0 B13R2.11634 CC1=NNC2=CC(Br)=C(F)C=C21 3469AJ [0,0,0,0,0,0|2,2,0]=4 1 B12R2.100 CC1=C(C)C=C2NN=CC2=C1 3052AJ [1,0,0,0,0,0|3,0,0]=4 2 B12R2.100 CC1=C(Cl)C=C2NN=CC2=C1 6440AJ [1,0,0,0,0,0|2,0,0]=3 3 B12R2.100 CC1=CC2=C(C=CN2)C=C1Cl 8210AA [1,0,0,0,0,0|3,0,0]=4 4 B12R2.100 CC1=CC2=C(C=CO2)C=C1Br 1113AB [1,0,0,0,0,0|2,1,0]=4 5 B12R2.100 CC1=CC2=C(C=NN2)C=C1N 2601AC [1,0,0,0,0,0|3,0,0]=4 6 B12R2.100 ClC1=C(Br)C=C2C=NNC2=C1 3136AJ [1,0,0,0,0,0|1,1,0]=3 7 B12R2.100 ClC1=C(Br)C=C2NC=CC2=C1 3264AA [1,0,0,0,0,0|2,1,0]=4 8 B12R2.100 ClC1=C(Cl)N=C2NC=CC2=C1 X5590 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.100 ClC1=CC2=C(C=C1Cl)OCO2 6653AE [1,0,0,0,0,0|2,0,0]=3 10 B12R2.100 ClC1=CC2=C(C=C1Cl)SC=N2 8204AJ [1,0,0,0,0,0|2,1,0]=4 11 B12R2.100 FC1=C(Cl)C=C2NN=NC2=C1 Y4901 [1,0,0,0,0,0|2,1,0]=4 12 B12R2.100 NC1=C(Cl)C=C2N=COC2=C1 W9501 [1,0,0,0,0,0|3,0,0]=4 13 B12R2.100 NC1=C(Cl)C=C2NN=CC2=C1 1239AB [1,0,0,0,0,0|2,0,0]=3 14 B12R2.100 NC1=CC2=C(C=C1F)NN=C2 Y5529 [1,0,0,0,0,0|2,1,0]=4 15 B12R2.100 OC1=C(Br)C=C2C=NNC2=C1 4319AA [1,0,0,0,0,0|2,1,0]=4 16 B12R2.132 BrC1=CC=C2OC=C(Br)C2=C1 Y4899 [1,0,0,0,0,0|2,1,0]=4 17 B12R2.132 CC1=CC2=C(C=C1)NN=C2Br Y9031 [1,0,0,0,0,0|3,0,0]=4 18 B12R2.132 CC1=CC2=C(C=C1)ON=C2N 4945AC [1,0,0,0,0,0|2,0,0]=3 19 B12R2.132 CC1=CC2=C(C=C1)ONC2=O 0075AC [1,0,0,0,0,0|1,0,2]=4 20 B12R2.132 CC1=NOC2=CC=C(N)C=C21 Z5192 [1,0,0,0,0,0|2,0,0]=3 21 B12R2.132 CN1N=CC2=C1C=C(Cl)C=C2 Y5770 [1,0,0,0,0,0|3,0,0]=4 22 B12R2.132 ClC1=CC2=C(C=C1)NC=C2Br 3152AC [1,0,0,0,0,0|3,0,0]=4 23 B12R2.132 ClC1=CC2=C(C=C1)NN=C2Br Y4530 [1,0,0,0,0,0|2,0,0]=3 24 B12R2.132 ClC1=CC2=C(C=N1)NN=C2I 3188AJ [1,0,0,0,0,0|3,0,0]=4 25 B12R2.132 ClC1=CC=C2NN=C(Cl)C2=C1 Z2667 [1,0,0,0,0,0|2,0,0]=3 26 B12R2.132 ClC1=CN=C2NN=C(I)C2=C1 3187AJ [1,0,0,0,0,0|3,0,0]=4 27 B12R2.132 ClC1=NOC2=C1C=C(Br)C=C2 5353AB [1,0,0,0,0,0|1,1,0]=3 28 B12R2.132 FC1=CC2=C(C=C1)NN=C2Br Y5630 [1,0,0,0,0,0|2,1,0]=4 29 B12R2.132 FC1=CC=C2ON=C(Cl)C2=C1 W3891 [1,0,0,0,0,0|1,1,0]=3 30 B12R2.132 NC1=CC2=C(C=C1)NN=C2Cl Y9056 [1,0,0,0,0,0|3,0,0]=4 31 B12R2.132 NC1=CC2=C(C=C1)ONC2=O 1421AC [1,0,0,0,0,0|1,0,2]=4 32 B12R2.132 NC1=NNC2=C1C=C(Cl)C=C2 B901 [1,0,0,0,0,0|2,0,0]=3 