0 B10R1.13 CC(=O)C1=CC=C(C)C=N1 7521AB [0,0,0,0,0,0|1,0,2]=3 1 B10R1.13 CC(=O)C1=CC=C(F)N=C1 W8700 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.13 CC(=O)C1=CC=C(O)N=C1 X9010 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 Z5392 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.13 CC(=O)C1=NC=C(F)C=C1 V9103 [0,0,0,0,0,0|2,0,2]=4 5 B10R1.13 CC(=O)C1=NC=C(O)C=C1 0360AC [0,0,0,0,0,0|2,0,2]=4 6 B10R1.13 CC(Br)C1=CC=C(F)C=C1 9966AB [0,0,0,0,0,0|2,0,0]=2 7 B10R1.13 CC(C)C1=CC=C(N)C=N1 Z4708 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.13 CC(C)C1=CN=C(Cl)N=C1 W7245 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.13 CC(C)C1=NN=C(Cl)C=C1 Z4894 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 Z2196 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.13 CC(N)C1=CC=C(Br)C=C1 V8869 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 V6495 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 Y9670 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.13 CC(N)C1=CC=C(F)C=C1 V5775 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.13 CC(O)C1=CC=C(O)C=C1 Z4466 [0,0,0,0,0,0|1,0,0]=1 16 B10R1.13 CC(O)C1=NC=C(Br)C=C1 8022AA [0,0,0,0,0,0|2,0,0]=2 17 B10R1.13 CC1=CC=C(C(=N)N)C=C1 2887AJ [0,0,0,0,0,0|2,0,1]=3 18 B10R1.13 CC1=CC=C(C(C)N)C=C1 8708AB [0,0,0,0,0,0|1,0,0]=1 19 B10R1.13 CC1=CC=C(S(=O)O)C=C1 7653AB [0,0,0,0,0,0|2,0,0]=2 20 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 7866AF [0,0,0,0,0,0|2,0,1]=3 21 B10R1.13 CC1=CN=C(C(=O)O)C=C1 9308AA [0,0,0,0,0,0|2,0,1]=3 22 B10R1.13 CC1=CN=C(C(=O)O)N=C1 Z5426 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.13 CC1=NC=C(B(O)O)C=N1 X7937 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.13 CC1=NC=C(C(C)O)C=C1 0117AA [0,0,0,0,0,0|1,0,0]=1 25 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 6145AJ [0,0,0,0,0,0|3,0,0]=3 26 B10R1.13 CN(C)C1=CC=C(F)C=C1 2692AE [0,0,0,0,0,0|3,0,0]=3 27 B10R1.13 CN(C)C1=CC=C(O)C=C1 Z4951 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.13 CN(C)C1=NC=C(I)C=C1 Z0561 [0,0,0,0,0,0|4,0,0]=4 29 B10R1.13 CN(C)C1=NC=C(N)C=C1 Z8075 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 V9278 [0,0,0,0,0,0|2,0,1]=3 31 B10R1.13 CS(=O)C1=CC=C(F)C=C1 7689AJ [0,0,0,0,0,0|2,0,1]=3 32 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 4787AJ [0,0,0,0,0,0|2,0,0]=2 33 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 X9175 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 W5396 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 1808AC [0,0,0,0,0,0|1,0,0]=1 36 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 X8527 [0,0,0,0,0,0|1,0,0]=1 37 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 6983AC [0,0,0,0,0,0|1,0,0]=1 38 B10R1.13 C[S+](C)C1=CC=C(O)C=C1 6544AL [0,0,0,0,0,0|3,0,0]=3 39 B10R1.13 FC(F)C1=CC=C(Br)C=C1 X0133 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.13 FC(F)C1=CN=C(Br)C=C1 4209AA [0,0,0,0,0,0|4,0,0]=4 41 B10R1.13 FC(F)C1=CN=C(Cl)C=C1 8632AE [0,0,0,0,0,0|4,0,0]=4 42 B10R1.13 FC(F)C1=NC=C(Br)C=C1 3005AC [0,0,0,0,0,0|4,0,0]=4 43 B10R1.13 FC1=CC=C(C(Cl)Cl)C=C1 V6035 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.13 FC1=CC=C(C(F)F)C=C1 8605AD [0,0,0,0,0,0|3,0,0]=3 45 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 1266AB [0,0,0,0,0,0|3,0,1]=4 46 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 C099 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.13 N=C(N)C1=CC=C(I)C=C1 2845AJ [0,0,0,0,0,0|3,0,1]=4 48 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 V4765 [0,0,0,0,0,0|2,1,1]=4 49 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 7847AF [0,0,0,0,0,0|2,0,2]=4 50 B10R1.13 NC1=CN=C(C(=O)O)C=C1 3083AJ [0,0,0,0,0,0|3,0,1]=4 51 B10R1.13 NC1=NC=C(B(O)O)C=C1 V8073 [0,0,0,0,0,0|4,0,0]=4 52 B10R1.13 O=C(O)C1=NC=C(I)C=C1 3537AB [0,0,0,0,0,0|3,0,1]=4 53 B10R1.13 O=C(O)C1=NC=C(O)C=C1 5863AH [0,0,0,0,0,0|3,0,1]=4 54 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 F105 [0,0,0,0,0,0|2,0,2]=4 55 B10R1.13 O=C1C=CC(C(=O)O)=CO1 7614AF [0,0,0,0,0,0|3,0,1]=4 56 B10R1.13 O=S([O-])C1=CC=C(Br)C=C1 V3821 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.13 OB(O)C1=CC=C(S)C=C1 N820 [0,0,0,0,0,0|3,0,0]=3 58 B10R1.13 OB(O)C1=NC=C(Cl)C=C1 X0922 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.13 OB(O)C1=NC=C(F)C=C1 V9453 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.1 C=CC1=CN=C(C)C=C1 Q615 [1,0,0,0,0,0|1,0,2]=4 61 B9R1.1 CC1=CC=C(CS)C=C1 7913AF [1,0,0,0,0,0|0,1,0]=2 62 B9R1.1 CC1=CN=C(C#N)C=C1 W3530 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.1 CC1=CN=C(CCl)C=C1 Y5002 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.1 CC1=CN=C(CO)C=C1 1457AB [1,0,0,0,0,0|1,0,0]=2 65 B9R1.1 CC1=NC=C(C=O)C=C1 W6750 [1,0,0,0,0,0|1,0,2]=4 66 B9R1.1 CC1=NC=C(CCl)C=C1 Z3855 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.1 CC1=NC=C(CO)C=N1 P435 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.1 CC1=NC=C(NN)C=C1 W9248 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.1 CCC1=CC=C(Br)N=C1 0198AB [1,0,0,0,0,0|2,0,0]=3 70 B9R1.1 CCC1=CC=C(Cl)C=C1 6872AE [1,0,0,0,0,0|1,0,0]=2 71 B9R1.1 CCC1=CC=C(F)C=C1 W6384 [1,0,0,0,0,0|1,0,0]=2 72 B9R1.1 CCC1=CN=C(N)C=C1 Y5080 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.1 CCC1=NC=C(Br)C=C1 W5934 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.1 CNC1=CC=C(Br)C=C1 Z5039 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.1 CNC1=CC=C(O)C=C1 V3446 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.1 CNC1=CN=C(Cl)C=C1 3620AA [1,0,0,0,0,0|3,0,0]=4 77 B9R1.1 CNC1=NC=C(Br)C=C1 W8725 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.1 CNC1=NC=C(F)C=C1 Z2980 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.1 COC1=CC=[N+]([O-])C=C1 5637AH [1,0,0,0,0,0|3,0,0]=4 80 B9R1.1 COC1=CN=C(F)C=C1 Z0149 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.1 COC1=CN=C(I)C=C1 V3638 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.1 COC1=CN=C(N)C=C1 X3522 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.1 COC1=NC=C(F)C=C1 C523 