0 B9R1.6 CC(=O)C1=CC=NC=N1 W6021 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.6 CC(=O)C1=CC=NN=C1 W6606 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 CC(=O)C1=CN=CN=C1 X8651 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 CC(=O)C1=NC=CC=N1 7575AB [0,0,0,0,0,0|3,0,0]=3 4 B9R1.6 CC(C)C1=NC=CC=C1 W7610 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.6 CC(N)C1=CC=CC=N1 4915AJ [0,0,0,0,0,0|3,0,1]=4 6 B9R1.6 CC(N)C1=CC=NC=C1 W3800 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.6 CC(N)C1=CC=NC=C1 W6570 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.6 CC(O)C1=NC=CC=C1 Z2356 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.6 CN(C)C1=CN=CC=C1 9643AA [0,0,0,0,0,0|4,0,0]=4 10 B9R1.6 CP(C)C1=CC=CC=C1 0349AC [0,0,0,0,0,0|3,0,0]=3 11 B9R1.6 C[C@@H](N)C1=CC=NC=C1 4791AJ [0,0,0,0,0,0|3,0,1]=4 12 B9R1.6 C[C@@H](N)C1=NC=CC=C1 W6374 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.6 C[C@@H](O)C1=CC=NC=C1 2673AB [0,0,0,0,0,0|2,0,1]=3 14 B9R1.6 C[C@@H](O)C1=CN=CC=C1 1829AC [0,0,0,0,0,0|2,0,1]=3 15 B9R1.6 C[C@H](N)C1=NC=CC=C1 5348AB [0,0,0,0,0,0|3,0,1]=4 16 B9R1.6 C[C@H](N)C1=NC=CC=C1 W5086 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.6 C[C@H](O)C1=CC=NC=C1 7927AB [0,0,0,0,0,0|2,0,1]=3 18 B9R1.6 C[C@H](O)C1=CN=CC=C1 7054AB [0,0,0,0,0,0|2,0,1]=3 19 B9R1.6 C[C@H](O)C1=NC=CC=C1 8783AB [0,0,0,0,0,0|2,0,1]=3 20 B9R1.6 FC(F)C1=CC=CC=C1 X8304 [0,0,0,0,0,0|2,0,1]=3 21 B9R1.6 FC(F)C1=CC=CC=N1 2389AA [0,0,0,0,0,0|3,0,1]=4 22 B9R1.6 FC(F)C1=CN=CC=C1 9427AE [0,0,0,0,0,0|3,0,1]=4 23 B9R1.6 N=C(N)C1=CN=CN=C1 7669AH [0,0,0,0,0,0|4,0,0]=4 24 B9R1.6 N=C(N)C1=NC=CC=C1 Z3386 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.6 N=C(N)C1=NC=CN=C1 R154 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.6 NC(=S)C1=NC=CC=N1 3907AE [0,0,0,0,0,0|3,1,0]=4 27 B9R1.6 O=C(F)C1=CC=CC=C1 3921AE [0,0,0,0,0,0|1,0,0]=1 28 B9R1.6 O=C(O)C1=CCCCO1 6288AJ [0,0,0,0,0,0|1,0,3]=4 29 B9R1.6 O=C(O)C1=CCCNC1 8985AB [0,0,0,0,0,0|1,0,3]=4 30 B9R1.6 O=C(O)C1=COCCC1 2840AE [0,0,0,0,0,0|1,0,3]=4 31 B9R1.6 O=C(O)C1=NC=CC=C1 7630AF [0,0,0,0,0,0|1,0,0]=1 32 B9R1.6 O=C(O)C1=NN=CC=C1 X0237 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.6 O=C(O)[C@H]1CC=CCC1 O030 [0,0,0,0,0,0|0,0,4]=4 34 B9R1.6 O=C([O-])C1=CC=NC=C1 8981AL [0,0,0,0,0,0|1,0,1]=2 35 B9R1.6 OB(O)C1=CC=NC=C1 X1923 [0,0,0,0,0,0|2,0,1]=3 36 B9R1.6 OB(O)C1=CN=CC=C1 8784AD [0,0,0,0,0,0|2,0,1]=3 37 B9R1.6 OB(O)C1=CN=CN=C1 0635AP [0,0,0,0,0,0|3,0,1]=4 38 B8R1.2 BrCC1=CC=NC=C1 Y7030 [1,0,0,0,0,0|2,0,1]=4 39 B8R1.2 CSC1=NC=CC=C1 L314 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.2 Cl[Hg]C1=CC=CC=C1 7627AF [1,0,0,0,0,0|2,0,0]=3 41 B8R1.2 N#CC1=CC=CC=C1 E085 [1,0,0,0,0,0|1,0,1]=3 42 B8R1.2 NCC1=CC=NC=C1 Z3385 [1,0,0,0,0,0|2,0,1]=4 43 B8R1.2 NNC1=CC=CN=C1 Z1664 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.2 O=CC1=CC=NC=N1 W4791 [1,0,0,0,0,0|2,0,0]=3 45 B8R1.2 OCC1=CC=NC=N1 W5525 [1,0,0,0,0,0|2,0,1]=4 46 B8R1.2 OCC1=CN=CN=C1 W4842 [1,0,0,0,0,0|2,0,1]=4 47 B8R1.2 OCC1=CN=NC=C1 7045AB [1,0,0,0,0,0|2,0,1]=4 48 B8R1.2 OCC1=NC=CC=N1 W6241 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.13 CC(=O)C1=CC=C(C)C=N1 7521AB [0,1,0,0,0,0|2,0,0]=3 50 B10R1.13 CC(=O)C1=CC=C(F)N=C1 W8700 [0,1,0,0,0,0|2,0,0]=3 51 B10R1.13 CC(=O)C1=CC=C(O)N=C1 X9010 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 Z5392 [0,1,0,0,0,0|2,0,0]=3 53 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 W3479 [0,1,0,0,0,0|3,0,0]=4 54 B10R1.13 CC(=O)C1=NC=C(F)C=C1 V9103 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.13 CC(=O)C1=NC=C(F)C=N1 W9324 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.13 CC(=O)C1=NC=C(O)C=C1 0360AC [0,1,0,0,0,0|2,0,0]=3 57 B10R1.13 CC(Br)C1=CC=C(F)C=C1 9966AB [0,1,0,0,0,0|2,0,1]=4 58 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 Z2196 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.13 CC(N)C1=CC=C(Br)C=C1 V8869 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 V6495 [0,1,0,0,0,0|2,0,1]=4 61 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 Y9670 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.13 CC(N)C1=CC=C(F)C=C1 V5775 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.13 CC(O)C1=CC=C(O)C=C1 Z4466 [0,1,0,0,0,0|1,0,1]=3 64 B10R1.13 CC(O)C1=NC=C(Br)C=C1 8022AA [0,1,0,0,0,0|2,0,1]=4 65 B10R1.13 CC1=CC=C(C(=N)N)C=C1 2887AJ [0,1,0,0,0,0|2,0,0]=3 66 B10R1.13 CC1=CC=C(C(C)N)C=C1 8708AB [0,1,0,0,0,0|2,0,1]=4 67 B10R1.13 CC1=CC=C(S(=O)O)C=C1 7653AB [0,1,0,0,0,0|1,0,0]=2 68 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 7866AF [0,1,0,0,0,0|1,0,1]=3 69 B10R1.13 CC1=CN=C(C(=O)O)C=C1 9308AA [0,1,0,0,0,0|1,0,0]=2 70 B10R1.13 CC1=CN=C(C(=O)O)N=C1 Z5426 [0,1,0,0,0,0|2,0,0]=3 71 B10R1.13 CC1=CN=C(C(N)=O)C=N1 X0289 [0,1,0,0,0,0|3,0,0]=4 72 B10R1.13 CC1=NC=C(C(C)O)C=C1 0117AA [0,1,0,0,0,0|2,0,1]=4 73 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 6145AJ [0,1,0,0,0,0|3,0,0]=4 74 B10R1.13 CN(C)C1=CC=C(F)C=C1 2692AE [0,1,0,0,0,0|3,0,0]=4 75 B10R1.13 CN(C)C1=CC=C(O)C=C1 Z4951 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 V9278 [0,1,0,0,0,0|2,0,0]=3 77 B10R1.13 CS(=O)C1=CC=C(F)C=C1 7689AJ [0,1,0,0,0,0|2,0,0]=3 78 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 4787AJ [0,1,0,0,0,0|2,0,1]=4 79 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 X9175 [0,1,0,0,0,0|2,0,1]=4 80 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 W5396 [0,1,0,0,0,0|2,0,1]=4 81 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 1808AC [0,1,0,0,0,0|1,0,1]=3 82 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 X8527 [0,1,0,0,0,0|1,0,1]=3 83 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 6983AC [0,1,0,0,0,0|1,0,1]=3 84 B10R1.13 C[S+](C)C1=CC=C(O)C=C1 6544AL [0,1,0,0,0,0|3,0,0]=4 85 B10R1.13 FC(F)C1=CC=C(Br)C=C1 X0133 [0,1,0,0,0,0|2,0,1]=4 86 B10R1.13 FC1=CC=C(C(Cl)Cl)C=C1 V6035 [0,1,0,0,0,0|2,0,1]=4 87 B10R1.13 FC1=CC=C(C(F)F)C=C1 8605AD [0,1,0,0,0,0|2,0,1]=4 88 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 1266AB [0,1,0,0,0,0|2,0,0]=3 89 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 C099 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.13 N=C(N)C1=CC=C(I)C=C1 2845AJ [0,1,0,0,0,0|2,0,0]=3 91 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 Z4383 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.13 NC(=O)C1=NC=C(Cl)N=C1 W4430 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.13 NC(=O)C1=NC=C(F)C=C1 6778AB [0,1,0,0,0,0|2,0,0]=3 94 B10R1.13 NC(=O)C1=NC=C(N)C=C1 W3172 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.13 NC(=O)C1=NN=C(Cl)C=C1 W7734 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 V4765 [0,1,0,0,0,0|1,1,0]=3 97 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 7847AF [0,1,0,0,0,0|0,0,1]=2 98 B10R1.13 NC1=CN=C(C(=O)O)C=C1 3083AJ [0,1,0,0,0,0|1,0,0]=2 99 B10R1.13 NC1=CN=C([N+](=O)[O-])C=C1 W3254 [0,1,0,0,0,0|2,0,1]=4 100 B10R1.13 NC1=NC=C(B(O)O)C=C1 V8073 [0,1,0,0,0,0|2,0,1]=4 101 B10R1.13 NC1=NC=C(C(=O)O)N=C1 W6057 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.13 NC1=NN=C(C(=O)O)C=C1 X0293 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 W5818 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 W8994 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 Z4686 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.13 O=C(O)C1=NC=C(I)C=C1 3537AB [0,1,0,0,0,0|1,0,0]=2 107 B10R1.13 O=C(O)C1=NC=C(O)C=C1 5863AH [0,1,0,0,0,0|1,0,0]=2 108 B10R1.13 O=C(O)C1=NC=C(O)N=C1 V1419 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 F105 [0,1,0,0,0,0|0,0,1]=2 110 B10R1.13 O=C1C=CC(C(=O)O)=CO1 7614AF [0,1,0,0,0,0|1,0,0]=2 111 B10R1.13 O=S([O-])C1=CC=C(Br)C=C1 V3821 [0,1,0,0,0,0|1,0,1]=3 112 B10R1.13 O=[N+]([O-])C1=CN=C(S)C=C1 Y5022 [0,1,0,0,0,0|2,0,1]=4 113 B10R1.13 OB(O)C1=CC=C(S)C=C1 N820 [0,1,0,0,0,0|1,0,1]=3 114 B10R1.13 OB(O)C1=NC=C(Cl)C=C1 X0922 [0,1,0,0,0,0|2,0,1]=4 115 B10R1.13 OB(O)C1=NC=C(F)C=C1 V9453 [0,1,0,0,0,0|2,0,1]=4 116 B10R1.15 C=C(CC)C1=CC=CC=C1 0460AB [0,1,0,0,0,0|2,0,0]=3 117 B10R1.15 C=CC(=O)C1=CC=CC=C1 1968AC [0,1,0,0,0,0|1,0,0]=2 118 B10R1.15 C=CS(=O)C1=CC=CC=C1 0500AB [0,1,0,0,0,0|2,0,0]=3 119 B10R1.15 CC(CBr)C1=CC=CC=C1 Y3159 [0,1,0,0,0,0|2,0,1]=4 120 B10R1.15 CC(CN)C1=CC=CC=C1 W4299 [0,1,0,0,0,0|2,0,1]=4 121 B10R1.15 CCC(=O)C1=CC=CN=C1 Y5018 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.15 CCC(=O)C1=NC=CC=C1 Y6177 [0,1,0,0,0,0|2,0,0]=3 123 B10R1.15 CCN(C)C1=CC=CC=C1 W7366 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.15 CCN(N)C1=CC=CC=C1 4841AL [0,1,0,0,0,0|3,0,0]=4 125 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 7435AJ [0,1,0,0,0,0|1,0,1]=3 126 B10R1.15 CN(C=O)C1=NC=CC=C1 0345AC [0,1,0,0,0,0|3,0,0]=4 127 B10R1.15 CNC(C)C1=CC=CC=C1 V5180 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.15 COC(=N)C1=CC=NC=C1 4422AB [0,1,0,0,0,0|2,0,0]=3 129 B10R1.15 COC(=N)C1=NC=CC=C1 3585AL [0,1,0,0,0,0|2,0,0]=3 130 B10R1.15 COC(=O)C1=CC=NN=C1 W5569 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.15 COS(=O)C1=CC=CC=C1 0314AC [0,1,0,0,0,0|1,0,0]=2 132 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 V5313 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.15 C\C(=N\O)C1=CC=CN=C1 V6841 [0,1,0,0,0,0|2,0,0]=3 134 B10R1.15 C\C(=N\O)C1=CC=NC=C1 Z8096 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.15 C\C(=N\O)C1=NC=CC=C1 V3827 [0,1,0,0,0,0|2,0,0]=3 136 B10R1.15 NC(CO)C1=CC=CC=N1 1465AJ [0,1,0,0,0,0|2,0,1]=4 137 B10R1.15 NCC(N)C1=CC=CC=C1 8461AA [0,1,0,0,0,0|2,0,1]=4 138 B10R1.15 NCC(O)C1=CC=CN=C1 5727AC [0,1,0,0,0,0|2,0,1]=4 139 B10R1.15 NCC(O)C1=NC=CC=C1 4964AH [0,1,0,0,0,0|2,0,1]=4 140 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 X3539 [0,1,0,0,0,0|1,0,1]=3 141 B10R1.15 NNC(=O)C1=NC=CN=C1 W8351 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.15 N\C(=N/O)C1=CC=CC=C1 3148AL [0,1,0,0,0,0|1,0,0]=2 143 B10R1.15 N\C(=N/O)C1=NC=CN=C1 4643AE [0,1,0,0,0,0|3,0,0]=4 144 B10R1.15 N\C(N=O)=C1/N=CC=CN1 2867AF [0,1,0,0,0,0|3,0,0]=4 145 B10R1.15 O=C(CBr)C1=CC=CC=N1 5318AB [0,1,0,0,0,0|2,0,0]=3 146 B10R1.15 O=C(CBr)C1=CC=CN=C1 C113 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.15 O=C(N[O-])C1=CC=CC=C1 7120AL [0,1,0,0,0,0|0,0,1]=2 148 B10R1.15 O=C(N[O-])C1=CC=CC=C1 7846AF [0,1,0,0,0,0|0,0,1]=2 149 B10R1.15 O=C(O[Ag])C1=CC=CC=C1 7828AF [0,1,0,0,0,0|0,0,0]=1 150 B10R1.28 CC(C)(O)C1=CC=CN=C1 Y7594 