000731011 [0,0,0,2,0,0|2,0,0]=4 11905 B12R2.10 C[C@@H]1CCCN1C2CCOC2 270004a_100015189458_100000752484 [0,0,0,2,0,0|2,0,0]=4 11906 B12R2.10 C[C@@H]1CCCN1C2CCOC2 34a_100015189458_100000690089 [0,0,0,2,0,0|2,0,0]=4 11907 B12R2.10 C[C@H]1CCCN1C2CCOC2 2230a_100020605311_100000731011 [0,0,0,2,0,0|2,0,0]=4 11908 B12R2.10 C[C@H]1CCCN1C2CCOC2 269982a_100020605311_100000731011 [0,0,0,2,0,0|2,0,0]=4 11909 B12R2.10 C[C@H]1CCCN1C2CCOC2 270004a_100020605311_100000752484 [0,0,0,2,0,0|2,0,0]=4 11910 B12R2.20 CC1CC1COC2CCCC2 34a_100000744939_100000179811 [0,0,0,2,0,0|2,0,0]=4 11911 B12R2.20 CC1CC1COC2CCCC2 7a_100000744939_100000179811 [0,0,0,2,0,0|2,0,0]=4 11912 B12R2.20 CC1CC1COC2CCOC2 34a_100000744939_100000690089 [0,0,0,2,0,0|1,0,0]=3 11913 B12R2.20 CC1CC1COC2CCOC2 7a_100000744939_100000731011 [0,0,0,2,0,0|1,0,0]=3 11914 B12R2.98 C1CC(CO1)N[C@@H]2CCOC2 2230a_200015188469_100000731011 [0,0,0,2,0,0|1,0,0]=3 11915 B12R2.98 C1CC(CO1)N[C@@H]2CCOC2 270004a_200015188469_100000752484 [0,0,0,2,0,0|1,0,0]=3 11916 B12R2.98 C1CC(CO1)N[C@H]2CCOC2 2230a_100015188467_100000731011 [0,0,0,2,0,0|1,0,0]=3 11917 B12R2.98 C1CC(CO1)N[C@H]2CCOC2 270004a_100015188467_100000752484 [0,0,0,2,0,0|1,0,0]=3 11918 B12R2.98 C1CC(CO1)N[C@H]2CCOC2 34a_100015188467_100000690089 [0,0,0,2,0,0|1,0,0]=3 11919 B12R2.98 C1CC(CO1)OC2CCSC2 7a_100011232664_100000731011 [0,0,0,2,0,0|0,1,0]=3 11920 B12R2.98 C1CC(CO1)O[C@H]2CCOC2 34a_100000717292_100000690089 [0,0,0,2,0,0|0,0,0]=2 11921 B12R2.98 C1CCC(C1)NC2CCOC2 2230a_100000211070_100000731011 [0,0,0,2,0,0|2,0,0]=4 11922 B12R2.98 C1CCC(C1)NC2CCOC2 270004a_100000211070_100000752484 [0,0,0,2,0,0|2,0,0]=4 11923 B12R2.98 C1CCC(C1)NC2CCOC2 34a_100000211070_100000690089 [0,0,0,2,0,0|2,0,0]=4 11924 B12R2.98 C1CCC(C1)N[C@@H]2CCOC2 2230a_200015188469_100000179811 [0,0,0,2,0,0|2,0,0]=4 11925 B12R2.98 C1CCC(C1)N[C@@H]2CCOC2 270004a_200015188469_100000210133 [0,0,0,2,0,0|2,0,0]=4 11926 B12R2.98 C1CCC(C1)N[C@H]2CCOC2 2230a_100015188467_100000179811 [0,0,0,2,0,0|2,0,0]=4 11927 B12R2.98 C1CCC(C1)N[C@H]2CCOC2 270004a_100015188467_100000210133 [0,0,0,2,0,0|2,0,0]=4 11928 B12R2.98 C1CCC(C1)N[C@H]2CCOC2 34a_100015188467_100000179811 [0,0,0,2,0,0|2,0,0]=4 11929 B12R2.98 C1CCC(C1)OC2CCCC2 34a_100000210269_100000179811 [0,0,0,2,0,0|2,0,0]=4 11930 B12R2.98 