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.1 CSC1=CC=C(C)C=C1 I356 [1,0,0,0,0,0|1,0,0]=2 85 B9R1.1 CSC1=CN=C(N)C=C1 2168AC [1,0,0,0,0,0|3,0,0]=4 86 B9R1.1 ClC1=NC=C(CBr)C=C1 X4352 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.1 ClCC1=NC=C(Br)C=C1 8626AA [1,0,0,0,0,0|3,0,0]=4 88 B9R1.1 FC1=NC=C(CBr)C=C1 Y6935 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.1 N#CC1=CC=C(S)C=C1 V7013 [1,0,0,0,0,0|2,0,1]=4 90 B9R1.1 NCC1=CC=C(Br)N=C1 X9441 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.1 NCC1=CC=C(N)C=N1 2034AC [1,0,0,0,0,0|3,0,0]=4 92 B9R1.1 NCC1=CC=C(O)C=C1 X6145 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.1 NCC1=CN=C(Cl)C=C1 8881AH [1,0,0,0,0,0|3,0,0]=4 94 B9R1.1 NCC1=CN=C(F)C=C1 0174AP [1,0,0,0,0,0|3,0,0]=4 95 B9R1.1 NCC1=NC=C(Cl)C=C1 Y9067 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.1 NNC1=CC=C(Br)C=C1 V2246 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.1 NNC1=CC=C(Cl)C=C1 2700AL [1,0,0,0,0,0|3,0,0]=4 98 B9R1.1 NNC1=CC=C(Cl)C=C1 6459AL [1,0,0,0,0,0|3,0,0]=4 99 B9R1.1 NNC1=CC=C(I)C=C1 0740AP [1,0,0,0,0,0|3,0,0]=4 100 B9R1.1 NNC1=CC=C(I)C=C1 H231 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.1 O=CC1=CC=C([O-])C=C1 6126AE [1,0,0,0,0,0|1,0,2]=4 102 B9R1.1 OCC1=CN=C(Cl)N=C1 1044AA [1,0,0,0,0,0|3,0,0]=4 103 B9R1.1 OCC1=NC=C(Br)C=N1 Z4443 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.1 OCC1=NC=C(Cl)C=C1 Y8215 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.1 OCC1=NC=C(Cl)N=C1 W8125 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.1 OCC1=NC=C(F)C=C1 W8534 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.1 [O-][N+]1=CC=C(CO)C=C1 1337AQ [1,0,0,0,0,0|2,0,0]=3 108 B9R1.6 CC(Br)C1=NC=CN=C1 5526AC [1,0,0,0,0,0|3,0,0]=4 109 B9R1.6 CC(C)C1=NC=CC=C1 W7610 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.6 CC(N)C1=CC=CC=N1 4915AJ [1,0,0,0,0,0|2,0,0]=3 111 B9R1.6 CC(N)C1=CC=NC=C1 W3800 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.6 CC(N)C1=CC=NC=C1 W6570 [1,0,0,0,0,0|2,0,0]=3 113 B9R1.6 CC(N)C1=NC=CN=C1 Z2224 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.6 CC(O)C1=NC=CC=C1 Z2356 [1,0,0,0,0,0|1,0,0]=2 115 B9R1.6 CN(C)C1=CN=CC=C1 9643AA [1,0,0,0,0,0|3,0,0]=4 116 B9R1.6 CP(C)C1=CC=CC=C1 0349AC [1,0,0,0,0,0|2,0,0]=3 117 B9R1.6 C[C@@H](N)C1=CC=NC=C1 4791AJ [1,0,0,0,0,0|2,0,0]=3 118 B9R1.6 C[C@@H](N)C1=NC=CC=C1 W6374 [1,0,0,0,0,0|2,0,0]=3 119 B9R1.6 C[C@@H](O)C1=CC=NC=C1 2673AB [1,0,0,0,0,0|1,0,0]=2 120 B9R1.6 C[C@@H](O)C1=CN=CC=C1 1829AC [1,0,0,0,0,0|1,0,0]=2 121 B9R1.6 C[C@H](N)C1=NC=CC=C1 5348AB [1,0,0,0,0,0|2,0,0]=3 122 B9R1.6 C[C@H](N)C1=NC=CC=C1 W5086 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.6 C[C@H](O)C1=CC=NC=C1 7927AB [1,0,0,0,0,0|1,0,0]=2 124 B9R1.6 C[C@H](O)C1=CN=CC=C1 7054AB [1,0,0,0,0,0|1,0,0]=2 125 B9R1.6 C[C@H](O)C1=NC=CC=C1 8783AB [1,0,0,0,0,0|1,0,0]=2 126 B9R1.6 FC(F)C1=CC=CC=C1 X8304 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.6 FC(F)C1=CC=CC=N1 2389AA [1,0,0,0,0,0|3,0,0]=4 128 B9R1.6 FC(F)C1=CN=CC=C1 9427AE [1,0,0,0,0,0|3,0,0]=4 129 B9R1.6 O=C(F)C1=CC=CC=C1 3921AE [1,0,0,0,0,0|1,0,2]=4 130 B9R1.6 O=C(O)C1=NC=CC=C1 7630AF [1,0,0,0,0,0|2,0,1]=4 131 B9R1.6 OB(O)C1=CC=NC=C1 X1923 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.6 OB(O)C1=CN=CC=C1 8784AD [1,0,0,0,0,0|3,0,0]=4 133 B11R1.3 C#CC1=CC=C(C(C)C)C=C1 W4698 [0,1,0,0,0,0|1,0,1]=3 134 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 1692AC [0,1,0,0,0,0|2,0,1]=4 135 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 5524AD [0,1,0,0,0,0|1,0,1]=3 136 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 5611AH [0,1,0,0,0,0|1,1,1]=4 137 B11R1.3 CN(C)C1=CC=C(CO)C=C1 O083 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.3 CN(C)C1=CC=C(N=O)C=C1 7896AF [0,1,0,0,0,0|3,0,0]=4 139 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 9791AL [0,1,0,0,0,0|0,0,2]=3 140 B11R1.3 COC1=CC=C(C(C)C)C=C1 X8289 [0,1,0,0,0,0|1,0,0]=2 141 B11R1.3 COC1=CC=C(C(C)N)C=C1 9546AB [0,1,0,0,0,0|1,0,0]=2 142 B11R1.3 COC1=CC=C([C@@H](C)N)C=C1 W9359 [0,1,0,0,0,0|1,0,0]=2 143 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 7612AA [0,1,0,0,0,0|0,0,0]=1 144 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 7882AA [0,1,0,0,0,0|0,0,0]=1 145 B11R1.3 COC1=CN=C(C(=O)O)C=C1 X2006 [0,1,0,0,0,0|2,0,1]=4 146 B11R1.3 COC1=CN=C(C(C)=O)C=C1 V5184 [0,1,0,0,0,0|1,0,2]=4 147 B11R1.3 CSC1=CC=C([N+](=O)[O-])C=C1 D347 [0,1,0,0,0,0|2,0,1]=4 148 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 2990AC [0,1,0,0,0,0|1,0,2]=4 149 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 X5512 [0,1,0,0,0,0|1,0,2]=4 150 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 K127 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 Z0369 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.19 CC1=CC=C(P(=O)(O)O)C=C1 3952AB [0,1,0,0,0,0|2,0,0]=3 153 B11R1.19 CC1=CC=C(S(=O)(=O)F)C=C1 V6030 [0,1,0,0,0,0|2,0,1]=4 154 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 1016AA [0,1,0,0,0,0|2,0,0]=3 155 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 7009AA [0,1,0,0,0,0|2,0,0]=3 156 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 I689 [0,1,0,0,0,0|2,0,0]=3 157 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 X7028 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Z4677 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=N1 W6471 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 8584AL [0,1,0,0,0,0|2,0,1]=4 161 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 8878AL [0,1,0,0,0,0|2,0,1]=4 162 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 8900AL [0,1,0,0,0,0|2,0,1]=4 163 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 9125AL [0,1,0,0,0,0|2,0,1]=4 164 B11R1.19 CC1=CC=C(S(C)(=N)=O)C=C1 9070AJ [0,1,0,0,0,0|1,0,1]=3 165 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 W9850 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.19 C[Si](C)(C)C1=CC=C(Br)C=C1 0837AC [0,1,0,0,0,0|2,1,0]=4 167 B11R1.19 FC1=CC=C(C(Cl)(Cl)Cl)C=C1 5379AB [0,1,0,0,0,0|3,0,0]=4 168 B11R1.19 O=S(=O)(O)C1=CC=C(S)C=C1 Z2885 [0,1,0,0,0,0|3,0,0]=4 