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.28 CC(C)(O)C1=NC=CC=C1 4873AB [0,1,0,0,0,0|2,0,1]=4 152 B10R1.28 CS(=O)(=O)C1=CC=NC=C1 8766AA [0,1,0,0,0,0|2,0,1]=4 153 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 8822AL [0,1,0,0,0,0|3,0,0]=4 154 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 9417AF [0,1,0,0,0,0|2,1,0]=4 155 B10R1.28 Cl[Si](Cl)(Cl)C1=CC=CC=C1 P877 [0,1,0,0,0,0|2,1,0]=4 156 B10R1.28 Cl[Sn](Cl)(Cl)C1=CC=CC=C1 7622AF [0,1,0,0,0,0|3,0,0]=4 157 B10R1.28 NS(=O)(=O)C1=CC=CC=N1 9715AB [0,1,0,0,0,0|2,0,1]=4 158 B10R1.28 NS(=O)(=O)C1=CC=CN=C1 V4958 [0,1,0,0,0,0|2,0,1]=4 159 B10R1.28 O=P([O-])([O-])C1=CC=CC=C1 8802AL [0,1,0,0,0,0|1,0,1]=3 160 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 9505AJ [0,1,0,0,0,0|1,0,1]=3 161 B10R1.28 O=S(=O)([O-])C1=CC=CN=C1 7356AF [0,1,0,0,0,0|2,0,1]=4 162 B10R1.28 O[B-](O)(O)C1=CC=CC=C1 8966AL [0,1,0,0,0,0|1,0,1]=3 163 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 2023AA [0,1,0,0,0,0|2,0,0]=3 164 B10R1.61 CC(=O)C1=C(Br)C=NC=N1 Z4017 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.61 CC(=O)C1=C(F)C=NC=C1 W9003 [0,1,0,0,0,0|2,0,0]=3 166 B10R1.61 CC(=O)C1=CC=CN=C1Br W8693 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.61 CC(=O)C1=CC=CN=C1C Y7806 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.61 CC(=O)C1=CC=CN=C1Cl W6955 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.61 CC(=O)C1=CC=CN=C1F Y4110 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.61 CC(=O)C1=CC=NC=C1N 5933AA [0,1,0,0,0,0|2,0,0]=3 171 B10R1.61 CC(=O)C1=NC=CC=C1Br Z3887 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.61 CC(=O)C1=NC=CN=C1Cl 3776AA [0,1,0,0,0,0|3,0,0]=4 173 B10R1.61 CC(Cl)C1=CC=CC=C1Cl 0284AB [0,1,0,0,0,0|2,0,1]=4 174 B10R1.61 CC(N)C1=C(O)C=CC=C1 5161AJ [0,1,0,0,0,0|2,0,1]=4 175 B10R1.61 CC(N)C1=CC=CC=C1Cl V8121 [0,1,0,0,0,0|2,0,1]=4 176 B10R1.61 CC(N)C1=CC=CC=C1Cl X6241 [0,1,0,0,0,0|2,0,1]=4 177 B10R1.61 CC(N)C1=CC=CC=C1F V7591 [0,1,0,0,0,0|2,0,1]=4 178 B10R1.61 CC(O)C1=C(Br)C=CC=C1 4894AJ [0,1,0,0,0,0|1,0,1]=3 179 B10R1.61 CC(O)C1=C(Cl)N=CC=C1 5872AA [0,1,0,0,0,0|2,0,1]=4 180 B10R1.61 CC(O)C1=CC=CC=C1F X8296 [0,1,0,0,0,0|1,0,1]=3 181 B10R1.61 CC(O)C1=CC=CC=C1N Z6783 [0,1,0,0,0,0|1,0,1]=3 182 B10R1.61 CC1=C(C(=O)O)C=CC=N1 1002AB [0,1,0,0,0,0|1,0,0]=2 183 B10R1.61 CC1=C(C(N)=O)C=CC=N1 W7162 [0,1,0,0,0,0|2,0,0]=3 184 B10R1.61 CC1=C(C(N)=O)C=NC=C1 X7929 [0,1,0,0,0,0|2,0,0]=3 185 B10R1.61 CC1=C([N+](=O)[O-])C=CN=C1 N214 [0,1,0,0,0,0|2,0,1]=4 186 B10R1.61 CC1=CC=CC=C1C(=N)N 1807AJ [0,1,0,0,0,0|2,0,0]=3 187 B10R1.61 CC1=CC=CC=C1C(=N)N 5089AH [0,1,0,0,0,0|2,0,0]=3 188 B10R1.61 CC1=CC=CN=C1B(O)O V9249 [0,1,0,0,0,0|2,0,1]=4 189 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] Y5320 [0,1,0,0,0,0|2,0,1]=4 190 B10R1.61 CC1=CC=NC=C1C(=O)O W9651 [0,1,0,0,0,0|1,0,0]=2 191 B10R1.61 CC1=NC=CC=C1B(O)O W9274 [0,1,0,0,0,0|2,0,1]=4 192 B10R1.61 CC1=NC=CC=C1B(O)O Z7106 [0,1,0,0,0,0|2,0,1]=4 193 B10R1.61 CC1=NC=CN=C1C(=O)O W6160 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.61 CN(C)C1=C(F)C=CC=C1 9536AF [0,1,0,0,0,0|3,0,0]=4 195 B10R1.61 CN(C)C1=CC=CC=C1O Z4668 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 1179AL [0,1,0,0,0,0|2,0,1]=4 197 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl X9707 [0,1,0,0,0,0|2,0,1]=4 198 B10R1.61 C[C@@H](N)C1=CC=CC=C1O X9575 [0,1,0,0,0,0|2,0,1]=4 199 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 8241AA [0,1,0,0,0,0|1,0,1]=3 200 B10R1.61 FC(F)C1=CC=CC=C1Br V7943 [0,1,0,0,0,0|2,0,1]=4 201 B10R1.61 FC1=CC=CC=C1C(Cl)Cl 3540AB [0,1,0,0,0,0|2,0,1]=4 202 B10R1.61 FC1=CC=CC=C1C(F)F 7228AE [0,1,0,0,0,0|2,0,1]=4 203 B10R1.61 N=C(N)C1=C(Cl)C=CC=N1 2250AJ [0,1,0,0,0,0|3,0,0]=4 204 B10R1.61 N=C(N)C1=CC=CC=C1Br Y9512 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.61 N=C(N)C1=CC=CC=C1Cl Y8078 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.61 N=C(N)C1=CC=CC=C1F W7062 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 W3053 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.61 NC(=O)C1=C(F)N=CC=C1 W5777 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.61 NC(=O)C1=C(N)C=CN=C1 W8196 [0,1,0,0,0,0|2,0,0]=3 210 B10R1.61 NC(=O)C1=C(N)C=NC=C1 W7596 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.61 NC(=O)C1=CC=CN=C1N Y7441 [0,1,0,0,0,0|2,0,0]=3 212 B10R1.61 NC(=O)C1=NC=CC=C1N W6587 [0,1,0,0,0,0|2,0,0]=3 213 B10R1.61 NC(=O)C1=NC=CN=C1Cl W4429 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.61 NC(=S)C1=C(O)C=CC=C1 5069AH [0,1,0,0,0,0|1,1,0]=3 215 B10R1.61 NC(=S)C1=CC=CC=C1F I217 [0,1,0,0,0,0|1,1,0]=3 216 B10R1.61 NC1=C(C(=O)O)C=NC=N1 W4353 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.61 NC1=CC=CC=C1[N+](=O)[O-] 5751AL [0,1,0,0,0,0|1,0,1]=3 218 B10R1.61 NC1=CN=CC=C1C(=O)O 9458AJ [0,1,0,0,0,0|1,0,0]=2 219 B10R1.61 NC1=NN=CC=C1C(=O)O W4411 [0,1,0,0,0,0|2,0,0]=3 220 B10R1.61 O=C(O)C1=C(Br)C=NC=N1 W7597 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.61 O=C(O)C1=C(Cl)C=NC=N1 Y9704 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.61 O=C(O)C1=C(O)C=CC=C1 7849AF [0,1,0,0,0,0|0,0,0]=1 223 B10R1.61 O=C(O)C1=C(O)N=CN=C1 W7701 [0,1,0,0,0,0|2,0,0]=3 224 B10R1.61 O=C(O)C1=CC=NNC1=O Z4861 [0,1,0,0,0,0|2,0,0]=3 225 B10R1.61 O=C(O)C1=NC=CC=C1I W8180 [0,1,0,0,0,0|1,0,0]=2 226 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 7836AF [0,1,0,0,0,0|0,0,1]=2 227 B10R1.61 O=C([O-])C1=C(S)C=CC=C1 9154AL [0,1,0,0,0,0|0,0,1]=2 228 B10R1.61 O=C1C=CNC=C1[N+](=O)[O-] X5156 [0,1,0,0,0,0|2,0,1]=4 229 B10R1.61 O=[N+]([O-])C1=C(Cl)C=NC=C1 X9816 [0,1,0,0,0,0|2,0,1]=4 230 B10R1.61 O=[N+]([O-])C1=C(O)C=NC=C1 X9895 [0,1,0,0,0,0|2,0,1]=4 231 B10R1.61 O=[N+]([O-])C1=NC=CC=C1F V1363 [0,1,0,0,0,0|2,0,1]=4 232 B10R1.61 O=[N+]([O-])C1=NC=CC=C1I V0112 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.61 OB(O)C1=C(Cl)C=NC=C1 X9631 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.61 OB(O)C1=C(F)C=NC=C1 Y6850 [0,1,0,0,0,0|2,0,1]=4 235 B10R1.61 OB(O)C1=CC=CC=C1I Y3509 [0,1,0,0,0,0|1,0,1]=3 236 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 3551AC [0,1,0,0,0,0|2,0,0]=3 237 B10R1.113 CC(=O)C1=CC(C)=NC=C1 W5046 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 Y8387 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.113 CC(=O)C1=CC(F)=CN=C1 4092AB [0,1,0,0,0,0|2,0,0]=3 240 B10R1.113 CC(=O)C1=CC=CC(Cl)=N1 1448AL [0,1,0,0,0,0|2,0,0]=3 241 B10R1.113 CC(=O)C1=CC=NC(Cl)=N1 5794AA [0,1,0,0,0,0|3,0,0]=4 242 B10R1.113 CC(=O)C1=CN=CC(C)=C1 5943AB [0,1,0,0,0,0|2,0,0]=3 243 B10R1.113 CC(=O)C1=C[N+]([O-])=CC=C1 X3366 [0,1,0,0,0,0|2,0,0]=3 244 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 8967AB [0,1,0,0,0,0|2,0,0]=3 245 B10R1.113 CC(N)C1=CC=CC(Br)=C1 4929AJ [0,1,0,0,0,0|2,0,1]=4 246 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 V4629 [0,1,0,0,0,0|2,0,1]=4 247 B10R1.113 CC(N)C1=CC=CC(F)=C1 1626AC [0,1,0,0,0,0|2,0,1]=4 248 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 4933AJ [0,1,0,0,0,0|1,0,1]=3 249 B10R1.113 CC(O)C1=CC(F)=CC=C1 2665AE [0,1,0,0,0,0|1,0,1]=3 250 B10R1.113 CC(O)C1=CC(O)=CC=C1 4940AJ [0,1,0,0,0,0|1,0,1]=3 251 B10R1.113 CC(O)C1=CC=CC(N)=C1 W4803 [0,1,0,0,0,0|1,0,1]=3 252 B10R1.113 CC(O)C1=NC(Br)=CC=C1 Z4144 [0,1,0,0,0,0|2,0,1]=4 253 B10R1.113 CC1=CC(B(O)O)=NC=C1 V5567 [0,1,0,0,0,0|2,0,1]=4 254 B10R1.113 CC1=CC(C(C)N)=CC=C1 8402AE [0,1,0,0,0,0|2,0,1]=4 255 B10R1.113 CC1=CC(C(N)=O)=CC=C1 F917 [0,1,0,0,0,0|1,0,0]=2 256 B10R1.113 CC1=CC(N(C)N)=CC=C1 4897AL [0,1,0,0,0,0|3,0,0]=4 257 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 W3022 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.113 CC1=CC([N+](=O)[O-])=NC=C1 X3370 [0,1,0,0,0,0|2,0,1]=4 259 B10R1.113 CC1=CC=CC(B(O)O)=N1 X0753 [0,1,0,0,0,0|2,0,1]=4 260 B10R1.113 CC1=CC=CC(C(=N)N)=C1 0599AB [0,1,0,0,0,0|2,0,0]=3 261 B10R1.113 CC1=CC=CC(C(C)O)=C1 8099AF [0,1,0,0,0,0|1,0,1]=3 262 B10R1.113 CC1=NC([N+](=O)[O-])=CC=C1 X6714 [0,1,0,0,0,0|2,0,1]=4 263 B10R1.113 CC1=NC=CC(C(=O)O)=N1 X9944 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.113 CC1=NC=CC([N+](=O)[O-])=C1 N229 [0,1,0,0,0,0|2,0,1]=4 265 B10R1.113 CN(C)C1=CC(F)=CC=C1 0769AB [0,1,0,0,0,0|3,0,0]=4 266 B10R1.113 CN(C)C1=CC=CC(Cl)=C1 0572AC [0,1,0,0,0,0|3,0,0]=4 267 B10R1.113 C[C@@H](O)C1=CC(Br)=CC=C1 6220AA [0,1,0,0,0,0|1,0,1]=3 268 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 6759AA [0,1,0,0,0,0|2,0,1]=4 269 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Z1666 [0,1,0,0,0,0|2,0,1]=4 270 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 X4842 [0,1,0,0,0,0|2,0,1]=4 271 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 6282AA [0,1,0,0,0,0|1,0,1]=3 272 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 6013AL [0,1,0,0,0,0|2,0,0]=3 273 B10R1.113 FC(F)C1=CC(Br)=CC=C1 W5231 [0,1,0,0,0,0|2,0,1]=4 274 B10R1.113 FC1=CC=CC(C(Cl)Cl)=C1 2666AE [0,1,0,0,0,0|2,0,1]=4 275 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 Y6780 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.113 NC(=O)C1=CC(N)=CN=C1 W7302 [0,1,0,0,0,0|2,0,0]=3 277 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 Y9632 [0,1,0,0,0,0|1,0,0]=2 278 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 Y9875 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.113 NC(=O)C1=NC(Cl)=CN=C1 4538AB [0,1,0,0,0,0|3,0,0]=4 280 B10R1.113 NC(=O)C1=NC(Cl)=NC=C1 Y8337 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 9338AB [0,1,0,0,0,0|2,0,0]=3 282 B10R1.113 NC(=O)C1=NC=CC(F)=C1 Y7165 [0,1,0,0,0,0|2,0,0]=3 283 B10R1.113 NC(=S)C1=CC=CC(Br)=C1 V4474 [0,1,0,0,0,0|1,1,0]=3 284 B10R1.113 NC(=S)C1=CC=CC(F)=C1 V7493 [0,1,0,0,0,0|1,1,0]=3 285 B10R1.113 NC(=S)C1=CC=CC(I)=C1 8330AC [0,1,0,0,0,0|1,1,0]=3 286 B10R1.113 NC1=CC(B(O)O)=CC=C1 N846 [0,1,0,0,0,0|1,0,1]=3 287 B10R1.113 NC1=CC(C(=O)O)=NC=C1 5565AH [0,1,0,0,0,0|1,0,0]=2 288 B10R1.113 NC1=CC(C(=O)O)=NC=C1 X8464 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.113 NC1=CC(C(=O)O)=NC=C1 X9744 [0,1,0,0,0,0|1,0,0]=2 290 B10R1.113 NC1=CC(C(=O)[O-])=CC=C1 5988AL [0,1,0,0,0,0|0,0,1]=2 291 B10R1.113 NC1=CC([N+](=O)[O-])=CN=C1 W9613 [0,1,0,0,0,0|2,0,1]=4 292 B10R1.113 NC1=CC=CC(C(F)F)=C1 4695AB [0,1,0,0,0,0|2,0,1]=4 293 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 6130AL [0,1,0,0,0,0|1,0,1]=3 294 B10R1.113 NC1=CN=CC(B(O)O)=C1 2762AA [0,1,0,0,0,0|2,0,1]=4 295 B10R1.113 NC1=CN=CC(C(=O)O)=N1 W7370 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.113 