33 B12R2.132 NC1=NNC2=C1C=C(I)C=C2 B894 [1,0,0,0,0,0|2,1,0]=4 34 B12R2.132 NC1=NOC2=CC=C(F)C=C21 5444AC [1,0,0,0,0,0|1,1,0]=3 35 B12R2.132 NC1COC2=CC=C(Cl)C=C21 3180AJ [1,0,0,0,0,0|2,0,1]=4 36 B12R2.132 O=C1COC2=CC=C(Cl)C=C12 W5443 [1,0,0,0,0,0|1,0,1]=3 37 B12R2.132 O=C1NCC2=CC=C(Cl)C=C12 8589AB [1,0,0,0,0,0|1,0,2]=4 38 B12R2.132 O=C1NOC2=C1C=C(Cl)C=C2 1873AB [1,0,0,0,0,0|0,0,2]=3 39 B12R2.612 BrC1=CC2=C(C=C1)C(Br)=NN2 4376AC [1,0,0,0,0,0|2,1,0]=4 40 B12R2.612 CC1=CC=C2C(=C1)NN=C2Cl 5317AH [1,0,0,0,0,0|3,0,0]=4 41 B12R2.612 CC1=NNC2=C1C=CC(O)=C2 W4256 [1,0,0,0,0,0|3,0,0]=4 42 B12R2.612 CC1=NNC2=C1C=NC(Cl)=C2 Y5173 [1,0,0,0,0,0|3,0,0]=4 43 B12R2.612 CC1=NOC2=CC(Cl)=CC=C21 V7165 [1,0,0,0,0,0|1,0,0]=2 44 B12R2.612 ClC1=CC2=C(C=C1)C(Br)=NN2 Y4528 [1,0,0,0,0,0|2,0,0]=3 45 B12R2.612 ClC1=CC=C2C(I)=NNC2=N1 3509AJ [1,0,0,0,0,0|3,0,0]=4 46 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 4591AA [1,0,0,0,0,0|1,1,0]=3 47 B12R2.612 FC1=CC2=C(C=C1)C(Br)=NN2 Y5635 [1,0,0,0,0,0|2,1,0]=4 48 B12R2.612 NC1=CC2=C(C=C1)C(I)=NN2 Y5631 [1,0,0,0,0,0|3,0,0]=4 49 B12R2.612 NC1=CC2=C(C=C1)C(O)=NN2 6424AJ [1,0,0,0,0,0|2,0,0]=3 50 B12R2.612 NC1=NOC2=CC(Cl)=CC=C21 V8834 [1,0,0,0,0,0|1,0,0]=2 51 B12R2.612 OC1CCC2=C1C=CC(Cl)=C2 3977AB [1,0,0,0,0,0|2,0,1]=4 52 B14R2.12145 N#CC1=NNC2=CC(Cl)=C(Cl)C=C21 4249AC [0,1,0,0,0,0|2,0,0]=3 53 B12R1.232 CC1=C(Cl)C=C(N)C(C(=O)O)=C1 V3515 [0,0,1,0,0,0|3,0,0]=4 54 B12R1.232 CC1=C(I)C=C(C(=O)O)C(O)=C1 Z1826 [0,0,1,0,0,0|2,1,0]=4 55 B12R1.232 CC1=CC(Cl)=C(Cl)C=C1B(O)O Y2685 [0,0,1,0,0,0|3,0,0]=4 56 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 2878AL [0,0,1,0,0,0|3,0,0]=4 57 B12R1.232 NC1=C(Cl)C=C(O)C(C(=O)O)=C1 V1240 [0,0,1,0,0,0|2,0,0]=3 58 B12R1.232 NC1=CC(Cl)=C(Cl)C=C1C(=O)O W4361 [0,0,1,0,0,0|2,0,0]=3 59 B12R1.232 O=C(O)C1=CC(Br)=C(Cl)C=C1Cl 2380AC [0,0,1,0,0,0|2,1,0]=4 60 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1O 8358AA [0,0,1,0,0,0|1,2,0]=4 61 B12R1.367 NCC(=O)C1=CC=C(Cl)C(Cl)=C1 5784AB [0,0,1,0,0,0|2,0,1]=4 62 B12R1.367 O=C(CO)C1=CC(Cl)=C(Cl)C=C1 9016AC [0,0,1,0,0,0|1,0,1]=3 63 B12R1.367 OCC(Cl)C1=CC=C(Cl)C(Cl)=C1 2028AL [0,0,1,0,0,0|2,0,1]=4 64 B12R1.367 