0 B9R1.8 BrCCC1=CC=CC=N1 5125AB [0,0,0,0,0,0|1,0,0]=1 1 B9R1.8 CCC[N+]1=CC=CC=C1 4961AL [0,0,0,0,0,0|2,0,0]=2 2 B9R1.8 CCC[N+]1=CC=CC=C1 K559 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.8 CCNC1=NC=CN=C1 Z2415 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.8 CNCC1=CC=CC=C1 3855AD [0,0,0,0,0,0|2,0,0]=2 5 B9R1.8 CNCC1=CC=CC=N1 7146AD [0,0,0,0,0,0|1,0,0]=1 6 B9R1.8 CNCC1=CC=NC=N1 6023AD [0,0,0,0,0,0|2,0,0]=2 7 B9R1.8 CNCC1=NC=CC=N1 X8879 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.8 CNCC1=NC=CN=C1 X9439 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.8 CNNC1=CC=CC=C1 V2456 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [0,0,0,0,0,0|1,0,2]=3 11 B9R1.8 ClCCC1=NC=CC=C1 X6257 [0,0,0,0,0,0|1,0,0]=1 12 B9R1.8 N#CCC1=CC=NC=C1 Z9553 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.8 N#CCC1=NC=CC=N1 8863AB [0,0,0,0,0,0|2,0,1]=3 14 B9R1.8 N#CCC1=NC=NC=C1 2417AC [0,0,0,0,0,0|2,0,1]=3 15 B9R1.8 N#CC[N+]1=CC=CC=C1 8359AL [0,0,0,0,0,0|3,0,1]=4 16 B9R1.8 N#CNC1=NC=CC=N1 3727AE [0,0,0,0,0,0|3,0,1]=4 17 B9R1.8 NCCC1=CC=CN=C1 5033AC [0,0,0,0,0,0|3,0,0]=3 18 B9R1.8 NCCC1=CN=CC=N1 1878AJ [0,0,0,0,0,0|2,0,0]=2 19 B9R1.8 NCCC1=NC=CN=C1 Y9352 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.8 NNCC1=CC=CC=N1 4874AC [0,0,0,0,0,0|2,0,0]=2 21 B9R1.8 NOCC1=CC=CN=C1 7306AJ [0,0,0,0,0,0|4,0,0]=4 22 B9R1.8 O=CNC1=NC=CC=C1 1807AL [0,0,0,0,0,0|2,0,1]=3 23 B9R1.8 OCCC1=CN=CN=C1 W8980 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.8 OCCC1=NC=CN=C1 Z5014 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.8 S=C=NC1=CC=CC=N1 3181AH [0,0,0,0,0,0|2,0,1]=3 26 B9R1.8 [N-]=[N+]=NC1=CC=CC=C1 0023AQ [0,0,0,0,0,0|4,0,0]=4 27 B8R1.2 BrCC1=CC=NC=C1 V2331 [1,0,0,0,0,0|3,0,0]=4 28 B8R1.2 BrCC1=NC=NC=C1 6571AA [1,0,0,0,0,0|2,0,0]=3 29 B8R1.2 Br[Se]C1=CC=CC=C1 8804AL [1,0,0,0,0,0|3,0,0]=4 30 B8R1.2 C=CC1=NC=CN=C1 R581 [1,0,0,0,0,0|1,0,2]=4 31 B8R1.2 CC[N+]1=CC=CC=C1 E438 [1,0,0,0,0,0|2,0,0]=3 32 B8R1.2 ClCC1=NN=CC=C1 2587AB [1,0,0,0,0,0|2,0,0]=3 33 B8R1.2 FCC1=CC=NC=C1 2557AL [1,0,0,0,0,0|3,0,0]=4 34 B8R1.2 ICC1=CN=CC=C1 5715AJ [1,0,0,0,0,0|3,0,0]=4 35 B8R1.2 N#CC1=CC=NC=N1 W6240 [1,0,0,0,0,0|2,0,1]=4 36 B8R1.2 NCC1=CC=CC=C1 7149AL [1,0,0,0,0,0|2,0,0]=3 37 B8R1.2 NCC1=CC=NC=N1 Y7101 [1,0,0,0,0,0|2,0,0]=3 38 B8R1.2 NNC1=NN=CC=C1 5599AB [1,0,0,0,0,0|3,0,0]=4 39 B8R1.2 NOC1=CC=CC=C1 X4801 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.2 O=CC1=NC=CC=N1 Y3220 [1,0,0,0,0,0|2,0,1]=4 41 B8R1.2 O=[As]C1=CC=CC=C1 7620AF [1,0,0,0,0,0|3,0,0]=4 42 B8R1.2 ONC1=CC=CC=C1 0019AQ [1,0,0,0,0,0|3,0,0]=4 43 B8R1.2 SCC1=CC=CN=C1 Z2753 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.1 