NC1=NC([N+](=O)[O-])=CC=C1 W3253 [0,1,0,0,0,0|2,0,1]=4 297 B10R1.113 NC1=NC=CC(C(=O)O)=N1 W4491 [0,1,0,0,0,0|2,0,0]=3 298 B10R1.113 NC1=NC=CC([N+](=O)[O-])=C1 R734 [0,1,0,0,0,0|2,0,1]=4 299 B10R1.113 O=C(Cl)C1=CC=CC(I)=C1 6069AL [0,1,0,0,0,0|1,0,0]=2 300 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 W5819 [0,1,0,0,0,0|2,0,0]=3 301 B10R1.113 O=C(O)C1=CC(I)=NC=C1 Y9547 [0,1,0,0,0,0|1,0,0]=2 302 B10R1.113 O=C(O)C1=CN=NC(Cl)=C1 9032AF [0,1,0,0,0,0|2,0,0]=3 303 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 B798 [0,1,0,0,0,0|2,0,0]=3 304 B10R1.113 O=C([O-])C1=CC=CC(F)=C1 X2825 [0,1,0,0,0,0|0,0,1]=2 305 B10R1.113 O=C1C=C(C(=O)O)C=NN1 W8905 [0,1,0,0,0,0|2,0,0]=3 306 B10R1.113 O=C1C=COC(C(=O)O)=C1 3223AL [0,1,0,0,0,0|1,0,0]=2 307 B10R1.113 O=C1N=CC=C(C(=O)O)N1 W9231 [0,1,0,0,0,0|2,0,0]=3 308 B10R1.113 O=[N+]([O-])C1=CC(F)=CN=C1 1349AA [0,1,0,0,0,0|2,0,1]=4 309 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=N1 X7043 [0,1,0,0,0,0|2,0,1]=4 310 B10R1.113 O=[N+]([O-])C1=CN=CC(O)=C1 W4031 [0,1,0,0,0,0|2,0,1]=4 311 B10R1.113 O=[N+]([O-])C1=NC(Br)=CC=C1 I194 [0,1,0,0,0,0|2,0,1]=4 312 B10R1.113 O=[N+]([O-])C1=NC=CC(F)=C1 4134AC [0,1,0,0,0,0|2,0,1]=4 313 B10R1.113 OB(O)C1=CC=CC(S)=C1 N825 [0,1,0,0,0,0|1,0,1]=3 314 B10R1.113 OB(O)C1=NC(F)=CC=C1 V9108 [0,1,0,0,0,0|2,0,1]=4 315 B10R2.6 C1=CC=C(C2CC2)C=C1 V8423 [0,0,0,1,0,0|2,0,1]=4 316 B10R2.320 BrC1=CC2=CC=CC=C12 K940 [0,0,0,1,0,0|2,0,0]=3 317 B8R1.7 CC(=O)C1=CNC=N1 9304AB [0,0,0,0,1,0|3,0,0]=4 318 B8R1.7 CC(=O)C1=CNN=C1 1947AB [0,0,0,0,1,0|3,0,0]=4 319 B8R1.7 CC(=O)C1=CSC=N1 W5893 [0,0,0,0,1,0|3,0,0]=4 320 B8R1.7 CC(=O)C1=NC=CN1 5223AE [0,0,0,0,1,0|3,0,0]=4 321 B8R1.7 CC(C)=C1C=CC=C1 1050AB [0,0,0,0,1,0|2,0,0]=3 322 B8R1.7 N1N=CC(C(=O)O)=N1 Y1161 [0,0,0,0,1,0|3,0,0]=4 323 B8R1.7 N=C(N)C1=CC=CS1 7913AB [0,0,0,0,1,0|3,0,0]=4 324 B8R1.7 NC(=O)C1=CC=CS1 X6987 [0,0,0,0,1,0|2,0,0]=3 325 B8R1.7 NC(=O)C1=CN=CS1 Y5540 [0,0,0,0,1,0|3,0,0]=4 326 B8R1.7 NC(=O)C1=NC=CO1 4142AC [0,0,0,0,1,0|3,0,0]=4 327 B8R1.7 NC(=S)C1=CC=CO1 5874AD [0,0,0,0,1,0|2,1,0]=4 328 B8R1.7 O=C(O)C1=CC=CN1 Q622 [0,0,0,0,1,0|1,0,0]=2 329 B8R1.7 O=C(O)C1=CC=NS1 0659AA [0,0,0,0,1,0|2,0,0]=3 330 B8R1.7 O=C(O)C1=CN=CO1 X4661 [0,0,0,0,1,0|2,0,0]=3 331 B8R1.7 O=C(O)C1=CSN=C1 Z5157 [0,0,0,0,1,0|2,0,0]=3 332 B8R1.7 O=C(O)[C@@H]1C=CCN1 W4258 [0,0,0,0,1,0|1,0,2]=4 333 B8R1.7 O=C([O-])C1=CC=CS1 Z2610 [0,0,0,0,1,0|1,0,1]=3 334 B8R1.7 O=[N+]([O-])C1=CC=CN1 W7207 [0,0,0,0,1,0|2,0,1]=4 335 B8R1.7 O=[N+]([O-])C1=CC=CS1 L329 [0,0,0,0,1,0|2,0,1]=4 336 B10R1.18 CC(=O)CC1=CC=NC=C1 4765AJ [0,0,0,0,0,1|2,0,0]=3 337 B10R1.18 CC(=O)CC1=NC=CC=C1 W7508 [0,0,0,0,0,1|2,0,0]=3 338 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 4736AL [0,0,0,0,0,1|2,0,0]=3 339 B10R1.18 CC(=O)NC1=CC=NC=C1 7350AB [0,0,0,0,0,1|2,0,0]=3 340 B10R1.18 CC(=O)NC1=CN=CC=C1 6108AE [0,0,0,0,0,1|2,0,0]=3 341 B10R1.18 CC(=O)NC1=NC=CC=C1 Y5038 [0,0,0,0,0,1|2,0,0]=3 342 B10R1.18 CC(=O)SC1=CC=CC=C1 9002AL [0,0,0,0,0,1|1,0,0]=2 343 B10R1.18 CC(Br)CC1=CC=CC=C1 0794AB [0,0,0,0,0,1|2,0,1]=4 344 B10R1.18 NC(=O)CC1=CC=CN=C1 4754AB [0,0,0,0,0,1|2,0,0]=3 345 B10R1.18 NC(=O)CC1=NC=CC=N1 Z3997 [0,0,0,0,0,1|3,0,0]=4 346 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 4299AL [0,0,0,0,0,1|2,0,0]=3 347 B10R1.18 NC(=O)OC1=CC=CC=C1 7861AF [0,0,0,0,0,1|1,0,0]=2 348 B10R1.18 NC(=S)NC1=CC=NC=C1 5284AD [0,0,0,0,0,1|2,1,0]=4 349 B7R1.3 BrC1=CC=NC=C1 V7564 [2,0,0,0,0,0|2,0,0]=4 350 B7R1.3 NC1=CC=CC=C1 7089AL [2,0,0,0,0,0|1,0,0]=3 351 B7R1.3 NC1=CC=CC=C1 7670AF [2,0,0,0,0,0|1,0,0]=3 352 B7R1.3 NC1=CC=NC=C1 2631AL [2,0,0,0,0,0|2,0,0]=4 353 B7R1.3 O=C1C=CC=CO1 X6757 [2,0,0,0,0,0|1,0,0]=3 354 B7R1.3 O=C1C=COC=C1 1768AA [2,0,0,0,0,0|1,0,0]=3 355 B7R1.3 OC1=CC=NC=C1 8186AJ [2,0,0,0,0,0|1,0,0]=3 356 B7R1.3 OC1=CC=NN=C1 Y3331 [2,0,0,0,0,0|2,0,0]=4 357 B7R1.3 OC1=NC=CC=N1 R414 [2,0,0,0,0,0|2,0,0]=4 358 B7R1.3 S=C1C=CC=CN1 1497AL [2,0,0,0,0,0|1,1,0]=4 359 B9R1.1 C=CC1=CN=C(C)C=C1 Q615 [1,1,0,0,0,0|2,0,0]=4 360 B9R1.1 CC1=CC=C(CS)C=C1 7913AF [1,1,0,0,0,0|0,1,1]=4 361 B9R1.1 CC1=CN=C(C=O)C=N1 Y9267 [1,1,0,0,0,0|2,0,0]=4 362 B9R1.1 CC1=CN=C(CO)C=C1 1457AB [1,1,0,0,0,0|1,0,1]=4 363 B9R1.1 CC1=NC=C(C=O)C=C1 W6750 [1,1,0,0,0,0|1,0,0]=3 364 B9R1.1 CC1=NC=C(C=O)C=N1 W9344 [1,1,0,0,0,0|2,0,0]=4 365 B9R1.1 CCC1=CC=C(Cl)C=C1 6872AE [1,1,0,0,0,0|1,0,1]=4 366 B9R1.1 CCC1=CC=C(F)C=C1 W6384 [1,1,0,0,0,0|1,0,1]=4 367 B9R1.1 CNC1=CC=C(Br)C=C1 Z5039 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.1 CNC1=CC=C(O)C=C1 V3446 [1,1,0,0,0,0|2,0,0]=4 369 B9R1.1 CSC1=CC=C(C)C=C1 I356 [1,1,0,0,0,0|2,0,0]=4 370 B9R1.1 N#CC1=CC=C(S)C=C1 V7013 [1,1,0,0,0,0|1,0,1]=4 371 B9R1.1 NC1=NC=C(C=O)C=C1 0819AC [1,1,0,0,0,0|1,0,0]=3 372 B9R1.1 NCC1=CC=C(O)C=C1 X6145 [1,1,0,0,0,0|1,0,1]=4 373 B9R1.1 NNC1=CC=C(Br)C=C1 V2246 [1,1,0,0,0,0|2,0,0]=4 374 B9R1.1 NNC1=CC=C(Cl)C=C1 2700AL [1,1,0,0,0,0|2,0,0]=4 375 B9R1.1 NNC1=CC=C(Cl)C=C1 6459AL [1,1,0,0,0,0|2,0,0]=4 376 B9R1.1 NNC1=CC=C(I)C=C1 0740AP [1,1,0,0,0,0|2,0,0]=4 377 B9R1.1 NNC1=CC=C(I)C=C1 H231 [1,1,0,0,0,0|2,0,0]=4 378 B9R1.1 O=CC1=CC=C([O-])C=C1 6126AE [1,1,0,0,0,0|0,0,0]=2 379 B9R1.1 O=CC1=CN=C(Cl)N=C1 X2947 [1,1,0,0,0,0|2,0,0]=4 380 B9R1.1 O=CC1=CN=C(F)C=C1 W7817 [1,1,0,0,0,0|1,0,0]=3 381 B9R1.1 O=CC1=NC=C(Cl)N=C1 4431AC [1,1,0,0,0,0|2,0,0]=4 382 B9R1.1 O=CC1=NC=C(O)C=C1 Y8673 [1,1,0,0,0,0|1,0,0]=3 383 B9R1.1 O=CC1=NN=C(Cl)C=C1 W5271 [1,1,0,0,0,0|2,0,0]=4 384 B9R1.1 O=CC1=NN=C(O)C=C1 V9271 [1,1,0,0,0,0|2,0,0]=4 385 B9R1.1 OCC1=NC=C(Cl)C=C1 Y8215 [1,1,0,0,0,0|1,0,1]=4 386 B9R1.1 OCC1=NC=C(F)C=C1 W8534 [1,1,0,0,0,0|1,0,1]=4 387 B9R1.1 [O-][N+]1=CC=C(CO)C=C1 1337AQ [1,1,0,0,0,0|1,0,1]=4 388 B9R1.2 C#CC1=CC(O)=CC=C1 Y3233 [1,1,0,0,0,0|1,0,1]=4 389 B9R1.2 C#CC1=CC=CC(C)=C1 1949AC [1,1,0,0,0,0|1,0,1]=4 390 B9R1.2 C=CC1=CC(C)=CC=C1 9514AF [1,1,0,0,0,0|1,0,0]=3 391 B9R1.2 C=CC1=CC(F)=NC=C1 8042AB [1,1,0,0,0,0|2,0,0]=4 392 B9R1.2 C=CC1=CC=CC(Br)=C1 0458AB [1,1,0,0,0,0|1,0,0]=3 393 B9R1.2 C=CC1=CC=CC(Cl)=C1 V0700 [1,1,0,0,0,0|1,0,0]=3 394 B9R1.2 C=CC1=NC(C)=CC=C1 2157AA [1,1,0,0,0,0|2,0,0]=4 395 B9R1.2 C=CC1=NC=CC(Cl)=C1 6889AC [1,1,0,0,0,0|2,0,0]=4 396 B9R1.2 CC1=CC(C=O)=CN=C1 X8532 [1,1,0,0,0,0|1,0,0]=3 397 B9R1.2 CC1=CC(C=O)=NC=C1 W6792 [1,1,0,0,0,0|1,0,0]=3 398 B9R1.2 CC1=CN=CC(CO)=C1 W9908 [1,1,0,0,0,0|1,0,1]=4 399 B9R1.2 CC1=NC=CC(C=O)=C1 I239 [1,1,0,0,0,0|1,0,0]=3 400 B9R1.2 CC1=NC=CC(C=O)=N1 X8509 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.2 CC1=NC=CC(CO)=C1 X8748 [1,1,0,0,0,0|1,0,1]=4 402 B9R1.2 CNC1=CC(F)=CC=C1 V3481 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.2 CNC1=CC=CC(Br)=C1 Z5012 [1,1,0,0,0,0|2,0,0]=4 404 B9R1.2 CNC1=CC=CC(F)=C1 W4192 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.2 CNC1=CC=CC(O)=C1 7298AA [1,1,0,0,0,0|2,0,0]=4 406 B9R1.2 COC1=CC(N)=CC=C1 8186AL [1,1,0,0,0,0|2,0,0]=4 407 B9R1.2 CSC1=CC=CC(Cl)=C1 L521 [1,1,0,0,0,0|2,0,0]=4 408 B9R1.2 ClCC1=CC(I)=CC=C1 8955AB [1,1,0,0,0,0|1,0,1]=4 409 B9R1.2 NC1=CC(C=O)=CC=C1 Y7351 [1,1,0,0,0,0|0,0,0]=2 410 B9R1.2 NC1=CC=CC(CF)=C1 5712AJ [1,1,0,0,0,0|1,0,1]=4 411 B9R1.2 NC1=CC=CC(CO)=N1 2443AC [1,1,0,0,0,0|1,0,1]=4 412 B9R1.2 O=CC1=CC(Cl)=NC=C1 X8543 [1,1,0,0,0,0|1,0,0]=3 413 B9R1.2 O=CC1=CC(Cl)=NC=C1 Z8697 [1,1,0,0,0,0|1,0,0]=3 414 B9R1.2 O=CC1=CN=CC(Cl)=C1 W9911 [1,1,0,0,0,0|1,0,0]=3 415 B9R1.2 O=CC1=NC=CC(Cl)=C1 W7511 [1,1,0,0,0,0|1,0,0]=3 416 B9R1.2 OCC1=CC(Cl)=CN=C1 V0671 [1,1,0,0,0,0|1,0,1]=4 417 B9R1.2 OCC1=CC(F)=NC=C1 Y5012 [1,1,0,0,0,0|1,0,1]=4 418 B9R1.2 OCC1=CC=CC(F)=N1 V5103 [1,1,0,0,0,0|1,0,1]=4 419 B9R1.2 OCC1=CC=CC(I)=C1 W7081 [1,1,0,0,0,0|0,0,1]=3 420 B9R1.2 OCC1=CN=CC(F)=C1 1380AB [1,1,0,0,0,0|1,0,1]=4 421 B9R1.8 C=COC1=CC=CC=C1 1277AQ [1,1,0,0,0,0|1,0,0]=3 422 B9R1.8 CC#CC1=CC=CC=C1 4952AL [1,1,0,0,0,0|1,0,1]=4 423 B9R1.8 COCC1=CC=CN=C1 5231AH [1,1,0,0,0,0|1,0,1]=4 424 B9R1.8 COCC1=CC=NC=C1 5493AH [1,1,0,0,0,0|1,0,1]=4 425 B9R1.8 COCC1=NC=CC=C1 V2195 [1,1,0,0,0,0|1,0,1]=4 426 B9R1.8 CSCC1=CC=CC=C1 7914AF [1,1,0,0,0,0|0,1,1]=4 427 B9R1.8 C\C=C/C1=CC=CC=C1 7457AL [1,1,0,0,0,0|1,0,0]=3 428 B9R1.8 C\N=C\C1=CC=CC=C1 R179 [1,1,0,0,0,0|1,0,0]=3 429 B9R1.8 ICCC1=CC=CC=C1 4037AL [1,1,0,0,0,0|1,0,1]=4 430 B9R1.8 N#COC1=CC=CC=C1 3790AL [1,1,0,0,0,0|1,0,1]=4 431 B9R1.8 NCCC1=CC=CC=C1 5784AL [1,1,0,0,0,0|1,0,1]=4 432 B9R1.8 N\N=C\C1=CC=CC=C1 7871AF [1,1,0,0,0,0|1,0,0]=3 433 B9R1.8 O=S=NC1=CC=CC=C1 8948AJ [1,1,0,0,0,0|1,0,0]=3 434 B9R1.8 OCCC1=CC=CC=C1 V0900 [1,1,0,0,0,0|0,0,1]=3 435 B9R1.8 OCCC1=CC=CN=C1 Y9667 [1,1,0,0,0,0|1,0,1]=4 436 B9R1.8 OCCC1=CC=NC=C1 6680AL [1,1,0,0,0,0|1,0,1]=4 437 B9R1.8 ONCC1=CC=CC=C1 9353AB [1,1,0,0,0,0|0,0,1]=3 438 B9R1.8 O\N=C\C1=NC=CC=C1 W9914 [1,1,0,0,0,0|1,0,0]=3 439 B9R1.8 [CH2][CH][CH]C1=CC=CC=C1 8736AL [1,1,0,0,0,0|1,0,1]=4 440 B9R1.15 C#CC1=C(C)C=CC=C1 1940AC [1,1,0,0,0,0|1,0,1]=4 441 B9R1.15 C#CC1=C(F)C=CC=C1 X7110 [1,1,0,0,0,0|1,0,1]=4 442 B9R1.15 C=CC1=C(Cl)C=CC=C1 0459AB [1,1,0,0,0,0|1,0,0]=3 443 B9R1.15 C=CC1=CC=CC=C1F 7948AJ [1,1,0,0,0,0|1,0,0]=3 444 B9R1.15 C=CC1=CC=CC=C1N Y8954 [1,1,0,0,0,0|1,0,0]=3 445 B9R1.15 CC1=C(C=O)C=CC=N1 W7274 [1,1,0,0,0,0|1,0,0]=3 446 B9R1.15 CC1=C(C=O)C=CN=C1 Y9992 [1,1,0,0,0,0|1,0,0]=3 447 B9R1.15 CC1=C(CO)C=NC=C1 6388AB [1,1,0,0,0,0|1,0,1]=4 448 B9R1.15 CC1=C(CO)N=CC=C1 9578AB [1,1,0,0,0,0|1,0,1]=4 449 B9R1.15 CC1=CC=CN=C1C=O W6954 [1,1,0,0,0,0|1,0,0]=3 450 B9R1.15 CC1=NC=CN=C1C=O 2084AB [1,1,0,0,0,0|2,0,0]=4 451 B9R1.15 CCC1=CC=CC=C1Cl 2607AF [1,1,0,0,0,0|1,0,1]=4 452 B9R1.15 CNC1=CC=CC=C1Br V9809 [1,1,0,0,0,0|2,0,0]=4 453 B9R1.15 CNC1=CC=CC=C1C Z6802 [1,1,0,0,0,0|2,0,0]=4 454 B9R1.15 CNC1=CC=CC=C1Cl 7929AJ [1,1,0,0,0,0|2,0,0]=4 455 B9R1.15 CNC1=CC=CC=C1F Z7993 [1,1,0,0,0,0|2,0,0]=4 456 B9R1.15 CSC1=CC=CC=C1Cl L223 [1,1,0,0,0,0|2,0,0]=4 457 B9R1.15 NC1=C(C=O)C=CN=C1 W6929 [1,1,0,0,0,0|1,0,0]=3 458 B9R1.15 NC1=C(C=O)C=NC=N1 8310AA [1,1,0,0,0,0|2,0,0]=4 459 B9R1.15 NC1=C(CO)C=CN=C1 Z2696 [1,1,0,0,0,0|1,0,1]=4 460 B9R1.15 NC1=CC=NC=C1C=O W6220 [1,1,0,0,0,0|1,0,0]=3 461 B9R1.15 NC1=CC=NC=C1C=O W9562 [1,1,0,0,0,0|1,0,0]=3 462 B9R1.15 NCC1=C(I)C=CC=C1 5274AB [1,1,0,0,0,0|1,0,1]=4 463 B9R1.15 NNC1=C(Cl)C=CC=C1 2065AL [1,1,0,0,0,0|2,0,0]=4 464 B9R1.15 O=CC1=C(O)C=NC=C1 W3998 [1,1,0,0,0,0|1,0,0]=3 465 B9R1.15 O=CC1=NC=CN=C1Cl X0372 [1,1,0,0,0,0|2,0,0]=4 466 B9R1.15 OCC1=C(Br)C=NC=C1 W3202 [1,1,0,0,0,0|1,0,1]=4 467 B9R1.15 OCC1=C(Cl)C=CN=C1 Z4482 [1,1,0,0,0,0|1,0,1]=4 468 B9R1.15 OCC1=C(S)C=CC=C1 3883AE [1,1,0,0,0,0|0,0,1]=3 