0 B11R2.1 BrC1=CN=C2C=CC=CN21 M10067358P [0,0,0,0,0,0|4,0,0]=4 1 B11R2.1 BrC1=CSC2=NC=CC=C21 M10204401P [0,0,0,0,0,0|4,0,0]=4 2 B11R2.1 BrC1=NNC2=C1C=CN=C2 M10461878P [0,0,0,0,0,0|4,0,0]=4 3 B11R2.1 BrC1=NNC2=CC=CN=C21 M10905813P [0,0,0,0,0,0|4,0,0]=4 4 B11R2.1 CC1=COC2=CC=CC=C12 M10170730P [0,0,0,0,0,0|3,0,0]=3 5 B11R2.1 CC1=NNC2=C1C=CC=C2 M10051935P [0,0,0,0,0,0|3,0,0]=3 6 B11R2.1 CC1=NNC2=NC=CC=C21 M10702863P [0,0,0,0,0,0|4,0,0]=4 7 B11R2.1 CN1C2=CC=CC=C2N=C1 M10033964P [0,0,0,0,0,0|4,0,0]=4 8 B11R2.1 CN1N=NC2=CC=CC=C21 M10122945P [0,0,0,0,0,0|4,0,0]=4 9 B11R2.1 ClC1=NN=C2C=CC=CN21 M10067320P [0,0,0,0,0,0|4,0,0]=4 10 B11R2.1 ClC1=NOC2=CC=CC=C12 M10141722P [0,0,0,0,0,0|3,0,0]=3 11 B11R2.1 ClC1CCC2=C1C=CC=C2 M10226780P [0,0,0,0,0,0|2,0,1]=3 12 B11R2.1 IC1=NNC2=C1C=CC=C2 M10420731P [0,0,0,0,0,0|3,0,0]=3 13 B11R2.1 IC1=NNC2=CC=CN=C21 M10905817P [0,0,0,0,0,0|4,0,0]=4 14 B11R2.1 NC1CCC2=C1C=CC=C2 M10437387P [0,0,0,0,0,0|2,0,1]=3 15 B11R2.1 NC1CCC2=CC=CN=C21 M10109508P [0,0,0,0,0,0|3,0,1]=4 16 B11R2.1 NN1C=CC2=C1C=CC=C2 M10270478P [0,0,0,0,0,0|3,0,1]=4 17 B11R2.1 NN1N=CC2=C1C=CC=C2 M10220074P [0,0,0,0,0,0|3,0,1]=4 18 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 M10217266P [0,0,0,0,0,0|2,0,1]=3 19 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 M10330454P [0,0,0,0,0,0|2,0,1]=3 20 B11R2.1 O=C1C2=CC=CC=C2SC1 M10004884P [0,0,0,0,0,0|2,0,0]=2 21 B11R2.1 O=C1CCC2=CC=CN=C21 M10212882P [0,0,0,0,0,0|2,0,0]=2 22 B11R2.1 O=C1CCC2=NC=CC=C21 M10202756P [0,0,0,0,0,0|2,0,0]=2 23 B11R2.1 O=C1NCC2=NC=CC=C21 M10241661P [0,0,0,0,0,0|2,0,0]=2 24 B11R2.1 O=C1NNC2=C1C=CN=C2 M10273851P [0,0,0,0,0,0|3,0,0]=3 25 B11R2.1 OC1=CNC2=C1C=CC=C2 M10011825P [0,0,0,0,0,0|2,0,1]=3 26 B11R2.1 OC1CCC2=C1C=CC=C2 M10090985P [0,0,0,0,0,0|1,0,2]=3 27 B11R2.1 ON1N=NC2=CC=CC=C21 M10045793P [0,0,0,0,0,0|3,0,1]=4 28 B11R2.1 ON1N=NC2=CC=CC=C21 M10477801P [0,0,0,0,0,0|3,0,1]=4 29 B11R2.1 [O-][N+]1=C2C=CC=CC2=NO1 M10011827P [0,0,0,0,0,0|2,0,1]=3 30 B10R2.7 C12=C(NCC1)C=CC=C2 M10012277P [1,0,0,0,0,0|2,0,0]=3 31 B10R2.7 C12=C(NN=C1)C=CC=C2 M10007137P [1,0,0,0,0,0|2,0,0]=3 32 B10R2.7 C12=CC=CC=C1OBO2 M10007238P [1,0,0,0,0,0|3,0,0]=4 33 B10R2.7 C12=CC=NN1C=CC=C2 M10007250P [1,0,0,0,0,0|3,0,0]=4 34 B10R2.7 C12=CN=CN1C=CC=C2 M10007247P [1,0,0,0,0,0|2,0,1]=4 35 B10R2.7 C12=NC=CC=C1NC=C2 M10007177P [1,0,0,0,0,0|3,0,0]=4 36 B10R2.7 C12=NC=CC=C1NN=C2 M10007180P [1,0,0,0,0,0|3,0,0]=4 37 B10R2.7 C12=NC=CN1C=CC=C2 M10007258P [1,0,0,0,0,0|3,0,0]=4 38 B10R2.7 C12=NN=CN1C=CC=C2 M10007261P [1,0,0,0,0,0|3,0,0]=4 39 B10R2.7 C12=NON=C1C=CC=C2 M10007199P [1,0,0,0,0,0|2,0,0]=3 40 B10R2.7 C=12CNCC1C=CN=C2 M10082704P [1,0,0,0,0,0|2,0,1]=4 41 B10R2.7 C=12NCCC1C=CN=C2 M10951399P [1,0,0,0,0,0|3,0,0]=4 42 B12R2.1 BrCC1=CSC2=CC=CC=C21 M10028873P [0,1,0,0,0,0|3,0,0]=4 43 B12R2.1 N#CC1=NNC2=C1C=CC=C2 M10253343P [0,1,0,0,0,0|3,0,0]=4 44 B12R2.1 N#CC1CCC2=C1C=CC=C2 M10193960P [0,1,0,0,0,0|2,0,1]=4 45 B12R2.1 O=CC1=C2C=CC=CN2C=N1 M10289942P [0,1,0,0,0,0|2,0,1]=4 46 B12R2.1 O=CC1=CN=C2C=CC=CN21 M10084778P [0,1,0,0,0,0|3,0,0]=4 47 B12R2.1 O=CC1=CNC2=C1C=NC=C2 M10083647P [0,1,0,0,0,0|3,0,0]=4 48 B12R2.1 O=CC1=NNC2=C1C=CC=C2 M10069854P [0,1,0,0,0,0|2,0,0]=3 49 B12R2.1 OCC1=CNC2=C1C=CC=C2 M12278082P [0,1,0,0,0,0|2,0,1]=4 50 B12R2.18 O=C1C(C2=CC=CN=C2N1)=O M10078714P [0,1,0,0,0,0|3,0,0]=4 51 B12R2.18 O=C1C(CC2=C1C=CC=C2)=O M10141381P [0,1,0,0,0,0|1,0,0]=2 52 B12R2.18 OC1C(Br)CC2=C1C=CC=C2 M10072804P [0,1,0,0,0,0|1,0,2]=4 53 B12R2.18 O[C@@H]1[C@H](N)C2=C(C=CC=C2)C1 M10107049P [0,1,0,0,0,0|2,0,1]=4 54 B12R2.18 O[C@H]1[C@H](Br)CC2=C1C=CC=C2 M10114550P [0,1,0,0,0,0|1,0,2]=4 55 B12R2.132 BrC1=CC=C2OC=C(Br)C2=C1 M10638246P [0,1,0,0,0,0|3,0,0]=4 56 B12R2.132 CC1=CNC2=C1C=C(Br)C=C2 M10111834P [0,1,0,0,0,0|3,0,0]=4 57 B12R2.132 CC1=NOC2=CC=C(N)C=C12 M10000560P [0,1,0,0,0,0|3,0,0]=4 58 B12R2.132 ClC1=NNC2=C1C=C(Br)C=C2 M10231512P [0,1,0,0,0,0|3,0,0]=4 59 B12R2.132 ClC1=NOC2=CC=C(Br)C=C12 M10873600P [0,1,0,0,0,0|3,0,0]=4 60 B12R2.132 IC1=NNC2=C1C=C(Br)C=C2 M10881078P [0,1,0,0,0,0|3,0,0]=4 61 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 M10131846P [0,1,0,0,0,0|1,0,0]=2 62 B12R2.132 O=C1CCC2=C1C=C(N)C=C2 M10436749P [0,1,0,0,0,0|1,0,0]=2 63 B12R2.132 O=C1COC2=CC=C(Cl)C=C12 M10052766P [0,1,0,0,0,0|2,0,0]=3 64 B12R2.132 O=C1NCC2=C1C=C(Br)C=C2 M10937697P [0,1,0,0,0,0|1,0,0]=2 65 B12R2.132 O=C1NCC2=C1C=C(N)C=C2 M10937700P [0,1,0,0,0,0|1,0,0]=2 66 B12R2.132 