C1CCC(C1)OC2CCCC2 7a_100000210269_100000179811 [0,0,0,2,0,0|2,0,0]=4 11931 B12R2.98 C1CCC(C1)OC2CCOC2 34a_100000210269_100000690089 [0,0,0,2,0,0|1,0,0]=3 11932 B12R2.98 C1CCC(C1)OC2CCOC2 7a_100000210269_100000731011 [0,0,0,2,0,0|1,0,0]=3 11933 B12R2.98 C1CCC(C1)OC2CCSC2 7a_100011232664_100000179811 [0,0,0,2,0,0|1,1,0]=4 11934 B12R2.98 C1CCC(C1)O[C@H]2CCOC2 34a_100000717292_100000179811 [0,0,0,2,0,0|1,0,0]=3 11935 B12R2.98 C1CCC(C1)SC2CCOC2 62a_100011217020_100000690089 [0,0,0,2,0,0|1,1,0]=4 11936 B12R2.98 C1COC(C1)OC2CCOC2 34a_100000085407_100000690089 [0,0,0,2,0,0|2,0,0]=4 11937 B12R2.98 C1C[C@@H](CO1)NC2CCSC2 270004a_100015188467_100000212027 [0,0,0,2,0,0|1,1,0]=4 11938 B12R2.98 C1C[C@H](CO1)NC2CCSC2 270004a_200015188469_100000212027 [0,0,0,2,0,0|1,1,0]=4 11939 B12R2.144 CCO[C@H]1CO[C@@H]2[C@H]1CCO2 34a_100015698664_100000210202 [0,0,0,2,0,0|2,0,0]=4 11940 B12R2.144 CCO[C@H]1CO[C@@H]2[C@H]1CCO2 7a_100015698664_100000210202 [0,0,0,2,0,0|2,0,0]=4 11941 B12R2.2056 C1CC(C1)CNC2CCOC2 2230a_100000738700_100000731011 [0,0,0,2,0,0|2,0,0]=4 11942 B12R2.2056 C1CC(C1)CNC2CCOC2 270004a_100000738700_100000752484 [0,0,0,2,0,0|2,0,0]=4 11943 B12R2.2056 C1CC(C1)CNC2CCOC2 34a_100000738700_100000690089 [0,0,0,2,0,0|2,0,0]=4 11944 B12R2.2056 C1CC(C1)CN[C@@H]2CCOC2 2230a_200015188469_100000763275 [0,0,0,2,0,0|2,0,0]=4 11945 B12R2.2056 C1CC(C1)CN[C@@H]2CCOC2 269862a_200015188469_100000753134 [0,0,0,2,0,0|2,0,0]=4 11946 B12R2.2056 C1CC(C1)CN[C@H]2CCOC2 2230a_100015188467_100000763275 [0,0,0,2,0,0|2,0,0]=4 11947 B12R2.2056 C1CC(C1)CN[C@H]2CCOC2 269862a_100015188467_100000753134 [0,0,0,2,0,0|2,0,0]=4 11948 B12R2.2056 C1CC(C1)CN[C@H]2CCOC2 34a_100015188467_100000763275 [0,0,0,2,0,0|2,0,0]=4 11949 B12R2.2056 C1CC(C1)COC2CCCC2 34a_100000210269_100000763275 [0,0,0,2,0,0|2,0,0]=4 11950 B12R2.2056 C1CC(C1)COC2CCCC2 34a_100000760304_100000179811 [0,0,0,2,0,0|2,0,0]=4 11951 B12R2.2056 C1CC(C1)COC2CCCC2 7a_100000210269_100000763275 [0,0,0,2,0,0|2,0,0]=4 11952 B12R2.2056 C1CC(C1)COC2CCOC2 34a_100000760304_100000690089 [0,0,0,2,0,0|1,0,0]=3 11953 B12R2.2056 C1CC(C1)COC2CCSC2 7a_100011232664_100000763275 [0,0,0,2,0,0|1,1,0]=4 11954 B12R2.2056 C1CC(C1)CO[C@H]2CCOC2 34a_100000717292_100000763275 [0,0,0,2,0,0|1,0,0]=3 11955 B12R2.2056 C1CC(C1)CSC2CCOC2 62a_100000763275_100000690089 [0,0,0,2,0,0|1,1,0]=4 11956 B12R2.2056 C1CC(CO1)NC[C@@H]2CCO2 2230a_100020831831_100000731011 [0,0,0,2,0,0|1,0,0]=3 11957 B12R2.2056 C1CC(CO1)NC[C@@H]2CCO2 270004a_100020831831_100000752484 [0,0,0,2,0,0|1,0,0]=3 11958 B12R2.2056 C1CC(CO1)NC[C@@H]2CCO2 34a_100020831831_100000690089 [0,0,0,2,0,0|1,0,0]=3 11959 B12R2.2056 C1CC(CO1)OCC2CCO2 34a_100000039022_100000690089 [0,0,0,2,0,0|0,0,0]=2 11960 B12R2.2056 C1CC(CO1)OCC2CNC2 34a_100016987283_100000690089 [0,0,0,2,0,0|2,0,0]=4 11961 B12R2.2056 C1CC(CO1)OCC2COC2 34a_100000060846_100000690089 [0,0,0,2,0,0|2,0,0]=4 11962 B12R2.2056 C1CC(CO1)SCC2CCO2 62a_100000103362_100000690089 [0,0,0,2,0,0|0,1,0]=3 11963 B12R2.2056 C1CC(O1)COC2CCSC2 7a_100011232664_100000103362 [0,0,0,2,0,0|0,1,0]=3 11964 B12R2.2056 C1CCC(C1)NCC2CCO2 2230a_100000211070_100000103362 [0,0,0,2,0,0|2,0,0]=4 11965 B12R2.2056 C1CCC(C1)NCC2CCO2 34a_100000211070_100000103362 [0,0,0,2,0,0|2,0,0]=4 11966 B12R2.2056 C1CCC(C1)NC[C@@H]2CCO2 2230a_100020831831_100000179811 [0,0,0,2,0,0|2,0,0]=4 11967 B12R2.2056 C1CCC(C1)NC[C@@H]2CCO2 270004a_100020831831_100000210133 [0,0,0,2,0,0|2,0,0]=4 11968 B12R2.2056 C1CCC(C1)NC[C@@H]2CCO2 34a_100020831831_100000179811 [0,0,0,2,0,0|2,0,0]=4 11969 B12R2.2056 C1CCC(C1)OCC2CCO2 34a_100000039022_100000179811 [0,0,0,2,0,0|1,0,0]=3 11970 B12R2.2056 C1CCC(C1)OCC2CCO2 34a_100000210269_100000103362 [0,0,0,2,0,0|1,0,0]=3 11971 B12R2.2056 C1CCC(C1)OCC2CCO2 7a_100000210269_100000103362 [0,0,0,2,0,0|1,0,0]=3 11972 B12R2.2056 C1CCC(C1)SCC2CCO2 62a_100000103362_100000179811 [0,0,0,2,0,0|1,1,0]=4 11973 B12R2.2056 C1CCC(C1)SCC2CCO2 62a_100011217020_100000103362 [0,0,0,2,0,0|1,1,0]=4 11974 B12R2.2056 C1COC(C1)OCC2CCO2 34a_100000085407_100000103362 [0,0,0,2,0,0|2,0,0]=4 11975 B12R2.2056 C1C[C@@H](CO1)NCC2CCO2 2230a_100015188467_100000103362 [0,0,0,2,0,0|1,0,0]=3 11976 B12R2.2056 C1C[C@@H](CO1)NCC2CCO2 34a_100015188467_100000103362 [0,0,0,2,0,0|1,0,0]=3 11977 B12R2.2056 C1C[C@@H](CO1)OCC2CCO2 34a_100000717292_100000103362 [0,0,0,2,0,0|0,0,0]=2 11978 B12R2.2056 C1C[C@@H](CO1)OCC2COC2 34a_100000717292_100010264016 [0,0,0,2,0,0|2,0,0]=4 11979 B12R2.2056 C1C[C@H](CO1)NCC2CCO2 2230a_200015188469_100000103362 [0,0,0,2,0,0|1,0,0]=3 11980 B12R2.2056 C1C[C@H](O1)CNC2CCSC2 270004a_100020831831_100000212027 [0,0,0,2,0,0|1,1,0]=4 