469 B9R1.15 OCC1=NC=CC=C1F W5329 [1,1,0,0,0,0|1,0,1]=4 470 B9R1.15 OCC1=NC=CC=C1O V3086 [1,1,0,0,0,0|1,0,1]=4 471 B9R1.11 CCC(=O)C1=CC=CN1 2175AL [0,1,0,0,1,0|2,0,0]=4 472 B9R1.11 COC(=O)C1=CC=NO1 W3292 [0,1,0,0,1,0|2,0,0]=4 473 B9R1.11 COC(=O)C1=CN=CN1 5358AA [0,1,0,0,1,0|2,0,0]=4 474 B9R1.11 COC(=O)C1=CN=CO1 Y7252 [0,1,0,0,1,0|2,0,0]=4 475 B9R1.11 COC(=O)C1=COC=N1 8746AA [0,1,0,0,1,0|2,0,0]=4 476 B9R1.11 COC(=O)C1=CSC=N1 Y5483 [0,1,0,0,1,0|2,0,0]=4 477 B9R1.11 COC(=O)C1=NC=CN1 W3783 [0,1,0,0,1,0|2,0,0]=4 478 B9R1.11 COC(=O)N1C=CC=C1 3202AE [0,1,0,0,1,0|1,0,0]=3 479 B9R1.11 CSC(=O)C1=CC=CO1 9771AJ [0,1,0,0,1,0|1,1,0]=4 480 B9R1.11 N=C(NO)C1=CC=CS1 Z3343 [0,1,0,0,1,0|2,0,0]=4 481 B9R1.11 O=C(CBr)C1=CC=CN1 Z2515 [0,1,0,0,1,0|2,0,0]=4 482 B9R1.11 O=C(CBr)C1=CC=CS1 Y6915 [0,1,0,0,1,0|2,0,0]=4 483 B9R1.35 CC(=O)C1=CSC(Br)=C1 W7213 [0,1,0,0,1,0|2,0,0]=4 484 B9R1.35 CC(=O)C1=CSC(Cl)=C1 Z0709 [0,1,0,0,1,0|2,0,0]=4 485 B9R1.35 CC1=CC(C(=O)O)=CO1 Y8297 [0,1,0,0,1,0|1,0,0]=3 486 B9R1.35 CC1=CC(C(=O)O)=CS1 Y8110 [0,1,0,0,1,0|1,0,0]=3 487 B9R1.35 CC1=CN=C(C(=O)O)S1 X0108 [0,1,0,0,1,0|2,0,0]=4 488 B9R1.35 CC1=CSC(C(=O)O)=C1 Z0185 [0,1,0,0,1,0|1,0,0]=3 489 B9R1.35 CC1=CSC(C(=O)O)=N1 X0105 [0,1,0,0,1,0|2,0,0]=4 490 B9R1.35 CC1=CSC(C(N)=O)=C1 Y4172 [0,1,0,0,1,0|2,0,0]=4 491 B9R1.35 CC1=NC(C(=O)O)=CN1 W3181 [0,1,0,0,1,0|2,0,0]=4 492 B9R1.35 CC1=NC(C(=O)O)=CO1 W4681 [0,1,0,0,1,0|2,0,0]=4 493 B9R1.35 CC1=NC(C(=O)O)=CS1 W5694 [0,1,0,0,1,0|2,0,0]=4 494 B9R1.35 CC1=NC=C(C(=O)O)O1 Y5240 [0,1,0,0,1,0|2,0,0]=4 495 B9R1.35 CN1C=CC(C(=O)O)=C1 W5804 [0,1,0,0,1,0|1,0,0]=3 496 B9R1.35 NC(=O)C1=CC(Br)=CN1 V4097 [0,1,0,0,1,0|2,0,0]=4 497 B9R1.35 NC(=O)C1=CC(Br)=CO1 6539AC [0,1,0,0,1,0|2,0,0]=4 498 B9R1.35 NC(=O)C1=CC(Br)=CS1 V7917 [0,1,0,0,1,0|2,0,0]=4 499 B9R1.35 NC(=O)C1=CC=C(Br)O1 6684AE [0,1,0,0,1,0|2,0,0]=4 500 B9R1.35 NC(=O)C1=CC=C(Br)S1 Z2951 [0,1,0,0,1,0|2,0,0]=4 501 B9R1.35 NC(=O)C1=CC=C(Cl)S1 7651AD [0,1,0,0,1,0|2,0,0]=4 502 B9R1.35 NC1=NNC(C(=O)O)=C1 4542AA [0,1,0,0,1,0|2,0,0]=4 503 B9R1.35 O=C(O)C1=CC(Br)=CO1 Z4623 [0,1,0,0,1,0|1,0,0]=3 504 B9R1.35 O=C(O)C1=CC(Br)=NO1 W7690 [0,1,0,0,1,0|2,0,0]=4 505 B9R1.35 O=C(O)C1=CC=C(F)S1 W6292 [0,1,0,0,1,0|1,0,0]=3 506 B9R1.35 O=C(O)C1=CC=C(I)S1 8970AB [0,1,0,0,1,0|1,0,0]=3 507 B9R1.35 O=C(O)C1=COC(Br)=C1 5491AJ [0,1,0,0,1,0|1,0,0]=3 508 B9R1.35 O=C(O)C1=COC(Br)=N1 Z3924 [0,1,0,0,1,0|2,0,0]=4 509 B9R1.35 O=C(O)C1=CSC(Br)=N1 W6688 [0,1,0,0,1,0|2,0,0]=4 510 B9R1.35 O=C(O)C1=CSC(Cl)=C1 W5762 [0,1,0,0,1,0|1,0,0]=3 511 B9R1.35 O=C(O)C1=CSC(Cl)=N1 W6687 [0,1,0,0,1,0|2,0,0]=4 512 B9R1.35 O=C(O)C1=NC=C(Br)S1 Y4853 [0,1,0,0,1,0|2,0,0]=4 513 B9R1.35 O=C(O)C1=NNC(Br)=C1 6022AA [0,1,0,0,1,0|2,0,0]=4 514 B9R1.35 O=C(O)C1=NNC(Cl)=C1 Y4463 [0,1,0,0,1,0|2,0,0]=4 515 B9R1.35 O=C(O)C1=NNC(O)=C1 4841AC [0,1,0,0,1,0|2,0,0]=4 516 B9R1.35 O=C1NC=C(C(=O)O)N1 V5719 [0,1,0,0,1,0|2,0,0]=4 517 B9R1.41 CC(=O)C1=C(N)SC=C1 9394AH [0,1,0,0,1,0|2,0,0]=4 518 B9R1.41 CC1=C(C(=O)O)C=CN1 4732AB [0,1,0,0,1,0|1,0,0]=3 519 B9R1.41 CC1=C(C(=O)O)C=CO1 Y9842 [0,1,0,0,1,0|1,0,0]=3 520 B9R1.41 CC1=C(C(=O)O)C=CS1 W4117 [0,1,0,0,1,0|1,0,0]=3 521 B9R1.41 CC1=C(C(=O)O)N=CO1 X8680 [0,1,0,0,1,0|2,0,0]=4 522 B9R1.41 CC1=C(C(=O)O)N=CS1 X8003 [0,1,0,0,1,0|2,0,0]=4 523 B9R1.41 CC1=CNN=C1C(=O)O 6212AJ [0,1,0,0,1,0|2,0,0]=4 524 B9R1.41 CC1=CSC=C1C(=O)O Z5123 [0,1,0,0,1,0|1,0,0]=3 525 B9R1.41 CC1=NSC=C1C(=O)O Y7681 [0,1,0,0,1,0|2,0,0]=4 526 B9R1.41 NC(=O)C1=C(Br)C=CS1 Z2703 [0,1,0,0,1,0|2,0,0]=4 527 B9R1.41 NC(=O)C1=C(Cl)C=CS1 Z2723 [0,1,0,0,1,0|2,0,0]=4 528 B9R1.41 NC(=O)C1=C(N)SC=C1 W3069 [0,1,0,0,1,0|2,0,0]=4 529 B9R1.41 NC(=O)C1=C(O)C=CS1 8373AB [0,1,0,0,1,0|2,0,0]=4 530 B9R1.41 NC(=O)C1=CC=CN1N W3458 [0,1,0,0,1,0|2,0,0]=4 531 B9R1.41 NC1=C(C(=O)O)SC=C1 V6581 [0,1,0,0,1,0|1,0,0]=3 532 B9R1.41 NC1=CNN=C1C(=O)O Y7141 [0,1,0,0,1,0|2,0,0]=4 533 B9R1.41 O=C(O)C1=C(Br)C=CO1 Z5464 [0,1,0,0,1,0|1,0,0]=3 534 B9R1.41 O=C(O)C1=C(Br)C=NN1 Z3880 [0,1,0,0,1,0|2,0,0]=4 535 B9R1.41 O=C(O)C1=C(Br)SC=N1 X8679 [0,1,0,0,1,0|2,0,0]=4 536 B9R1.41 O=C(O)C1=C(F)C=CS1 W5425 [0,1,0,0,1,0|1,0,0]=3 537 B9R1.41 O=C(O)C1=C(O)C=CS1 7114AB [0,1,0,0,1,0|1,0,0]=3 538 B9R1.41 O=C(O)C1=CSC=C1Br Y7756 [0,1,0,0,1,0|1,0,0]=3 539 B9R1.41 O=C(O)C1=NNC=C1Cl W8728 [0,1,0,0,1,0|2,0,0]=4 540 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 9287AB [0,1,0,0,0,1|1,0,0]=3 541 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 7126AD [0,1,0,0,0,1|1,0,0]=3 542 B11R1.20 CC(=O)CC1=CC=C(I)C=C1 1094AB [0,1,0,0,0,1|1,0,0]=3 543 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 Q226 [0,1,0,0,0,1|1,0,0]=3 544 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 9364AB [0,1,0,0,0,1|1,0,0]=3 545 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 W8064 [0,1,0,0,0,1|2,0,0]=4 546 B11R1.20 CC(=O)NC1=NC=C(F)C=C1 N473 [0,1,0,0,0,1|2,0,0]=4 547 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 Y9762 [0,1,0,0,0,1|2,0,0]=4 548 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 3597AB [0,1,0,0,0,1|1,0,0]=3 549 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 X3804 [0,1,0,0,0,1|1,0,0]=3 550 B11R1.20 FC(F)=CC1=CC=C(Br)C=C1 4778AL [0,1,0,0,0,1|2,0,0]=4 551 B11R1.20 FC1=CC=C(OC(=S)Cl)C=C1 6504AL [0,1,0,0,0,1|1,1,0]=4 552 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 1638AC [0,1,0,0,0,1|1,0,0]=3 553 B11R1.20 NC(=O)CC1=CC=C(Cl)C=C1 Y6115 [0,1,0,0,0,1|1,0,0]=3 554 B11R1.20 NC(=O)NC1=CC=C(Br)C=C1 6622AD [0,1,0,0,0,1|1,0,0]=3 555 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 V3810 [0,1,0,0,0,1|1,1,0]=4 556 B11R1.20 O=C(Cl)OC1=CC=C(Cl)C=C1 1997AC [0,1,0,0,0,1|1,0,0]=3 557 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 5630AH [0,1,0,0,0,1|0,0,0]=2 558 B11R1.20 O=C(O)CC1=NC=C(Br)C=N1 X9054 [0,1,0,0,0,1|2,0,0]=4 559 B11R1.36 C=C(B(O)O)C1=CC=CC=C1 V3410 [0,1,0,0,0,1|1,0,1]=4 560 B11R1.36 CC(=O)C(Br)C1=CC=CC=C1 U801 [0,1,0,0,0,1|1,0,0]=3 561 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Y8969 [0,1,0,0,0,1|1,0,0]=3 562 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 U170 [0,1,0,0,0,1|0,0,0]=2 563 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 0850AC [0,1,0,0,0,1|1,0,0]=3 564 B11R1.36 NC(=O)C(O)C1=CC=CC=C1 3705AE [0,1,0,0,0,1|1,0,0]=3 565 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 7117AH [0,1,0,0,0,1|1,0,0]=3 566 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 5421AJ [0,1,0,0,0,1|1,0,0]=3 567 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 6492AB [0,1,0,0,0,1|0,0,0]=2 568 B11R1.40 C=CC(=O)NC1=CC=CC=C1 1202AB [0,1,0,0,0,1|1,0,0]=3 569 B11R1.40 CC(CO)OC1=CC=CC=C1 5778AL [0,1,0,0,0,1|1,0,1]=4 570 B11R1.40 CNC(=O)CC1=CC=CC=C1 8080AE [0,1,0,0,0,1|1,0,0]=3 571 B11R1.40 COC(=O)CC1=CC=CN=C1 X5277 [0,1,0,0,0,1|1,0,0]=3 572 B11R1.40 COC(=O)CC1=CN=CC=N1 4720AB [0,1,0,0,0,1|2,0,0]=4 573 B11R1.40 COC(=O)CC1=NC=CC=N1 9043AB [0,1,0,0,0,1|2,0,0]=4 574 B11R1.40 NNC(=O)NC1=CC=CC=C1 5322AE [0,1,0,0,0,1|1,0,0]=3 575 B11R1.40 N\C(CC1=CC=CC=C1)=N/O 6479AD [0,1,0,0,0,1|1,0,0]=3 576 B11R1.40 O=C(CBr)NC1=CC=CC=C1 7553AB [0,1,0,0,0,1|1,0,0]=3 577 B11R1.40 O=C(CCl)NC1=CC=CC=C1 V6785 [0,1,0,0,0,1|1,0,0]=3 578 B11R1.40 O=C(CCl)NC1=NC=CC=C1 7349AB [0,1,0,0,0,1|2,0,0]=4 579 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 9403AJ [0,1,0,0,0,1|1,0,0]=3 580 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 0110AB [0,1,0,0,0,1|1,0,0]=3 581 B11R1.86 CC(=O)NC1=CC=CN=C1C Y5364 [0,1,0,0,0,1|2,0,0]=4 582 B11R1.86 CC(=O)OC1=C(Cl)C=CC=C1 5581AL [0,1,0,0,0,1|1,0,0]=3 583 B11R1.86 CC(=O)OC1=CC=CC=C1I 0334AE [0,1,0,0,0,1|1,0,0]=3 584 B11R1.86 N=C(N)NC1=C(Cl)C=CC=C1 7455AH [0,1,0,0,0,1|2,0,0]=4 585 B11R1.86 NC(=O)CC1=CC=CC=C1Br V7162 [0,1,0,0,0,1|1,0,0]=3 586 B11R1.86 NC(=O)CC1=CC=CC=C1Cl 5189AJ [0,1,0,0,0,1|1,0,0]=3 587 B11R1.86 NC(=O)NC1=CC=CC=C1Br 5783AA [0,1,0,0,0,1|1,0,0]=3 588 B11R1.86 O=C(O)CC1=CC=CN=C1Cl Y5005 [0,1,0,0,0,1|1,0,0]=3 589 B11R1.86 O=C(O)CN1C=CC=NC1=O 4217AF [0,1,0,0,0,1|2,0,0]=4 590 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 8966AA [0,1,0,0,0,1|1,0,0]=3 591 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 9330AB [0,1,0,0,0,1|1,0,0]=3 592 B11R1.157 CC(=O)NC1=CC(C)=NC=C1 Z2800 [0,1,0,0,0,1|2,0,0]=4 593 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 X9936 [0,1,0,0,0,1|2,0,0]=4 594 B11R1.157 CC(=O)NC1=CC=CC(N)=N1 1571AA [0,1,0,0,0,1|2,0,0]=4 595 B11R1.157 CC(=O)NC1=NC(Br)=CC=C1 V4683 [0,1,0,0,0,1|2,0,0]=4 596 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 Z6551 [0,1,0,0,0,1|2,0,0]=4 597 B11R1.157 CC(=O)NC1=NC=CC(C)=C1 Y9356 [0,1,0,0,0,1|2,0,0]=4 598 B11R1.157 CC(=O)NC1=NC=CC(Cl)=C1 Y6141 [0,1,0,0,0,1|2,0,0]=4 599 B11R1.157 CC(=O)OC1=CC=CC(Br)=C1 Z4634 [0,1,0,0,0,1|1,0,0]=3 600 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 W7149 [0,1,0,0,0,1|1,0,0]=3 601 B11R1.157 O=C(O)CC1=CC(Br)=NC=C1 Y5077 [0,1,0,0,0,1|1,0,0]=3 602 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 4909AB [0,1,0,0,0,1|1,0,0]=3 603 B11R1.157 O=C(O)CC1=NC(Br)=CC=C1 1843AA [0,1,0,0,0,1|1,0,0]=3 604 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 Z5259 [0,1,0,0,0,1|1,0,0]=3 605 B11R1.509 CS(=O)(=O)OC1=CC=CC=C1 8793AL [0,1,0,0,0,1|1,0,1]=4 606 B11R1.509 O=P([O-])([O-])OC1=CC=CC=C1 6617AH [0,1,0,0,0,1|1,0,1]=4 607 B11R1.3 C#CC1=CC=C(C(=O)[O-])C=C1 4378AD [0,2,0,0,0,0|0,0,1]=3 608 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 5524AD [0,2,0,0,0,0|2,0,0]=4 609 B11R1.3 C=CC1=CC=C(S(=O)[O-])C=C1 6707AL [0,2,0,0,0,0|1,0,1]=4 610 B11R1.3 C=CC1=CC=C([N+](=O)[O-])C=C1 Z2333 [0,2,0,0,0,0|1,0,1]=4 611 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 5611AH [0,2,0,0,0,0|1,1,0]=4 612 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 9791AL [0,2,0,0,0,0|1,0,0]=3 613 B11R1.3 CNC1=NC=C(C(=O)O)C=N1 7697AB [0,2,0,0,0,0|2,0,0]=4 614 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 7612AA [0,2,0,0,0,0|1,0,1]=4 615 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 7882AA [0,2,0,0,0,0|1,0,1]=4 616 B11R1.3 COC1=CN=C(C(=O)O)C=C1 X2006 [0,2,0,0,0,0|1,0,0]=3 617 B11R1.3 COC1=CN=C(C(C)=O)C=C1 V5184 [0,2,0,0,0,0|2,0,0]=4 618 B11R1.3 COC1=NN=C(C(=O)O)C=C1 Y9484 [0,2,0,0,0,0|2,0,0]=4 619 B11R1.3 CSC1=CC=C([N+](=O)[O-])C=C1 D347 [0,2,0,0,0,0|1,0,1]=4 620 B11R1.3 CSC1=NC=C(C(=O)O)C=N1 X8931 [0,2,0,0,0,0|2,0,0]=4 621 B11R1.3 N#CC1=CC=C(C(=N)N)C=C1 6152AJ [0,2,0,0,0,0|2,0,0]=4 622 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 3169AB [0,2,0,0,0,0|1,0,0]=3 