O=C1NOC2=CC=C(F)C=C12 M10638587P [0,1,0,0,0,0|2,0,0]=3 67 B12R2.132 O=C1OCC2=C1C=C(I)C=C2 M10273454P [0,1,0,0,0,0|0,0,0]=1 68 B12R2.132 O=C1OCC2=C1C=C(N)C=C2 M10294288P [0,1,0,0,0,0|0,0,0]=1 69 B12R2.132 OB1OCC2=CC=C(O)C=C12 M11111296P [0,1,0,0,0,0|1,0,1]=3 70 B12R2.196 NC1=NNC2=C1C=CC=C2Br M10119784P [0,1,0,0,0,0|3,0,0]=4 71 B12R2.196 O=C1CCC2=C1C=CC=C2F M10018854P [0,1,0,0,0,0|1,0,0]=2 72 B12R2.196 O=C1NCC2=C1C=CC=C2N M10867297P [0,1,0,0,0,0|1,0,0]=2 73 B12R2.196 O=C1NCC2=C1C=CC=C2O M10867307P [0,1,0,0,0,0|1,0,0]=2 74 B12R2.196 O=C1OCC2=C(Br)C=CC=C12 M10647329P [0,1,0,0,0,0|0,0,0]=1 75 B12R2.196 O=C1OCC2=C1C=CC=C2N M10307420P [0,1,0,0,0,0|0,0,0]=1 76 B12R2.203 NC1=NNC2=C1C(F)=CC=C2 M10874805P [0,1,0,0,0,0|3,0,0]=4 77 B12R2.203 O=C1CCC2=C1C(F)=CC=C2 M10927160P [0,1,0,0,0,0|1,0,0]=2 78 B12R2.203 O=C1NOC2=CC=CC(F)=C12 M10807010P [0,1,0,0,0,0|2,0,0]=3 79 B12R2.612 ClC1=CC2=C(C=C1)C(Br)=NN2 M11020597P [0,1,0,0,0,0|3,0,0]=4 80 B12R2.612 NC1=CC2=C(C=C1)C(Cl)=NN2 M10170224P [0,1,0,0,0,0|3,0,0]=4 81 B12R2.612 NC1CCC2=C1C=CC(C)=C2 M10797512P [0,1,0,0,0,0|2,0,1]=4 82 B12R2.612 O1C2=CC(O)=CC=C2C(=O)C1 M10086130P [0,1,0,0,0,0|2,0,0]=3 83 B12R2.612 O=C1CCC2=C1C=CC(C)=C2 M10064636P [0,1,0,0,0,0|1,0,0]=2 84 B12R2.612 O=C1CCC2=C1C=CC(N)=C2 M10054800P [0,1,0,0,0,0|1,0,0]=2 85 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 M10052757P [0,1,0,0,0,0|2,0,0]=3 86 B12R2.612 O=C1NOC2=CC(F)=CC=C12 M10638588P [0,1,0,0,0,0|2,0,0]=3 87 B12R2.612 O=C1OCC2=C1C=CC(N)=C2 M10412409P [0,1,0,0,0,0|0,0,0]=1 88 B12R2.612 OC1=NNC2=C1C=CC(Br)=C2 M10020627P [0,1,0,0,0,0|2,0,1]=4 89 B12R2.612 OC1CCC2=C1C=CC(Cl)=C2 M10221629P [0,1,0,0,0,0|1,0,2]=4 90 B12R2.2028 N=C1C2=C(C=CC=C2)C(N1)=N M10189872P [0,1,0,0,0,0|2,0,1]=4 91 B12R2.2028 N=C1NC(C2=C1C=CC=C2)=N M10295506P [0,1,0,0,0,0|2,0,1]=4 92 B12R2.2028 O=C1CC(Br)C2=C1C=CC=C2 M10243903P [0,1,0,0,0,0|1,0,0]=2 93 B12R2.2028 O=C1NC(C2=C1C=CN=C2)=O M10065158P [0,1,0,0,0,0|2,0,1]=4 94 B12R2.2028 O=C1NC(O)C2=NC=CC=C21 M10696674P [0,1,0,0,0,0|2,0,0]=3 95 B12R2.2028 O=C1NN(C)C2=C1C=CC=C2 M10025032P [0,1,0,0,0,0|2,0,0]=3 96 B12R2.2028 O=C1OC(Cl)C2=C1C=CC=C2 M10087510P [0,1,0,0,0,0|0,0,0]=1 97 B10R1.15 BrCC(C1=CC=CN=C1)=O M10151041P [0,0,1,0,0,0|3,0,0]=4 98 B10R1.15 BrCC(C1=NC=CC=C1)=O M10150216P [0,0,1,0,0,0|3,0,0]=4 99 B10R1.15 C[C@@H](NC)C1=CC=CC=C1 M10082047P [0,0,1,0,0,0|2,0,1]=4 100 B10R1.15 ClCC(C1=CC=CN=C1)=O M10350662P [0,0,1,0,0,0|3,0,0]=4 101 B10R1.15 ClCC(C1=CC=CN=C1)=O M12276696P [0,0,1,0,0,0|3,0,0]=4 102 B10R1.15 NC(CC)C1=CC=CC=C1 M10388570P [0,0,1,0,0,0|2,0,1]=4 103 B10R1.15 NCC(C1=CC=CC=C1)=O M10016076P [0,0,1,0,0,0|2,0,0]=3 104 B10R1.17 C=CCCC1=CC=CC=C1 M10020323P [0,0,1,0,0,0|2,0,0]=3 105 B10R1.17 CNCCC1=CC=CC=C1 M10060073P [0,0,1,0,0,0|3,0,0]=4 106 B10R1.17 S=C=NCC1=CC=CC=C1 M10016600P [0,0,1,0,0,0|1,1,1]=4 107 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 M10309731P [0,0,1,0,0,0|3,0,0]=4 108 B10R1.20 CCC1=CC=CC=C1CC M10005067P [0,0,1,0,0,0|2,0,1]=4 109 B10R1.20 O=CC1=C(OC)N=CC=C1 M10442166P [0,0,1,0,0,0|3,0,0]=4 110 B10R1.20 O=CC1=CC=CC=C1C=O M10198856P [0,0,1,0,0,0|0,0,2]=3 111 B10R1.20 O=CC1=CC=CC=C1CC M10177455P [0,0,1,0,0,0|1,0,0]=2 112 B10R1.20 O=CC1=CC=CC=C1OC M10005068P [0,0,1,0,0,0|2,0,0]=3 113 B10R1.20 O=CC1=NC=CC=C1OC M10037086P [0,0,1,0,0,0|3,0,0]=4 114 B10R1.20 OCC1=NC=CC=C1CO M10877017P [0,0,1,0,0,0|1,0,2]=4 115 B10R1.61 CC(C1=C(C)C=CN=C1)=O M10258434P [0,0,1,0,0,0|2,0,0]=3 116 B10R1.61 CC(C1=CC=CC=C1O)=O M10655952P [0,0,1,0,0,0|2,0,0]=3 117 B10R1.61 CC(C1=CC=CC=C1S)=O M10195420P [0,0,1,0,0,0|2,0,0]=3 118 B10R1.61 CC1=C(B(O)O)C=CN=C1 M10025397P [0,0,1,0,0,0|2,0,1]=4 119 B10R1.61 CC1=CC=CC=C1N(C)C M10015825P [0,0,1,0,0,0|3,0,0]=4 120 B10R1.61 C[C@@H](O)C1=CC=CC=C1Br M10462400P [0,0,1,0,0,0|2,0,1]=4 121 B10R1.61 C[C@@H](O)C1=CC=CC=C1Cl M10710888P [0,0,1,0,0,0|2,0,1]=4 122 B10R1.61 C[C@H](O)C1=CC=CC=C1Br M10694376P [0,0,1,0,0,0|2,0,1]=4 123 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl M10733988P [0,0,1,0,0,0|2,0,1]=4 124 B10R1.61 ClC1=NC=CC=C1C(C)=O M10283880P [0,0,1,0,0,0|3,0,0]=4 125 B10R1.61 N=C(N)C1=CC=CC=C1F M10292680P [0,0,1,0,0,0|3,0,0]=4 126 B10R1.61 O=C(C1=C(N)C=CN=C1)N M10105230P [0,0,1,0,0,0|3,0,0]=4 127 B10R1.61 O=C(C1=CN=CN=C1C)O M10785280P [0,0,1,0,0,0|2,0,0]=3 128 B10R1.61 O=C(C1=NC=CN=C1C)O M10244952P [0,0,1,0,0,0|2,0,0]=3 129 B10R1.61 O=C(C1=NC=CN=C1Cl)O M10197914P [0,0,1,0,0,0|3,0,0]=4 130 B10R1.61 O=C(C1=NC=CNC1=O)O M10167209P [0,0,1,0,0,0|3,0,0]=4 131 B10R1.61 O=C(C1=NC=NC=C1C)O M10083525P [0,0,1,0,0,0|2,0,0]=3 132 B10R1.61 O=C(Cl)C1=CC=CC=C1I M10015820P [0,0,1,0,0,0|2,0,0]=3 133 B10R1.61 O=C(N)C1=CC=CC=C1Br M10059208P [0,0,1,0,0,0|2,0,0]=3 134 B10R1.61 O=C(N)C1=CC=CC=C1F M10010862P [0,0,1,0,0,0|2,0,0]=3 135 B10R1.61 O=C(N)C1=CN=CC=C1Cl M10105231P [0,0,1,0,0,0|3,0,0]=4 136 B10R1.61 O=C(O)C1=CC=CC=C1I M11206439P [0,0,1,0,0,0|1,0,0]=2 137 B10R1.61 O=C(O)C1=CC=NC=C1C M10059322P [0,0,1,0,0,0|1,0,0]=2 138 B10R1.61 O=C(O)C1=CC=NC=C1N M10108414P [0,0,1,0,0,0|2,0,0]=3 139 B10R1.61 O=C(O)C1=CC=NC=C1O M10112201P [0,0,1,0,0,0|2,0,0]=3 140 B10R1.61 O=C(O)C1=CN=CC=C1Cl M10112713P [0,0,1,0,0,0|2,0,0]=3 141 B10R1.61 O=C(O)C1=NC=CC=C1O M10022321P [0,0,1,0,0,0|2,0,0]=3 142 B10R1.61 O=C1C(C(C)=O)=CC=CN1 M10385329P [0,0,1,0,0,0|3,0,0]=4 143 B10R1.61 [O-]C1=CC=CC=C1[N+]([O-])=O M10204346P [0,0,1,0,0,0|2,0,1]=4 144 B10R2.32 O=C1CCC2=C1C=CS2 M10078627P [0,0,0,0,1,0|2,0,0]=3 145 B10R2.32 O=C1CCC2=C1SC=C2 M10078628P [0,0,0,0,1,0|2,0,0]=3 146 B10R2.320 BrC1=CC2=CC=CC=C12 M10168858P [0,0,0,0,1,0|1,0,1]=3 147 B10R2.320 O=C1C2=CC=CC=C2C1 M10054777P [0,0,0,0,1,0|0,0,0]=1 148 B12R2.24 BrC1=CC=C2C=CC=CC2=C1 M10005935P [0,0,0,0,0,1|2,0,1]=4 149 B12R2.24 CC1NC2=C(C=CC=C2)CC1 M10036158P [0,0,0,0,0,1|2,0,1]=4 150 B12R2.24 ClC1=CC=C2C=CC=CC2=C1 M10002070P [0,0,0,0,0,1|2,0,1]=4 151 B12R2.24 ClC1=NC=C2C=CC=CC2=N1 M10084266P [0,0,0,0,0,1|2,0,1]=4 152 B12R2.24 FC1=CC=C2C=CC=CC2=C1 M10008277P [0,0,0,0,0,1|2,0,1]=4 153 B12R2.24 NC1=CC2=C(C=N1)C=CC=C2 M10189864P [0,0,0,0,0,1|2,0,1]=4 154 B12R2.24 NC1=CC=C2C=CC=CC2=C1 M10002071P [0,0,0,0,0,1|2,0,1]=4 155 B12R2.24 NC1=NC2=CC=CC=C2C=C1 M10014666P [0,0,0,0,0,1|2,0,1]=4 156 B12R2.24 NC1CC2=C(C=CC=C2)CC1 M10049516P [0,0,0,0,0,1|2,0,1]=4 157 B12R2.24 O=C1NC2=CN=CC=C2C=C1 M10279455P [0,0,0,0,0,1|2,0,1]=4 158 B12R2.24 O=C1OCC2=C(C=CC=C2)C1 M10062650P [0,0,0,0,0,1|0,0,0]=1 159 B12R2.1081 CC1=C2C=CC=CC2=CC=C1 M10030239P [0,0,0,0,0,1|2,0,1]=4 160 B12R2.1081 CC1=NC=CC2=C1C=CC=C2 M10035300P [0,0,0,0,0,1|2,0,1]=4 161 B12R2.1081 CC1CCNC2=C1C=CC=C2 M10160403P [0,0,0,0,0,1|2,0,1]=4 162 B12R2.1081 CC1NCCC2=C1C=CC=C2 M10678709P [0,0,0,0,0,1|2,0,1]=4 163 B12R2.1081 CC1NCCC2=C1C=CC=C2 M11192517P [0,0,0,0,0,1|2,0,1]=4 164 B12R2.1081 CN1CCCC2=C1C=CC=C2 M11192453P [0,0,0,0,0,1|3,0,0]=4 165 B12R2.1081 C[C@@H]1NCCC2=C1C=CC=C2 M12277889P [0,0,0,0,0,1|2,0,1]=4 166 B12R2.1081 C[C@H]1NCCC2=C1C=CC=C2 M12277888P [0,0,0,0,0,1|2,0,1]=4 167 B12R2.1081 ClC1=C2C=CC=CC2=NC=N1 M10069512P [0,0,0,0,0,1|2,0,1]=4 168 B12R2.1081 ClC1CCCC2=C1C=CC=C2 M10686877P [0,0,0,0,0,1|2,0,1]=4 169 B12R2.1081 NC1=CC=NC2=CC=CC=C12 M10014612P [0,0,0,0,0,1|2,0,1]=4 170 B12R2.1081 NC1=NC=CC2=C1C=CC=C2 M10032372P [0,0,0,0,0,1|2,0,1]=4 171 B12R2.1081 O=C1C2=C(N=CC=C2)C=CN1 M10180996P [0,0,0,0,0,1|2,0,1]=4 172 B12R2.1081 O=C1C2=CC=CN=C2NC=N1 M10184727P [0,0,0,0,0,1|2,0,1]=4 173 B12R2.1081 O=C1CCCC2=C1C=NC=C2 M10172395P [0,0,0,0,0,1|2,0,0]=3 174 B12R2.1081 O=C1CCNC2=C1C=CC=C2 M10061767P [0,0,0,0,0,1|1,0,0]=2 175 B12R2.1081 O=C1CCOC2=CC=CN=C21 M10875023P [0,0,0,0,0,1|2,0,0]=3 176 B12R2.1081 O=C1COCC2=C1C=CC=C2 M10168044P [0,0,0,0,0,1|0,0,0]=1 177 B12R2.1081 O=C1NCCC2=C1C=CC=C2 M10028879P [0,0,0,0,0,1|1,0,0]=2 178 B12R2.1081 O=C1NCCC2=C1N=CC=C2 M10854246P [0,0,0,0,0,1|2,0,0]=3 179 B12R2.1081 OC1=NC=CC2=C1C=CC=C2 M10012135P [0,0,0,0,0,1|1,0,2]=4 180 B12R2.1081 OC1CCCC2=C1C=CC=C2 M11193696P [0,0,0,0,0,1|1,0,2]=4 181 B9R1.6 CC(C1=CN=CN=C1)=O M10114103P [1,0,1,0,0,0|2,0,0]=4 182 B9R1.6 CC(C1=NC=CC=N1)=O M10270086P [1,0,1,0,0,0|2,0,0]=4 183 B9R1.6 C[SiH](C)C1=CC=CC=C1 M10020227P [1,0,1,0,0,0|1,1,0]=4 184 B9R1.6 NC(C)C1=CC=CC=C1 M10209842P [1,0,1,0,0,0|1,0,1]=4 185 B9R1.6 O=C(Cl)C1=CC=CN=C1 M10114789P [1,0,1,0,0,0|2,0,0]=4 186 B9R1.6 O=C([O-])C1=CC=CC=C1 M10194531P [1,0,1,0,0,0|0,0,1]=3 187 B9R1.6 O=C([O-])C1=CN=CC=C1 M10404235P [1,0,1,0,0,0|1,0,1]=4 188 B9R1.6 O=C([O-])C1=NC=CC=C1 M10138174P [1,0,1,0,0,0|1,0,1]=4 189 B9R1.6 O=C([O-])C1=NC=CC=C1 M10152479P [1,0,1,0,0,0|1,0,1]=4 190 B9R1.6 O=P(C1=CC=CC=C1)O M10036149P [1,0,1,0,0,0|1,0,0]=3 191 B9R1.6 O=P(C1=CC=CC=C1)[O-] M10191804P [1,0,1,0,0,0|1,0,1]=4 192 B9R1.6 O=S(C1=CC=CC=C1)O M10016337P [1,0,1,0,0,0|1,0,0]=3 193 B9R1.6 OC(C1=CC=CC=C1)=S M10002682P [1,0,1,0,0,0|0,1,0]=3 194 B9R1.8 Br[Mg]CC1=CC=CC=C1 M10033223P [1,0,1,0,0,0|2,0,0]=4 195 B9R1.8 COCC1=CC=CC=C1 M10013562P [1,0,1,0,0,0|0,0,1]=3 196 B9R1.8 