11981 B12R2.2336 CCOCC1CC2CCC1C2 34a_100000229996_100000210202 [0,0,0,2,0,0|2,0,0]=4 11982 B12R2.2383 C(CC1CC1)NC2CCOC2 270004a_100000764129_100000752484 [0,0,0,2,0,0|2,0,0]=4 11983 B12R2.2383 C(CC1CC1)NC2CCOC2 34a_100000764129_100000690089 [0,0,0,2,0,0|2,0,0]=4 11984 B12R2.2383 C(CC1CC1)N[C@@H]2CCOC2 2230a_200015188469_100000694398 [0,0,0,2,0,0|2,0,0]=4 11985 B12R2.2383 C(CC1CC1)N[C@H]2CCOC2 2230a_100015188467_100000694398 [0,0,0,2,0,0|2,0,0]=4 11986 B12R2.2383 C(CC1CC1)N[C@H]2CCOC2 34a_100015188467_100000694398 [0,0,0,2,0,0|2,0,0]=4 11987 B12R2.2383 C(CC1CC1)OC2CCSC2 7a_100011232664_100000764125 [0,0,0,2,0,0|1,1,0]=4 11988 B12R2.2383 C1CC(CO1)OCCC2CC2 34a_100000754188_100000690089 [0,0,0,2,0,0|1,0,0]=3 11989 B12R2.2383 C1CC(CO1)OCCC2CC2 7a_100000754188_100000731011 [0,0,0,2,0,0|1,0,0]=3 11990 B12R2.2383 C1CC(CO1)OCC[C@@H]2CO2 34a_100009820653_100000690089 [0,0,0,2,0,0|2,0,0]=4 11991 B12R2.2383 C1CC(CO1)SCCC2CC2 62a_100000764125_100000690089 [0,0,0,2,0,0|1,1,0]=4 11992 B12R2.2383 C1CCC(C1)OCCC2CC2 34a_100000210269_100000694398 [0,0,0,2,0,0|2,0,0]=4 11993 B12R2.2383 C1CCC(C1)OCCC2CC2 34a_100000754188_100000179811 [0,0,0,2,0,0|2,0,0]=4 11994 B12R2.2383 C1CCC(C1)OCCC2CC2 7a_100000210269_100000764125 [0,0,0,2,0,0|2,0,0]=4 11995 B12R2.2383 C1CCC(C1)OCCC2CC2 7a_100000754188_100000179811 [0,0,0,2,0,0|2,0,0]=4 11996 B12R2.2383 C1C[C@@H](CO1)OCCC2CC2 34a_100000717292_100000694398 [0,0,0,2,0,0|1,0,0]=3 11997 B12R2.2383 C1C[C@@H](CO1)OCCC2CO2 34a_100000717292_100000732470 [0,0,0,2,0,0|2,0,0]=4 11998 B12R2.2057 C1CN(CCO1)CCC2CC2 2230a_100015191051_100000694398 [0,0,0,2,0,0|2,0,0]=4 11999 B12R2.2057 C1CN(CCO1)CCC2CC2 269982a_100015191051_100000694398 [0,0,0,2,0,0|2,0,0]=4 12000 B12R2.2057 C1CN(CCO1)CCC2CC2 34a_100015191051_100000694398 [0,0,0,2,0,0|2,0,0]=4 12001 B12R2.2058 C1CC(C1)CN2CCOCC2 2230a_100015191051_100000763275 [0,0,0,2,0,0|2,0,0]=4 12002 B12R2.2058 C1CC(C1)CN2CCOCC2 269982a_100015191051_100000763275 [0,0,0,2,0,0|2,0,0]=4 12003 B12R2.2058 C1CC(C1)CN2CCOCC2 34a_100015191051_100000763275 [0,0,0,2,0,0|2,0,0]=4 12004 B12R2.2058 C1CC(O1)CN2CCSCC2 2230a_100000737611_100000103362 [0,0,0,2,0,0|1,1,0]=4 12005 B12R2.2058 C1CC(O1)CN2CCSCC2 269982a_100000737611_100000103362 [0,0,0,2,0,0|1,1,0]=4 12006 B12R2.2058 C1CN(CCO1)CC2CCO2 