623 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 6545AE [0,2,0,0,0,0|1,0,0]=3 624 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 2990AC [0,2,0,0,0,0|1,0,0]=3 625 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 X5512 [0,2,0,0,0,0|1,0,0]=3 626 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 K127 [0,2,0,0,0,0|1,0,1]=4 627 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 Z0369 [0,2,0,0,0,0|1,0,1]=4 628 B11R1.19 CC1=CC=C(P(=O)(O)O)C=C1 3952AB [0,2,0,0,0,0|1,0,0]=3 629 B11R1.19 CC1=CC=C(S(=O)(=O)F)C=C1 V6030 [0,2,0,0,0,0|1,0,1]=4 630 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 1016AA [0,2,0,0,0,0|1,0,0]=3 631 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 7009AA [0,2,0,0,0,0|1,0,0]=3 632 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 I689 [0,2,0,0,0,0|1,0,0]=3 633 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 X7028 [0,2,0,0,0,0|1,0,0]=3 634 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Z4677 [0,2,0,0,0,0|1,0,0]=3 635 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=N1 W6471 [0,2,0,0,0,0|2,0,0]=4 636 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 8584AL [0,2,0,0,0,0|1,0,1]=4 637 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 8878AL [0,2,0,0,0,0|1,0,1]=4 638 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 8900AL [0,2,0,0,0,0|1,0,1]=4 639 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 9125AL [0,2,0,0,0,0|1,0,1]=4 640 B11R1.19 CC1=CC=C(S(C)(=N)=O)C=C1 9070AJ [0,2,0,0,0,0|2,0,0]=4 641 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 W9850 [0,2,0,0,0,0|1,0,1]=4 642 B11R1.19 NC1=CC=C(S(=O)(=O)[O-])C=C1 P258 [0,2,0,0,0,0|1,0,1]=4 643 B11R1.19 NS(=O)(=O)C1=CC=C(Br)C=C1 R868 [0,2,0,0,0,0|1,0,1]=4 644 B11R1.19 O=S(=O)(F)C1=CC=C(Br)C=C1 V6199 [0,2,0,0,0,0|1,0,1]=4 645 B11R1.19 O=S(=O)(F)C1=CC=C(Cl)C=C1 0495AQ [0,2,0,0,0,0|1,0,1]=4 646 B11R1.19 O=S(=O)(O)C1=CC=C(S)C=C1 Z2885 [0,2,0,0,0,0|1,0,0]=3 647 B11R1.21 CC(=O)C1=CC(Br)=C(Cl)C=C1 V6556 [0,2,0,0,0,0|1,0,0]=3 648 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 8306AB [0,2,0,0,0,0|1,0,0]=3 649 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)N=C1 1001AD [0,2,0,0,0,0|2,0,0]=4 650 B11R1.21 CC(=O)C1=CC(Cl)=C(O)C=C1 2899AB [0,2,0,0,0,0|1,0,0]=3 651 B11R1.21 CC(=O)C1=CC=C(Br)C(C)=C1 V5550 [0,2,0,0,0,0|1,0,0]=3 652 B11R1.21 CC(=O)C1=CC=C(C)C(C)=C1 L433 [0,2,0,0,0,0|1,0,0]=3 653 B11R1.21 CC(=O)C1=CC=C(Cl)C(F)=C1 7623AA [0,2,0,0,0,0|1,0,0]=3 654 B11R1.21 CC(=O)C1=CC=C(Cl)C(N)=C1 V7793 [0,2,0,0,0,0|1,0,0]=3 655 B11R1.21 CC(=O)C1=CC=C(F)C(N)=C1 Z6029 [0,2,0,0,0,0|1,0,0]=3 656 B11R1.21 CC(=O)C1=CC=C(F)C(O)=C1 Z1157 [0,2,0,0,0,0|1,0,0]=3 657 B11R1.21 CC(=O)C1=CC=C(N)C(F)=C1 X8376 [0,2,0,0,0,0|1,0,0]=3 658 B11R1.21 CC(O)C1=CC(Cl)=C(Cl)C=C1 7334AA [0,2,0,0,0,0|1,0,1]=4 659 B11R1.21 CC(O)C1=CC(F)=C(F)C=C1 4919AJ [0,2,0,0,0,0|1,0,1]=4 660 B11R1.21 CC1=C(Cl)N=C(C(=O)O)C=C1 X9173 [0,2,0,0,0,0|1,0,0]=3 661 B11R1.21 CC1=C(Cl)N=CC(C(=O)O)=C1 Y9777 [0,2,0,0,0,0|1,0,0]=3 662 B11R1.21 CC1=C(F)C=C(C(=N)N)C=C1 5833AD [0,2,0,0,0,0|2,0,0]=4 663 B11R1.21 CC1=C(F)C=C(C(N)=O)C=C1 8761AA [0,2,0,0,0,0|1,0,0]=3 664 B11R1.21 CC1=C(F)C=CC(C(=O)O)=N1 0227AA [0,2,0,0,0,0|1,0,0]=3 665 B11R1.21 CC1=CC(B(O)O)=CC=C1Br Z0391 [0,2,0,0,0,0|1,0,1]=4 666 B11R1.21 CC1=CC(B(O)O)=CC=C1O X0988 [0,2,0,0,0,0|1,0,1]=4 667 B11R1.21 CC1=CC(C(=O)O)=CC=C1I W6695 [0,2,0,0,0,0|0,0,0]=2 668 B11R1.21 CC1=CC=C(B(O)O)C=C1O X0622 [0,2,0,0,0,0|1,0,1]=4 669 B11R1.21 CC1=CC=C(C(=N)N)C=C1C 2090AJ [0,2,0,0,0,0|2,0,0]=4 670 B11R1.21 CC1=CC=C(C(N)=O)C=C1C 5611AE [0,2,0,0,0,0|1,0,0]=3 671 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1I X6968 [0,2,0,0,0,0|1,0,1]=4 672 B11R1.21 CC1=NC(C(=O)O)=CC=C1Br Z0162 [0,2,0,0,0,0|1,0,0]=3 673 B11R1.21 CC1=NC(C(=O)O)=CNC1=O 2046AC [0,2,0,0,0,0|2,0,0]=4 674 B11R1.21 CC1=NC=C(C(=O)O)C=C1Br 3254AA [0,2,0,0,0,0|1,0,0]=3 675 B11R1.21 CC1=NC=C(C(=O)O)N=C1C 6284AA [0,2,0,0,0,0|2,0,0]=4 676 B11R1.21 CN1C=C(C(=O)O)C=CC1=O 4744AB [0,2,0,0,0,0|1,0,0]=3 677 B11R1.21 CN1C=CC(C(=O)O)=CC1=O 4035AB [0,2,0,0,0,0|1,0,0]=3 678 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 Y6979 [0,2,0,0,0,0|2,0,0]=4 679 B11R1.21 N=C(N)C1=CC=C(N)C(N)=C1 Z5036 [0,2,0,0,0,0|2,0,0]=4 680 B11R1.21 NC(=O)C1=CC(F)=C(Cl)C=C1 3859AC [0,2,0,0,0,0|1,0,0]=3 681 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 0685AF [0,2,0,0,0,0|1,0,0]=3 682 B11R1.21 NC(=O)C1=CC=C(Br)C(F)=C1 V7636 [0,2,0,0,0,0|1,0,0]=3 683 B11R1.21 NC(=O)C1=CC=C(F)C(Br)=C1 V6034 [0,2,0,0,0,0|1,0,0]=3 684 B11R1.21 NC(=O)C1=CC=C(F)C(Cl)=C1 Y9866 [0,2,0,0,0,0|1,0,0]=3 685 B11R1.21 NC(=S)C1=CC=C(Cl)C(Cl)=C1 7596AD [0,2,0,0,0,0|1,1,0]=4 686 B11R1.21 NC1=C(N)C=C([N+](=O)[O-])C=C1 0519AC [0,2,0,0,0,0|1,0,1]=4 687 B11R1.21 NC1=CC(B(O)O)=CC=C1Cl X2490 [0,2,0,0,0,0|1,0,1]=4 688 B11R1.21 NC1=CC(C(=O)O)=CC=C1F X2787 [0,2,0,0,0,0|0,0,0]=2 689 B11R1.21 NC1=CC=C(C(=O)O)C=C1I W4421 [0,2,0,0,0,0|0,0,0]=2 690 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1N 6627AL [0,2,0,0,0,0|1,0,1]=4 691 B11R1.21 NC1=NC=C(C(=O)O)C=C1Br W3918 [0,2,0,0,0,0|1,0,0]=3 692 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 5955AB [0,2,0,0,0,0|1,0,0]=3 693 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 9297AB [0,2,0,0,0,0|0,0,0]=2 694 B11R1.21 O=C(O)C1=CC(F)=C(Cl)N=C1 Y8936 [0,2,0,0,0,0|1,0,0]=3 695 B11R1.21 O=C(O)C1=CC(I)=C(O)C=C1 4787AB [0,2,0,0,0,0|0,0,0]=2 696 B11R1.21 O=C(O)C1=CC=C(Cl)C(=O)N1 0937AA [0,2,0,0,0,0|1,0,0]=3 697 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=N1 3423AC [0,2,0,0,0,0|1,0,0]=3 698 B11R1.21 O=C(O)C1=CC=C(I)C(Br)=C1 Z4496 [0,2,0,0,0,0|0,0,0]=2 699 B11R1.21 O=C(O)C1=CN=C(F)C(Br)=C1 Z4560 [0,2,0,0,0,0|1,0,0]=3 700 B11R1.21 O=C(O)C1=NC(Br)=C(Br)C=C1 W5183 [0,2,0,0,0,0|1,0,0]=3 701 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 Z3847 [0,2,0,0,0,0|1,0,0]=3 702 B11R1.21 O=C(O)C1=NC(Cl)=C(Br)C=C1 6719AC [0,2,0,0,0,0|1,0,0]=3 703 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 Z5279 [0,2,0,0,0,0|1,0,0]=3 704 B11R1.21 O=C(O)C1=NC(O)=C(Br)C=C1 X9492 [0,2,0,0,0,0|1,0,0]=3 705 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(I)C=C1 5675AB [0,2,0,0,0,0|1,0,1]=4 706 B11R1.21 O=[N+]([O-])C1=CC(I)=C(Cl)C=C1 1578AC [0,2,0,0,0,0|1,0,1]=4 707 B11R1.21 O=[N+]([O-])C1=CC=C(I)C(Br)=C1 V7447 [0,2,0,0,0,0|1,0,1]=4 708 B11R1.21 O=[N+]([O-])C1=CC=C(I)C(F)=C1 X3080 [0,2,0,0,0,0|1,0,1]=4 709 B11R1.21 O=[N+]([O-])C1=CC=C(I)C(O)=C1 0160AB [0,2,0,0,0,0|1,0,1]=4 710 B11R1.21 O=[N+]([O-])C1=CC=C(O)C(I)=C1 X6896 [0,2,0,0,0,0|1,0,1]=4 711 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 X1338 [0,2,0,0,0,0|1,0,1]=4 712 B11R1.21 OB(O)C1=CC=C(Br)C(Cl)=C1 Y3860 [0,2,0,0,0,0|1,0,1]=4 713 B11R1.21 OB(O)C1=CC=C(Br)C(F)=C1 X0757 [0,2,0,0,0,0|1,0,1]=4 714 B11R1.21 OB(O)C1=CC=C(Cl)C(O)=C1 V9085 [0,2,0,0,0,0|1,0,1]=4 715 B11R1.21 OB(O)C1=CC=C(F)C(Br)=C1 Z7247 [0,2,0,0,0,0|1,0,1]=4 716 B11R1.21 OB(O)C1=CC=C(F)C(O)=C1 V1915 [0,2,0,0,0,0|1,0,1]=4 717 B11R1.22 CC1=CC=C(C(=O)C#N)C=C1 5639AH [0,2,0,0,0,0|1,0,0]=3 718 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 Z5095 [0,2,0,0,0,0|0,0,1]=3 719 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 1635AE [0,2,0,0,0,0|1,0,0]=3 720 B11R1.22 CC1=CC=C(\C(N)=N/O)C=C1 9986AA [0,2,0,0,0,0|1,0,0]=3 721 B11R1.22 CNC(=O)C1=CC=C(Cl)N=C1 5281AE [0,2,0,0,0,0|2,0,0]=4 722 B11R1.22 COC(=O)C1=CC=[N+]([O-])C=C1 4844AB [0,2,0,0,0,0|1,0,0]=3 723 B11R1.22 COC(=O)C1=CN=C(O)C=C1 W7719 [0,2,0,0,0,0|1,0,0]=3 724 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 W9246 [0,2,0,0,0,0|2,0,0]=4 725 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 W4394 [0,2,0,0,0,0|2,0,0]=4 726 B11R1.22 COC(=O)C1=NC=C(C)C=C1 W5212 [0,2,0,0,0,0|1,0,0]=3 727 B11R1.22 COC(=O)C1=NC=C(F)C=C1 Z7177 [0,2,0,0,0,0|1,0,0]=3 728 B11R1.22 COC(=O)C1=NC=C(N)C=C1 W7797 [0,2,0,0,0,0|1,0,0]=3 729 B11R1.22 COC(=O)C1=NC=C(N)N=C1 W3046 [0,2,0,0,0,0|2,0,0]=4 730 B11R1.22 COC(=O)C1=NC=C(O)C=C1 W5304 [0,2,0,0,0,0|1,0,0]=3 731 B11R1.22 COC(=O)C1=NC=C(O)N=C1 W3047 [0,2,0,0,0,0|2,0,0]=4 732 B11R1.22 COC(=O)C1=NN=C(C)C=C1 1449AA [0,2,0,0,0,0|2,0,0]=4 733 B11R1.22 COC(=O)C1=NN=C(Cl)C=C1 W7653 [0,2,0,0,0,0|2,0,0]=4 734 B11R1.22 COC(=O)C1=NN=C(N)C=C1 V9902 [0,2,0,0,0,0|2,0,0]=4 735 B11R1.22 COC(=O)C1=NNC(=O)C=C1 W7503 [0,2,0,0,0,0|2,0,0]=4 736 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 6535AL [0,2,0,0,0,0|1,0,0]=3 737 B11R1.22 N#CC(=O)C1=CC=C(Cl)C=C1 5602AH [0,2,0,0,0,0|1,0,0]=3 738 B11R1.22 N=C(NO)C1=CC=C(N)N=C1 1482AH [0,2,0,0,0,0|2,0,0]=4 739 B11R1.22 N=C(NO)C1=CC=[N+]([O-])C=C1 3747AL [0,2,0,0,0,0|2,0,0]=4 740 B11R1.22 NC(=NO)C1=CN=C(Cl)C=C1 4043AE [0,2,0,0,0,0|2,0,0]=4 741 B11R1.22 NC(CO)C1=CC=C(F)C=C1 4163AD [0,2,0,0,0,0|1,0,1]=4 742 B11R1.22 NC1=CC=C(\C(N)=N\O)C=C1 V4875 [0,2,0,0,0,0|1,0,0]=3 743 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 Y5103 [0,2,0,0,0,0|1,0,0]=3 744 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 L165 [0,2,0,0,0,0|1,0,0]=3 745 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 W8329 [0,2,0,0,0,0|1,0,0]=3 746 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 X8275 [0,2,0,0,0,0|1,0,0]=3 747 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 X6772 [0,2,0,0,0,0|1,0,1]=4 748 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 7597AD [0,2,0,0,0,0|1,0,0]=3 749 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 0082AE [0,2,0,0,0,0|1,0,0]=3 750 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 5413AB [0,2,0,0,0,0|0,0,0]=2 751 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 Z3623 [0,2,0,0,0,0|0,0,1]=3 752 B11R1.22 OC(CCl)C1=CC=C(Cl)C=C1 2026AL [0,2,0,0,0,0|1,0,1]=4 753 B11R1.166 CC(=O)C1=C(Br)C=C(Br)C=C1 3856AB [0,2,0,0,0,0|1,0,0]=3 754 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 2758AC [0,2,0,0,0,0|1,0,0]=3 755 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 2994AB [0,2,0,0,0,0|1,0,0]=3 756 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 4310AA [0,2,0,0,0,0|1,0,0]=3 757 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 0678AC [0,2,0,0,0,0|1,0,0]=3 758 B11R1.166 CC(=O)C1=CC=C(C)C=C1O Y9837 [0,2,0,0,0,0|1,0,0]=3 759 B11R1.166 CC(=O)C1=CC=C(F)C=C1Br Z6300 [0,2,0,0,0,0|1,0,0]=3 760 B11R1.166 CC(=O)C1=CC=C(F)C=C1C X8299 [0,2,0,0,0,0|1,0,0]=3 761 B11R1.166 CC(=O)C1=CC=C(F)N=C1F 5538AC [0,2,0,0,0,0|2,0,0]=4 762 B11R1.166 CC(=O)C1=CC=C(N)C=C1F Y7069 [0,2,0,0,0,0|1,0,0]=3 763 B11R1.166 CC(=O)C1=CC=C(N)C=C1O