169 B11R1.21 CC(=O)C1=CC(Br)=C(Cl)C=C1 V6556 [0,1,0,0,0,0|1,0,2]=4 170 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 8306AB [0,1,0,0,0,0|1,0,2]=4 171 B11R1.21 CC(=O)C1=CC(Cl)=C(O)C=C1 2899AB [0,1,0,0,0,0|1,0,2]=4 172 B11R1.21 CC(=O)C1=CC=C(Br)C(C)=C1 V5550 [0,1,0,0,0,0|1,0,2]=4 173 B11R1.21 CC(=O)C1=CC=C(C)C(C)=C1 L433 [0,1,0,0,0,0|0,0,2]=3 174 B11R1.21 CC(=O)C1=CC=C(Cl)C(F)=C1 7623AA [0,1,0,0,0,0|1,0,2]=4 175 B11R1.21 CC(=O)C1=CC=C(Cl)C(N)=C1 V7793 [0,1,0,0,0,0|1,0,2]=4 176 B11R1.21 CC(=O)C1=CC=C(F)C(N)=C1 Z6029 [0,1,0,0,0,0|1,0,2]=4 177 B11R1.21 CC(=O)C1=CC=C(F)C(O)=C1 Z1157 [0,1,0,0,0,0|1,0,2]=4 178 B11R1.21 CC(=O)C1=CC=C(N)C(F)=C1 X8376 [0,1,0,0,0,0|1,0,2]=4 179 B11R1.21 CC(C)C1=CC(N)=C(O)C=C1 3701AB [0,1,0,0,0,0|2,0,0]=3 180 B11R1.21 CC(C)C1=CC=C(Cl)C(Br)=C1 Z1055 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.21 CC(C)C1=CC=C(I)C(Br)=C1 Y3499 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.21 CC(N)C1=CC=C(F)C(F)=C1 V4872 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.21 CC(O)C1=CC(Cl)=C(Cl)C=C1 7334AA [0,1,0,0,0,0|1,0,0]=2 184 B11R1.21 CC(O)C1=CC(F)=C(F)C=C1 4919AJ [0,1,0,0,0,0|1,0,0]=2 185 B11R1.21 CC1=C(Cl)N=C(C(=O)O)C=C1 X9173 [0,1,0,0,0,0|2,0,1]=4 186 B11R1.21 CC1=C(F)C=C(C(=N)N)C=C1 5833AD [0,1,0,0,0,0|2,0,1]=4 187 B11R1.21 CC1=C(F)C=C(C(N)=O)C=C1 8761AA [0,1,0,0,0,0|1,0,2]=4 188 B11R1.21 CC1=CC(B(O)O)=CC=C1Br Z0391 [0,1,0,0,0,0|3,0,0]=4 189 B11R1.21 CC1=CC(B(O)O)=CC=C1O X0988 [0,1,0,0,0,0|3,0,0]=4 190 B11R1.21 CC1=CC(C(=O)O)=CC=C1I W6695 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.21 CC1=CC(N(C)C)=CC=C1Br V6278 [0,1,0,0,0,0|3,0,0]=4 192 B11R1.21 CC1=CC=C(B(O)O)C=C1O X0622 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.21 CC1=CC=C(C(=N)N)C=C1C 2090AJ [0,1,0,0,0,0|2,0,1]=4 194 B11R1.21 CC1=CC=C(C(N)=O)C=C1C 5611AE [0,1,0,0,0,0|1,0,2]=4 195 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1I X6968 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.21 CC1=NC=C(C(=O)O)C=C1Br 3254AA [0,1,0,0,0,0|2,0,1]=4 197 B11R1.21 CN1C=CC(C(=O)O)=CC1=O 4035AB [0,1,0,0,0,0|2,0,1]=4 198 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(Cl)C=C1 1032AL [0,1,0,0,0,0|2,0,0]=3 199 B11R1.21 FC1=C(Br)C=C(C(F)F)C=C1 1987AF [0,1,0,0,0,0|3,0,0]=4 200 B11R1.21 FC1=CC=C(C(F)F)C=C1Cl 1168AD [0,1,0,0,0,0|3,0,0]=4 201 B11R1.21 FC1=CC=C(C(F)F)C=C1F 1175AD [0,1,0,0,0,0|3,0,0]=4 202 B11R1.21 NC1=CC(B(O)O)=CC=C1Cl X2490 [0,1,0,0,0,0|3,0,0]=4 203 B11R1.21 NC1=CC(C(=O)O)=CC=C1F X2787 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.21 NC1=CC=C(C(=O)O)C=C1I W4421 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 9297AB [0,1,0,0,0,0|2,0,1]=4 206 B11R1.21 O=C(O)C1=CC(I)=C(O)C=C1 4787AB [0,1,0,0,0,0|2,0,1]=4 207 B11R1.21 O=C(O)C1=CC=C(I)C(Br)=C1 Z4496 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 X1338 [0,1,0,0,0,0|3,0,0]=4 209 B11R1.21 OB(O)C1=CC=C(Br)C(Cl)=C1 Y3860 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.21 OB(O)C1=CC=C(Br)C(F)=C1 X0757 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.21 OB(O)C1=CC=C(Cl)C(O)=C1 V9085 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.21 OB(O)C1=CC=C(F)C(Br)=C1 Z7247 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.21 OB(O)C1=CC=C(F)C(O)=C1 V1915 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 5818AB [0,1,0,0,0,0|2,0,0]=3 215 B11R1.22 CC1=CC=C(C(=O)C#N)C=C1 5639AH [0,1,0,0,0,0|0,0,3]=4 216 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 Z5095 [0,1,0,0,0,0|0,0,3]=4 217 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 1635AE [0,1,0,0,0,0|1,0,2]=4 218 B11R1.22 CC1=CC=C(\C(N)=N/O)C=C1 9986AA [0,1,0,0,0,0|1,0,1]=3 219 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 9145AE [0,1,0,0,0,0|2,0,0]=3 220 B11R1.22 CCN(C)C1=CC=C(N)C=C1 9950AH [0,1,0,0,0,0|3,0,0]=4 221 B11R1.22 COC(=O)C1=NC=C(C)C=C1 W5212 [0,1,0,0,0,0|1,0,2]=4 222 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 6535AL [0,1,0,0,0,0|1,0,1]=3 223 B11R1.22 NC(CO)C1=CC=C(F)C=C1 4163AD [0,1,0,0,0,0|2,0,0]=3 224 B11R1.22 NC1=CC=C(\C(N)=N\O)C=C1 V4875 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 Y5103 [0,1,0,0,0,0|1,0,2]=4 226 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 L165 [0,1,0,0,0,0|1,0,2]=4 227 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 W8329 [0,1,0,0,0,0|1,0,2]=4 228 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 X6772 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 7597AD [0,1,0,0,0,0|2,0,1]=4 230 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 0082AE [0,1,0,0,0,0|1,0,2]=4 231 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 5413AB [0,1,0,0,0,0|1,0,2]=4 232 B11R1.22 OC(CCl)C1=CC=C(Cl)C=C1 2026AL [0,1,0,0,0,0|1,0,0]=2 233 B11R1.166 CC(=O)C1=C(Br)C=C(Br)C=C1 3856AB [0,1,0,0,0,0|1,0,2]=4 234 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 2758AC [0,1,0,0,0,0|1,0,2]=4 235 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 2994AB [0,1,0,0,0,0|0,0,2]=3 236 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 4310AA [0,1,0,0,0,0|0,0,2]=3 237 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 0678AC [0,1,0,0,0,0|1,0,2]=4 238 B11R1.166 CC(=O)C1=CC=C(C)C=C1O Y9837 [0,1,0,0,0,0|0,0,2]=3 239 B11R1.166 CC(=O)C1=CC=C(F)C=C1Br Z6300 [0,1,0,0,0,0|1,0,2]=4 240 B11R1.166 CC(=O)C1=CC=C(F)C=C1C X8299 [0,1,0,0,0,0|1,0,2]=4 241 B11R1.166 CC(=O)C1=CC=C(N)C=C1F Y7069 [0,1,0,0,0,0|1,0,2]=4 242 B11R1.166 CC(=O)C1=CC=C(N)C=C1O W4814 [0,1,0,0,0,0|1,0,2]=4 243 B11R1.166 CC(=O)C1=CC=C(O)C=C1Br W7388 [0,1,0,0,0,0|1,0,2]=4 244 B11R1.166 CC(N)C1=CC=C(F)C=C1F 8997AB [0,1,0,0,0,0|2,0,0]=3 245 B11R1.166 CC1=CC(Br)=CC=C1B(O)O X0634 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 Y8311 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 7695AC [0,1,0,0,0,0|1,0,0]=2 248 B11R1.166 CC1=CC=C(B(O)O)C(C)=N1 V7334 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.166 CC1=CC=C(B(O)O)C(F)=N1 Z1064 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.166 CC1=CC=C(C(=N)N)C(Cl)=C1 1657AJ [0,1,0,0,0,0|2,0,1]=4 251 B11R1.166 CC1=CC=C(C(=O)O)C(C)=N1 