2230a_100015191051_100000103362 [0,0,0,2,0,0|1,0,0]=3 12007 B12R2.2058 C1CN(CCO1)CC2CCO2 269982a_100015191051_100000103362 [0,0,0,2,0,0|1,0,0]=3 12008 B12R2.2058 C1CN(CCO1)CC2CCO2 34a_100015191051_100000103362 [0,0,0,2,0,0|1,0,0]=3 12009 B12R2.2110 CCOCCN1CC2CC2C1 2230a_100000741873_100011215890 [0,0,0,2,0,0|2,0,0]=4 12010 B12R2.2110 CCOCCN1CC2CC2C1 269982a_100000741873_100011215890 [0,0,0,2,0,0|2,0,0]=4 12011 B12R2.2110 CCOCCN1CC2CC2C1 34a_100000741873_100000210147 [0,0,0,2,0,0|2,0,0]=4 12012 B12R2.423 CC1CC1COCCC2CC2 34a_100000744939_100000694398 [0,0,0,2,0,0|2,0,0]=4 12013 B12R2.423 CC1CC1COCCC2CC2 7a_100000744939_100000764125 [0,0,0,2,0,0|2,0,0]=4 12014 B12R2.444 CC1CC1COCC2CCC2 34a_100000744939_100000763275 [0,0,0,2,0,0|2,0,0]=4 12015 B12R2.444 CC1CC1COCC2CCC2 7a_100000744939_100000763275 [0,0,0,2,0,0|2,0,0]=4 12016 B12R2.444 CC1CC1COCC2CCO2 34a_100000744939_100000103362 [0,0,0,2,0,0|1,0,0]=3 12017 B12R2.444 CC1CC1COCC2CCO2 7a_100000744939_100000103362 [0,0,0,2,0,0|1,0,0]=3 12018 B12R2.1114 CC1SCCN1CC2CCO2 2230a_200011216479_100000103362 [0,0,0,2,0,0|1,1,0]=4 12019 B12R2.1114 CC1SCCN1CC2CCO2 269982a_200011216479_100000103362 [0,0,0,2,0,0|1,1,0]=4 12020 B12R2.1114 CC1SCCN1CC2CCO2 34a_200011216479_100000103362 [0,0,0,2,0,0|1,1,0]=4 12021 B12R2.1114 C[C@@H]1CCCN1CC2CCO2 2230a_100015189458_100000103362 [0,0,0,2,0,0|2,0,0]=4 12022 B12R2.1114 C[C@@H]1CCCN1CC2CCO2 269982a_100015189458_100000103362 [0,0,0,2,0,0|2,0,0]=4 12023 B12R2.1114 C[C@@H]1CCCN1CC2CCO2 34a_100015189458_100000103362 [0,0,0,2,0,0|2,0,0]=4 12024 B12R2.1114 C[C@H]1CCCN1CC2CCO2 2230a_100020605311_100000103362 [0,0,0,2,0,0|2,0,0]=4 12025 B12R2.1114 C[C@H]1CCCN1CC2CCO2 269982a_100020605311_100000103362 [0,0,0,2,0,0|2,0,0]=4 12026 B12R2.2381 C(CC1CC1)NCC2CCO2 34a_100000764129_100000103362 [0,0,0,2,0,0|2,0,0]=4 12027 B12R2.2381 C(CC1CC1)NC[C@@H]2CCO2 2230a_100020831831_100000694398 [0,0,0,2,0,0|2,0,0]=4 12028 B12R2.2381 C(CC1CC1)NC[C@@H]2CCO2 34a_100020831831_100000694398 [0,0,0,2,0,0|2,0,0]=4 12029 B12R2.2381 C(CC1CC1)OCC2CCO2 34a_100000039022_100000694398 [0,0,0,2,0,0|1,0,0]=3 12030 B12R2.2381 C(CC1CC1)OCC2CCO2 34a_100000754188_100000103362 [0,0,0,2,0,0|1,0,0]=3 12031 B12R2.2381 C(CC1CC1)OCC2CCO2 7a_100000754188_100000103362 [0,0,0,2,0,0|1,0,0]=3 12032 B12R2.2381 C(CC1CO1)OCC2CCO2 