C=CCC1=CC=C(C)C=C1 1127AQ [0,1,0,0,0,0|1,0,2]=4 45 B10R1.1 C=CCC1=CC=C(Cl)C=C1 5641AD [0,1,0,0,0,0|1,0,2]=4 46 B10R1.1 CC1=CC=C(CNN)C=C1 8497AC [0,1,0,0,0,0|3,0,0]=4 47 B10R1.1 CC1=CC=C(SCCl)C=C1 7374AL [0,1,0,0,0,0|3,0,0]=4 48 B10R1.1 CC1=NC=C(CCO)C=C1 0118AA [0,1,0,0,0,0|3,0,0]=4 49 B10R1.1 CCCC1=CC=C(C)C=C1 4911AL [0,1,0,0,0,0|1,0,0]=2 50 B10R1.1 CCCC1=CC=C(F)C=C1 2755AE [0,1,0,0,0,0|1,0,0]=2 51 B10R1.1 CCNC1=CC=C(F)C=C1 5502AB [0,1,0,0,0,0|2,0,0]=3 52 B10R1.1 CCNC1=CC=C(O)C=C1 0115AC [0,1,0,0,0,0|2,0,0]=3 53 B10R1.1 CCNC1=NC=C(Br)C=C1 W8816 [0,1,0,0,0,0|1,0,0]=2 54 B10R1.1 CCNC1=NC=C(Br)C=N1 V5881 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.1 CCOC1=CN=C(Cl)C=C1 Z5197 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.1 CCSC1=NC=C(Br)C=N1 V8149 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.1 CNCC1=CC=C(N)C=C1 Q169 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.1 COCC1=CC=C(I)C=C1 5525AC [0,1,0,0,0,0|2,0,0]=3 59 B10R1.1 N#CCC1=NC=C(Br)C=N1 W8650 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.1 NCCC1=CC=C(Cl)C=C1 1166AJ [0,1,0,0,0,0|2,0,0]=3 61 B10R1.1 NNCC1=CC=C(F)C=C1 0826AC [0,1,0,0,0,0|3,0,0]=4 62 B10R1.1 NOCC1=CC=C(Br)C=C1 5547AB [0,1,0,0,0,0|3,0,0]=4 63 B10R1.4 C=CCC1=C(Cl)C=CC=C1 7969AA [0,1,0,0,0,0|1,0,2]=4 64 B10R1.4 C=CCC1=CC=CC=C1Br 0424AQ [0,1,0,0,0,0|1,0,2]=4 65 B10R1.4 CC1=C(CCN)N=CC=C1 3182AC [0,1,0,0,0,0|1,0,0]=2 66 B10R1.4 CC1=CC=CC=C1CNN 4794AE [0,1,0,0,0,0|3,0,0]=4 67 B10R1.4 CCCC1=C(Br)C=NC=N1 V9533 [0,1,0,0,0,0|1,0,0]=2 68 B10R1.4 CCCC1=C(C)C=CC=C1 4903AL [0,1,0,0,0,0|1,0,0]=2 69 B10R1.4 CCNC1=C(N)C=CC=C1 8052AD [0,1,0,0,0,0|2,0,0]=3 70 B10R1.4 CCNC1=C(N)C=CC=N1 0189AE [0,1,0,0,0,0|1,0,0]=2 71 B10R1.4 CCOC1=C(Br)C=NC=C1 V5422 [0,1,0,0,0,0|3,0,0]=4 72 B10R1.4 CCOC1=CC=CNC1=O 5869AJ [0,1,0,0,0,0|3,0,0]=4 73 B10R1.4 CCOC1=NC=CC=C1F 3378AC [0,1,0,0,0,0|1,0,0]=2 74 B10R1.4 CCSC1=CC=CC=C1Br I195 [0,1,0,0,0,0|2,0,0]=3 75 B10R1.4 CNCC1=C(C)C=CC=N1 1508AF [0,1,0,0,0,0|1,0,0]=2 76 B10R1.4 N#CCC1=NC=CC=C1F 1107AJ [0,1,0,0,0,0|1,0,1]=3 77 B10R1.4 N#CCC1=NC=CN=C1Cl X0224 [0,1,0,0,0,0|2,0,1]=4 78 B10R1.4 NCCC1=CC=CC=C1N W6472 [0,1,0,0,0,0|2,0,0]=3 79 B10R1.4 NNCC1=CC=CC=C1Cl 3182AF [0,1,0,0,0,0|3,0,0]=4 80 B10R1.4 NNCC1=CC=CC=C1Cl 4668AE [0,1,0,0,0,0|3,0,0]=4 81 B10R1.4 NNCC1=CC=CC=C1F W6669 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.4 NOCC1=CC=CC=C1I 3260AC [0,1,0,0,0,0|3,0,0]=4 83 B10R1.4 ONCC1=CC=CC=C1F Z3766 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.10 C=CCC1=CC=CC(C)=C1 0989AQ [0,1,0,0,0,0|1,0,2]=4 85 B10R1.10 CC1=CC(CCBr)=CC=C1 0637AQ [0,1,0,0,0,0|2,0,0]=3 86 B10R1.10 CC1=NC(CCN)=CC=C1 X7037 [0,1,0,0,0,0|1,0,0]=2 87 B10R1.10 