W4814 [0,2,0,0,0,0|1,0,0]=3 764 B11R1.166 CC(=O)C1=CC=C(O)C=C1Br W7388 [0,2,0,0,0,0|1,0,0]=3 765 B11R1.166 CC(=O)C1=NC=C(F)C=C1F 1576AA [0,2,0,0,0,0|2,0,0]=4 766 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 Y6583 [0,2,0,0,0,0|1,0,0]=3 767 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 V1675 [0,2,0,0,0,0|1,0,0]=3 768 B11R1.166 CC1=C(C(=O)O)C=NC(Cl)=C1 Y9253 [0,2,0,0,0,0|1,0,0]=3 769 B11R1.166 CC1=C(C(=O)O)C=NC(F)=C1 Y4793 [0,2,0,0,0,0|1,0,0]=3 770 B11R1.166 CC1=CC(Br)=CC=C1B(O)O X0634 [0,2,0,0,0,0|1,0,1]=4 771 B11R1.166 CC1=CC(Br)=CC=C1[N+](=O)[O-] W6725 [0,2,0,0,0,0|1,0,1]=4 772 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 Y8311 [0,2,0,0,0,0|1,0,0]=3 773 B11R1.166 CC1=CC(Cl)=CN=C1C(=O)O W9131 [0,2,0,0,0,0|1,0,0]=3 774 B11R1.166 CC1=CC(N)=NC=C1C(=O)O 9417AA [0,2,0,0,0,0|1,0,0]=3 775 B11R1.166 CC1=CC=C(C(=N)N)C(Cl)=C1 1657AJ [0,2,0,0,0,0|2,0,0]=4 776 B11R1.166 CC1=CC=C(C(=O)O)C(C)=N1 8698AB [0,2,0,0,0,0|1,0,0]=3 777 B11R1.166 CC1=CC=C(C(=O)O)C(N)=N1 3156AH [0,2,0,0,0,0|1,0,0]=3 778 B11R1.166 CC1=CC=C(C(N)=O)C(O)=C1 V1241 [0,2,0,0,0,0|1,0,0]=3 779 B11R1.166 CC1=CN=C(C(=O)O)C(Br)=C1 X9475 [0,2,0,0,0,0|1,0,0]=3 780 B11R1.166 CC1=NC(Br)=CC=C1C(=O)O Y3603 [0,2,0,0,0,0|1,0,0]=3 781 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 1550AC [0,2,0,0,0,0|2,0,0]=4 782 B11R1.166 N=C(N)C1=C(F)C=C(F)C=C1 1881AF [0,2,0,0,0,0|2,0,0]=4 783 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl 4921AH [0,2,0,0,0,0|2,0,0]=4 784 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 1045AA [0,2,0,0,0,0|1,0,0]=3 785 B11R1.166 NC(=O)C1=C(F)C=C(Cl)C=C1 0977AA [0,2,0,0,0,0|1,0,0]=3 786 B11R1.166 NC(=O)C1=CC=C(Br)C=C1N Y7066 [0,2,0,0,0,0|1,0,0]=3 787 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1Cl I649 [0,2,0,0,0,0|1,0,0]=3 788 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1N 9852AB [0,2,0,0,0,0|2,0,0]=4 789 B11R1.166 NC(=O)C1=CC=C(F)C=C1Cl N615 [0,2,0,0,0,0|1,0,0]=3 790 B11R1.166 NC(=O)C1=CC=C(F)C=C1N Z3951 [0,2,0,0,0,0|1,0,0]=3 791 B11R1.166 NC(=O)C1=CC=C(N)C=C1F 2625AJ [0,2,0,0,0,0|1,0,0]=3 792 B11R1.166 NC(=O)C1=CC=C(N)C=C1O 8918AB [0,2,0,0,0,0|1,0,0]=3 793 B11R1.166 NC(=S)C1=C(Cl)C=C(Cl)C=C1 2662AB [0,2,0,0,0,0|1,1,0]=4 794 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=N1 X9391 [0,2,0,0,0,0|1,0,0]=3 795 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=N1 W7166 [0,2,0,0,0,0|1,0,0]=3 796 B11R1.166 NC1=C(C(=O)O)C=NC(=O)N1 4638AB [0,2,0,0,0,0|2,0,0]=4 797 B11R1.166 NC1=C(C(=O)O)C=NC(Cl)=C1 1373AA [0,2,0,0,0,0|1,0,0]=3 798 B11R1.166 NC1=CC(I)=CC=C1C(=O)O W4360 [0,2,0,0,0,0|0,0,0]=2 799 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 R830 [0,2,0,0,0,0|0,0,0]=2 800 B11R1.166 NC1=CC(O)=C(C(=O)[O-])C=C1 6048AA [0,2,0,0,0,0|0,0,1]=3 801 B11R1.166 NC1=CC(O)=CC=C1C(=O)O X8023 [0,2,0,0,0,0|0,0,0]=2 802 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 P262 [0,2,0,0,0,0|0,0,1]=3 803 B11R1.166 NC1=CC=C([N+](=O)[O-])C(N)=C1 F769 [0,2,0,0,0,0|1,0,1]=4 804 B11R1.166 NC1=NC(Cl)=NC=C1C(=O)O 2075AC [0,2,0,0,0,0|2,0,0]=4 805 B11R1.166 NC1=NC=C(C(=O)O)C(N)=N1 Z2443 [0,2,0,0,0,0|2,0,0]=4 806 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=N1 9274AB [0,2,0,0,0,0|1,0,0]=3 807 B11R1.166 O=C(O)C1=C(Br)C=C(Br)N=C1 1337AC [0,2,0,0,0,0|1,0,0]=3 808 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 5021AH [0,2,0,0,0,0|0,0,0]=2 809 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 Z3983 [0,2,0,0,0,0|1,0,0]=3 810 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br W6933 [0,2,0,0,0,0|1,0,0]=3 811 B11R1.166 O=C(O)C1=CC=C(Br)N=C1F Z8316 [0,2,0,0,0,0|1,0,0]=3 812 B11R1.166 O=C(O)C1=CN=C(Cl)N=C1Cl X2143 [0,2,0,0,0,0|2,0,0]=4 813 B11R1.166 O=C(O)C1=CN=C(O)C=C1Cl Z5074 [0,2,0,0,0,0|1,0,0]=3 814 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F Y9776 [0,2,0,0,0,0|1,0,0]=3 815 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl Y8676 [0,2,0,0,0,0|2,0,0]=4 816 B11R1.166 O=C(O)C1=NC=C(F)C=C1Br Y7202 [0,2,0,0,0,0|1,0,0]=3 817 B11R1.166 O=[N+]([O-])C1=C(O)C=C(O)C=C1 3437AB [0,2,0,0,0,0|1,0,1]=4 818 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)C=C1Br W7568 [0,2,0,0,0,0|1,0,1]=4 819 B11R1.166 O=[N+]([O-])C1=CC=C(I)C=C1F V5003 [0,2,0,0,0,0|1,0,1]=4 820 B11R1.166 O=[N+]([O-])C1=CC=C(O)C=C1Br Z4867 [0,2,0,0,0,0|1,0,1]=4 821 B11R1.166 OB(O)C1=CC=C(Br)C=C1Cl Y3588 [0,2,0,0,0,0|1,0,1]=4 822 B11R1.166 OB(O)C1=CC=C(Br)C=C1F X0626 [0,2,0,0,0,0|1,0,1]=4 823 B11R1.166 OB(O)C1=CC=C(Cl)C=C1Br Z1311 [0,2,0,0,0,0|1,0,1]=4 824 B11R1.166 OB(O)C1=CC=C(Cl)C=C1O Z8731 [0,2,0,0,0,0|1,0,1]=4 825 B11R1.166 OB(O)C1=CC=C(F)C=C1Br Y3859 [0,2,0,0,0,0|1,0,1]=4 826 B11R1.166 OB(O)C1=CC=C(F)C=C1O V1926 [0,2,0,0,0,0|1,0,1]=4 827 B11R1.166 OB(O)C1=CC=C(O)C=C1Cl X0991 [0,2,0,0,0,0|1,0,1]=4 828 B11R1.7 C#CC(C)(O)C1=CC=CC=C1 X7093 [0,2,0,0,0,0|1,0,1]=4 829 B11R1.7 CC(C)(CO)C1=CC=CC=C1 1041AB [0,2,0,0,0,0|1,0,1]=4 830 B11R1.7 CCS(=N)(=O)C1=CC=CC=C1 9057AJ [0,2,0,0,0,0|2,0,0]=4 831 B11R1.7 O=S(=O)(CF)C1=CC=CC=C1 0643AB [0,2,0,0,0,0|1,0,1]=4 832 B11R1.7 O=S(=O)(NO)C1=CC=CC=C1 7672AF [0,2,0,0,0,0|1,0,0]=3 833 B11R1.12 CCN(N=O)C1=CC=CC=C1 8933AJ [0,2,0,0,0,0|2,0,0]=4 834 B11R1.12 CO[C@@H](CO)C1=CC=CC=C1 9242AA [0,2,0,0,0,0|0,0,2]=4 835 B11R1.12 N#CC(C=O)C1=CC=CC=C1 6061AE [0,2,0,0,0,0|1,0,1]=4 836 B11R1.16 C=CCC(O)C1=CC=CC=C1 4955AL [0,2,0,0,0,0|1,0,1]=4 837 B11R1.16 CCCC(=O)C1=CC=NC=C1 8728AA [0,2,0,0,0,0|2,0,0]=4 838 B11R1.16 CCCC(=O)C1=CN=CC=C1 8727AA [0,2,0,0,0,0|2,0,0]=4 839 B11R1.16 CCCC(=O)C1=NC=CC=C1 V4534 [0,2,0,0,0,0|2,0,0]=4 840 B11R1.16 CCCC(O)C1=CC=CC=C1 4946AL [0,2,0,0,0,0|1,0,1]=4 841 B11R1.16 CCNC(=O)C1=CC=CN=C1 8551AL [0,2,0,0,0,0|2,0,0]=4 842 B11R1.16 CCOC(=O)C1=CC=NC=N1 X0336 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.16 CCOC(=O)C1=NC=CN=C1 X5895 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.16 CCO[P+](=O)C1=CC=CC=C1 1965AB [0,2,0,0,0,0|1,0,0]=3 845 B11R1.16 CNCC(O)C1=CC=CC=C1 7554AE [0,2,0,0,0,0|1,0,1]=4 846 B11R1.16 CNOC(=O)C1=CC=CC=C1 8702AL [0,2,0,0,0,0|0,0,0]=2 847 B11R1.16 N#CCC(=O)C1=CC=CN=C1 W5295 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.16 N#CCC(=O)C1=CC=NC=C1 W4748 [0,2,0,0,0,0|2,0,0]=4 849 B11R1.16 N#CCC(=O)C1=NC=CC=C1 V6511 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.16 N#CCC(O)C1=CC=CC=C1 5339AH [0,2,0,0,0,0|1,0,1]=4 851 B11R1.16 N#C\C=C(/Cl)C1=CC=CC=C1 5314AH [0,2,0,0,0,0|2,0,0]=4 852 B11R1.16 NCCC(O)C1=CC=CC=C1 6964AB [0,2,0,0,0,0|1,0,1]=4 853 B11R1.23 CC1=CC(\C(N)=N\O)=CC=C1 2551AE [0,2,0,0,0,0|1,0,0]=3 854 B11R1.23 CCC(=O)C1=CC(C)=CC=C1 7236AB [0,2,0,0,0,0|1,0,0]=3 855 B11R1.23 CNC(=O)C1=CC(Cl)=NC=C1 Z9574 [0,2,0,0,0,0|2,0,0]=4 856 B11R1.23 CNC(=O)C1=CC=CC(Br)=C1 V6197 [0,2,0,0,0,0|1,0,0]=3 857 B11R1.23 CNC(=O)C1=CC=CC(F)=C1 V7378 [0,2,0,0,0,0|1,0,0]=3 858 B11R1.23 COC(=O)C1=CC(=O)NC=C1 W9272 [0,2,0,0,0,0|1,0,0]=3 859 B11R1.23 COC(=O)C1=CC(C)=CC=N1 6274AA [0,2,0,0,0,0|1,0,0]=3 860 B11R1.23 COC(=O)C1=CC(C)=NC=C1 8594AA [0,2,0,0,0,0|1,0,0]=3 861 B11R1.23 COC(=O)C1=CC(C)=NC=N1 1480AC [0,2,0,0,0,0|2,0,0]=4 862 B11R1.23 COC(=O)C1=CC(F)=NC=C1 Z6058 [0,2,0,0,0,0|1,0,0]=3 863 B11R1.23 COC(=O)C1=CC(I)=NC=C1 Z9814 [0,2,0,0,0,0|1,0,0]=3 864 B11R1.23 COC(=O)C1=CC(O)=NC=N1 7127AJ [0,2,0,0,0,0|2,0,0]=4 865 B11R1.23 COC(=O)C1=CC=CC(N)=C1 3819AC [0,2,0,0,0,0|0,0,0]=2 866 B11R1.23 COC(=O)C1=CC=C[N+]([O-])=C1 5036AD [0,2,0,0,0,0|1,0,0]=3 867 B11R1.23 COC(=O)C1=CN=CC(F)=C1 V6033 [0,2,0,0,0,0|1,0,0]=3 868 B11R1.23 COC(=O)C1=CN=CC(N)=C1 4299AJ [0,2,0,0,0,0|1,0,0]=3 869 B11R1.23 COC(=O)C1=NC(=O)NC=C1 6326AC [0,2,0,0,0,0|2,0,0]=4 870 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 W6055 [0,2,0,0,0,0|2,0,0]=4 871 B11R1.23 COC(=O)C1=NC(Br)=NC=C1 3663AA [0,2,0,0,0,0|2,0,0]=4 872 B11R1.23 COC(=O)C1=NC(C)=CN=C1 7130AJ [0,2,0,0,0,0|2,0,0]=4 873 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 W3275 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.23 COC(=O)C1=NC(N)=CN=C1 X9326 [0,2,0,0,0,0|2,0,0]=4 875 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 W3865 [0,2,0,0,0,0|1,0,0]=3 876 B11R1.23 COC(=O)C1=NC=CC(F)=C1 V8670 [0,2,0,0,0,0|1,0,0]=3 877 B11R1.23 COC(=O)C1=NC=CC(I)=C1 V5601 [0,2,0,0,0,0|1,0,0]=3 878 B11R1.23 COC(=O)C1=NC=CC(O)=C1 V6083 [0,2,0,0,0,0|1,0,0]=3 879 B11R1.23 N#CC(=O)C1=CC(Br)=CC=C1 5306AH [0,2,0,0,0,0|1,0,0]=3 880 B11R1.23 N#CC(=O)C1=CC=CC(Cl)=C1 5318AH [0,2,0,0,0,0|1,0,0]=3 881 B11R1.23 NC1=CC(\C(N)=N\O)=CC=C1 2356AL [0,2,0,0,0,0|1,0,0]=3 882 B11R1.23 NNC(=O)C1=CC(Br)=NC=C1 V4994 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.23 NNC(=O)C1=CC(N)=NC=C1 Z2507 [0,2,0,0,0,0|2,0,0]=4 884 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 8613AB [0,2,0,0,0,0|1,0,0]=3 885 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 8613AC [0,2,0,0,0,0|1,0,0]=3 886 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 V6203 [0,2,0,0,0,0|1,0,0]=3 887 B11R1.23 NNC(=O)C1=CC=CC(I)=C1 2340AE [0,2,0,0,0,0|1,0,0]=3 888 B11R1.23 NNC(=O)C1=NC=CC(Cl)=C1 Z2867 [0,2,0,0,0,0|2,0,0]=4 889 B11R1.23 N\C(=N/O)C1=CC(F)=CC=C1 5430AE [0,2,0,0,0,0|1,0,0]=3 890 B11R1.23 N\C(N=O)=C1/C=CNC(Cl)=C1 0861AF [0,2,0,0,0,0|2,0,0]=4 891 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 Y1217 [0,2,0,0,0,0|1,0,0]=3 892 B11R1.23 O=CC(=O)C1=CC=CC(F)=C1 Y7249 [0,2,0,0,0,0|0,0,1]=3 893 B11R1.222 CC1=CC=CC=C1N(C)C=O 8371AL [0,2,0,0,0,0|2,0,0]=4 894 B11R1.222 CCC(=O)C1=CC=CC=C1C V4211 [0,2,0,0,0,0|1,0,0]=3 895 B11R1.222 CCC(=O)C1=CC=CC=C1Cl Z4973 [0,2,0,0,0,0|1,0,0]=3 896 B11R1.222 CNC(=O)C1=C(F)C=CC=C1 2080AL [0,2,0,0,0,0|1,0,0]=3 897 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 5571AJ [0,2,0,0,0,0|1,0,0]=3 898 B11R1.222 CNC(=O)C1=C(O)C=CC=N1 2289AJ [0,2,0,0,0,0|2,0,0]=4 899 B11R1.222 CNC(=O)C1=CC=CC=C1S 0033AP [0,2,0,0,0,0|1,0,0]=3 900 B11R1.222 CNC(=O)C1=CC=CN=C1Cl 5008AE [0,2,0,0,0,0|2,0,0]=4 901 B11R1.222 CNC(=O)C1=CC=CN=C1N 3745AC [0,2,0,0,0,0|2,0,0]=4 902 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 Y3316 [0,2,0,0,0,0|1,0,0]=3 903 B11R1.222 COC(=O)C1=C(F)C=NC=C1 Y3317 [0,2,0,0,0,0|1,0,0]=3 904 B11R1.222 COC(=O)C1=C(I)C=NC=C1 W4067 [0,2,0,0,0,0|1,0,0]=3 905 B11R1.222 COC(=O)C1=C(I)N=CC=C1 V9048 [0,2,0,0,0,0|1,0,0]=3 906 B11R1.222 COC(=O)C1=C(N)N=CN=C1 W8049 [0,2,0,0,0,0|2,0,0]=4 907 B11R1.222 COC(=O)C1=C(O)C=NC=C1 X8555 [0,2,0,0,0,0|1,0,0]=3 908 B11R1.222 COC(=O)C1=C(O)N=CC=C1 W7787 [0,2,0,0,0,0|1,0,0]=3 909 B11R1.222 COC(=O)C1=CC=CN=C1Br Z0661 [0,2,0,0,0,0|1,0,0]=3 