Cl[Mg]CC1=CC=CC=C1 M10097238P [1,0,1,0,0,0|2,0,0]=4 197 B9R1.8 NCCC1=CC=CC=C1 M10005773P [1,0,1,0,0,0|1,0,1]=4 198 B9R1.8 NNCC1=CC=CC=C1 M10014053P [1,0,1,0,0,0|2,0,0]=4 199 B9R1.8 NOCC1=CC=CC=C1 M10016568P [1,0,1,0,0,0|1,0,0]=3 200 B9R1.8 NOCC1=CC=CC=C1 M10046733P [1,0,1,0,0,0|1,0,0]=3 201 B9R1.8 O=C=NC1=CC=CC=C1 M10003095P [1,0,1,0,0,0|1,0,1]=4 202 B9R1.8 ONCC1=CC=CC=C1 M10016566P [1,0,1,0,0,0|1,0,1]=4 203 B9R1.8 SCCC1=CC=CC=C1 M10062928P [1,0,1,0,0,0|0,1,1]=4 204 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 M10114263P [1,0,1,0,0,0|1,0,1]=4 205 B9R1.15 C=CC1=CC=CC=C1Cl M10039284P [1,0,1,0,0,0|2,0,0]=4 206 B9R1.15 C=CC1=CC=CC=C1F M10009983P [1,0,1,0,0,0|2,0,0]=4 207 B9R1.15 CC1=CC=CC=C1CBr M10001945P [1,0,1,0,0,0|1,0,1]=4 208 B9R1.15 CC1=CC=CC=C1NC M10015911P [1,0,1,0,0,0|2,0,0]=4 209 B9R1.15 CC1=CC=CC=C1[Mg]Br M10023463P [1,0,1,0,0,0|2,0,0]=4 210 B9R1.15 IC1=CC=CC=C1CCl M10307641P [1,0,1,0,0,0|2,0,0]=4 211 B9R1.15 NC1=CC=CC=C1C=C M10058208P [1,0,1,0,0,0|2,0,0]=4 212 B9R1.15 NC1=CC=CC=C1CN M10062856P [1,0,1,0,0,0|2,0,0]=4 213 B9R1.15 O=C1C(CN)=CC=CN1 M10502587P [1,0,1,0,0,0|2,0,0]=4 214 B9R1.15 O=CC1=CC=NC=C1Br M10437566P [1,0,1,0,0,0|2,0,0]=4 215 B9R1.15 O=CC1=CC=NC=C1O M10037087P [1,0,1,0,0,0|1,0,0]=3 216 B9R1.15 O=CC1=CN=CC=C1Br M10780732P [1,0,1,0,0,0|2,0,0]=4 217 B9R1.15 O=CC1=CN=CC=C1Cl M10692636P [1,0,1,0,0,0|2,0,0]=4 218 B9R1.15 O=CC1=NC=CC=C1F M10213085P [1,0,1,0,0,0|2,0,0]=4 219 B9R1.15 O=CC1=NC=CC=C1N M10281263P [1,0,1,0,0,0|2,0,0]=4 220 B9R1.15 O=CC1=NC=CC=C1O M10037088P [1,0,1,0,0,0|1,0,0]=3 221 B9R1.15 OC1=CC=CC=C1CBr M10300898P [1,0,1,0,0,0|1,0,1]=4 222 B9R1.15 OCC1=NC=CC=C1N M10264876P [1,0,1,0,0,0|2,0,0]=4 223 B9R1.15 OCC1=NC=CC=C1O M10129274P [1,0,1,0,0,0|1,0,1]=4 224 B11R1.12 CO[C@H](C1=CC=CC=C1)CO M10150609P [0,1,1,0,0,0|0,0,2]=4 225 B11R1.12 O=C\C(C1=CC=CC=C1)=C\C M10062936P [0,1,1,0,0,0|1,0,0]=3 226 B11R1.16 C\C=C\C(C1=CC=CC=C1)=O M11192493P [0,1,1,0,0,0|1,0,0]=3 227 B11R1.16 N=C(OCC)C1=CC=CC=C1 M10071237P [0,1,1,0,0,0|1,0,0]=3 228 B11R1.16 O=C(C1=CC=CC=C1)CCF M10011121P [0,1,1,0,0,0|1,0,0]=3 229 B11R1.16 O=C(C1=CC=CC=C1)\C=N\O M10013371P [0,1,1,0,0,0|2,0,0]=4 230 B11R1.16 O=C(C1=NC=CN=C1)OCC M10097264P [0,1,1,0,0,0|2,0,0]=4 231 B11R1.16 O=C(C1=NN=CC=C1)OCC M10027463P [0,1,1,0,0,0|2,0,0]=4 232 B11R1.16 O=C(NCO)C1=CN=CC=C1 M10055680P [0,1,1,0,0,0|2,0,0]=4 233 B11R1.16 O=C(OCCl)C1=CC=CC=C1 M10071312P [0,1,1,0,0,0|0,0,0]=2 234 B11R1.22 BrC1=CC=C(C(CN)=O)C=C1 M10076586P [0,1,1,0,0,0|2,0,0]=4 235 B11R1.22 ClC1=CC=C(C(CBr)=O)C=C1 M10794167P [0,1,1,0,0,0|2,0,0]=4 236 B11R1.22 ClC1=CC=C(C(CCl)=O)C=C1 M10023687P [0,1,1,0,0,0|2,0,0]=4 237 B11R1.22 O=C(C1=CC=C(Br)C=C1)CCl M11191642P [0,1,1,0,0,0|2,0,0]=4 238 B11R1.22 O=C(C1=CC=C(Cl)C=C1)C=O M10067853P [0,1,1,0,0,0|2,0,0]=4 239 B11R1.22 O=C(C1=CC=C(O)C=C1)CBr M12278098P [0,1,1,0,0,0|2,0,0]=4 240 B11R1.22 O=C(C1=CN=C(Cl)N=C1)OC M10851875P [0,1,1,0,0,0|2,0,0]=4 241 B11R1.22 O=C(C1=COC(C=C1)=O)OC M10082895P [0,1,1,0,0,0|1,0,0]=3 242 B11R1.22 O=C(C1=NC=C(Br)N=C1)OC M10833959P [0,1,1,0,0,0|2,0,0]=4 243 B11R1.22 O=C(C1=NC=C(N)N=C1)OC M10127468P [0,1,1,0,0,0|2,0,0]=4 244 B11R1.22 O=C(NN)C1=CC=C(Br)C=C1 M10082045P [0,1,1,0,0,0|2,0,0]=4 245 B11R1.22 O=C(OC)C1=CN=C(F)C=C1 M10030640P [0,1,1,0,0,0|1,0,0]=3 246 B11R1.22 O=C(OC)C1=CN=C(I)C=C1 M10801564P [0,1,1,0,0,0|1,0,0]=3 247 B11R1.22 O=C(OC)C1=CN=C(O)C=C1 M10418114P [0,1,1,0,0,0|1,0,0]=3 248 B11R1.22 OC1=CC=C(C(CN)=O)C=C1 M10162282P [0,1,1,0,0,0|2,0,0]=4 249 B11R1.22 OC1=CC=C(C(CO)=O)C=C1 M10079470P [0,1,1,0,0,0|2,0,0]=4 250 B11R1.22 OCC(C1=CC=C(F)C=C1)=O M10010254P [0,1,1,0,0,0|2,0,0]=4 251 B11R1.23 ClC1=CC(C(CCl)=O)=CC=C1 M10172170P [0,1,1,0,0,0|2,0,0]=4 252 B11R1.23 O=C(C1=CC(Cl)=NN=C1)OC M11100759P [0,1,1,0,0,0|2,0,0]=4 253 B11R1.23 O=C(C1=CC=CC(Br)=C1)C=O M10662193P [0,1,1,0,0,0|2,0,0]=4 254 B11R1.23 O=C(C1=CC=CC(Cl)=C1)C=O M10805839P [0,1,1,0,0,0|2,0,0]=4 255 B11R1.23 O=C(C1=NC(Cl)=NC=C1)OC M10774860P [0,1,1,0,0,0|2,0,0]=4 256 B11R1.23 O=C(C1=NC(I)=CC=C1)OC M10998655P [0,1,1,0,0,0|1,0,0]=3 257 B11R1.23 O=C(C1=NC=CC(N)=C1)OC M10443076P [0,1,1,0,0,0|1,0,0]=3 258 B11R1.23 O=C(C1=NC=NC(Cl)=C1)OC M10094134P [0,1,1,0,0,0|2,0,0]=4 259 B11R1.23 O=C(NC)C1=NC=CC(Cl)=C1 M10017942P [0,1,1,0,0,0|2,0,0]=4 260 B11R1.23 O=C(NC)C1=NC=CC(Cl)=C1 M10838625P [0,1,1,0,0,0|2,0,0]=4 261 B11R1.23 O=C(OC)C1=CC=CC(Cl)=C1 M10048910P [0,1,1,0,0,0|0,0,0]=2 262 B11R1.23 O=C(OC)C1=CC=CC(I)=C1 