CCCC1=CC(C)=CC=C1 4908AL [0,1,0,0,0,0|1,0,0]=2 88 B10R1.10 CCCC1=CC(O)=CC=N1 2583AA [0,1,0,0,0,0|0,0,0]=1 89 B10R1.10 CCNC1=CN=CC(Cl)=N1 V9758 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.10 CCNC1=NC(Br)=CC=C1 V7492 [0,1,0,0,0,0|1,0,0]=2 91 B10R1.10 CCNC1=NC=CC(N)=C1 W9213 [0,1,0,0,0,0|1,0,0]=2 92 B10R1.10 CCOC1=CC(=O)C=CN1 0560AA [0,1,0,0,0,0|1,0,1]=3 93 B10R1.10 CCOC1=CC(C)=NC=C1 V3972 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.10 CCOC1=CC(C)=NC=N1 Y4950 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.10 CCOC1=CC(F)=NC=C1 9218AA [0,1,0,0,0,0|3,0,0]=4 96 B10R1.10 CCOC1=CC(N)=CN=C1 7168AB [0,1,0,0,0,0|3,0,0]=4 97 B10R1.10 CCOC1=CC(S)=CC=C1 L529 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.10 CCOC1=CC=CC(N)=N1 Y4042 [0,1,0,0,0,0|1,0,0]=2 99 B10R1.10 CCOC1=CC=NC(Cl)=C1 R739 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.10 CCOC1=NC(Cl)=CN=C1 6461AA [0,1,0,0,0,0|2,0,0]=3 101 B10R1.10 CCOC1=NC=CC(=O)N1 Z2552 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.10 CNCC1=CC(O)=CC=C1 2952AD [0,1,0,0,0,0|2,0,0]=3 103 B10R1.10 CNCC1=NC(C)=CC=C1 0779AC [0,1,0,0,0,0|1,0,0]=2 104 B10R1.10 CNCC1=NC=CC(C)=C1 8285AC [0,1,0,0,0,0|1,0,0]=2 105 B10R1.10 N#CCC1=NC(Cl)=CC=C1 Y6377 [0,1,0,0,0,0|1,0,1]=3 106 B10R1.10 NCCC1=CC(N)=CC=C1 1934AJ [0,1,0,0,0,0|2,0,0]=3 107 B10R1.10 NCCC1=CC(N)=CC=C1 4022AC [0,1,0,0,0,0|2,0,0]=3 108 B10R1.10 NCCC1=CC=CC(Br)=N1 5436AB [0,1,0,0,0,0|1,0,0]=2 109 B10R1.10 NCCC1=CC=CC(O)=C1 E330 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.10 NCCC1=NC(Br)=CC=C1 5025AA [0,1,0,0,0,0|1,0,0]=2 111 B10R1.10 NNCC1=CC(F)=CC=C1 4670AE [0,1,0,0,0,0|3,0,0]=4 112 B10R1.10 NOCC1=CC(Cl)=CC=C1 3026AB [0,1,0,0,0,0|3,0,0]=4 113 B10R1.10 O=C1C=C(CCO)C=CC1 V0891 [0,1,0,0,0,0|2,0,1]=4 114 B10R1.10 O=CCC1=CC=CC(Br)=C1 Y7020 [0,1,0,0,0,0|2,0,1]=4 115 B10R1.10 O=CNC1=NC=CC(Br)=C1 Z9862 [0,1,0,0,0,0|2,0,1]=4 116 B10R1.10 OCCC1=CC=NC(Cl)=C1 1041AJ [0,1,0,0,0,0|3,0,0]=4 117 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 4800AJ [0,1,0,0,0,0|1,0,2]=4 118 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 4836AJ [0,1,0,0,0,0|1,0,2]=4 119 B10R1.15 C=C(CBr)C1=CC=CC=C1 Z4610 [0,1,0,0,0,0|2,0,1]=4 120 B10R1.15 CCC(=O)C1=CC=NC=C1 8726AA [0,1,0,0,0,0|2,0,1]=4 121 B10R1.15 CCC(=O)C1=NC=CN=C1 7151AB [0,1,0,0,0,0|1,0,1]=3 122 B10R1.15 CCC(Cl)C1=CC=CC=C1 1017AL [0,1,0,0,0,0|1,0,0]=2 123 B10R1.15 CCC(N)C1=CC=CC=C1 8188AD [0,1,0,0,0,0|1,0,0]=2 124 B10R1.15 CCC(N)C1=CC=CN=C1 4943AJ [0,1,0,0,0,0|2,0,0]=3 125 B10R1.15 CCC(N)C1=CC=CN=C1 4945AJ [0,1,0,0,0,0|2,0,0]=3 126 B10R1.15 COC(=N)C1=NC=CN=C1 9109AE [0,1,0,0,0,0|2,0,1]=4 127 B10R1.15 C[C@H](CO)C1=CC=CC=C1 4835AB [0,1,0,0,0,0|2,0,0]=3 128 B10R1.15 FC(CBr)C1=CC=CC=C1 9366AA [0,1,0,0,0,0|2,0,0]=3 129 B10R1.15 NC(CF)C1=CC=CC=C1 0514AQ [0,1,0,0,0,0|2,0,0]=3 130 B10R1.15 NC(CO)C1=CC=CN=C1 W5825 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.15 NC(CO)C1=CC=NC=C1 1467AJ [0,1,0,0,0,0|3,0,0]=4 132 B10R1.15 NCC(O)C1=CC=CC=N1 1453AJ [0,1,0,0,0,0|1,0,0]=2 133 B10R1.15 NCC(O)C1=CC=CN=C1 5133AH [0,1,0,0,0,0|3,0,0]=4 134 B10R1.15 NCC(O)C1=NC=CC=C1 9384AJ [0,1,0,0,0,0|1,0,0]=2 135 B10R1.15 NC[C@@H](F)C1=CC=CC=C1 0407AQ [0,1,0,0,0,0|2,0,0]=3 136 B10R1.15 NC[C@H](O)C1=CC=CN=C1 Z3832 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.15 O=C(CBr)C1=NC=CN=C1 Z2340 [0,1,0,0,0,0|2,0,1]=4 138 B10R1.15 OC(CBr)C1=CC=CC=C1 W4218 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.17 CCCCC1=CC=CN=C1 X7086 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.17 CCCCC1=NC=CC=C1 S413 [0,1,0,0,0,0|0,0,0]=1 141 B10R1.17 CCNCC1=CC=CN=C1 Y5832 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.17 CNCCC1=CC=CN=C1 7424AH [0,1,0,0,0,0|2,0,0]=3 143 B10R1.17 CNCCC1=CC=NC=C1 5552AE [0,1,0,0,0,0|2,0,0]=3 144 B10R1.17 CNCCC1=CC=NC=C1 X8552 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.17 CNCCC1=CN=CC=C1 6627AD [0,1,0,0,0,0|2,0,0]=3 146 B10R1.17 COCCC1=NC=CC=C1 4987AL [0,1,0,0,0,0|0,0,0]=1 147 B10R1.17 N#CCCC1=CC=CC=N1 1449AE [0,1,0,0,0,0|0,0,1]=2 148 B10R1.17 N#CCCC1=CC=NC=C1 2937AC [0,1,0,0,0,0|2,0,1]=4 149 B10R1.17 NCC#CC1=CC=CC=C1 1105AQ [0,1,0,0,0,0|1,0,2]=4 150 B10R1.17 NCCCC1=CC=CC=N1 7820AA [0,1,0,0,0,0|0,0,0]=1 151 B10R1.17 NCCNC1=CC=CC=N1 1624AC [0,1,0,0,0,0|1,0,0]=2 152 B10R1.17 NCCNC1=CC=CN=C1 4424AJ [0,1,0,0,0,0|3,0,0]=4 153 B10R1.17 NCCNC1=NC=CC=N1 4050AD [0,1,0,0,0,0|2,0,0]=3 154 B10R1.17 NCCOC1=CC=CN=C1 Z4583 [0,1,0,0,0,0|3,0,0]=4 155 B10R1.17 NCCOC1=CC=NC=C1 1280AJ [0,1,0,0,0,0|3,0,0]=4 156 B10R1.17 NCCOC1=CC=NC=C1 2194AB [0,1,0,0,0,0|3,0,0]=4 157 B10R1.17 NCCSC1=CC=CC=C1 6800AD [0,1,0,0,0,0|2,0,0]=3 158 B10R1.17 NCCSC1=CC=CC=N1 3135AE [0,1,0,0,0,0|1,0,0]=2 159 B10R1.17 O=CCOC1=CC=CC=C1 0811AB [0,1,0,0,0,0|2,0,1]=4 160 B10R1.17 OCC#CC1=CC=CC=N1 5627AJ [0,1,0,0,0,0|0,0,2]=3 161 B10R1.17 OCCCC1=NC=CC=C1 5625AJ [0,1,0,0,0,0|0,0,0]=1 162 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [0,1,0,0,0,0|2,0,1]=4 163 B10R1.18 CC(=O)CC1=NC=CN=C1 0450AC [0,1,0,0,0,0|1,0,1]=3 164 B10R1.18 CC(=S)NC1=CC=CC=C1 8077AF [0,1,0,0,0,0|2,0,1]=4 165 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [0,1,0,0,0,0|1,0,2]=4 166 B10R1.18 CC(C)CC1=CC=CC=N1 9571AB [0,1,0,0,0,0|0,0,0]=1 167 B10R1.18 CC(C)CC1=CC=NC=C1 6191AJ [0,1,0,0,0,0|2,0,0]=3 168 B10R1.18 CC(C)CC1=NC=CN=C1 R582 [0,1,0,0,0,0|1,0,0]=2 169 B10R1.18 CC(N)CC1=CC=CC=N1 