910 B11R1.222 COC(=O)C1=CC=COC1=O 8572AD [0,2,0,0,0,0|1,0,0]=3 911 B11R1.222 COC(=O)C1=CN=CC=C1C X4936 [0,2,0,0,0,0|1,0,0]=3 912 B11R1.222 COC(=O)C1=NC=CC=C1Br X8327 [0,2,0,0,0,0|1,0,0]=3 913 B11R1.222 COC(=O)C1=NC=CC=C1F V8242 [0,2,0,0,0,0|1,0,0]=3 914 B11R1.222 COC(=O)C1=NC=CC=C1N W5753 [0,2,0,0,0,0|1,0,0]=3 915 B11R1.222 COC(=O)C1=NC=CN=C1C Z4722 [0,2,0,0,0,0|2,0,0]=4 916 B11R1.222 C\C(NO)=C1\C=CC=CC1=O 0747AD [0,2,0,0,0,0|1,0,0]=3 917 B11R1.222 N#CC(=O)C1=C(Cl)C=CC=C1 1673AJ [0,2,0,0,0,0|1,0,0]=3 918 B11R1.222 N#CC(=O)C1=CC=CC=C1F V7828 [0,2,0,0,0,0|1,0,0]=3 919 B11R1.222 N#CC(O)C1=C(Cl)C=CC=C1 6052AA [0,2,0,0,0,0|1,0,1]=4 920 B11R1.222 NCC(=O)C1=CC=CC=C1F W9587 [0,2,0,0,0,0|1,0,0]=3 921 B11R1.222 NNC(=O)C1=CC=CC=C1Br 9319AD [0,2,0,0,0,0|1,0,0]=3 922 B11R1.222 O=C(CBr)C1=CC=CC=C1F V7141 [0,2,0,0,0,0|1,0,0]=3 923 B11R1.222 OC[C@@H](O)C1=CC=CC=C1Cl X3149 [0,2,0,0,0,0|0,0,2]=4 924 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 0975AC [0,2,0,0,0,0|1,0,1]=4 925 B11R1.87 CC(C)(O)C1=C(I)C=CC=C1 0699AC [0,2,0,0,0,0|1,0,1]=4 926 B11R1.87 CC(C)(O)C1=C(N)C=CC=C1 4989AD [0,2,0,0,0,0|1,0,1]=4 927 B11R1.87 CC1=C(S(=O)(=O)O)C=NC=C1 6590AB [0,2,0,0,0,0|2,0,0]=4 928 B11R1.87 CP(C)(=O)C1=CC=CC=C1N Z3963 [0,2,0,0,0,0|2,0,0]=4 929 B11R1.87 CS(=O)(=O)C1=CC=CC=C1Br V5288 [0,2,0,0,0,0|1,0,1]=4 930 B11R1.87 CS(=O)(=O)C1=CC=CC=C1F 0033AC [0,2,0,0,0,0|1,0,1]=4 931 B11R1.87 NC1=CC=CC=C1[As](=O)(O)O Z3707 [0,2,0,0,0,0|1,0,0]=3 932 B11R1.87 O=S(=O)(F)C1=CC=CC=C1Br 0559AQ [0,2,0,0,0,0|1,0,1]=4 933 B11R1.87 O=S(=O)(O)C1=CC=CC=C1I X0186 [0,2,0,0,0,0|1,0,0]=3 934 B11R1.87 O=S(=O)([O-])C1=CC=CC=C1I 8973AL [0,2,0,0,0,0|1,0,1]=4 935 B11R1.155 CC(C)(O)C1=CC=CC(Br)=C1 Y8665 [0,2,0,0,0,0|1,0,1]=4 936 B11R1.155 CC1=CC(S(=O)(=O)O)=CN=C1 6589AB [0,2,0,0,0,0|2,0,0]=4 937 B11R1.155 CS(=O)(=O)C1=CC=CC(Cl)=C1 5861AJ [0,2,0,0,0,0|1,0,1]=4 938 B11R1.155 NS(=O)(=O)C1=CC(Cl)=CC=C1 8888AA [0,2,0,0,0,0|1,0,1]=4 939 B11R1.155 O=S(=O)(F)C1=CC(Cl)=CC=C1 0475AQ [0,2,0,0,0,0|1,0,1]=4 940 B11R1.155 O=S(=O)(O)C1=CC=CC(Br)=C1 Z2705 [0,2,0,0,0,0|1,0,0]=3 941 B11R1.155 O=S(=O)([O-])C1=CC=CC(O)=C1 3822AL [0,2,0,0,0,0|1,0,1]=4 942 B11R1.53 C#CC1=CC=CC=C1C(=O)O X5254 [0,2,0,0,0,0|0,0,0]=2 943 B11R1.53 C#CC1=CC=CC=C1[N+](=O)[O-] 8348AA [0,2,0,0,0,0|1,0,1]=4 944 B11R1.53 CCC1=NC=CC=C1C(=O)O 4086AB [0,2,0,0,0,0|1,0,0]=3 945 B11R1.53 CNC1=C(C(N)=O)C=CC=C1 1673AC [0,2,0,0,0,0|1,0,0]=3 946 B11R1.53 COC1=C(C(=O)O)C=CN=C1 W7675 [0,2,0,0,0,0|1,0,0]=3 947 B11R1.53 COC1=C(C(C)O)C=CC=C1 6281AA [0,2,0,0,0,0|1,0,1]=4 948 B11R1.53 COC1=CC=CN=C1C(=O)O W3589 [0,2,0,0,0,0|1,0,0]=3 949 B11R1.53 COC1=CC=NC=C1C(=O)O Z6400 [0,2,0,0,0,0|1,0,0]=3 950 B11R1.53 COC1=NC=CC=C1C(C)=O 5873AA [0,2,0,0,0,0|2,0,0]=4 951 B11R1.53 COC1=NC=CN=C1C(=O)O Z4703 [0,2,0,0,0,0|2,0,0]=4 952 B11R1.53 N#CC1=C(C(N)=O)C=CC=C1 5587AL [0,2,0,0,0,0|1,0,0]=3 953 B11R1.53 NCC1=C([N+](=O)[O-])C=CC=C1 9912AA [0,2,0,0,0,0|1,0,1]=4 954 B11R1.53 NCC1=CC=CC=C1[N+](=O)[O-] 1917AB [0,2,0,0,0,0|1,0,1]=4 955 B11R1.53 NNC1=CC=CC=C1[N+](=O)[O-] U331 [0,2,0,0,0,0|1,0,1]=4 956 B11R1.53 O=C(O)C1=CC=CC=C1CBr X0137 [0,2,0,0,0,0|0,0,0]=2 957 B11R1.53 O=[IH2]C1=C(C(=O)O)C=CC=C1 7834AF [0,2,0,0,0,0|0,0,0]=2 958 B11R1.53 O=[N+]([O-])C1=C(CCl)C=CC=C1 7974AJ [0,2,0,0,0,0|1,0,1]=4 959 B11R1.53 OB(O)C1=CC=CC=C1CBr K677 [0,2,0,0,0,0|1,0,1]=4 960 B11R1.156 CC(=O)C1=C(C)C=CC=C1C 0896AB [0,2,0,0,0,0|1,0,0]=3 961 B11R1.156 CC(=O)C1=C(F)C=CC=C1Cl V8421 [0,2,0,0,0,0|1,0,0]=3 962 B11R1.156 CC(=O)C1=C(O)C=CC=C1Br W6967 [0,2,0,0,0,0|1,0,0]=3 963 B11R1.156 CC(O)C1=C(Cl)C=CC=C1Cl 7516AB [0,2,0,0,0,0|1,0,1]=4 964 B11R1.156 CC(O)C1=C(F)C=CC=C1F 4888AJ [0,2,0,0,0,0|1,0,1]=4 965 B11R1.156 CC1=C(B(O)O)C(F)=CC=C1 Z1856 [0,2,0,0,0,0|1,0,1]=4 966 B11R1.156 CC1=C(C(=O)Cl)C(Cl)=CC=C1 5526AJ [0,2,0,0,0,0|1,0,0]=3 967 B11R1.156 CC1=C([N+](=O)[O-])C(N)=CC=C1 W7280 [0,2,0,0,0,0|1,0,1]=4 968 B11R1.156 CC1=CC=CC(C)=C1C(N)=O 5515AE [0,2,0,0,0,0|1,0,0]=3 969 B11R1.156 CC1=CC=CC(Cl)=C1[N+](=O)[O-] W6803 [0,2,0,0,0,0|1,0,1]=4 970 B11R1.156 CC1=CC=NC(C)=C1C(=O)O 1387AJ [0,2,0,0,0,0|1,0,0]=3 971 B11R1.156 N=C(N)C1=C(Cl)C=CC=C1Cl 4934AH [0,2,0,0,0,0|2,0,0]=4 972 B11R1.156 NC(=O)C1=C(Br)C=NC=C1F Z4108 [0,2,0,0,0,0|2,0,0]=4 973 B11R1.156 NC(=O)C1=C(Cl)C=CC=C1Cl V0556 [0,2,0,0,0,0|1,0,0]=3 974 B11R1.156 NC(=O)C1=C(F)C=CC=C1Br 2020AL [0,2,0,0,0,0|1,0,0]=3 975 B11R1.156 NC(=O)C1=C(F)C=CC=C1Cl R427 [0,2,0,0,0,0|1,0,0]=3 976 B11R1.156 NC(=S)C1=C(F)C=CC=C1F Y6316 [0,2,0,0,0,0|1,1,0]=4 977 B11R1.156 NC1=C(C(=O)O)C(Cl)=CC=N1 Z4930 [0,2,0,0,0,0|1,0,0]=3 978 B11R1.156 O=C(Cl)C1=C(Cl)C=CC=C1Br Y3742 [0,2,0,0,0,0|1,0,0]=3 979 B11R1.156 O=C(O)C1=C(Br)C=NC=C1Br X1279 [0,2,0,0,0,0|1,0,0]=3 980 B11R1.156 O=C(O)C1=C(Br)N=CC=C1O Z7668 [0,2,0,0,0,0|1,0,0]=3 981 B11R1.156 O=C(O)C1=C(F)C=CN=C1Cl 1651AJ [0,2,0,0,0,0|1,0,0]=3 982 B11R1.156 O=C(O)C1=C(F)C=NC=C1F W9303 [0,2,0,0,0,0|1,0,0]=3 983 B11R1.156 O=C(O)C1=C(F)N=CC=C1I W9065 [0,2,0,0,0,0|1,0,0]=3 984 B11R1.156 O=C(O)C1=C(I)C=CC=C1Cl 6169AA [0,2,0,0,0,0|0,0,0]=2 985 B11R1.156 O=C([O-])C1=C(Cl)C=CC=C1Cl 3819AL [0,2,0,0,0,0|0,0,1]=3 986 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1Br 6151AA [0,2,0,0,0,0|1,0,1]=4 987 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1O X3112 [0,2,0,0,0,0|1,0,1]=4 988 B11R1.156 O=[N+]([O-])C1=C(F)C=CC=C1O W5924 [0,2,0,0,0,0|1,0,1]=4 989 B11R1.156 O=[N+]([O-])C1=C(I)C=CC=C1Cl V9313 [0,2,0,0,0,0|1,0,1]=4 990 B11R1.156 OB(O)C1=C(Br)C=CC=C1Br Z0890 [0,2,0,0,0,0|1,0,1]=4 991 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Br Y3655 [0,2,0,0,0,0|1,0,1]=4 992 B11R1.156 OB(O)C1=C(Cl)C=CC=C1O Z1203 [0,2,0,0,0,0|1,0,1]=4 993 B11R1.156 OB(O)C1=C(I)C=CC=C1F X2551 [0,2,0,0,0,0|1,0,1]=4 994 B11R1.156 OB(O)C1=C(O)C=CC=C1F X1810 [0,2,0,0,0,0|1,0,1]=4 995 B11R1.156 OB(O)C1=C(O)C=CC=C1O Y5572 [0,2,0,0,0,0|1,0,1]=4 996 B11R1.159 CC(=O)C1=C(F)C(Cl)=CC=C1 8191AA [0,2,0,0,0,0|1,0,0]=3 997 B11R1.159 CC(=O)C1=CC=CC(Br)=C1F X4555 [0,2,0,0,0,0|1,0,0]=3 998 B11R1.159 CC(=O)C1=CC=CC(Br)=C1O Z4323 [0,2,0,0,0,0|1,0,0]=3 999 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1Cl W6990 [0,2,0,0,0,0|1,0,0]=3 1000 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1N X3777 [0,2,0,0,0,0|1,0,0]=3 1001 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1O Y8724 [0,2,0,0,0,0|1,0,0]=3 1002 B11R1.159 CC(=O)C1=CC=CC(F)=C1Cl X8155 [0,2,0,0,0,0|1,0,0]=3 1003 B11R1.159 CC(=O)C1=CC=CC(F)=C1O 0838AC [0,2,0,0,0,0|1,0,0]=3 1004 B11R1.159 CC(=O)C1=CC=NC(Cl)=C1N 4107AB [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O 3708AA [0,2,0,0,0,0|1,0,0]=3 1006 B11R1.159 CC1=C(C(=O)O)C=CN=C1Cl 6142AA [0,2,0,0,0,0|1,0,0]=3 1007 B11R1.159 CC1=C(Cl)C(B(O)O)=CC=C1 V9082 [0,2,0,0,0,0|1,0,1]=4 1008 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O X0699 [0,2,0,0,0,0|1,0,1]=4 1009 B11R1.159 CC1=C(F)C=CC=C1C(N)=O 2425AL [0,2,0,0,0,0|1,0,0]=3 1010 B11R1.159 CC1=C(I)C([N+](=O)[O-])=CC=C1 9484AB [0,2,0,0,0,0|1,0,1]=4 1011 B11R1.159 CC1=C(I)C=CC=C1C(=O)O X2813 [0,2,0,0,0,0|0,0,0]=2 1012 B11R1.159 CC1=C(I)C=CC=C1[N+](=O)[O-] 5676AB [0,2,0,0,0,0|1,0,1]=4 1013 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1O F298 [0,2,0,0,0,0|1,0,1]=4 1014 B11R1.159 CN1C=CC=C(C(=O)O)C1=O 7787AA [0,2,0,0,0,0|1,0,0]=3 1015 B11R1.159 NC(=O)C1=C(Cl)C(F)=CC=C1 8088AE [0,2,0,0,0,0|1,0,0]=3 1016 B11R1.159 NC(=O)C1=CC=CC(Br)=C1F V8396 [0,2,0,0,0,0|1,0,0]=3 1017 B11R1.159 NC(=O)C1=CC=CC(Br)=C1N Z4759 [0,2,0,0,0,0|1,0,0]=3 1018 B11R1.159 NC(=O)C1=CC=CC(Cl)=C1Cl V1409 [0,2,0,0,0,0|1,0,0]=3 1019 B11R1.159 NC(=O)C1=CC=CC(F)=C1F 6164AD [0,2,0,0,0,0|1,0,0]=3 1020 B11R1.159 NC1=C(Br)C(C(=O)O)=CC=C1 V3721 [0,2,0,0,0,0|0,0,0]=2 1021 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl Z4908 [0,2,0,0,0,0|1,0,0]=3 1022 B11R1.159 NC1=C(Cl)C(C(=O)O)=CC=C1 X8028 [0,2,0,0,0,0|0,0,0]=2 1023 B11R1.159 NC1=C(O)C(C(=O)O)=CC=C1 X8030 [0,2,0,0,0,0|0,0,0]=2 1024 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1Br W7219 [0,2,0,0,0,0|1,0,1]=4 1025 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1F 0874AB [0,2,0,0,0,0|1,0,1]=4 1026 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1O Y9591 [0,2,0,0,0,0|1,0,1]=4 1027 B11R1.159 O=C(O)C1=C(Br)C(Br)=NC=C1 0541AA [0,2,0,0,0,0|1,0,0]=3 1028 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 8344AB [0,2,0,0,0,0|0,0,0]=2 1029 B11R1.159 O=C(O)C1=C(F)C(Br)=NC=C1 5472AJ [0,2,0,0,0,0|1,0,0]=3 1030 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 X4483 [0,2,0,0,0,0|0,0,0]=2 1031 B11R1.159 O=C(O)C1=CC=CC(=O)N1O Z5390 [0,2,0,0,0,0|1,0,0]=3 1032 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Br Z4927 [0,2,0,0,0,0|0,0,0]=2 1033 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Cl X8043 [0,2,0,0,0,0|0,0,0]=2 1034 B11R1.159 O=C(O)C1=CC=CC(F)=C1I X4486 [0,2,0,0,0,0|0,0,0]=2 1035 B11R1.159 O=C(O)C1=CC=CC(I)=C1Br 3273AC [0,2,0,0,0,0|0,0,0]=2 1036 B11R1.159 O=C(O)C1=CC=CC(I)=C1Cl A542 [0,2,0,0,0,0|0,0,0]=2 1037 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1Cl 6646AC [0,2,0,0,0,0|1,0,0]=3 1038 B11R1.159 O=[N+]([O-])C1=C(Cl)C(F)=CC=C1 W4442 [0,2,0,0,0,0|1,0,1]=4 1039 B11R1.159 O=[N+]([O-])C1=C(I)C(Br)=CC=C1 3598AB [0,2,0,0,0,0|1,0,1]=4 1040 B11R1.159 OB(O)C1=CC=CC(Br)=C1F V1879 [0,2,0,0,0,0|1,0,1]=4 1041 B11R1.159 OB(O)C1=CC=CC(Cl)=C1O Z1159 [0,2,0,0,0,0|1,0,1]=4 1042 B11R1.159 OB(O)C1=CC=CC(I)=C1F Y3525 [0,2,0,0,0,0|1,0,1]=4 1043 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 X4553 [0,2,0,0,0,0|1,0,0]=3 1044 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 7032AB [0,2,0,0,0,0|1,0,0]=3 1045 B11R1.167 CC(=O)C1=CC(Br)=CN=C1Cl 1939AF [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F X8969 [0,2,0,0,0,0|2,0,0]=4 1047 B11R1.167 CC(=O)C1=CC(C)=CC=C1F X8298 [0,2,0,0,0,0|1,0,0]=3 1048 B11R1.167 CC(=O)C1=CC(F)=CC=C1N Z4461 [0,2,0,0,0,0|1,0,0]=3 1049 B11R1.167 CC(=O)C1=CC(O)=CC=C1F V3358 [0,2,0,0,0,0|1,0,0]=3 1050 B11R1.167 CC(O)C1=C(Cl)C=CC(Cl)=C1 4885AJ [0,2,0,0,0,0|1,0,1]=4 1051 B11R1.167 CC(O)C1=C(O)C=CC(F)=C1 4905AJ [0,2,0,0,0,0|1,0,1]=4 1052 B11R1.167 CC(O)C1=CC(Br)=CC=C1F W6927 [0,2,0,0,0,0|1,0,1]=4 1053 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 4311AB [0,2,0,0,0,0|1,0,0]=3 1054 B11R1.167 CC1=C(C(N)=O)C=C(F)C=C1 9177AA [0,2,0,0,0,0|1,0,0]=3 1055 B11R1.167 CC1=CC=C(Cl)C(C(=O)O)=N1 4794AC [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.167 CC1=CC=C(Cl)N=C1C(=O)O X7045 [0,2,0,0,0,0|1,0,0]=3 1057 B11R1.167 