M10016366P [0,1,1,0,0,0|0,0,0]=2 263 B11R1.23 O=C(OC)C1=CC=NC(C)=C1 M10145402P [0,1,1,0,0,0|1,0,0]=3 264 B11R1.23 O=C(OC)C1=CC=NC(I)=C1 M10738540P [0,1,1,0,0,0|1,0,0]=3 265 B11R1.23 O=C(OC)C1=CN=CC(N)=C1 M10229499P [0,1,1,0,0,0|1,0,0]=3 266 B11R1.23 O=C(OC)C1=NC=CC(Br)=C1 M10207050P [0,1,1,0,0,0|1,0,0]=3 267 B11R1.23 O=C(OC)C1=NC=CC(Cl)=C1 M10185148P [0,1,1,0,0,0|1,0,0]=3 268 B11R1.23 O=C(OC)C1=NC=CC(Cl)=C1 M10805680P [0,1,1,0,0,0|1,0,0]=3 269 B11R1.23 O=C(OO)C1=CC=CC(Cl)=C1 M10023683P [0,1,1,0,0,0|1,0,0]=3 270 B11R1.23 OC1=CC(C(CBr)=O)=CC=C1 M10044570P [0,1,1,0,0,0|2,0,0]=4 271 B11R1.36 CC(C)C(C1=CC=CC=C1)=O M10015939P [0,1,1,0,0,0|1,0,0]=3 272 B11R1.36 CC(F)C(C1=CC=CC=C1)=O M10168847P [0,1,1,0,0,0|1,0,0]=3 273 B11R1.36 O=C(N(C)C)C1=CC=CC=C1 M10015943P [0,1,1,0,0,0|1,0,0]=3 274 B11R1.222 CC1=CC=CC=C1C(CBr)=O M10257084P [0,1,1,0,0,0|2,0,0]=4 275 B11R1.222 CCC(C1=CC=CC=C1O)=O M10015895P [0,1,1,0,0,0|1,0,0]=3 276 B11R1.222 O=C(C#N)C1=CC=CC=C1C M10082249P [0,1,1,0,0,0|2,0,0]=4 277 B11R1.222 O=C(C1=CC=CNC1=O)OC M10112204P [0,1,1,0,0,0|1,0,0]=3 278 B11R1.222 O=C(C1=CN=CNC1=O)OC M10066180P [0,1,1,0,0,0|2,0,0]=4 279 B11R1.222 O=C(C1=NC=CN=C1C)OC M10244953P [0,1,1,0,0,0|2,0,0]=4 280 B11R1.222 O=C(C1=NC=CN=C1Cl)OC M10199725P [0,1,1,0,0,0|2,0,0]=4 281 B11R1.222 O=C(C1=NC=CN=C1O)OC M10199724P [0,1,1,0,0,0|2,0,0]=4 282 B11R1.222 O=C(NC)C1=CC=CC=C1N M10060394P [0,1,1,0,0,0|1,0,0]=3 283 B11R1.222 O=C(NC)C1=CC=CC=C1S M10164094P [0,1,1,0,0,0|1,0,0]=3 284 B11R1.222 O=C(OC)C1=C(Br)N=CC=C1 M10266614P [0,1,1,0,0,0|1,0,0]=3 285 B11R1.222 O=C(OC)C1=C(I)N=CC=C1 M10033834P [0,1,1,0,0,0|1,0,0]=3 286 B11R1.222 O=C(OC)C1=C(O)N=CC=C1 M10424969P [0,1,1,0,0,0|1,0,0]=3 287 B11R1.222 O=C(OC)C1=CC=CC=C1Br M10015892P [0,1,1,0,0,0|0,0,0]=2 288 B11R1.222 O=C(OC)C1=CC=NC=C1Br M10309681P [0,1,1,0,0,0|1,0,0]=3 289 B11R1.222 O=C(OC)C1=CC=NC=C1N M10281523P [0,1,1,0,0,0|1,0,0]=3 290 B11R1.222 O=C(OC)C1=CC=NC=C1O M10112202P [0,1,1,0,0,0|1,0,0]=3 291 B11R1.222 O=C(OC)C1=CN=CC=C1C M10220278P [0,1,1,0,0,0|1,0,0]=3 292 B11R1.222 O=C(OC)C1=CN=CC=C1N M10140869P [0,1,1,0,0,0|1,0,0]=3 293 B11R1.222 O=C(OC)C1=CN=CC=C1O M10424883P [0,1,1,0,0,0|1,0,0]=3 294 B11R1.1 O=C\C=C\C1=CC=C(F)C=C1 M10185947P [0,1,1,0,0,0|1,0,1]=4 295 B11R1.17 O=C\C=C\C1=CC=CC=C1C M10615838P [0,1,1,0,0,0|1,0,1]=4 296 B11R1.24 O=C\C=C\C1=CC=CC(Cl)=C1 M10289314P [0,1,1,0,0,0|1,0,1]=4 297 B11R1.24 O=C\C=C\C1=CC=CC(F)=C1 M10289315P [0,1,1,0,0,0|1,0,1]=4 298 B11R1.28 C=CCNCC1=CC=CC=C1 M10062629P [0,1,1,0,0,0|2,0,0]=4 299 B11R1.28 ClCCOCC1=CC=CC=C1 M10148097P [0,1,1,0,0,0|1,0,1]=4 300 B11R1.28 OCCOCC1=CC=CC=C1 M10016555P [0,1,1,0,0,0|0,0,2]=4 301 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 M10192599P [0,1,1,0,0,0|0,0,0]=2 302 B11R1.91 O=C(O)CCC1=NC=CC=C1 M10135517P [0,1,1,0,0,0|2,0,0]=4 303 B11R1.91 O=C(O)COC1=CC=CC=C1 M10190227P [0,1,1,0,0,0|2,0,0]=4 304 B11R1.91 O=[N+](CCC1=CC=CC=C1)[O-] M10084031P [0,1,1,0,0,0|2,0,0]=4 305 B11R1.91 S\C(N)=N\CC1=CC=CC=C1 M10013542P [0,1,1,0,0,0|1,1,0]=4 306 B11R1.37 O=CC1=CC(Cl)=CC=C1OC M10100356P [0,1,1,0,0,0|2,0,0]=4 307 B11R1.37 O=CC1=CC=C(Br)C=C1OC M10250771P [0,1,1,0,0,0|2,0,0]=4 308 B11R1.37 O=CC1=CC=C(F)C=C1C#N M10468228P [0,1,1,0,0,0|1,0,1]=4 309 B11R1.41 N#CC1=CC=CC=C1CCO M10248278P [0,1,1,0,0,0|1,0,1]=4 310 B11R1.41 NOCC1=CC=CC=C1OC M10857713P [0,1,1,0,0,0|2,0,0]=4 311 B11R1.41 O=CC1=CC=CC=C1CCBr M10177301P [0,1,1,0,0,0|1,0,0]=3 312 B11R1.53 N#CC1=CC=CC=C1C(C)=O M10601682P [0,1,1,0,0,0|1,0,1]=4 313 B11R1.53 O=C(Cl)C1=CC=CC=C1C#N M10198862P [0,1,1,0,0,0|1,0,1]=4 314 B11R1.53 O=C(N)C1=CC=CC=C1CBr M11010748P [0,1,1,0,0,0|1,0,0]=3 315 B11R1.53 O=C(O)C1=CC=CC=C1C#C M10220915P [0,1,1,0,0,0|1,0,1]=4 316 B11R1.53 O=C(O)C1=CC=CC=C1CC M10015969P [0,1,1,0,0,0|1,0,0]=3 317 B11R1.53 O=C(O)C1=CC=CC=C1OC M10013270P [0,1,1,0,0,0|2,0,0]=4 318 B11R1.53 O=C(O)C1=NC=CC=C1C=O M10159484P [0,1,1,0,0,0|1,0,1]=4 319 B11R1.53 O=CC1=CC=CC=C1[N+]([O-])=O M10194508P [0,1,1,0,0,0|1,0,1]=4 320 B11R1.53 O=[N+](C1=CC=CC=C1CC)[O-] M10015971P [0,1,1,0,0,0|2,0,0]=4 321 B11R1.265 O=CC1=C(OC)C=CC=C1F M10769439P [0,1,1,0,0,0|2,0,0]=4 322 B11R1.265 O=CC1=C(OC)C=CC=C1I M10068124P [0,1,1,0,0,0|2,0,0]=4 323 B11R1.87 O=S(C1=C(C)C=CN=C1)(O)=O M10066456P [0,1,1,0,0,0|2,0,0]=4 324 B11R1.87 O=S(C1=CC=CC=C1C)(Cl)=O M10005020P [0,1,1,0,0,0|1,0,1]=4 325 B11R1.87 O=S(C1=CC=CC=C1I)(O)=O M10388681P [0,1,1,0,0,0|2,0,0]=4 326 B11R1.156 CC1=CC=CC(Cl)=C1[N+]([O-])=O