O\N=C(/Cl)C1=CC(Cl)=C(Cl)C=C1 8237AC [0,0,1,0,0,0|1,0,0]=2 65 B12R1.448 COC1=CC(Cl)=C(Cl)C=C1OC V4874 [0,0,1,0,0,0|3,0,0]=4 66 B12R1.448 OCC1=C(CO)C=C(Cl)C(Cl)=C1 8103AD [0,0,1,0,0,0|2,0,1]=4 67 B14R2.28472 O=C1CCOC2=CC(O)=C(Cl)C=C12 5972AH [0,0,0,0,0,1|2,0,1]=4 68 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 2235AJ [1,0,1,0,0,0|1,1,0]=4 69 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 5315AH [1,0,1,0,0,0|1,1,0]=4 70 B11R1.21 NC(=O)C1=CC=C(Cl)C(Cl)=C1 8805AD [1,0,1,0,0,0|0,0,2]=4 71 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=N1 X3304 [1,0,1,0,0,0|1,0,1]=4 72 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 X6546 [1,0,1,0,0,0|0,1,1]=4 73 B11R1.21 OB(O)C1=CC=C(Cl)C(Br)=C1 V2870 [1,0,1,0,0,0|1,1,0]=4 74 B11R1.166 CC1=C(C(=N)N)C=CC(Cl)=C1 1883AF [1,0,1,0,0,0|2,0,0]=4 75 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl 1384AJ [1,0,1,0,0,0|2,0,0]=4 76 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1F 5593AH [1,0,1,0,0,0|2,0,0]=4 77 B11R1.166 NC(=O)C1=C(O)C=C(Cl)C=C1 4852AB [1,0,1,0,0,0|0,0,2]=4 78 B11R1.166 O=C(O)C1=CC=C(I)C=C1O 8615AA [1,0,1,0,0,0|1,1,0]=4 79 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 0380AC [1,0,1,0,0,0|2,0,0]=4 80 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 5824AH [1,0,1,0,0,0|2,0,0]=4 81 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1O 1351AA [1,0,1,0,0,0|2,0,0]=4 82 B11R1.277 COC1=C(Cl)C=C(Cl)C(Cl)=C1 V6898 [1,0,1,0,0,0|2,0,0]=4 83 B11R1.277 O=CC1=CC(F)=C(Cl)C=C1O 2773AJ [1,0,1,0,0,0|0,1,1]=4 84 B11R1.22 C\C(=N/O)C1=CC=C(Cl)C=C1 6594AD [1,0,1,0,0,0|1,0,0]=3 85 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 W6566 [1,0,1,0,0,0|1,0,0]=3 86 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 W7901 [1,0,1,0,0,0|1,1,0]=4 87 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [1,0,1,0,0,0|1,0,1]=4 88 B11R1.22 O\N=C(/Cl)C1=CC=C(Br)C=C1 9497AJ [1,0,1,0,0,0|1,1,0]=4 89 B11R1.22 O\N=C(/Cl)C1=CC=C(Cl)C=C1 2731AB [1,0,1,0,0,0|1,0,0]=3 90 B11R1.23 N=C(NO)C1=CC=CC(Cl)=C1 W4576 [1,0,1,0,0,0|1,0,1]=4 91 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 X3148 [1,0,1,0,0,0|1,0,1]=4 92 B11R1.23 O\N=C(/Cl)C1=CC(Br)=CC=C1 9462AJ [1,0,1,0,0,0|1,1,0]=4 93 B11R1.23 O\N=C(/Cl)C1=CC(F)=CC=C1 9466AJ [1,0,1,0,0,0|1,1,0]=4 94 B11R1.192 C=CCC1=CC(Cl)=C(Cl)C=C1 7092AD [1,0,1,0,0,0|2,0,0]=4 95 B11R1.192 O=CCC1=CC=C(Cl)C(Cl)=C1 W9614 [1,0,1,0,0,0|1,0,1]=4 96 B11R2.36 BrC1=CC2=C(C=C1)C=NS2 3952AC [2,0,0,0,0,0|0,2,0]=4 97 B11R2.36 ClC1=CC=C2CC=CC2=C1 5224AB [2,0,0,0,0,0|2,0,0]=4 98 B11R2.36 ClC1=CN=C2C=COC2=C1 2366AA [2,0,0,0,0,0|2,0,0]=4 99 B11R2.36 ClC1=CN=C2C=NNC2=C1 Y5253 [2,0,0,0,0,0|2,0,0]=4 100 B11R2.36 OC1=CC=C2OC=CC2=C1 Y7409 [2,0,0,0,0,0|2,0,0]=4 101 B11R2.1 BrC1=COC2=CC=CC=C12 Y9562 [2,0,0,0,0,0|2,0,0]=4 102 B11R2.1 BrC1=NOC2=C1C=CC=C2 5187AA [2,0,0,0,0,0|1,0,0]=3 103 B11R2.1 NC1=NOC2=NC=CC=C12 V9236 [2,0,0,0,0,0|2,0,0]=4 104 B13R1.1807 COC(=O)C1=CC(Br)=C(Cl)C=C1O V6593 [0,1,1,0,0,0|1,1,0]=4 105 B13R1.2398 COC1=C(B(O)O)C=C(Cl)C(Cl)=C1 X1890 [0,1,1,0,0,0|2,0,0]=4 106 B13R1.2398 COC1=CC(Cl)=C(Br)C=C1C(=O)O V9606 [0,1,1,0,0,0|1,1,0]=4 107 B13R1.511 O=C(O)COC1=CC(Cl)=C(F)C=C1 0415AE [0,1,1,0,0,0|1,1,0]=4 108 B13R2.669 CC1=NOC2=C1C=C(C=O)C=C2 2355AJ [1,1,0,0,0,0|2,0,0]=4 109 B13R2.2136 N#CC1=NNC2=C1C=C(Cl)C=C2 Y5376 [1,1,0,0,0,0|2,0,0]=4 110 B13R2.2136 OCC1=NNC2=C1C=C(Cl)C=C2 Z2077 [1,1,0,0,0,0|1,0,0]=3 111 B13R2.2136 OCC1=NNC2=C1C=C(F)C=C2 8841AH [1,1,0,0,0,0|1,1,0]=4 112 B13R2.662 N#CC1=NNC2=CC(Cl)=CC=C21 4247AC [1,1,0,0,0,0|2,0,0]=4 113 B13R2.11642 ClC1=CC2=C(C(Cl)=C1)C(I)=NN2 2597AL [1,1,0,0,0,0|2,0,0]=4 114 B15R2.86973 COC1=C2C=C(Cl)C(F)=CC2=CC=N1 0856AD [0,1,0,0,0,1|1,1,0]=4 115 B13R2.155 CC1=CC2=CC(Cl)=CC=C2C=N1 6863AA [1,0,0,0,0,1|2,0,0]=4 116 B13R2.155 NC1=NC2=CC(Cl)=CC=C2C=N1 9906AA [1,0,0,0,0,1|2,0,0]=4 117 B13R2.155 O=C1COC2=C(C=C(Cl)C=C2)C1 Z4519 [1,0,0,0,0,1|1,0,1]=4 118 B13R2.155 OC1=CC2=CC(F)=CC=C2C=N1 V6327 [1,0,0,0,0,1|1,1,0]=4 119 B13R2.162 CC1=CC2=C(C=CN=C2O)C=C1 6494AJ [1,0,0,0,0,1|2,0,0]=4 120 B13R2.162 ClC1=CC2=C(Br)N=CC=C2C=C1 Y5225 [1,0,0,0,0,1|2,0,0]=4 121 B13R2.3683 NC1=NC2=C(C=N1)C=C(Cl)C=C2 0301AB [1,0,0,0,0,1|2,0,0]=4 122 B13R2.3683 NC1=NN=C2C=C(Cl)C=CC2=N1 7798AB [1,0,0,0,0,1|2,0,0]=4 123 B13R2.5179 OC1=C2C=CC(Cl)=CC2=CC=N1 Y5260 [1,0,0,0,0,1|1,0,0]=3 124 B13R2.5179 OC1=NN=CC2=CC(Cl)=CC=C21 3525AJ [1,0,0,0,0,1|1,0,0]=3