4560AE [0,1,0,0,0,0|0,0,0]=1 170 B10R1.18 CC(N)CC1=CN=CC=N1 4220AC [0,1,0,0,0,0|1,0,0]=2 171 B10R1.18 CC(O)CC1=CC=CC=N1 5034AE [0,1,0,0,0,0|0,0,0]=1 172 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 7881AA [0,1,0,0,0,0|1,0,0]=2 173 B10R1.18 C[C@H](O)CC1=CC=CC=C1 7611AA [0,1,0,0,0,0|1,0,0]=2 174 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [0,1,0,0,0,0|2,0,1]=4 175 B10R1.18 N=C(N)CC1=NC=CC=C1 0398AD [0,1,0,0,0,0|1,0,1]=3 176 B10R1.18 NC(=S)CC1=CC=CC=C1 7353AE [0,1,0,0,0,0|2,0,1]=4 177 B10R1.18 O=C(O)CC1=CC=NC=N1 W5433 [0,1,0,0,0,0|2,0,1]=4 178 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [0,1,0,0,0,0|1,0,1]=3 179 B10R1.18 O=C(O)CC1=NC=CC=N1 W7752 [0,1,0,0,0,0|2,0,1]=4 180 B10R2.6 C1=CC(C2CC2)=CC=N1 Z0635 [0,0,0,1,0,0|2,0,0]=3 181 B10R2.7 C1=CC2=C(C=C1)CSC2 1903AB [0,0,0,1,0,0|2,0,0]=3 182 B10R2.7 C1=CC2=C(C=N1)CCN2 1361AJ [0,0,0,1,0,0|3,0,0]=4 183 B10R2.7 C1=CC2=C(C=N1)NCC2 1831AC [0,0,0,1,0,0|3,0,0]=4 184 B10R2.7 C1=CC2=C(C=NN2)N=C1 2555AB [0,0,0,1,0,0|2,0,1]=4 185 B10R2.7 C1=CC2=C(N=C1)N=CN2 2570AB [0,0,0,1,0,0|2,0,1]=4 186 B10R2.7 C1=CN=C2CCNC2=C1 1360AJ [0,0,0,1,0,0|1,0,0]=2 187 B10R2.7 C1=CN=C2CNCC2=C1 V7126 [0,0,0,1,0,0|1,0,0]=2 188 B10R2.7 C1=CN=C2CNCC2=C1 W3225 [0,0,0,1,0,0|1,0,0]=2 189 B10R2.7 C1=CN=C2CNCC2=N1 6417AJ [0,0,0,1,0,0|2,0,0]=3 190 B10R2.7 C1=CN=C2OC=NC2=C1 7311AJ [0,0,0,1,0,0|2,0,1]=4 191 B8R1.8 BrCCC1=CC=CS1 Z5496 [0,0,0,0,1,0|2,0,0]=3 192 B8R1.8 BrCCN1C=NC=N1 3988AF [0,0,0,0,1,0|3,0,0]=4 193 B8R1.8 C=CCN1C=CC=N1 9666AH [0,0,0,0,1,0|1,0,2]=4 194 B8R1.8 CCCC1=CC=CO1 Z5525 [0,0,0,0,1,0|1,0,0]=2 195 B8R1.8 CCCC1=CSC=C1 Z5466 [0,0,0,0,1,0|1,0,0]=2 196 B8R1.8 CCCC1=NCCN1 5769AL [0,0,0,0,1,0|1,0,2]=4 197 B8R1.8 CCCC1=NCCO1 5790AL [0,0,0,0,1,0|1,0,2]=4 198 B8R1.8 CCCC1=NN=CO1 5829AA [0,0,0,0,1,0|2,0,0]=3 199 B8R1.8 CCNC1=CC=CS1 W4294 [0,0,0,0,1,0|2,0,0]=3 200 B8R1.8 CCNC1=NC=CS1 4125AJ [0,0,0,0,1,0|2,0,0]=3 201 B8R1.8 CNCC1=CC=CO1 7008AC [0,0,0,0,1,0|2,0,0]=3 202 B8R1.8 CNCC1=CC=NN1 0420AC [0,0,0,0,1,0|2,0,1]=4 203 B8R1.8 CNCC1=CC=NO1 4172AJ [0,0,0,0,1,0|3,0,0]=4 204 B8R1.8 CNCC1=CN=CS1 Z3350 [0,0,0,0,1,0|3,0,0]=4 205 B8R1.8 CNCC1=CSC=N1 3622AA [0,0,0,0,1,0|2,0,0]=3 206 B8R1.8 CNCC1=NC=CN1 4097AE [0,0,0,0,1,0|2,0,0]=3 207 B8R1.8 CNCC1=NC=CS1 4356AD [0,0,0,0,1,0|2,0,0]=3 208 B8R1.8 CNCC1=NOC=C1 4335AJ [0,0,0,0,1,0|2,0,0]=3 209 B8R1.8 CNCC1=NOC=C1 7285AH [0,0,0,0,1,0|2,0,0]=3 210 B8R1.8 ClCCC1=CNC=N1 X4176 [0,0,0,0,1,0|2,0,0]=3 211 B8R1.8 ClCCC1=CNN=C1 9537AF [0,0,0,0,1,0|3,0,0]=4 212 B8R1.8 N#CCC1=NC=CS1 4664AJ [0,0,0,0,1,0|2,0,1]=4 213 B8R1.8 N#CCC1=NNC=C1 Z1629 [0,0,0,0,1,0|2,0,1]=4 214 B8R1.8 N#CCN1C=CC=N1 9014AC [0,0,0,0,1,0|2,0,1]=4 215 