M10072152P [0,1,1,0,0,0|1,0,1]=4 327 B11R1.156 O=C(O)C1=C(C)C=CC=C1Br M10594683P [0,1,1,0,0,0|0,0,0]=2 328 B11R1.156 O=C(O)C1=C(C)C=NC=C1F M10114185P [0,1,1,0,0,0|1,0,0]=3 329 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1Cl M10127695P [0,1,1,0,0,0|2,0,0]=4 330 B11R1.156 O=C(O)C1=C(F)C=NC=C1F M11031064P [0,1,1,0,0,0|2,0,0]=4 331 B11R1.156 O=C(O)C1=C(O)C=CC=C1N M10014339P [0,1,1,0,0,0|1,0,0]=3 332 B11R1.159 CC(C1=CC=CC(Br)=C1N)=O M10961991P [0,1,1,0,0,0|2,0,0]=4 333 B11R1.159 CC(C1=CC=CC(C)=C1C)=O M10040404P [0,1,1,0,0,0|1,0,0]=3 334 B11R1.159 CC(C1=CC=CC(N)=C1O)=O M10588286P [0,1,1,0,0,0|2,0,0]=4 335 B11R1.159 CC(C1=CC=CC(O)=C1O)=O M10124289P [0,1,1,0,0,0|2,0,0]=4 336 B11R1.159 O=C(C1=NC=NC(Cl)=C1C)O M10083595P [0,1,1,0,0,0|2,0,0]=4 337 B11R1.159 O=C(C1=NC=NC(O)=C1C)O M11105119P [0,1,1,0,0,0|2,0,0]=4 338 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I M10716849P [0,1,1,0,0,0|1,0,0]=3 339 B11R1.159 O=C(O)C1=CC=CC(I)=C1C M10736428P [0,1,1,0,0,0|0,0,0]=2 340 B11R1.159 O=C(O)C1=CC=CC(I)=C1N M10167391P [0,1,1,0,0,0|1,0,0]=3 341 B11R1.159 O=C(O)C1=CC=CC(N)=C1N M10015537P [0,1,1,0,0,0|1,0,0]=3 342 B11R1.159 O=C(O)C1=CC=NC(Cl)=C1F M10904386P [0,1,1,0,0,0|2,0,0]=4 343 B11R1.159 O=C(O)C1=CC=NC(F)=C1F M11000247P [0,1,1,0,0,0|2,0,0]=4 344 B11R1.159 O=C(O)C1=CN=CC(Br)=C1O M10097255P [0,1,1,0,0,0|2,0,0]=4 345 B11R1.166 CC(C1=CC=C(Br)C=C1F)=O M10903289P [0,1,1,0,0,0|2,0,0]=4 346 B11R1.166 CC(C1=CC=C(Br)C=C1O)=O M10208950P [0,1,1,0,0,0|2,0,0]=4 347 B11R1.166 CC(C1=CC=C(Cl)C=C1Br)=O M10021457P [0,1,1,0,0,0|2,0,0]=4 348 B11R1.166 CC(C1=CC=C(Cl)C=C1F)=O M10804741P [0,1,1,0,0,0|2,0,0]=4 349 B11R1.166 CC(C1=CC=C(Cl)C=C1O)=O M10097246P [0,1,1,0,0,0|2,0,0]=4 350 B11R1.166 CC(C1=CC=C(N)C=C1Cl)=O M10447645P [0,1,1,0,0,0|2,0,0]=4 351 B11R1.166 CC(C1=CC=C(O)C=C1O)=O M10185982P [0,1,1,0,0,0|2,0,0]=4 352 B11R1.166 O=C(C1=C(N)C=C(O)N=C1)O M10500943P [0,1,1,0,0,0|2,0,0]=4 353 B11R1.166 O=C(C1=CN=C(C)N=C1C)O M10455448P [0,1,1,0,0,0|2,0,0]=4 354 B11R1.166 O=C(C1=CN=C(N)N=C1C)O M10020363P [0,1,1,0,0,0|2,0,0]=4 355 B11R1.166 O=C(Cl)C1=CC=C(Cl)C=C1F M10009980P [0,1,1,0,0,0|2,0,0]=4 356 B11R1.166 O=C(N)C1=CC=C(O)C=C1O M10051621P [0,1,1,0,0,0|2,0,0]=4 357 B11R1.166 O=C(O)C1=C(C)N=C(C)C=C1 M10081304P [0,1,1,0,0,0|1,0,0]=3 358 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 M10114188P [0,1,1,0,0,0|2,0,0]=4 359 B11R1.166 O=C(O)C1=CC=C(Br)C=C1C M10431894P [0,1,1,0,0,0|0,0,0]=2 360 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Cl M10309446P [0,1,1,0,0,0|1,0,0]=3 361 B11R1.166 O=C(O)C1=CC=C(Br)C=C1F M10684902P [0,1,1,0,0,0|1,0,0]=3 362 B11R1.166 O=C(O)C1=CC=C(Br)C=C1N M10167387P [0,1,1,0,0,0|1,0,0]=3 363 B11R1.166 O=C(O)C1=CC=C(F)C=C1Br M10132408P [0,1,1,0,0,0|1,0,0]=3 364 B11R1.166 O=C(O)C1=CC=C(I)C=C1F M10719837P [0,1,1,0,0,0|1,0,0]=3 365 B11R1.166 O=C(O)C1=CC=C(I)C=C1N M10167390P [0,1,1,0,0,0|1,0,0]=3 366 B11R1.166 O=C(O)C1=CC=C(O)C=C1C M10014604P [0,1,1,0,0,0|0,0,0]=2 367 B11R1.166 O=C(O)C1=CN=C(C)C=C1Cl M11097765P [0,1,1,0,0,0|2,0,0]=4 368 B11R1.166 O=C(O)C1=CN=C(O)C=C1Cl M10449854P [0,1,1,0,0,0|2,0,0]=4 369 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1N M10271845P [0,1,1,0,0,0|2,0,0]=4 370 B11R1.166 O=C(O)C1=NC=C(F)C=C1F M10948825P [0,1,1,0,0,0|2,0,0]=4 371 B11R1.166 O=C([O-])C1=CC=C(N)C=C1O M10082890P [0,1,1,0,0,0|1,0,1]=4 372 B11R1.166 OC1=CC(N)=CC=C1C([O-])=O M10005003P [0,1,1,0,0,0|1,0,1]=4 373 B11R1.167 CC(C1=CC(Br)=CC=C1N)=O M10205079P [0,1,1,0,0,0|2,0,0]=4 374 B11R1.167 CC(C1=CC(Cl)=CC=C1Br)=O M10023635P [0,1,1,0,0,0|2,0,0]=4 375 B11R1.167 CC(C1=CC(Cl)=CC=C1N)=O M10034749P [0,1,1,0,0,0|2,0,0]=4 376 B11R1.167 CC(C1=CC(F)=CC=C1Br)=O M10025041P [0,1,1,0,0,0|2,0,0]=4 377 B11R1.167 CC(C1=CC(F)=CC=C1N)=O M10042636P [0,1,1,0,0,0|2,0,0]=4 378 B11R1.167 CC1=CC=[N+](C)C=C1C(N)=O M10676560P [0,1,1,0,0,0|2,0,0]=4 379 B11R1.167 O=C(C1=CC(Cl)=CN=C1C)O M10100378P [0,1,1,0,0,0|1,0,0]=3 380 B11R1.167 O=C(C1=NC(C)=CN=C1C)O M10043888P [0,1,1,0,0,0|2,0,0]=4 381 B11R1.167 O=C(N)C1=CC(Br)=CC=C1N M10142063P [0,1,1,0,0,0|2,0,0]=4 382 B11R1.167 O=C(O)C1=C(Br)C=NC(Cl)=C1 M10021375P [0,1,1,0,0,0|2,0,0]=4 383 B11R1.167 O=C(O)C1=C(Br)N=CC(Br)=C1 M10205800P [0,1,1,0,0,0|2,0,0]=4 384 B11R1.167 O=C(O)C1=C(Br)N=CC(Cl)=C1 M10413552P [0,1,1,0,0,0|2,0,0]=4 385 B11R1.167 O=C(O)C1=C(C)N=CC(Br)=C1 M10864383P [0,1,1,0,0,0|1,0,0]=3 386 B11R1.167 O=C(O)C1=C(Cl)N=CC(C)=C1 M10422190P [0,1,1,0,0,0|2,0,0]=4 387 B11R1.167 