CC1=CC=C(O)C(C(N)=O)=C1 V1242 [0,2,0,0,0,0|1,0,0]=3 1058 B11R1.167 CC1=CC=C(O)N=C1C(=O)O Z3910 [0,2,0,0,0,0|1,0,0]=3 1059 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 Z4478 [0,2,0,0,0,0|2,0,0]=4 1060 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 W7762 [0,2,0,0,0,0|1,0,0]=3 1061 B11R1.167 CC1=CN=C(N)C(C(N)=O)=C1 0576AA [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.167 CC1=CNC(=O)C(C(=O)O)=C1 4899AB [0,2,0,0,0,0|1,0,0]=3 1063 B11R1.167 CC1=NC(C(=O)O)=C(O)C=C1 6892AA [0,2,0,0,0,0|1,0,0]=3 1064 B11R1.167 CC1=NC=C(Br)C(C(=O)O)=N1 X8520 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 Y4678 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.167 NC(=O)C1=C(Cl)C=CC(F)=C1 4150AC [0,2,0,0,0,0|1,0,0]=3 1067 B11R1.167 NC(=O)C1=C(N)N=CC(Br)=C1 8666AB [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.167 NC(=O)C1=CC(Br)=CC=C1Cl V4012 [0,2,0,0,0,0|1,0,0]=3 1069 B11R1.167 NC(=O)C1=CC(Br)=CC=C1I Z4555 [0,2,0,0,0,0|1,0,0]=3 1070 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl Z0829 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.167 NC(=O)C1=CC(F)=CN=C1Cl 1698AC [0,2,0,0,0,0|2,0,0]=4 1072 B11R1.167 NC1=CC=C(Br)C(C(=O)O)=N1 X8656 [0,2,0,0,0,0|1,0,0]=3 1073 B11R1.167 NC1=CC=C(Br)C([N+](=O)[O-])=C1 X2890 [0,2,0,0,0,0|1,0,1]=4 1074 B11R1.167 NC1=CN=C(F)C=C1C(=O)O 8804AA [0,2,0,0,0,0|1,0,0]=3 1075 B11R1.167 NC1=NC=C(Br)C(C(=O)O)=C1 Y6748 [0,2,0,0,0,0|1,0,0]=3 1076 B11R1.167 O=C(Cl)C1=CC(Cl)=CC=C1Cl E633 [0,2,0,0,0,0|1,0,0]=3 1077 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl Z0665 [0,2,0,0,0,0|1,0,0]=3 1078 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F Y4537 [0,2,0,0,0,0|1,0,0]=3 1079 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1F W9067 [0,2,0,0,0,0|1,0,0]=3 1080 B11R1.167 O=C(O)C1=CC(F)=CN=C1F 0695AF [0,2,0,0,0,0|1,0,0]=3 1081 B11R1.167 O=C(O)C1=CC(I)=CC=C1I Z1811 [0,2,0,0,0,0|0,0,0]=2 1082 B11R1.167 O=C(O)C1=CC(I)=CN=C1Cl 6435AE [0,2,0,0,0,0|1,0,0]=3 1083 B11R1.167 O=C(O)C1=CC(O)=CC=C1F X2155 [0,2,0,0,0,0|0,0,0]=2 1084 B11R1.167 O=C(O)C1=CC(O)=CC=C1I X8082 [0,2,0,0,0,0|0,0,0]=2 1085 B11R1.167 O=C(O)C1=CC(O)=CN=C1Cl 5941AB [0,2,0,0,0,0|1,0,0]=3 1086 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Br Z7473 [0,2,0,0,0,0|1,0,0]=3 1087 B11R1.167 O=C(O)C1=NC(F)=CC=C1F Y4248 [0,2,0,0,0,0|1,0,0]=3 1088 B11R1.167 O=C([O-])C1=CC(F)=CC=C1F W6704 [0,2,0,0,0,0|0,0,1]=3 1089 B11R1.167 O=C([O-])C1=CC(O)=CC=C1O M915 [0,2,0,0,0,0|0,0,1]=3 1090 B11R1.167 O=[N+]([O-])C1=C(I)C=CC(I)=C1 9545AF [0,2,0,0,0,0|1,0,1]=4 1091 B11R1.167 O=[N+]([O-])C1=CC(I)=CC=C1F V5517 [0,2,0,0,0,0|1,0,1]=4 1092 B11R1.167 OB(O)C1=CC(Br)=CC=C1Br Y3510 [0,2,0,0,0,0|1,0,1]=4 1093 B11R1.167 OB(O)C1=CC(Br)=CC=C1F V1958 [0,2,0,0,0,0|1,0,1]=4 1094 B11R1.167 OB(O)C1=CC(Br)=CC=C1O Z1034 [0,2,0,0,0,0|1,0,1]=4 1095 B11R1.167 OB(O)C1=CC(Cl)=CC=C1O Y5113 [0,2,0,0,0,0|1,0,1]=4 1096 B11R1.167 OB(O)C1=CC(F)=CC=C1Br Z1205 [0,2,0,0,0,0|1,0,1]=4 1097 B11R1.167 OB(O)C1=CC(O)=CC=C1Cl V9023 [0,2,0,0,0,0|1,0,1]=4 1098 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 X8328 [0,2,0,0,0,0|1,0,0]=3 1099 B11R1.74 CC(=O)C1=CC(F)=CC(Br)=C1 Z6809 [0,2,0,0,0,0|1,0,0]=3 1100 B11R1.74 CC1=CC(C(=O)O)=CC(=O)N1 Z2245 [0,2,0,0,0,0|1,0,0]=3 1101 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 Y9408 [0,2,0,0,0,0|1,0,0]=3 1102 B11R1.74 CC1=CC(Cl)=CC(B(O)O)=C1 W9381 [0,2,0,0,0,0|1,0,1]=4 1103 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 Z4893 [0,2,0,0,0,0|0,0,0]=2 1104 B11R1.74 CC1=CC(F)=CC(B(O)O)=C1 V1864 [0,2,0,0,0,0|1,0,1]=4 1105 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 X3116 [0,2,0,0,0,0|0,0,0]=2 1106 B11R1.74 CC1=CC(O)=CC([N+](=O)[O-])=C1 X9708 [0,2,0,0,0,0|1,0,1]=4 1107 B11R1.74 N=C(N)C1=CC(Cl)=CC(Cl)=C1 7826AD [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 Y7546 [0,2,0,0,0,0|2,0,0]=4 1109 B11R1.74 NC(=O)C1=CC(Br)=CC(Br)=C1 Z0270 [0,2,0,0,0,0|1,0,0]=3 1110 B11R1.74 NC(=O)C1=CC(Cl)=NC(Cl)=C1 Z1030 [0,2,0,0,0,0|2,0,0]=4 1111 B11R1.74 NC(=O)C1=CC(F)=CC(F)=C1 Z0102 [0,2,0,0,0,0|1,0,0]=3 1112 B11R1.74 NC1=CC(C(=O)O)=CC(Cl)=C1 X8029 [0,2,0,0,0,0|0,0,0]=2 1113 B11R1.74 NC1=CC(C(=O)O)=CC(F)=C1 W8462 [0,2,0,0,0,0|0,0,0]=2 1114 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 6925AA [0,2,0,0,0,0|0,0,0]=2 1115 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 Z5106 [0,2,0,0,0,0|0,0,0]=2 1116 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 5927AL [0,2,0,0,0,0|0,0,0]=2 1117 B11R1.74 NC1=CC([N+](=O)[O-])=CC(Cl)=C1 7604AB [0,2,0,0,0,0|1,0,1]=4 1118 B11R1.74 O=C(O)C1=CC(I)=CC(F)=C1 X4491 [0,2,0,0,0,0|0,0,0]=2 1119 B11R1.74 O=C([O-])C1=CC(F)=CC(F)=C1 7506AB [0,2,0,0,0,0|0,0,1]=3 1120 B11R1.74 O=[N+]([O-])C1=CC(Cl)=CC(Br)=C1 W4533 [0,2,0,0,0,0|1,0,1]=4 1121 B11R1.74 OB(O)C1=CC(Cl)=CC(Br)=C1 Y3771 [0,2,0,0,0,0|1,0,1]=4 1122 B11R1.74 OB(O)C1=CC(F)=CC(Br)=C1 X2347 [0,2,0,0,0,0|1,0,1]=4 1123 B11R1.74 OB(O)C1=CC(F)=CC(Cl)=C1 V1884 [0,2,0,0,0,0|1,0,1]=4 1124 B11R1.74 OB(O)C1=CC(O)=CC(Cl)=C1 X1659 [0,2,0,0,0,0|1,0,1]=4 1125 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 5335AH [0,2,0,0,0,0|0,0,0]=2 1126 B11R1.266 CNC1=CC([N+](=O)[O-])=CC=C1 9301AB [0,2,0,0,0,0|1,0,1]=4 1127 B11R1.266 CNC1=CC=CC(C(=O)O)=C1 7186AB [0,2,0,0,0,0|0,0,0]=2 1128 B11R1.266 CNC1=CN=CC(C(=O)O)=C1 6280AJ [0,2,0,0,0,0|1,0,0]=3 1129 B11R1.266 COC1=CC(C(=N)N)=CC=C1 2322AJ [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.266 COC1=CC(C(=O)O)=CN=C1 W4373 [0,2,0,0,0,0|1,0,0]=3 1131 B11R1.266 COC1=CC(C(C)=O)=NC=C1 8865AB [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.266 COC1=CC(C(N)=O)=NC=C1 V8887 [0,2,0,0,0,0|2,0,0]=4 1133 B11R1.266 COC1=CC=CC(C(C)O)=C1 1536AB [0,2,0,0,0,0|1,0,1]=4 1134 B11R1.266 COC1=CC=CC(C(N)=O)=N1 4601AF [0,2,0,0,0,0|2,0,0]=4 1135 B11R1.266 COC1=CN=CC(C(=O)O)=C1 Y6897 [0,2,0,0,0,0|1,0,0]=3 1136 B11R1.266 COC1=NC=NC(C(=O)O)=C1 4930AB [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.266 CSC1=CC=CC([N+](=O)[O-])=C1 U815 [0,2,0,0,0,0|1,0,1]=4 1138 B11R1.266 CSC1=NC=CC(C(=O)O)=N1 X9021 [0,2,0,0,0,0|2,0,0]=4 1139 B11R1.266 N#CC1=CC(C(N)=O)=CC=C1 0969AE [0,2,0,0,0,0|1,0,0]=3 1140 B11R1.266 N#CC1=NC=CC(C(=O)O)=C1 W3495 [0,2,0,0,0,0|1,0,0]=3 1141 B11R1.266 NC(=O)C1=CC=CC(C=O)=C1 5247AA [0,2,0,0,0,0|1,0,0]=3 1142 B11R1.266 NC(=O)C1=CC=CC(CBr)=C1 Z4812 [0,2,0,0,0,0|1,0,0]=3 1143 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 Q654 [0,2,0,0,0,0|0,0,0]=2 1144 B11R1.266 NCC1=CC(C(N)=O)=CC=C1 Z6536 [0,2,0,0,0,0|1,0,0]=3 1145 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 Y9548 [0,2,0,0,0,0|1,0,0]=3 1146 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 X0219 [0,2,0,0,0,0|0,0,0]=2 1147 B11R1.266 O=C(O)C1=CC=CC(CO)=C1 X8078 [0,2,0,0,0,0|0,0,0]=2 1148 B11R1.266 O=C(O)C1=NC(CO)=CC=C1 X9395 [0,2,0,0,0,0|1,0,0]=3 1149 B11R1.266 O=CC1=CC(C(=O)O)=CC=N1 3286AC [0,2,0,0,0,0|1,0,0]=3 1150 B9R1.13 O=C(O)CC1=CC=CO1 V2403 [0,0,1,1,0,0|1,0,1]=4 1151 B9R2.50 C1=CC2=C(C=C1)CC2 M026 [1,0,0,1,0,0|1,0,1]=4 1152 B11R2.10 BrC1=CC2=CC=CC=C2S1 Y9390 [0,0,0,1,0,1|1,1,0]=4 1153 B11R2.10 CC1=CC2=C(C=CC=C2)C1 1054AB [0,0,0,1,0,1|2,0,0]=4 1154 B11R2.10 CC1=CC2=C(C=CC=C2)S1 3343AA [0,0,0,1,0,1|1,1,0]=4 1155 B11R2.10 CC1=NC2=NC=CC=C2O1 W8875 [0,0,0,1,0,1|2,0,0]=4 1156 B11R2.10 CC1CC2=C(C=CC=C2)O1 5226AL [0,0,0,1,0,1|1,0,1]=4 1157 B11R2.10 FC1=NC2=CC=CC=C2S1 Y7071 [0,0,0,1,0,1|1,1,0]=4 1158 B11R2.10 NC1=CC2=CC=CC=C2S1 W6356 [0,0,0,1,0,1|1,1,0]=4 1159 B11R2.10 NC1=NC2=C(C=CN=C2)O1 Z3900 [0,0,0,1,0,1|2,0,0]=4 1160 B11R2.10 O=C1CC2=C(C=CC=N2)N1 3636AB [0,0,0,1,0,1|2,0,0]=4 1161 B11R2.10 O=C1CC2=CC=CN=C2N1 W7017 [0,0,0,1,0,1|2,0,0]=4 1162 B11R2.10 O=C1CC2=CN=CC=C2N1 6234AA [0,0,0,1,0,1|2,0,0]=4 1163 B11R2.10 O=C1NC2=CC=CN=C2N1 W3559 [0,0,0,1,0,1|2,0,0]=4 1164 B11R2.10 O=C1O[N+]2=C(C=CC=C2)S1 4938AL [0,0,0,1,0,1|1,0,0]=3 1165 B11R2.10 S=C1NC2=C(N=CC=C2)O1 8657AA [0,0,0,1,0,1|1,1,0]=4 1166 B11R2.10 SC1=NC2=NC=CC=C2O1 Z4832 [0,0,0,1,0,1|1,1,0]=4 1167 B11R2.1 BrC1=CSC2=CC=CC=C12 Y9947 [0,1,0,1,0,0|1,1,0]=4 1168 B11R2.1 CC1=CCC2=C1C=CC=C2 1962AC [0,1,0,1,0,0|2,0,0]=4 1169 B11R2.1 CC1=COC2=CC=CC=C12 W4465 [0,1,0,1,0,0|1,0,0]=3 1170 B11R2.1 CC1=CSC2=CC=CC=C12 I293 [0,1,0,1,0,0|1,1,0]=4 1171 B11R2.1 CC1=NNC2=C1C=CC=C2 W5365 [0,1,0,1,0,0|2,0,0]=4 1172 B11R2.1 CC1=NOC2=CC=CC=C21 Z4787 [0,1,0,1,0,0|1,0,0]=3 1173 B11R2.1 IC1=CSC2=C1C=CC=C2 4666AB [0,1,0,1,0,0|1,1,0]=4 1174 B11R2.1 NC1=NCC2=C1C=CC=C2 2334AL [0,1,0,1,0,0|2,0,0]=4 1175 B11R2.1 NC1=NOC2=CC=CN=C21 X9078 [0,1,0,1,0,0|2,0,0]=4 1176 B11R2.1 NC1=NSC2=CC=CC=C21 D152 [0,1,0,1,0,0|1,1,0]=4 1177 B11R2.1 O=C1CCC2=C1C=CN=C2 4302AB [0,1,0,1,0,0|2,0,0]=4 1178 B11R2.1 O=C1CCC2=CC=CN=C12 W5328 [0,1,0,1,0,0|2,0,0]=4 1179 B11R2.1 O=C1CCC2=NC=CC=C12 W5126 [0,1,0,1,0,0|2,0,0]=4 1180 B11R2.1 O=C1CSC2=CC=CC=C12 X9761 [0,1,0,1,0,0|0,1,0]=3 1181 B11R2.1 O=C1NCC2=C1C=CC=N2 5330AB [0,1,0,1,0,0|2,0,0]=4 1182 B11R2.1 O=C1SSC2=C1C=CC=C2 6202AB [0,1,0,1,0,0|0,1,0]=3 1183 B11R2.1 OC1=NOC2=CC=CC=C21 W4501 [0,1,0,1,0,0|0,0,1]=3 1184 B11R2.40 CC1(C2=CC=CC=C2)CO1 5786AL [0,1,0,1,0,0|1,0,1]=4 1185 B11R2.35 ClC1=CC=CC(C2CO2)=C1 1738AL [0,1,0,1,0,0|1,0,1]=4 1186 B7R1.1 O=CC1=CC=NS1 7399AB [1,0,0,0,1,0|2,0,0]=4 1187 B7R1.1 O=CC1=CNN=C1 9871AH [1,0,0,0,1,0|2,0,0]=4 1188 B7R1.1 O=CC1=CON=C1 0015AC [1,0,0,0,1,0|2,0,0]=4 1189 B7R1.1 O=CC1=NC=CS1 0841AA [1,0,0,0,1,0|2,0,0]=4 1190 B11R1.91 C=C(C)OCC1=CC=CC=C1 7143AL [0,0,0,0,0,2|2,0,0]=4 1191 B11R1.91 CC(=O)C#CC1=CC=CC=C1 W3943 [0,0,0,0,0,2|1,0,0]=3 1192 B11R1.91 CC(=O)CSC1=CC=CC=C1 4421AE [0,0,0,0,0,2|1,0,0]=3 1193 B11R1.91 CC(=O)NCC1=CC=NC=C1 8097AD [0,0,0,0,0,2|2,0,0]=4 1194 B11R1.91 N=C(N)CSC1=CC=CC=C1 0460AF [0,0,0,0,0,2|2,0,0]=4 1195 B11R1.91 N=C(N)NCC1=CC=CC=C1 8483AD [0,0,0,0,0,2|2,0,0]=4 1196 B11R1.91 NC(=O)COC1=CC=CC=C1 6854AE [0,0,0,0,0,2|1,0,0]=3 1197 B11R1.91 NC(=S)COC1=CC=CC=C1 9422AJ [0,0,0,0,0,2|1,1,0]=4 1198 B11R1.91 O=C(O)C#CC1=NC=CC=C1 5629AJ [0,0,0,0,0,2|1,0,0]=3 1199 B11R1.91 O=C(O)CCC1=CC=NC=C1 Y9675 [0,0,0,0,0,2|1,0,0]=3 1200 B11R1.91 O=C(O)COC1=CC=CC=N1 8675AB [0,0,0,0,0,2|1,0,0]=3 1201 B11R1.91 O=C(O)COC1=CN=CC=C1 4069AE [0,0,0,0,0,2|1,0,0]=3 1202 B11R1.91 O=C(O)CSC1=NC=CC=N1 1304AQ [0,0,0,0,0,2|2,0,0]=4 1203 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 U931 [0,0,0,0,0,2|1,0,0]=3 1204 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 Y8120 [0,0,0,0,0,2|1,0,0]=3 1205 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 Z3718 [0,0,0,0,0,2|0,0,1]=3