8698AB [0,1,0,0,0,0|2,0,1]=4 252 B11R1.166 CC1=CC=C(C(=O)O)C(N)=N1 3156AH [0,1,0,0,0,0|2,0,1]=4 253 B11R1.166 CC1=CC=C(C(N)=O)C(O)=C1 V1241 [0,1,0,0,0,0|1,0,2]=4 254 B11R1.166 CC1=CN=C(C(=O)O)C(Br)=C1 X9475 [0,1,0,0,0,0|2,0,1]=4 255 B11R1.166 CN(C)C1=C(N)C=C(Br)C=C1 6146AD [0,1,0,0,0,0|3,0,0]=4 256 B11R1.166 CN(C)C1=CC=C(N)C=C1Br V8153 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.166 C[C@@H](N)C1=CC=C(F)C=C1F W8481 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.166 FC1=CC(Br)=CC=C1C(F)F 9176AE [0,1,0,0,0,0|3,0,0]=4 259 B11R1.166 FC1=CC(Cl)=CC=C1C(F)F 1143AD [0,1,0,0,0,0|3,0,0]=4 260 B11R1.166 FC1=CC=C(C(F)F)C(Br)=C1 0483AF [0,1,0,0,0,0|3,0,0]=4 261 B11R1.166 FC1=CC=C(C(F)F)C(F)=C1 0485AF [0,1,0,0,0,0|3,0,0]=4 262 B11R1.166 NC1=CC(I)=CC=C1C(=O)O W4360 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 R830 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.166 NC1=CC(O)=CC=C1C(=O)O X8023 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 5021AH [0,1,0,0,0,0|2,0,1]=4 266 B11R1.166 OB(O)C1=CC=C(Br)C=C1Cl Y3588 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.166 OB(O)C1=CC=C(Br)C=C1F X0626 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.166 OB(O)C1=CC=C(Cl)C=C1Br Z1311 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.166 OB(O)C1=CC=C(Cl)C=C1O Z8731 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.166 OB(O)C1=CC=C(F)C=C1Br Y3859 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.166 OB(O)C1=CC=C(F)C=C1O V1926 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.166 OB(O)C1=CC=C(O)C=C1Cl X0991 [0,1,0,0,0,0|3,0,0]=4 273 B11R2.34 BrC1=CC=C(C2CC2)C=C1 2180AA [0,0,0,1,0,0|2,0,0]=3 274 B11R2.34 FC1=NC=C(C2CC2)C=C1 Y3567 [0,0,0,1,0,0|3,0,0]=4 275 B11R2.34 OC1=CC=C(C2CC2)C=C1 Z3817 [0,0,0,1,0,0|2,0,0]=3 276 B9R1.35 CC1=CC(C(=O)O)=CO1 Y8297 [0,0,0,0,1,0|2,0,1]=4 277 B9R1.35 CC1=CC(C(=O)O)=CS1 Y8110 [0,0,0,0,1,0|2,0,1]=4 278 B9R1.35 CC1=CSC(C(=O)O)=C1 Z0185 [0,0,0,0,1,0|2,0,1]=4 279 B9R1.35 CC1=CSC(C(C)N)=N1 3800AD [0,0,0,0,1,0|3,0,0]=4 280 B9R1.35 CN1C=CC(C(=O)O)=C1 W5804 [0,0,0,0,1,0|2,0,1]=4 281 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 9287AB [0,0,0,0,0,1|1,0,2]=4 282 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 7126AD [0,0,0,0,0,1|0,0,2]=3 283 B11R1.20 CC(=O)CC1=CC=C(I)C=C1 1094AB [0,0,0,0,0,1|1,0,2]=4 284 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 Q226 [0,0,0,0,0,1|1,0,2]=4 285 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 9364AB [0,0,0,0,0,1|1,0,2]=4 286 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 3597AB [0,0,0,0,0,1|1,0,2]=4 287 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 V4230 [0,0,0,0,0,1|2,0,0]=3 288 B11R1.20 CC(C)CC1=CC=C(N)C=C1 3122AB [0,0,0,0,0,1|2,0,0]=3 289 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 Z8271 [0,0,0,0,0,1|2,0,0]=3 290 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 Z0788 [0,0,0,0,0,1|2,0,0]=3 291 B11R1.20 CC(C)OC1=CC=C(N)C=C1 V4472 [0,0,0,0,0,1|2,0,0]=3 292 B11R1.20 CC(C)OC1=CC=C(O)C=C1 Y9996 [0,0,0,0,0,1|2,0,0]=3 293 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 Y6445 [0,0,0,0,0,1|3,0,0]=4 294 B11R1.20 CC1=CC=C(OC(F)F)C=C1 4991AD [0,0,0,0,0,1|2,0,0]=3 295 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 X3804 [0,0,0,0,0,1|2,0,1]=4 296 B11R1.20 FC(F)OC1=CC=C(Cl)C=C1 0130AF [0,0,0,0,0,1|3,0,0]=4 297 B11R1.20 FC(F)OC1=CC=C(I)C=C1 X8132 [0,0,0,0,0,1|3,0,0]=4 298 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 5630AH [0,0,0,0,0,1|2,0,1]=4 299 B11R1.20 OC1=CC=C(OC(F)F)C=C1 V8554 [0,0,0,0,0,1|3,0,0]=4 300 B8R1.2 BrCC1=CC=NC=C1 Y7030 [2,0,0,0,0,0|2,0,0]=4 301 B8R1.2 CSC1=NC=CC=C1 L314 [2,0,0,0,0,0|2,0,0]=4 302 B8R1.2 Cl[Hg]C1=CC=CC=C1 7627AF [2,0,0,0,0,0|2,0,0]=4 303 B8R1.2 N#CC1=CC=CC=C1 E085 [2,0,0,0,0,0|1,0,1]=4 304 B8R1.2 NCC1=CC=NC=C1 Z3385 [2,0,0,0,0,0|2,0,0]=4 305 B8R1.2 OCC1=CC=NC=N1 W5525 [2,0,0,0,0,0|2,0,0]=4 306 B8R1.2 OCC1=CN=CN=C1 W4842 [2,0,0,0,0,0|2,0,0]=4 307 B8R1.2 OCC1=CN=NC=C1 7045AB [2,0,0,0,0,0|2,0,0]=4 308 B8R1.2 OCC1=NC=CC=N1 W6241 [2,0,0,0,0,0|2,0,0]=4 309 B8R1.3 CC1=CC=C(F)C=N1 I740 [2,0,0,0,0,0|2,0,0]=4 310 B8R1.3 CC1=NC=C(Cl)C=C1 V7477 [2,0,0,0,0,0|2,0,0]=4 311 B8R1.3 CC1=NC=C(O)C=N1 W5688 [2,0,0,0,0,0|2,0,0]=4 312 B8R1.3 NC1=CN=C(O)C=C1 V5265 [2,0,0,0,0,0|2,0,0]=4 313 B8R1.3 NC1=NC=C(O)C=C1 V8126 [2,0,0,0,0,0|2,0,0]=4 314 B8R1.3 OC1=CN=C(I)C=C1 5466AA [2,0,0,0,0,0|2,0,0]=4 315 B8R1.3 [O-]C1=CC=C(Cl)C=C1 3305AA [2,0,0,0,0,0|1,0,1]=4 316 B10R1.1 CC1=CC=C(CCBr)C=C1 W7663 [1,1,0,0,0,0|0,0,0]=2 317 B10R1.1 CC1=CC=C(CCN)C=C1 1184AJ [1,1,0,0,0,0|0,0,0]=2 318 B10R1.1 CC1=CC=C(NC=O)C=C1 6608AL [1,1,0,0,0,0|0,0,2]=4 319 B10R1.1 CCCC1=CC=C(Cl)C=C1 5012AE [1,1,0,0,0,0|1,0,0]=3 320 B10R1.1 CCOC1=CN=C(Br)C=C1 V5913 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.1 CCOC1=NC=C(F)C=C1 3377AC [1,1,0,0,0,0|2,0,0]=4 322 B10R1.1 CCSC1=CC=C(Br)C=C1 9641AD [1,1,0,0,0,0|1,0,0]=3 323 B10R1.1 CNCC1=CC=C(Br)C=C1 7292AJ [1,1,0,0,0,0|1,0,0]=3 324 B10R1.1 CNCC1=CC=C(C)C=C1 7294AJ [1,1,0,0,0,0|0,0,0]=2 325 B10R1.1 CNCC1=CC=C(C)C=C1 W7964 [1,1,0,0,0,0|0,0,0]=2 326 B10R1.1 CNCC1=CC=C(Cl)C=C1 7293AJ [1,1,0,0,0,0|1,0,0]=3 327 B10R1.1 CNCC1=CN=C(C)N=C1 Z4024 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.1 COCC1=CC=C(Br)C=C1 Z0209 [1,1,0,0,0,0|1,0,0]=3 329 B10R1.1 COCC1=CC=C(N)C=C1 V7837 [1,1,0,0,0,0|1,0,0]=3 330 B10R1.1 CSCC1=CN=C(Cl)C=C1 7608AC [1,1,0,0,0,0|2,0,0]=4 331 B10R1.1 N#CCC1=CC=C(I)C=C1 X2663 [1,1,0,0,0,0|1,0,1]=4 332 B10R1.1 N#CCC1=CC=C(N)C=C1 4180AB [1,1,0,0,0,0|1,0,1]=4 333 B10R1.1 NCCC1=CC=C(Br)C=C1 0590AB [1,1,0,0,0,0|1,0,0]=3 334 B10R1.1 NNCC1=CC=C(Br)C=C1 3948AE [1,1,0,0,0,0|2,0,0]=4 335 B10R1.1 NNCC1=CC=C(F)C=C1 Z3849 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.1 NOCC1=CC=C(F)C=C1 9348AA [1,1,0,0,0,0|1,0,0]=3 337 B10R1.1 O=CCC1=CC=C(Br)C=C1 W5028 [1,1,0,0,0,0|1,0,1]=4 338 B10R1.1 O=CCC1=CC=C(Cl)C=C1 W6225 [1,1,0,0,0,0|1,0,1]=4 339 B10R1.1 O=CCC1=CC=C(F)C=C1 8959AA [1,1,0,0,0,0|1,0,1]=4 340 B10R1.1 OC1=CC=C(CCBr)C=C1 6870AA [1,1,0,0,0,0|1,0,0]=3 341 B10R1.1 OCCC1=CC=C(Cl)N=C1 1226AJ [1,1,0,0,0,0|2,0,0]=4 342 B10R1.1 OCCC1=CC=C(I)C=C1 W6745 [1,1,0,0,0,0|1,0,0]=3 343 B10R1.1 OCCC1=NC=C(Br)C=C1 3590AA [1,1,0,0,0,0|2,0,0]=4 344 B10R1.3 C=CC1=CC=C(CN)C=C1 X4444 [1,1,0,0,0,0|0,0,2]=4 345 B10R1.3 CCC1=CC=C(C=O)N=C1 5847AH [1,1,0,0,0,0|1,0,1]=4 346 B10R1.3 CNC1=CC=C(C#N)C=C1 V6076 [1,1,0,0,0,0|1,0,1]=4 347 B10R1.3 CNC1=CC=C(OC)C=C1 Z6803 [1,1,0,0,0,0|1,0,0]=3 348 B10R1.3 COC1=CC=C(CN)C=N1 8647AA [1,1,0,0,0,0|2,0,0]=4 349 B10R1.3 COC1=CC=C(NN)C=C1 4215AB [1,1,0,0,0,0|2,0,0]=4 350 B10R1.3 COC1=CC=C(SC)C=C1 I355 [1,1,0,0,0,0|1,0,0]=3 351 B10R1.3 COC1=CN=C(CCl)C=C1 1704AC [1,1,0,0,0,0|2,0,0]=4 352 B10R1.3 COC1=CN=C(CN)C=C1 4773AJ [1,1,0,0,0,0|2,0,0]=4 353 B10R1.3 COC1=CN=C(CO)C=C1 X9716 [1,1,0,0,0,0|1,0,0]=3 354 B10R1.3 COC1=NC=C(CCl)C=C1 0532AA [1,1,0,0,0,0|2,0,0]=4 355 B10R1.3 COC1=NC=C(CN)C=C1 3334AC [1,1,0,0,0,0|2,0,0]=4 356 B10R1.3 CSC1=CC=C(CBr)C=C1 1120AQ [1,1,0,0,0,0|1,0,0]=3 357 B10R1.3 CSC1=CC=C(CN)C=C1 0258AF [1,1,0,0,0,0|1,0,0]=3 358 B10R1.3 N#CC1=CC=C(CN)C=C1 X8693 [1,1,0,0,0,0|1,0,1]=4 359 B10R1.3 N#CC1=NC=C(CO)C=C1 V6774 [1,1,0,0,0,0|1,0,1]=4 360 B10R1.3 NCC1=CC=C(CO)C=C1 W6028 [1,1,0,0,0,0|0,0,0]=2 361 B10R1.25 CC1=C(CBr)C=CC(F)=C1 3485AC [1,1,0,0,0,0|2,0,0]=4 362 B10R1.25 CC1=CC(C)=C(C#N)C=C1 7417AD [1,1,0,0,0,0|1,0,1]=4 363 B10R1.25 CC1=CC(C)=C(NN)C=C1 9955AL [1,1,0,0,0,0|2,0,0]=4 364 B10R1.25 CC1=CC(Cl)=CC=C1CO Z0039 [1,1,0,0,0,0|1,0,0]=3 365 B10R1.25 CC1=CC(F)=C(NN)C=C1 6959AB [1,1,0,0,0,0|2,0,0]=4 366 B10R1.25 CC1=CC=C(C#N)C(Cl)=C1 X2763 [1,1,0,0,0,0|1,0,1]=4 367 B10R1.25 CC1=CC=C(C#N)C(O)=C1 W3997 [1,1,0,0,0,0|1,0,1]=4 368 B10R1.25 CC1=CC=C(C=O)C(Cl)=C1 W6599 [1,1,0,0,0,0|0,0,2]=4 369 B10R1.25 CC1=CC=C(C=O)C(O)=C1 X2734 [1,1,0,0,0,0|0,0,2]=4 370 B10R1.25 CC1=CC=C(CN)C(Cl)=C1 0833AC [1,1,0,0,0,0|1,0,0]=3 371 B10R1.25 CC1=CC=C(CO)C(C)=N1 6029AE [1,1,0,0,0,0|1,0,0]=3 372 B10R1.25 CC1=CC=C(CO)C(N)=C1 2629AC [1,1,0,0,0,0|0,0,0]=2 373 B10R1.25 CC1=CC=C(NN)C(Cl)=C1 W4649 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.25 CC1=CN=C(CCl)C(C)=C1 Z5081 [1,1,0,0,0,0|2,0,0]=4 375 B10R1.25 CC1=CN=C(CO)C(C)=C1 0932AC [1,1,0,0,0,0|1,0,0]=3 376 B10R1.25 CC1=NC(F)=CC=C1CO Z0987 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.25 CC1=NC=C(CO)C(N)=N1 W8173 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.25 CCC1=C(F)C=C(Br)C=C1 9478AB [1,1,0,0,0,0|1,0,0]=3 379 B10R1.25 CCC1=CN=C(C)C=C1Br 6901AC [1,1,0,0,0,0|1,0,0]=3 380 B10R1.25 CCC1=NC=C(C)N=C1C 6750AA [1,1,0,0,0,0|2,0,0]=4 381 B10R1.25 CNC1=C(F)C=C(F)C=C1 1904AL [1,1,0,0,0,0|2,0,0]=4 382 B10R1.25 CNC1=C(N)C=C(Br)C=C1 2680AJ [1,1,0,0,0,0|2,0,0]=4 383 B10R1.25 CNC1=CC=C(Cl)C=C1Cl V5409 [1,1,0,0,0,0|2,0,0]=4 384 B10R1.25 CNC1=CC=C(F)C=C1Br Y6882 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.25 COC1=C(Br)C=C(F)C=C1 H620 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.25 COC1=C(I)C=C(C)C=C1 X4546 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.25 COC1=C(O)C=C(O)C=C1 9124AB [1,1,0,0,0,0|2,0,0]=4 388 B10R1.25 COC1=CC=C(Br)C=C1Cl Z0644 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.25 COC1=CC=C(Br)C=C1I Z5421 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.25 COC1=CC=C(C)N=C1Br Y8405 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.25 COC1=CC=C(C)N=C1N X3671 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.25 COC1=CC=C(Cl)C=C1I N695 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.25 COC1=CC=C(Cl)C=C1O 4776AB [1,1,0,0,0,0|2,0,0]=4 394 B10R1.25 COC1=CC=C(F)C=C1Cl X4244 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.25 COC1=CC=C(F)C=C1N V5190 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.25 COC1=CC=C(I)C=C1C X8379 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.25 COC1=CC=C(I)C=C1N X5382 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.25 COC1=CC=C(N)C=C1C Y6043 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.25 COC1=CC=C(N)C=C1Cl 5846AJ [1,1,0,0,0,0|2,0,0]=4 400 B10R1.25 COC1=CC=C(N)C=C1N 5296AL [1,1,0,0,0,0|2,0,0]=4 401 B10R1.25 COC1=CC=C(N)C=C1N N030 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.25 COC1=CC=C(O)C=C1C Z0198 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.25 COC1=CC=C(S)C=C1F 5336AH [1,1,0,0,0,0|2,0,0]=4 404 B10R1.25 COC1=NC=C(C)C=C1Br W9936 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.25 CSC1=CC=C(Br)C=C1Cl Y3518 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.25 CSC1=CC=C(Br)C=C1F Z0393 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.25 CSC1=CC=C(F)C=C1Br Z1091 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.25 CSC1=CC=C(F)C=C1C Z0086 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.25 CSC1=CC=C(F)C=C1F Z0047 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.25 NC1=C(CO)C=NC(Cl)=C1 3013AC [1,1,0,0,0,0|2,0,0]=4 411 B10R1.25 NC1=CC(Br)=CC=C1CO V9454 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.25 NCC1=C(C)C=C(Br)C=C1 9535AF [1,1,0,0,0,0|2,0,0]=4 413 B10R1.25 NCC1=C(Cl)C=C(Br)C=C1 8749AH [1,1,0,0,0,0|2,0,0]=4 414 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 1211AC [1,1,0,0,0,0|2,0,0]=4 415 B10R1.25 NCC1=CC=C(Br)C=C1F X8114 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.25 OCC1=C(O)C=C(Br)C=C1 8742AA [1,1,0,0,0,0|1,0,0]=3 417 B10R1.25 OCC1=CC=C(Br)C=C1Br V7191 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.25 OCC1=CC=C(Br)C=C1Cl Z0302 [1,1,0,0,0,0|1,0,0]=3 419 B10R1.25 OCC1=CC=C(Cl)N=C1Cl Z0687 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.25 OCC1=NC=C(Br)C=C1F 0986AD [1,1,0,0,0,0|2,0,0]=4 421 B10R1.25 OCC1=NC=C(F)C=C1F Y6947 [1,1,0,0,0,0|2,0,0]=4 422 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 2629AB [1,1,0,0,0,0|2,0,0]=4 423 B10R1.176 CC1=C(C)C=C(NN)C=C1 3967AD [1,1,0,0,0,0|2,0,0]=4 424 B10R1.176 CC1=C(I)C=C(C#N)C=C1 5919AB [1,1,0,0,0,0|1,0,1]=4 425 B10R1.176 CC1=CC(CCl)=CC=C1Br V3412 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.176 CC1=CC(CO)=CC=C1Br W3250 [1,1,0,0,0,0|1,0,0]=3 427 B10R1.176 CC1=CC(CO)=CC=C1F V4762 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.176 CC1=CC=C(C=O)C=C1Cl W5560 [1,1,0,0,0,0|0,0,2]=4 429 B10R1.176 CC1=CC=C(CN)C=C1Cl W7826 [1,1,0,0,0,0|1,0,0]=3 430 B10R1.176 CC1=CC=C(CO)C=C1Br Z0777 [1,1,0,0,0,0|0,0,0]=2 431 B10R1.176 CCC1=CC(Br)=C(O)C=C1 7273AE [1,1,0,0,0,0|1,0,0]=3 432 B10R1.176 CCC1=CC(O)=C(O)C=C1 2184AA [1,1,0,0,0,0|1,0,0]=3 433 B10R1.176 CCC1=CC=C(Br)C(F)=C1 W9564 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.176 CCC1=CC=C(N)C(O)=C1 1522AJ [1,1,0,0,0,0|1,0,0]=3 435 B10R1.176 CCC1=CN=C(C)C(C)=N1 L039 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.176 CNC1=CC=C(C)C(Br)=C1 Z8003 [1,1,0,0,0,0|1,0,0]=3 437 B10R1.176 COC1=CC(N)=C(F)C=C1 9367AB [1,1,0,0,0,0|2,0,0]=4 438 B10R1.176 COC1=CC(N)=C(O)C=C1 0175AE [1,1,0,0,0,0|2,0,0]=4 439 B10R1.176 COC1=CC(O)=C(N)C=C1 5590AB [1,1,0,0,0,0|2,0,0]=4 440 B10R1.176 COC1=CC=C(Br)C(I)=C1 6659AB [1,1,0,0,0,0|2,0,0]=4 441 B10R1.176 COC1=CC=C(Br)C(O)=C1 W7550 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.176 COC1=CC=C(F)C(C)=C1 1547AB [1,1,0,0,0,0|2,0,0]=4 443 B10R1.176 COC1=CC=C(F)C(Cl)=C1 V4191 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.176 COC1=CC=C(F)C(I)=C1 Y3551 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.176 COC1=CC=C(F)C(O)=C1 Y3754 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.176 COC1=CC=C(I)C(N)=C1 W3349 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.176 COC1=CC=C(I)C(O)=C1 5618AB [1,1,0,0,0,0|2,0,0]=4 448 B10R1.176 COC1=CC=C(N)C(F)=C1 V8518 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.176 COC1=CC=C(N)C(I)=C1 W4105 [1,1,0,0,0,0|2,0,0]=4 450 B10R1.176 COC1=CC=C(N)C(N)=C1 1452AA [1,1,0,0,0,0|2,0,0]=4 451 B10R1.176 COC1=CC=C(N)C(O)=C1 Z4697 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.176 COC1=CC=C(O)C(C)=C1 Y5462 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.176 NC1=C(F)C=CC(CO)=C1 7761AD [1,1,0,0,0,0|1,0,0]=3 454 B10R1.176 NC1=CC(CO)=CC=C1Br Z9064 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.176 NC1=CC=C(CO)C=C1F 7228AA [1,1,0,0,0,0|1,0,0]=3 456 B10R1.176 NCC1=CC=C(Cl)C(Br)=C1 V7987 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.176 NCC1=CC=C(Cl)C(F)=C1 X8372 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.176 NCC1=CC=C(F)C(Br)=C1 2384AL [1,1,0,0,0,0|2,0,0]=4 459 B10R1.176 NCC1=CC=C(F)C(Br)=C1 X3002 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.176 OCC1=CC(Cl)=C(Cl)N=C1 Y5464 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.176 OCC1=CC(O)=C(O)C=C1 5062AB [1,1,0,0,0,0|1,0,0]=3 462 B10R1.176 OCC1=CC=C(Br)C(Cl)=C1 Y3805 [1,1,0,0,0,0|1,0,0]=3 463 B10R1.176 OCC1=CC=C(Cl)C(Br)=C1 X8250 [1,1,0,0,0,0|1,0,0]=3 464 B10R1.15 C=C(CC)C1=CC=CC=C1 0460AB [1,1,0,0,0,0|1,0,1]=4 465 B10R1.15 CC(CBr)C1=CC=CC=C1 Y3159 [1,1,0,0,0,0|1,0,0]=3 466 B10R1.15 CC(CN)C1=CC=CC=C1 W4299 [1,1,0,0,0,0|1,0,0]=3 467 B10R1.15 CCC(N)C1=CC=NC=C1 4998AJ [1,1,0,0,0,0|2,0,0]=4 468 B10R1.15 CCC(N)C1=NC=CC=C1 4914AJ [1,1,0,0,0,0|2,0,0]=4 469 B10R1.15 CCN(C)C1=CC=CC=C1 W7366 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.15 CCN(N)C1=CC=CC=C1 4841AL [1,1,0,0,0,0|2,0,0]=4 471 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 7435AJ [1,1,0,0,0,0|0,0,0]=2 472 B10R1.15 CNC(C)C1=CC=CC=C1 V5180 [1,1,0,0,0,0|1,0,0]=3 473 B10R1.15 CNC(C)C1=CC=CN=C1 0995AD [1,1,0,0,0,0|2,0,0]=4 474 B10R1.15 CNC(C)C1=CC=NC=C1 5030AD [1,1,0,0,0,0|2,0,0]=4 475 B10R1.15 CNC(C)C1=NC=CC=C1 9484AC [1,1,0,0,0,0|2,0,0]=4 476 B10R1.15 COS(=O)C1=CC=CC=C1 0314AC [1,1,0,0,0,0|1,0,1]=4 477 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 V5313 [1,1,0,0,0,0|1,0,0]=3 478 B10R1.15 C\C(=N\O)C1=CC=CN=C1 V6841 [1,1,0,0,0,0|1,0,1]=4 479 B10R1.15 C\C(=N\O)C1=CC=NC=C1 Z8096 [1,1,0,0,0,0|1,0,1]=4 480 B10R1.15 C\C(=N\O)C1=NC=CC=C1 V3827 [1,1,0,0,0,0|1,0,1]=4 481 B10R1.15 NC(CO)C1=CC=CC=N1 1465AJ [1,1,0,0,0,0|2,0,0]=4 482 B10R1.15 NCC(N)C1=CC=CC=C1 8461AA [1,1,0,0,0,0|1,0,0]=3 483 B10R1.15 NCC(O)C1=CC=CN=C1 5727AC [1,1,0,0,0,0|1,0,0]=3 484 B10R1.15 NCC(O)C1=NC=CC=C1 4964AH [1,1,0,0,0,0|1,0,0]=3 485 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 X3539 [1,1,0,0,0,0|0,0,0]=2 486 B10R1.15 N\C(=N/O)C1=CC=CC=C1 3148AL [1,1,0,0,0,0|1,0,1]=4 487 B10R1.15 O=C(O[Ag])C1=CC=CC=C1 7828AF [1,1,0,0,0,0|1,0,1]=4 488 B10R1.28 CC(C)(N)C1=CC=CC=N1 5199AJ [1,1,0,0,0,0|2,0,0]=4 489 B10R1.28 CC(C)(O)C1=CC=CN=C1 Y7594 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.28 CC(C)(O)C1=NC=CC=C1 4873AB [1,1,0,0,0,0|1,0,0]=3 491 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 8822AL [1,1,0,0,0,0|2,0,0]=4 492 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 9417AF [1,1,0,0,0,0|1,1,0]=4 493 B10R1.28 O[B-](O)(O)C1=CC=CC=C1 8966AL [1,1,0,0,0,0|2,0,0]=4 494 B10R1.61 CC(Cl)C1=CC=CC=C1Cl 0284AB [1,1,0,0,0,0|1,0,0]=3 495 B10R1.61 CC(N)C1=C(O)C=CC=C1 5161AJ [1,1,0,0,0,0|1,0,0]=3 496 B10R1.61 CC(N)C1=CC=CC=C1Cl V8121 [1,1,0,0,0,0|1,0,0]=3 497 B10R1.61 CC(N)C1=CC=CC=C1Cl X6241 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.61 CC(N)C1=CC=CC=C1F V7591 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.61 CC(O)C1=C(Br)C=CC=C1 4894AJ [1,1,0,0,0,0|0,0,0]=2 500 B10R1.61 CC(O)C1=C(Cl)N=CC=C1 5872AA [1,1,0,0,0,0|1,0,0]=3 501 B10R1.61 CC(O)C1=CC=CC=C1F X8296 [1,1,0,0,0,0|0,0,0]=2 502 B10R1.61 CC(O)C1=CC=CC=C1N Z6783 [1,1,0,0,0,0|0,0,0]=2 503 B10R1.61 CN(C)C1=C(F)C=CC=C1 9536AF [1,1,0,0,0,0|2,0,0]=4 504 B10R1.61 CN(C)C1=CC=CC=C1O Z4668 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 1179AL [1,1,0,0,0,0|1,0,0]=3 506 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl X9707 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.61 C[C@@H](N)C1=CC=CC=C1O X9575 [1,1,0,0,0,0|1,0,0]=3 508 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 8241AA [1,1,0,0,0,0|0,0,0]=2 509 B10R1.61 FC(F)C1=CC=CC=C1Br V7943 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.61 FC1=CC=CC=C1C(Cl)Cl 3540AB [1,1,0,0,0,0|2,0,0]=4 511 B10R1.61 FC1=CC=CC=C1C(F)F 7228AE [1,1,0,0,0,0|2,0,0]=4 512 B10R1.61 O=C(O)C1=C(O)C=CC=C1 7849AF [1,1,0,0,0,0|1,0,1]=4 513 B10R1.61 OB(O)C1=CC=CC=C1I Y3509 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.113 CC(C)C1=CC=CC(Br)=N1 Z6690 