O=C(O)C1=C(Cl)N=CC(O)=C1 M10250128P [0,1,1,0,0,0|2,0,0]=4 388 B11R1.167 O=C(O)C1=CC(C)=CC=C1Cl M10090728P [0,1,1,0,0,0|1,0,0]=3 389 B11R1.167 O=C(O)C1=CC(C)=CC=C1I M10265765P [0,1,1,0,0,0|1,0,0]=3 390 B11R1.167 O=C(O)C1=CC(F)=CC=C1I M10265769P [0,1,1,0,0,0|1,0,0]=3 391 B11R1.167 O=C(O)C1=CC(N)=CC=C1Br M10048175P [0,1,1,0,0,0|1,0,0]=3 392 B11R1.167 O=C(O)C1=CC(N)=CC=C1N M10015883P [0,1,1,0,0,0|1,0,0]=3 393 B11R1.167 O=C(O)C1=CC(O)=CC=C1C M10014599P [0,1,1,0,0,0|0,0,0]=2 394 B11R1.167 O=C(O)C1=CC(O)=CC=C1Cl M10291718P [0,1,1,0,0,0|1,0,0]=3 395 B11R1.167 O=C(O)C1=NC(Br)=CC=C1F M11097342P [0,1,1,0,0,0|2,0,0]=4 396 B11R1.167 O=C(O)C1=NC(C)=CC=C1O M10129197P [0,1,1,0,0,0|2,0,0]=4 397 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1C M11111913P [0,1,1,0,0,0|1,0,0]=3 398 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1N M10007549P [0,1,1,0,0,0|2,0,0]=4 399 B11R2.10 BrC1=CC2=CC=CC=C2S1 M10072498P [1,1,0,0,0,0|2,0,0]=4 400 B11R2.10 CC1=CC2=CC=CC=C2O1 M10191752P [1,1,0,0,0,0|2,0,0]=4 401 B11R2.36 BrC1=CC2=C(C=C1)C=NN2 M10476738P [1,1,0,0,0,0|2,0,0]=4 402 B11R2.36 BrC1=CC2=C(C=C1)CCN2 M10396601P [1,1,0,0,0,0|2,0,0]=4 403 B11R2.36 BrC1=CC2=C(CNC2)C=C1 M10725028P [1,1,0,0,0,0|1,0,1]=4 404 B11R2.36 BrC1=CC2=NON=C2C=C1 M10259450P [1,1,0,0,0,0|2,0,0]=4 405 B11R2.36 BrC1=CC=C2OCCC2=C1 M10421778P [1,1,0,0,0,0|2,0,0]=4 406 B11R2.36 BrC1=CC=C2ON=CC2=C1 M10994040P [1,1,0,0,0,0|2,0,0]=4 407 B11R2.36 CC1=CC2=C(NN=C2)C=C1 M10036113P [1,1,0,0,0,0|2,0,0]=4 408 B11R2.36 ClC1=CC2=C(C=C1)CCN2 M10587555P [1,1,0,0,0,0|2,0,0]=4 409 B11R2.36 ClC1=CC2=C(CNC2)C=C1 M11033369P [1,1,0,0,0,0|1,0,1]=4 410 B11R2.36 ClC1=CC2=C(NC=C2)C=C1 M10149485P [1,1,0,0,0,0|2,0,0]=4 411 B11R2.36 FC1=CC=C2C(C=CS2)=C1 M10437074P [1,1,0,0,0,0|2,0,0]=4 412 B11R2.36 IC1=CC2=C(NN=C2)C=C1 M10285587P [1,1,0,0,0,0|2,0,0]=4 413 B11R2.36 NC1=CC2=C(CNC2)C=C1 M10889276P [1,1,0,0,0,0|1,0,1]=4 414 B11R2.36 NC1=CC2=C(COC2)C=C1 M10352529P [1,1,0,0,0,0|0,0,1]=3 415 B11R2.36 NC1=CC=C2C=NOC2=C1 M10982908P [1,1,0,0,0,0|2,0,0]=4 416 B11R2.36 NC1=CC=C2OCCC2=C1 M10250054P [1,1,0,0,0,0|2,0,0]=4 417 B11R2.36 NC1=CC=C2ON=CC2=C1 M10843376P [1,1,0,0,0,0|2,0,0]=4 418 B11R2.36 OC1=CC2=C(CCC2)C=C1 M10031294P [1,1,0,0,0,0|1,0,1]=4 419 B11R2.36 OC1=CC2=C(NC=C2)C=C1 M10038351P [1,1,0,0,0,0|2,0,0]=4 420 B11R2.36 OC1=CC=C2OCCC2=C1 M10242931P [1,1,0,0,0,0|2,0,0]=4 421 B11R2.106 BrC1=C2C(C=CS2)=CC=C1 M10030590P [1,1,0,0,0,0|2,0,0]=4 422 B11R2.106 BrC1=C2OC=CC2=CC=C1 M10737143P [1,1,0,0,0,0|2,0,0]=4 423 B11R2.106 BrC1=C2OCCC2=CC=C1 M10832246P [1,1,0,0,0,0|2,0,0]=4 424 B11R2.106 BrC1=CC=CC2=C1C=NN2 M10815465P [1,1,0,0,0,0|2,0,0]=4 425 B11R2.106 BrC1=CC=CC2=C1CC=C2 M10144225P [1,1,0,0,0,0|1,0,0]=3 426 B11R2.106 BrC1=CC=CC2=C1CNC2 M10080184P [1,1,0,0,0,0|1,0,1]=4 427 B11R2.106 FC1=C2C(C=CS2)=CC=C1 M10863524P [1,1,0,0,0,0|2,0,0]=4 428 B11R2.106 FC1=CC=CC2=C1CCN2 M10893724P [1,1,0,0,0,0|2,0,0]=4 429 B11R2.106 OC1=CC=CC2=C1C=NN2 M10483164P [1,1,0,0,0,0|2,0,0]=4 430 B11R2.202 O=C1C2=CSC=C2C(O1)=O M10082800P [0,1,0,0,1,0|1,0,1]=4 431 B11R2.988 OCC1=CC2=CC=CC=C12 M10134953P [0,1,0,0,1,0|0,0,2]=4 432 B13R2.155 O=C1CC2=C(C=CC(Br)=C2)CC1 M10734406P [0,1,0,0,0,1|1,0,0]=3 433 B13R2.155 O=C1CC2=C(C=CC(Cl)=C2)CC1 M10150161P [0,1,0,0,0,1|1,0,0]=3 434 B13R2.155 O=C1CC2=C(C=CC(O)=C2)CC1 M10234539P [0,1,0,0,0,1|1,0,0]=3 435 B13R2.155 O=C1COC2=CC=C(Br)C=C2N1 M10182872P [0,1,0,0,0,1|2,0,0]=4 436 B13R2.155 O=C1NC2=C(C=CC(Br)=C2)C=N1 M10088508P [0,1,0,0,0,1|1,0,1]=4 437 B13R2.155 O=C1NC2=C(C=CC(Br)=C2)N=C1 M10485764P [0,1,0,0,0,1|2,0,0]=4 438 B13R2.155 O=C1NC2=C(C=CC(N)=C2)CC1 M10174088P [0,1,0,0,0,1|1,0,0]=3 439 B13R2.162 O=C1CC2=C(C=CC=C2Br)CC1 M10704031P [0,1,0,0,0,1|1,0,0]=3 440 B13R2.162 O=C1CC2=C(C=CC=C2O)CC1 M10271445P [0,1,0,0,0,1|1,0,0]=3 441 B13R2.162 O=C1NC2=C(C=CC=C2Br)C=C1 M10427659P [0,1,0,0,0,1|1,0,1]=4 442 B13R2.328 O=C1C2=CC=CC=C2N=C(C)O1 M10013132P [0,1,0,0,0,1|1,0,1]=4 443 B13R2.369 O=C1NC2=C(C=CC=C2)NC1=O M10138641P [0,1,0,0,0,1|2,0,0]=4 444 B13R2.3683 ClC1=CC=2CCC(=O)OC2C=C1 M10234057P [0,1,0,0,0,1|1,0,0]=3 445 B13R2.3683 O=C1CC2=C(C=C(F)C=C2)CC1 M10206132P [0,1,0,0,0,1|1,0,0]=3 446 B13R2.3683 O=C1NC2=C(C=C(Br)C=C2)CN1 M11121609P [0,1,0,0,0,1|1,0,0]=3 447 B13R2.3683 O=C1NC2=C(C=C(Br)C=C2)NC1 M11001677P [0,1,0,0,0,1|2,0,0]=4 448 B13R2.5179 O=C1CC2=C(C(Br)=CC=C2)CC1 M10734405P [0,1,0,0,0,1|1,0,0]=3 449 B13R2.342 O=C1CCOC2=C1C=CC=C2Br M10831155P [0,1,0,0,0,1|1,0,0]=3 