B8R1.8 NCCC1=CC=CN1 1070AJ [0,0,0,0,1,0|1,0,1]=3 216 B8R1.8 NCCC1=CNN=C1 Y9068 [0,0,0,0,1,0|3,0,0]=4 217 B8R1.8 NCCC1=CSC=C1 8829AB [0,0,0,0,1,0|2,0,0]=3 218 B8R1.8 NCCC1=NC=CN1 9985AA [0,0,0,0,1,0|2,0,0]=3 219 B8R1.8 NCCC1=NC=CS1 5806AE [0,0,0,0,1,0|2,0,0]=3 220 B8R1.8 NCCC1=NC=NN1 1050AJ [0,0,0,0,1,0|3,0,0]=4 221 B8R1.8 NCCC1=NC=NN1 9546AE [0,0,0,0,1,0|3,0,0]=4 222 B8R1.8 NCCN1C=CC=C1 3045AB [0,0,0,0,1,0|2,0,0]=3 223 B8R1.8 NCCN1C=CN=C1 4503AH [0,0,0,0,1,0|3,0,0]=4 224 B8R1.8 NCCN1C=CN=C1 W3356 [0,0,0,0,1,0|3,0,0]=4 225 B8R1.8 NCCN1C=CN=N1 5980AB [0,0,0,0,1,0|3,0,0]=4 226 B8R1.8 NCCN1C=NC=N1 7160AB [0,0,0,0,1,0|3,0,0]=4 227 B8R1.8 NCCN1C=NC=N1 Y5405 [0,0,0,0,1,0|3,0,0]=4 228 B8R1.8 OCCC1=CON=C1 4140AC [0,0,0,0,1,0|3,0,0]=4 229 B8R1.8 OCCN1C=CC=C1 4278AL [0,0,0,0,1,0|2,0,0]=3 230 B7R1.3 CC1=CC=CN=N1 X0232 [2,0,0,0,0,0|1,0,0]=3 231 B7R1.3 CC1=CCC=CC1 7751AF [2,0,0,0,0,0|1,0,1]=4 232 B7R1.3 C[N+]1=CC=CC=C1 1581AB [2,0,0,0,0,0|2,0,0]=4 233 B7R1.3 ClC1=NN=CC=C1 X0225 [2,0,0,0,0,0|2,0,0]=4 234 B7R1.3 SC1=NC=CN=C1 2178AE [2,0,0,0,0,0|2,0,0]=4 235 B7R1.3 [SeH]C1=CC=CC=C1 8806AL [2,0,0,0,0,0|2,0,0]=4 236 B9R1.1 C=CC1=NC=C(Br)C=C1 1393AB [1,1,0,0,0,0|0,0,2]=4 237 B9R1.1 CC1=CN=C(CCl)C=N1 Y4151 [1,1,0,0,0,0|2,0,0]=4 238 B9R1.1 CC1=CN=C(CCl)N=C1 5238AA [1,1,0,0,0,0|2,0,0]=4 239 B9R1.1 CC1=CN=C(CCl)N=C1 W8706 [1,1,0,0,0,0|2,0,0]=4 240 B9R1.1 CC1=CN=C(CO)N=C1 5144AC [1,1,0,0,0,0|2,0,0]=4 241 B9R1.1 CC1=CN=C(NN)C=C1 6685AB [1,1,0,0,0,0|2,0,0]=4 242 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [1,1,0,0,0,0|1,0,0]=3 243 B9R1.1 CCC1=CC=C(Cl)C=N1 2584AA [1,1,0,0,0,0|0,0,0]=2 244 B9R1.1 CCC1=CC=C(N)C=N1 5249AA [1,1,0,0,0,0|0,0,0]=2 245 B9R1.1 CCC1=CC=C(S)C=C1 S243 [1,1,0,0,0,0|1,0,0]=3 246 B9R1.1 CCC1=CN=C(N)C=N1 X9917 [1,1,0,0,0,0|1,0,0]=3 247 B9R1.1 CCC1=CNC(=O)C=C1 7602AB [1,1,0,0,0,0|2,0,0]=4 248 B9R1.1 CCC1=NC=C(Br)C=N1 W8957 [1,1,0,0,0,0|1,0,0]=3 249 B9R1.1 CNC1=CC=C(Br)C=C1 V7923 [1,1,0,0,0,0|2,0,0]=4 250 B9R1.1 CNC1=CC=C(Cl)C=C1 V5059 [1,1,0,0,0,0|2,0,0]=4 251 B9R1.1 CNC1=CC=C(N)C=C1 F921 [1,1,0,0,0,0|2,0,0]=4 252 B9R1.1 CNC1=NC=C(N)C=C1 2702AB [1,1,0,0,0,0|1,0,0]=3 253 B9R1.1 CNC1=NC=C(N)C=N1 1831AJ [1,1,0,0,0,0|2,0,0]=4 254 B9R1.1 COC1=CN=C(I)C=N1 6098AC [1,1,0,0,0,0|2,0,0]=4 255 B9R1.1 COC1=NN=C(I)C=C1 8933AA [1,1,0,0,0,0|2,0,0]=4 256 B9R1.1 CSC1=CC=C(S)C=C1 U208 [1,1,0,0,0,0|2,0,0]=4 257 B9R1.1 CSC1=NC=C(C)C=N1 Z2994 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.1 CSC1=NC=C(Cl)C=C1 Z1031 [1,1,0,0,0,0|1,0,0]=3 259 B9R1.1 CSC1=NC=C(Cl)C=N1 2139AL [1,1,0,0,0,0|2,0,0]=4 260 B9R1.1 CSC1=NC=C(N)C=N1 6318AJ [1,1,0,0,0,0|2,0,0]=4 261 B9R1.1 CSC1=NC=C(O)C=N1 Z4789 [1,1,0,0,0,0|2,0,0]=4 