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.113 CC(N)C1=CC=CC(Br)=C1 4929AJ [1,1,0,0,0,0|1,0,0]=3 516 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 V4629 [1,1,0,0,0,0|1,0,0]=3 517 B10R1.113 CC(N)C1=CC=CC(F)=C1 1626AC [1,1,0,0,0,0|1,0,0]=3 518 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 4933AJ [1,1,0,0,0,0|0,0,0]=2 519 B10R1.113 CC(O)C1=CC(F)=CC=C1 2665AE [1,1,0,0,0,0|0,0,0]=2 520 B10R1.113 CC(O)C1=CC(O)=CC=C1 4940AJ [1,1,0,0,0,0|0,0,0]=2 521 B10R1.113 CC(O)C1=CC=CC(N)=C1 W4803 [1,1,0,0,0,0|0,0,0]=2 522 B10R1.113 CC(O)C1=NC(Br)=CC=C1 Z4144 [1,1,0,0,0,0|1,0,0]=3 523 B10R1.113 CC1=CC(C(C)N)=CC=C1 8402AE [1,1,0,0,0,0|1,0,0]=3 524 B10R1.113 CC1=CC(N(C)N)=CC=C1 4897AL [1,1,0,0,0,0|2,0,0]=4 525 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 W3022 [1,1,0,0,0,0|1,0,0]=3 526 B10R1.113 CC1=CC=CC(C(C)O)=C1 8099AF [1,1,0,0,0,0|0,0,0]=2 527 B10R1.113 CN(C)C1=CC(F)=CC=C1 0769AB [1,1,0,0,0,0|2,0,0]=4 528 B10R1.113 CN(C)C1=CC=CC(Cl)=C1 0572AC [1,1,0,0,0,0|2,0,0]=4 529 B10R1.113 C[C@@H](O)C1=CC(Br)=CC=C1 6220AA [1,1,0,0,0,0|0,0,0]=2 530 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 6759AA [1,1,0,0,0,0|1,0,0]=3 531 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Z1666 [1,1,0,0,0,0|1,0,0]=3 532 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 X4842 [1,1,0,0,0,0|1,0,0]=3 533 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 6282AA [1,1,0,0,0,0|0,0,0]=2 534 B10R1.113 FC(F)C1=CC(Br)=CC=C1 W5231 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.113 FC1=CC=CC(C(Cl)Cl)=C1 2666AE [1,1,0,0,0,0|2,0,0]=4 536 B10R1.113 NC1=CC(B(O)O)=CC=C1 N846 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.113 NC1=CC=CC(C(F)F)=C1 4695AB [1,1,0,0,0,0|2,0,0]=4 538 B10R1.113 OB(O)C1=CC=CC(S)=C1 N825 [1,1,0,0,0,0|2,0,0]=4 539 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 Y8233 [0,1,0,0,0,1|1,0,0]=3 540 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 X2669 [0,1,0,0,0,1|1,0,1]=4 541 B12R1.4 O=C(O)CC1=CC=C(CCl)C=C1 8192AB [0,1,0,0,0,1|1,0,1]=4 542 B12R1.19 CC(=O)NC1=CC(Cl)=C(C)C=C1 8603AE [0,1,0,0,0,1|0,0,2]=4 543 B12R1.19 CC(C)OC1=CC=C(Br)C(Cl)=C1 Z0496 [0,1,0,0,0,1|2,0,0]=4 544 B12R1.19 CC(C)OC1=CC=C(Br)C(F)=C1 Y3572 [0,1,0,0,0,1|2,0,0]=4 545 B12R1.20 CC(Br)C(=O)C1=CC=C(F)C=C1 V5340 [0,1,0,0,0,1|2,0,0]=4 546 B12R1.20 CC(Cl)C(=O)C1=CC=C(F)C=C1 0025AF [0,1,0,0,0,1|2,0,0]=4 547 B12R1.49 CC1=CC=C(NC(=O)CBr)C=C1 5090AE [0,1,0,0,0,1|0,0,2]=4 548 B12R1.49 CC1=CC=C(OC(=O)CN)C=C1 X9825 [0,1,0,0,0,1|0,0,2]=4 549 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 3569AL [0,1,0,0,0,1|0,0,2]=4 550 B12R1.49 NC(CO)CC1=CC=C(Cl)C=C1 6147AJ [0,1,0,0,0,1|2,0,0]=4 551 B12R1.49 NC(CO)CC1=CC=C(Cl)C=C1 W5702 [0,1,0,0,0,1|2,0,0]=4 552 B12R1.49 N[C@@H](CO)CC1=CC=C(O)C=C1 5559AB [0,1,0,0,0,1|2,0,0]=4 553 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 6908AB [0,1,0,0,0,1|2,0,0]=4 554 B12R1.106 CC(C)(C)OC1=CC=C(Cl)C=C1 F450 [0,1,0,0,0,1|2,0,0]=4 555 B12R1.106 CC(C)(C)OC1=CC=C(N)C=C1 V6697 [0,1,0,0,0,1|2,0,0]=4 556 B12R1.106 CC(C)(C)OC1=CC=C(O)C=C1 8269AD [0,1,0,0,0,1|2,0,0]=4 557 B12R1.106 CC1=CC=C(SC(F)(F)F)C=C1 V5435 [0,1,0,0,0,1|2,0,0]=4 558 B12R1.233 CC(=O)NC1=C(C)C=C(C)C=C1 6935AD [0,1,0,0,0,1|0,0,2]=4 559 B12R1.233 CC(C)OC1=CC=C(Br)C=C1F Z0350 [0,1,0,0,0,1|2,0,0]=4 560 B12R1.233 CC(C)OC1=CC=C(F)C=C1Br Z0349 [0,1,0,0,0,1|2,0,0]=4 561 B12R1.233 CC1=CC=C(CC(=O)O)C(C)=C1 X2163 [0,1,0,0,0,1|1,0,1]=4 562 B12R1.233 CC1=CC=C(CC(=O)O)C(F)=C1 7260AB [0,1,0,0,0,1|1,0,1]=4 563 B12R1.233 CC1=CN=C(OC(C)C)C(Br)=C1 V7642 [0,1,0,0,0,1|2,0,0]=4 564 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 7913AD [0,2,0,0,0,0|1,0,0]=3 565 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 4042AB [0,2,0,0,0,0|0,0,2]=4 566 B12R1.5 COC1=CC=C(\C(Cl)=N\O)C=C1 2157AE [0,2,0,0,0,0|1,0,1]=4 567 B12R1.5 CSC1=CC=C(C(=O)CBr)C=C1 5495AH [0,2,0,0,0,0|0,0,2]=4 568 B12R1.6 CC(C)(C)C1=CC=C(CS)C=C1 S759 [0,2,0,0,0,0|1,0,0]=3 569 B12R1.6 COC1=CC=C(P(=O)(O)O)C=C1 7410AD [0,2,0,0,0,0|2,0,0]=4 570 B12R1.6 COC1=CC=C(S(C)(=O)=O)C=C1 V5418 [0,2,0,0,0,0|1,0,1]=4 571 B12R1.6 CS(=O)(=O)C1=CC=C(CCl)C=C1 E962 [0,2,0,0,0,0|1,0,1]=4 572 B12R1.6 CS(=O)(=O)C1=CC=C(CN)C=C1 6915AC [0,2,0,0,0,0|1,0,1]=4 573 B12R1.6 NCC1=CC=C(C(F)(F)F)C=C1 3195AB [0,2,0,0,0,0|2,0,0]=4 574 B12R1.48 CC(C)C1=CC=C(C=O)C(Br)=C1 Z0908 [0,2,0,0,0,0|1,0,1]=4 575 B12R1.48 CC1=CC(B(O)O)=CC=C1CO X1737 [0,2,0,0,0,0|2,0,0]=4 576 B12R1.48 CNC1=CC=C(C(C)=O)C=C1N Y8046 [0,2,0,0,0,0|0,0,2]=4 577 B12R1.48 COC1=C(F)C=C(C(C)N)C=C1 8200AC [0,2,0,0,0,0|1,0,0]=3 578 B12R1.48 COC1=CC=C(B(O)O)C=C1Cl N290 [0,2,0,0,0,0|2,0,0]=4 579 B12R1.48 COC1=CC=C(C(=O)O)C=C1I V7285 [0,2,0,0,0,0|1,0,1]=4 580 B12R1.48 COC1=CC=C(C(C)=O)C=C1Br X8264 [0,2,0,0,0,0|0,0,2]=4 581 B12R1.48 COC1=CC=C(C(C)=O)C=C1Cl 1930AE [0,2,0,0,0,0|0,0,2]=4 582 B12R1.48 COC1=CC=C(C(C)=O)C=C1O W7333 [0,2,0,0,0,0|0,0,2]=4 583 B12R1.48 NCC1=C(F)C=C(B(O)O)C=C1 X1548 [0,2,0,0,0,0|2,0,0]=4 584 B12R1.48 OCC1=CC=C(B(O)O)C=C1F Y3638 [0,2,0,0,0,0|2,0,0]=4 585 B12R1.113 CC(C)C1=CC=C(CC=O)C=C1 3688AE [0,2,0,0,0,0|1,0,0]=3 586 B12R1.113 CCNC1=CC=C(C(=O)O)C=C1 Y9966 [0,2,0,0,0,0|1,0,1]=4 587 B12R1.113 CCOC1=CC=C(C(C)N)C=C1 7973AC [0,2,0,0,0,0|1,0,0]=3 588 B12R1.113 CN(C)C1=CC=C(CCO)C=C1 Z4804 [0,2,0,0,0,0|2,0,0]=4 589 B12R1.113 N#CCC1=CC=C(B(O)O)C=C1 N874 [0,2,0,0,0,0|2,0,0]=4 590 B12R1.113 N#CCC1=CC=C(C(=O)O)C=C1 Y6260 [0,2,0,0,0,0|1,0,1]=4 591 B12R1.113 OCCC1=CC=C(B(O)O)C=C1 X0518 [0,2,0,0,0,0|2,0,0]=4 592 B12R1.256 CC(=O)C1=CC=C(C(C)=O)C=C1 B629 [0,2,0,0,0,0|0,0,2]=4 593 B12R1.256 CN(C)C1=CC=C(B(O)O)C=C1 X1636 [0,2,0,0,0,0|2,0,0]=4 594 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 9179AH [0,2,0,0,0,0|1,0,1]=4 595 B12R1.256 FC(F)C1=CC=C(C(F)F)C=C1 X8269 [0,2,0,0,0,0|2,0,0]=4 596 B12R1.256 OB(O)C1=CC=C(C(F)F)C=C1 V9456 [0,2,0,0,0,0|2,0,0]=4 597 B12R1.452 O=C(O)C1=CC=C(CO)C=C1F Y8250 [0,2,0,0,0,0|1,0,1]=4 598 B12R1.452 OCC1=CC=C(B(O)O)C(F)=C1 Z9693 [0,2,0,0,0,0|2,0,0]=4 599 B12R1.9 CC(C)(C#N)C1=CC=C(N)C=C1 X9114 [0,2,0,0,0,0|2,0,0]=4 600 B12R1.9 CC(C)(CO)C1=CC=C(Cl)C=C1 2572AC [0,2,0,0,0,0|1,0,0]=3 601 