450 B13R2.342 O=C1CCOC2=C1C=CC=C2Cl M10252844P [0,1,0,0,0,1|1,0,0]=3 451 B13R2.342 O=C1CCOC2=C1C=CC=C2F M10677126P [0,1,0,0,0,1|1,0,0]=3 452 B13R2.342 O=C1NC=CC2=C1C=CC=C2C M10183542P [0,1,0,0,0,1|1,0,1]=4 453 B13R2.342 O=C1NC=CC2=C1C=CC=C2O M10069174P [0,1,0,0,0,1|1,0,1]=4 454 B13R2.342 O=C1NCCC2=C1C=CC=C2C M10728724P [0,1,0,0,0,1|1,0,0]=3 455 B13R2.371 O=C1CCC(C)C2=C1C=CC=C2 M10162865P [0,1,0,0,0,1|1,0,0]=3 456 B13R2.371 O=C1NC=C(Br)C2=C1C=CC=C2 M10058811P [0,1,0,0,0,1|1,0,1]=4 457 B13R2.371 O=C1NN=C(Cl)C2=C1C=CC=C2 M10041854P [0,1,0,0,0,1|1,0,1]=4 458 B13R2.9 O=CC1=CNC2=C1C=CC=C2Br M10698315P [0,2,0,0,0,0|2,0,0]=4 459 B13R2.9 O=CC1=CNC2=C1C=CC=C2C M10066143P [0,2,0,0,0,0|2,0,0]=4 460 B13R2.9 O=CC1=CNC2=C1C=CC=C2Cl M10025101P [0,2,0,0,0,0|2,0,0]=4 461 B13R2.9 O=CC1=CNC2=C1C=CC=C2F M10724581P [0,2,0,0,0,0|2,0,0]=4 462 B13R2.72 CC(C1=NNC2=C1C=CC=C2)=O M10063932P [0,2,0,0,0,0|2,0,0]=4 463 B13R2.72 O=C(C1=COC2=CC=CC=C12)O M10194324P [0,2,0,0,0,0|2,0,0]=4 464 B13R2.72 O=C(C1=NNC2=C1C=CC=C2)N M10588264P [0,2,0,0,0,0|2,0,0]=4 465 B13R2.72 O=C(C1=NOC2=C1C=CC=C2)O M10203223P [0,2,0,0,0,0|2,0,0]=4 466 B13R2.72 O=C(C1CCC2=C1C=CC=C2)N M10221350P [0,2,0,0,0,0|1,0,1]=4 467 B13R2.72 O=C(C1CCC2=C1C=CC=C2)O M10130766P [0,2,0,0,0,0|1,0,1]=4 468 B13R2.72 O=C(Cl)C1=CNC2=C1C=CC=C2 M10307804P [0,2,0,0,0,0|2,0,0]=4 469 B13R2.72 O=[N+](C1=CNC2=C1C=CC=C2)[O-] M10066119P [0,2,0,0,0,0|2,0,0]=4 470 B13R2.662 O=CC1=CNC2=C1C=CC(C)=C2 M10066142P [0,2,0,0,0,0|2,0,0]=4 471 B13R2.662 O=CC1=NNC2=C1C=CC(Br)=C2 M10019507P [0,2,0,0,0,0|2,0,0]=4 472 B13R2.2091 O=CC1=CNC2=C1C(C)=CC=C2 M10066141P [0,2,0,0,0,0|2,0,0]=4 473 B13R2.2091 O=CC1=CNC2=C1C(F)=CC=C2 M10178268P [0,2,0,0,0,0|2,0,0]=4 474 B13R2.2136 O=CC1=CNC2=C1C=C(C)C=C2 M10265866P [0,2,0,0,0,0|2,0,0]=4 475 B13R2.2136 O=CC1=CNC2=C1C=C(F)C=C2 M10042601P [0,2,0,0,0,0|2,0,0]=4 476 B13R2.2136 O=CC1=CNC2=C1C=C(O)C=C2 M10054228P [0,2,0,0,0,0|2,0,0]=4 477 B13R2.2136 O=CC1=NNC2=C1C=C(Br)C=C2 M10829414P [0,2,0,0,0,0|2,0,0]=4 478 B13R2.3028 O=C1C(C)CC2=C1C=C(F)C=C2 M10234443P [0,2,0,0,0,0|1,0,0]=3 479 B13R2.3028 O=C1NC2=C(C=C(I)C=C2)C1=O M10167416P [0,2,0,0,0,0|2,0,0]=4 480 B13R2.3085 O=C1N(C)C2=C(C=CC=C2)C1=O M10039584P [0,2,0,0,0,0|2,0,0]=4 481 B13R2.3085 O=C1N(Cl)C(C2=C1C=CC=C2)=O M10054885P [0,2,0,0,0,0|1,0,1]=4 482 B13R2.3085 O=C1N(N)C(C2=C1C=CC=C2)=O M10037416P [0,2,0,0,0,0|1,0,1]=4 483 B13R2.4825 O=C1C(C)CC2=C1C=CC=C2Br M10803012P [0,2,0,0,0,0|1,0,0]=3 484 B13R2.4856 O=C1NC2=C(C(Cl)=CC=C2)C1=O M10090821P [0,2,0,0,0,0|2,0,0]=4 485 B13R2.669 N#CC1=CC2=C(CCC2=O)C=C1 M10436750P [0,2,0,0,0,0|1,0,0]=3 486 B13R2.5187 O=C1OC(C2=C1C=CC(C)=C2)=O M10160961P [0,2,0,0,0,0|0,0,1]=3 487 B13R2.11634 O=C1CCC2=C1C=C(F)C(F)=C2 M10790614P [0,2,0,0,0,0|1,0,0]=3 488 B13R2.4857 O=C1NC(C2=C1C=CC=C2N)=O M10044904P [0,2,0,0,0,0|1,0,1]=4 489 B13R2.4857 O=C1OC(C2=C1C=CC=C2C)=O M10192324P [0,2,0,0,0,0|0,0,1]=3 490 B13R2.4857 O=C1OC(C2=C1C=CC=C2Cl)=O M10004115P [0,2,0,0,0,0|0,0,1]=3 491 B13R2.2130 O=C1CCC2=C1C=CC(OC)=C2 M10068827P [0,2,0,0,0,0|1,0,0]=3 492 B9R0.2 C\C=C\C=C\COC(C)=O M10032064P [0,0,2,0,0,0|0,0,2]=4 493 B9R1.11 O=C(C1=CC=CO1)SC M10125734P [0,0,1,0,1,0|1,1,0]=4 494 B9R1.11 O=C(C1=CC=CS1)OC M10072317P [0,0,1,0,1,0|1,0,0]=3 495 B9R1.11 O=C(C1=CC=NO1)OC M10134693P [0,0,1,0,1,0|2,0,0]=4 496 B9R1.11 O=C(C1=COC=N1)OC M10799100P [0,0,1,0,1,0|2,0,0]=4 497 B9R1.11 O=C(C1=NC=CN1)OC M10148851P [0,0,1,0,1,0|2,0,0]=4 498 B9R1.41 O=C(C1=C(Br)SC=C1)O M10184016P [0,0,1,0,1,0|2,0,0]=4 499 B9R1.41 O=C(C1=C(C)NC=C1)O M10232587P [0,0,1,0,1,0|1,0,0]=3 500 B9R1.41 O=C(C1=C(C)OC=N1)O M10652463P [0,0,1,0,1,0|2,0,0]=4 501 B9R1.41 O=C(C1=C(C)SC=N1)O M10710316P [0,0,1,0,1,0|2,0,0]=4 502 B9R1.41 O=C(C1=C(F)C=CS1)O M10217169P [0,0,1,0,1,0|2,0,0]=4 503 B9R1.41 O=C(C1=CON=C1C)O M10147590P [0,0,1,0,1,0|2,0,0]=4 504 B9R1.41 O=C(C1=CSN=C1C)O M10139322P [0,0,1,0,1,0|2,0,0]=4 505 B9R2.50 C12=CC=CC=C1CC2 M10018631P [1,0,0,0,1,0|0,0,1]=3 506 B11R1.86 CC(CC1=CC=CC=C1Br)=O M10172330P [0,0,1,0,0,1|2,0,0]=4 507 B11R1.86 CC(CC1=CC=CC=C1C)=O M10257313P [0,0,1,0,0,1|1,0,0]=3 508 B11R1.86 CC(CC1=CC=CC=C1Cl)=O M10088231P [0,0,1,0,0,1|2,0,0]=4 509 B11R1.86 CC(CC1=CC=CC=C1F)=O M10048160P [0,0,1,0,0,1|2,0,0]=4 510 B11R1.86 CC(CC1=CC=CC=C1O)=O M12278736P [0,0,1,0,0,1|2,0,0]=4 511 B11R1.86 O=C(Cl)OC1=CC=CC=C1Cl M10160517P [0,0,1,0,0,1|2,0,0]=4 512 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 M10021502P [0,0,0,0,0,2|1,0,0]=3