262 B9R1.1 ClCC1=NC=C(Cl)C=C1 7439AC [1,1,0,0,0,0|1,0,0]=3 263 B9R1.1 NC1=CC=C(CO)N=C1 8824AH [1,1,0,0,0,0|1,0,0]=3 264 B9R1.1 NCC1=CN=C(Cl)C=N1 1378AA [1,1,0,0,0,0|2,0,0]=4 265 B9R1.1 NCC1=NC=C(Br)C=C1 8830AH [1,1,0,0,0,0|1,0,0]=3 266 B9R1.1 NCC1=NC=C(Br)C=C1 W3796 [1,1,0,0,0,0|1,0,0]=3 267 B9R1.1 NCC1=NC=C(Br)C=N1 Z4014 [1,1,0,0,0,0|2,0,0]=4 268 B9R1.1 NCC1=NC=C(Cl)C=N1 8838AH [1,1,0,0,0,0|2,0,0]=4 269 B9R1.1 NCC1=NC=C(Cl)C=N1 9256AH [1,1,0,0,0,0|2,0,0]=4 270 B9R1.1 NNC1=NC=C(F)C=C1 Z4149 [1,1,0,0,0,0|2,0,0]=4 271 B9R1.1 OCC1=CC=C(Cl)N=N1 0342AA [1,1,0,0,0,0|2,0,0]=4 272 B9R1.1 OCC1=NC=C(Cl)C=N1 4772AJ [1,1,0,0,0,0|2,0,0]=4 273 B9R1.1 OCC1=NC=C(F)C=C1 3321AB [1,1,0,0,0,0|1,0,0]=3 274 B9R1.2 C#CC1=NC=CC(Br)=C1 3384AA [1,1,0,0,0,0|0,0,2]=4 275 B9R1.2 C#CC1=NC=CC(N)=C1 0256AC [1,1,0,0,0,0|0,0,2]=4 276 B9R1.2 C=CC1=CC(C)=CC=N1 6788AA [1,1,0,0,0,0|0,0,2]=4 277 B9R1.2 C=CC1=NC=CC(Br)=C1 6873AB [1,1,0,0,0,0|0,0,2]=4 278 B9R1.2 C=CC1=NC=CC(N)=C1 0535AA [1,1,0,0,0,0|0,0,2]=4 279 B9R1.2 CC1=CC(CCl)=NC=C1 4926AB [1,1,0,0,0,0|1,0,0]=3 280 B9R1.2 CC1=CC(CN)=NC=C1 Y7378 [1,1,0,0,0,0|1,0,0]=3 281 B9R1.2 CC1=CC(CO)=NC=C1 Z4739 [1,1,0,0,0,0|1,0,0]=3 282 B9R1.2 CC1=CC=CC(CBr)=N1 Y9700 [1,1,0,0,0,0|1,0,0]=3 283 B9R1.2 CC1=CC=CC(NN)=N1 W6763 [1,1,0,0,0,0|2,0,0]=4 284 B9R1.2 CC1=CN=CC(CCl)=N1 2673AC [1,1,0,0,0,0|2,0,0]=4 285 B9R1.2 CC1=NC(CO)=NC=C1 Y3221 [1,1,0,0,0,0|2,0,0]=4 286 B9R1.2 CCC1=CC(=O)N=CN1 4704AA [1,1,0,0,0,0|1,0,1]=4 287 B9R1.2 CCC1=CC(F)=CC=C1 0760AC [1,1,0,0,0,0|1,0,0]=3 288 B9R1.2 CCC1=CC(N)=CC=N1 5543AJ [1,1,0,0,0,0|0,0,0]=2 289 B9R1.2 CCC1=CC(N)=NC=N1 3305AC [1,1,0,0,0,0|1,0,0]=3 290 B9R1.2 CCC1=CC=NC(Cl)=C1 5411AB [1,1,0,0,0,0|2,0,0]=4 291 B9R1.2 CCC1=NC(C)=CC=C1 2156AA [1,1,0,0,0,0|0,0,0]=2 292 B9R1.2 CNC1=CC(O)=NC=N1 2155AA [1,1,0,0,0,0|2,0,0]=4 293 B9R1.2 CNC1=NC(N)=NC=C1 0200AA [1,1,0,0,0,0|2,0,0]=4 294 B9R1.2 COC1=CC(Br)=NC=N1 8292AE [1,1,0,0,0,0|2,0,0]=4 295 B9R1.2 COC1=CN=CC(Br)=N1 Y5654 [1,1,0,0,0,0|2,0,0]=4 296 B9R1.2 COC1=NC(=O)C=CN1 W4926 [1,1,0,0,0,0|2,0,0]=4 297 B9R1.2 COC1=NC(C)=CN=C1 2865AB [1,1,0,0,0,0|2,0,0]=4 298 B9R1.2 CSC1=CC=CC(O)=C1 1026AE [1,1,0,0,0,0|2,0,0]=4 299 B9R1.2 CSC1=NC(C)=CN=C1 2879AB [1,1,0,0,0,0|2,0,0]=4 300 B9R1.2 CSC1=NC=CC(Br)=N1 W9785 [1,1,0,0,0,0|2,0,0]=4 301 B9R1.2 CSC1=NC=CC(Cl)=C1 W5514 [1,1,0,0,0,0|1,0,0]=3 302 B9R1.2 FC1=CC=CC(CBr)=N1 Z3784 [1,1,0,0,0,0|1,0,0]=3 303 B9R1.2 NC1=CC=CC(C=O)=N1 3868AB [1,1,0,0,0,0|1,0,1]=4 304 B9R1.2 NC1=NC(CO)=CC=N1 1009AB [1,1,0,0,0,0|2,0,0]=4 305 B9R1.2 NCC1=CC(N)=NC=N1 3584AF [1,1,0,0,0,0|2,0,0]=4 306 B9R1.2 NCC1=CC=CC(Br)=N1 X7041 [1,1,0,0,0,0|1,0,0]=3 307 B9R1.2 NCC1=NC(Br)=CC=C1 5367AC [1,1,0,0,0,0|1,0,0]=3 