B12R1.9 CC(C)(CO)C1=CC=C(N)C=C1 W4047 [0,2,0,0,0,0|1,0,0]=3 602 B12R1.9 CC1=CC=C(S(=O)(=O)NO)C=C1 V3581 [0,2,0,0,0,0|2,0,0]=4 603 B12R1.23 CC(C)(C)C1=CC(I)=C(O)C=C1 5051AB [0,2,0,0,0,0|2,0,0]=4 604 B12R1.23 CC(C)(C)C1=CC=C(Br)C(N)=C1 8608AB [0,2,0,0,0,0|2,0,0]=4 605 B12R1.23 CC(C)(C)C1=CC=C(I)C(O)=C1 2963AL [0,2,0,0,0,0|2,0,0]=4 606 B12R1.23 CC(C)(C)C1=CC=C(N)C(Br)=C1 B845 [0,2,0,0,0,0|2,0,0]=4 607 B12R1.23 CC(C)(C)C1=CC=C(N)C(Cl)=C1 5834AB [0,2,0,0,0,0|2,0,0]=4 608 B12R1.23 CC(C)(C)C1=CC=C(N)C(N)=C1 X0240 [0,2,0,0,0,0|2,0,0]=4 609 B12R1.23 CC(F)(F)C1=CC(Br)=C(F)C=C1 9145AC [0,2,0,0,0,0|2,0,0]=4 610 B12R1.23 CC1=C(Cl)C=C(C(F)(F)F)C=C1 9095AE [0,2,0,0,0,0|2,0,0]=4 611 B12R1.23 CC1=CC=C(C(F)(F)F)C=C1F 0947AD [0,2,0,0,0,0|2,0,0]=4 612 B12R1.126 CC1=CC(Br)=C(C(F)(F)F)C=C1 4137AA [0,2,0,0,0,0|2,0,0]=4 613 B12R1.126 CC1=CC(C)=C(S(C)(=O)=O)C=C1 9898AB [0,2,0,0,0,0|1,0,1]=4 614 B12R1.126 CC1=CC(N)=C(C(F)(F)F)C=C1 1476AA [0,2,0,0,0,0|2,0,0]=4 615 B12R1.126 CC1=CC=C(C(F)(F)F)C(Cl)=C1 R400 [0,2,0,0,0,0|2,0,0]=4 616 B12R1.126 CC1=CC=C(S(C)(=O)=O)C(Br)=C1 V8929 [0,2,0,0,0,0|1,0,1]=4 617 B12R1.56 CC1=C(C=O)C=C(B(O)O)C=C1 X1457 [0,2,0,0,0,0|2,0,0]=4 618 B12R1.56 COC1=C(O)C=CC(C(C)O)=C1 1912AB [0,2,0,0,0,0|1,0,0]=3 619 B12R1.232 CC(=O)C1=C(O)C=C(C)C(Br)=C1 5801AH [0,2,0,0,0,0|0,0,2]=4 620 B12R1.232 CC1=C(Br)C=C(B(O)O)C(F)=C1 Z1178 [0,2,0,0,0,0|2,0,0]=4 621 B12R1.232 CC1=C(Br)C=C(C(=O)O)C(N)=C1 1515AJ [0,2,0,0,0,0|1,0,1]=4 622 B12R1.232 CC1=C(F)C=C(C(=O)O)C(Br)=C1 X4313 [0,2,0,0,0,0|1,0,1]=4 623 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1Cl 3182AJ [0,2,0,0,0,0|1,0,1]=4 624 B12R1.367 CCC(N)C1=CC(C)=C(C)C=C1 4088AE [0,2,0,0,0,0|1,0,0]=3 625 B12R1.367 COC(=O)C1=CC(C)=C(C)C=C1 4972AB [0,2,0,0,0,0|0,0,2]=4 626 B12R1.367 C\C(=N\O)C1=CC=C(Cl)C(Cl)=C1 Y9895 [0,2,0,0,0,0|1,0,1]=4 627 B12R1.893 CC1=C(C)C(O)=C(C(=O)O)C=C1 6015AE [0,2,0,0,0,0|1,0,1]=4 628 B12R1.893 CC1=CC=C(B(O)O)C(F)=C1F V6287 [0,2,0,0,0,0|2,0,0]=4 629 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1I 3470AC [0,2,0,0,0,0|1,0,1]=4 630 B12R1.16 CC1=CC=C(C(N)CCO)C=C1 Z3667 [0,2,0,0,0,0|1,0,0]=3 631 B12R1.16 CC1=CC=C(N(C)CCO)C=C1 2784AB [0,2,0,0,0,0|1,0,0]=3 632 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 5727AB [0,2,0,0,0,0|0,0,2]=4 633 B12R1.16 CCC[C@H](N)C1=CC=C(F)C=C1 X9684 [0,2,0,0,0,0|2,0,0]=4 634 B12R1.16 NC(CCO)C1=CC=C(F)C=C1 W7350 [0,2,0,0,0,0|2,0,0]=4 635 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 W9123 [0,2,0,0,0,0|2,0,0]=4 636 B12R1.1703 COC(=O)C1=CC=C(C)C=C1N W4018 [0,2,0,0,0,0|0,0,2]=4 637 B12R1.57 CC1=CC=C(B(O)O)C(C#N)=C1 6021AA [0,2,0,0,0,0|2,0,0]=4 638 B12R1.1000 CC1=CC(C)=C(N(C)C)C(C)=C1 8375AL [0,2,0,0,0,0|2,0,0]=4 639 B12R1.1000 CC1=CC(F)=C(C(=O)O)C(F)=C1 Z3965 [0,2,0,0,0,0|1,0,1]=4 640 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(C)=C1 5059AH [0,2,0,0,0,0|1,0,1]=4 641 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(O)=C1 6588AB [0,2,0,0,0,0|1,0,1]=4 642 B10R2.6 C1=CC=C(C2CC2)C=C1 V8423 [1,0,0,1,0,0|1,0,0]=3 643 B12R2.294 IC1=CC=C(OC2CC2)C=C1 4594AA [0,0,0,1,0,1|2,0,0]=4 644 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 W5647 [0,0,0,1,0,1|0,0,2]=4 645 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 7799AD [0,0,0,1,0,1|1,0,1]=4 646 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)O1 9767AB [0,0,0,1,0,1|1,0,1]=4 647 B12R2.606 CC1=NC2=CC=C(Br)C=C2O1 Z4197 [0,0,0,1,0,1|1,0,1]=4 648 B12R2.606 CC1=NC2=CC=C(N)C=C2O1 Y9498 [0,0,0,1,0,1|1,0,1]=4 649 B12R2.606 CC1CC2=C(C=CC(F)=C2)N1 2765AC [0,0,0,1,0,1|2,0,0]=4 650 B12R2.606 OC1CC2=C(C=C(Br)C=C2)C1 W8856 [0,0,0,1,0,1|1,0,0]=3 651 B12R2.9 O=CC1=CC=C(C2CC2)C=C1 9503AJ [0,1,0,1,0,0|1,0,1]=4 652 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 9971AH [0,1,0,1,0,0|1,0,0]=3 653 B12R2.290 NC1(C2=CC=C(Br)C=C2)CC1 9464AH [0,1,0,1,0,0|2,0,0]=4 654 B12R2.290 NC1(C2=CC=C(Cl)C=C2)CC1 Z6326 [0,1,0,1,0,0|2,0,0]=4 655 B12R2.290 NC1(C2=CC=C(F)C=C2)CC1 X2091 [0,1,0,1,0,0|2,0,0]=4 656 B12R2.612 CC1=CC=C2C(=O)NOC2=C1 Z5011 [0,1,0,1,0,0|1,0,1]=4 657 B12R2.612 CC1=NOC2=C1C=CC(Br)=C2 0136AC [0,1,0,1,0,0|1,0,1]=4 658 B12R2.612 CC1=NOC2=C1C=CC(O)=C2 W7711 [0,1,0,1,0,0|1,0,1]=4 659 B12R2.612 NC1CCC2=CC(Br)=CC=C21 3110AJ [0,1,0,1,0,0|2,0,0]=4 660 B12R2.612 OB1OCC2=CC(F)=CC=C12 3338AH [0,1,0,1,0,0|2,0,0]=4 661 B12R2.2302 FC1=CC=C(C2CNC2)C=C1 2234AL [0,1,0,1,0,0|2,0,0]=4 662 B8R1.1 CC1=CC(CO)=NO1 W5683 [1,0,0,0,1,0|2,0,0]=4 663 B8R1.1 CC1=CC=C(CO)O1 Y8951 [1,0,0,0,1,0|1,0,0]=3 664 B8R1.1 CC1=CN=C(CO)S1 W4281 [1,0,0,0,1,0|2,0,0]=4 665 B8R1.1 CC1=CSC(CO)=C1 Y9977 [1,0,0,0,1,0|1,0,0]=3 666 B8R1.1 CC1=CSC(CO)=N1 Y5277 [1,0,0,0,1,0|2,0,0]=4 667 B8R1.1 CC1=NC(CO)=CS1 Y4033 [1,0,0,0,1,0|2,0,0]=4 668 B8R1.1 CC1=NC=C(CO)S1 8183AB [1,0,0,0,1,0|2,0,0]=4 669 B8R1.1 CC1=NOC(CO)=C1 Y7569 [1,0,0,0,1,0|2,0,0]=4 670 B8R1.1 CCN1C=C[N+](C)=C1 4846AL [1,0,0,0,1,0|2,0,0]=4 671 B8R1.1 CCN1C=C[N+](C)=C1 4847AL [1,0,0,0,1,0|2,0,0]=4 672 B8R1.1 CCN1C=C[N+](C)=C1 4849AL [1,0,0,0,1,0|2,0,0]=4 673 B8R1.1 CCN1C=C[N+](C)=C1 4850AL [1,0,0,0,1,0|2,0,0]=4 674 B8R1.1 CCN1C=C[N+](C)=C1 7687AJ [1,0,0,0,1,0|2,0,0]=4 675 B8R1.1 CCN1C=C[N+](C)=C1 7688AJ [1,0,0,0,1,0|2,0,0]=4 676 B8R1.1 CN1C=C(CO)C=N1 X8991 [1,0,0,0,1,0|2,0,0]=4 677 B8R1.1 CN1C=NC(CO)=C1 Y7819 [1,0,0,0,1,0|2,0,0]=4 678 B8R1.1 OCC1=CC=C(Br)S1 X5386 [1,0,0,0,1,0|2,0,0]=4 679 B8R1.1 OCC1=CC=C(Cl)S1 1513AC [1,0,0,0,1,0|2,0,0]=4 680 B8R1.7 CC(C)=C1C=CC=C1 1050AB [1,0,0,0,1,0|1,0,1]=4 681 B8R1.7 CC(C)C1=CC=CO1 U090 [1,0,0,0,1,0|2,0,0]=4 682 B8R1.7 CC(N)C1=COC=C1 2007AB [1,0,0,0,1,0|2,0,0]=4 683 B10R1.18 CC(=O)SC1=CC=CC=C1 9002AL [1,0,0,0,0,1|0,0,2]=4 684 B10R1.18 CC(Br)CC1=CC=CC=C1 0794AB [1,0,0,0,0,1|1,0,0]=3 685 B10R1.18 CC(C)OC1=NC=CC=C1 Z0239 [1,0,0,0,0,1|2,0,0]=4 686 B10R1.18 CC(N)CC1=CC=CN=C1 V7434 [1,0,0,0,0,1|2,0,0]=4 687 B12R1.21 CC(=O)CSC1=CC=C(C)C=C1 0827AD [0,0,0,0,0,2|0,0,2]=4 688 B12R1.21 CC(=O)OCC1=CC=C(C)C=C1 5686AF [0,0,0,0,0,2|0,0,2]=4 689 B12R1.21 CC(C)COC1=CC=C(N)C=C1 4819AE [0,0,0,0,0,2|2,0,0]=4 690 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 8511AE [0,0,0,0,0,2|1,0,0]=3