34a_100000039022_100000732470 [0,0,0,2,0,0|2,0,0]=4 12033 B12R2.2381 C(C[C@@H]1CO1)OCC2CCO2 34a_100009820653_100000103362 [0,0,0,2,0,0|2,0,0]=4 12034 B12R2.2381 C1CC(C1)COCCC2CC2 34a_100000754188_100000763275 [0,0,0,2,0,0|2,0,0]=4 12035 B12R2.2381 C1CC(C1)COCCC2CC2 34a_100000760304_100000694398 [0,0,0,2,0,0|2,0,0]=4 12036 B12R2.2381 C1CC(C1)COCCC2CC2 7a_100000754188_100000763275 [0,0,0,2,0,0|2,0,0]=4 12037 B12R2.2381 C1CC(O1)CSCCC2CC2 62a_100000103362_100000764125 [0,0,0,2,0,0|1,1,0]=4 12038 B12R2.2381 C1CC(O1)CSCCC2CC2 62a_100000764125_100000103362 [0,0,0,2,0,0|1,1,0]=4 12039 B12R2.2382 C1CC(C1)CNCC2CCO2 2230a_100000738700_100000103362 [0,0,0,2,0,0|2,0,0]=4 12040 B12R2.2382 C1CC(C1)CNCC2CCO2 34a_100000738700_100000103362 [0,0,0,2,0,0|2,0,0]=4 12041 B12R2.2382 C1CC(C1)CNC[C@@H]2CCO2 2230a_100020831831_100000763275 [0,0,0,2,0,0|2,0,0]=4 12042 B12R2.2382 C1CC(C1)CNC[C@@H]2CCO2 269862a_100020831831_100000753134 [0,0,0,2,0,0|2,0,0]=4 12043 B12R2.2382 C1CC(C1)CNC[C@@H]2CCO2 34a_100020831831_100000763275 [0,0,0,2,0,0|2,0,0]=4 12044 B12R2.2382 C1CC(C1)COCC2CCC2 34a_100000760304_100000763275 [0,0,0,2,0,0|2,0,0]=4 12045 B12R2.2382 C1CC(C1)COCC2CCO2 34a_100000039022_100000763275 [0,0,0,2,0,0|1,0,0]=3 12046 B12R2.2382 C1CC(C1)COCC2CCO2 34a_100000760304_100000103362 [0,0,0,2,0,0|1,0,0]=3 12047 B12R2.2382 C1CC(C1)CSCC2CCO2 62a_100000103362_100000763275 [0,0,0,2,0,0|1,1,0]=4 12048 B12R2.2382 C1CC(C1)CSCC2CCO2 62a_100000763275_100000103362 [0,0,0,2,0,0|1,1,0]=4 12049 B12R2.2382 C1CC(O1)CNC[C@@H]2CCO2 2230a_100020831831_100000103362 [0,0,0,2,0,0|1,0,0]=3 12050 B12R2.2382 C1CC(O1)CNC[C@@H]2CCO2 34a_100020831831_100000103362 [0,0,0,2,0,0|1,0,0]=3 12051 B12R2.2382 C1CC(O1)COCC2CCO2 34a_100000039022_100000103362 [0,0,0,2,0,0|0,0,0]=2 12052 B12R2.2382 C1CC(O1)COCC2CNC2 34a_100016987283_100000103362 [0,0,0,2,0,0|2,0,0]=4 12053 B12R2.2382 C1CC(O1)COCC2COC2 34a_100000039022_100010264016 [0,0,0,2,0,0|2,0,0]=4 12054 B12R2.2382 C1CC(O1)COCC2COC2 34a_100000060846_100000103362 [0,0,0,2,0,0|2,0,0]=4 12055 B12R2.2382 C1CC(O1)CSCC2CCO2 62a_100000103362_100000103362 [0,0,0,2,0,0|0,1,0]=3 12056 B12R2.2014 C(CC1CC1)OCCC2CC2 34a_100000754188_100000694398 [0,0,0,2,0,0|2,0,0]=4 12057 B12R2.2014 C(CC1CC1)OCCC2CC2 7a_100000754188_100000764125 [0,0,0,2,0,0|2,0,0]=4