308 B9R1.2 NCC1=NC(F)=CC=C1 4862AA [1,1,0,0,0,0|1,0,0]=3 309 B9R1.2 NCC1=NC(F)=CC=C1 Y8188 [1,1,0,0,0,0|1,0,0]=3 310 B9R1.2 NCC1=NC=CC(Br)=C1 W8887 [1,1,0,0,0,0|1,0,0]=3 311 B9R1.2 NCC1=NC=CC(Br)=C1 Z3782 [1,1,0,0,0,0|1,0,0]=3 312 B9R1.2 NNC1=NC=CC(I)=C1 Y3597 [1,1,0,0,0,0|2,0,0]=4 313 B9R1.2 O=CC1=CC=CC(F)=N1 N399 [1,1,0,0,0,0|1,0,1]=4 314 B9R1.2 OC1=CC=CC(CBr)=C1 Y9989 [1,1,0,0,0,0|2,0,0]=4 315 B9R1.2 OC1=NC(CCl)=NC=C1 Y3173 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.2 OCC1=CC(S)=CC=C1 0333AF [1,1,0,0,0,0|2,0,0]=4 317 B9R1.2 OCC1=CN=CC(Br)=N1 3660AA [1,1,0,0,0,0|2,0,0]=4 318 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [1,1,0,0,0,0|1,0,0]=3 319 B9R1.6 CC(Cl)C1=NC=CN=C1 Z2354 [1,1,0,0,0,0|1,0,0]=3 320 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [1,1,0,0,0,0|1,0,0]=3 321 B9R1.6 CN(C)C1=NC=NC=C1 3385AB [1,1,0,0,0,0|2,0,0]=4 322 B9R1.6 CN(N)C1=CN=CC=N1 1013AJ [1,1,0,0,0,0|2,0,0]=4 323 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [1,1,0,0,0,0|2,0,0]=4 324 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [1,1,0,0,0,0|1,0,0]=3 325 B9R1.6 CS(=O)C1=NC=CC=N1 7770AJ [1,1,0,0,0,0|2,0,0]=4 326 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [1,1,0,0,0,0|0,0,0]=2 327 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [1,1,0,0,0,0|2,0,0]=4 328 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [1,1,0,0,0,0|2,0,0]=4 329 B9R1.6 O=C([O-])C1=NC=CC=C1 8839AL [1,1,0,0,0,0|1,0,1]=4 330 B9R1.6 OB(O)C1=NC=CC=C1 X0604 [1,1,0,0,0,0|2,0,0]=4 331 B9R1.15 CC1=CC=CN=C1CBr Y9115 [1,1,0,0,0,0|1,0,0]=3 332 B9R1.15 CC1=CC=CN=C1CO 0931AC [1,1,0,0,0,0|1,0,0]=3 333 B9R1.15 CC1=NC=CN=C1CCl 2672AC [1,1,0,0,0,0|2,0,0]=4 334 B9R1.15 CC1=NC=CN=C1CO 8119AA [1,1,0,0,0,0|2,0,0]=4 335 B9R1.15 CCC1=C(Br)C=CN=C1 0440AA [1,1,0,0,0,0|2,0,0]=4 336 B9R1.15 CCC1=C(Br)C=NC=C1 W9928 [1,1,0,0,0,0|2,0,0]=4 337 B9R1.15 CCC1=CC=CC=C1C Z4941 [1,1,0,0,0,0|1,0,0]=3 338 B9R1.15 CCC1=NC=CN=C1N 5741AC [1,1,0,0,0,0|1,0,0]=3 339 B9R1.15 CCC1=[N+]([O-])C=CC=C1 7886AF [1,1,0,0,0,0|0,0,1]=3 340 B9R1.15 CNC1=CC=CC=C1Br 0544AC [1,1,0,0,0,0|2,0,0]=4 341 B9R1.15 CNC1=NC=CC=C1N 6884AB [1,1,0,0,0,0|1,0,0]=3 342 B9R1.15 CNC1=NC=CN=C1N Y6424 [1,1,0,0,0,0|2,0,0]=4 343 B9R1.15 COC1=NC=CC=C1F Z7565 [1,1,0,0,0,0|1,0,0]=3 344 B9R1.15 CSC1=NC=CC=C1Br V6364 [1,1,0,0,0,0|1,0,0]=3 345 B9R1.15 CSC1=NC=CN=C1Cl 0040AP [1,1,0,0,0,0|2,0,0]=4 346 B9R1.15 ClCC1=C(Br)C=CC=C1 8546AB [1,1,0,0,0,0|2,0,0]=4 347 B9R1.15 ClCC1=NC=CC=C1Br Z8668 [1,1,0,0,0,0|1,0,0]=3 348 B9R1.15 ClCC1=NC=CN=C1Cl W6373 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.15 FC1=CC=CN=C1CCl X7998 [1,1,0,0,0,0|1,0,0]=3 350 B9R1.15 NC1=C(CO)N=CC=C1 5776AJ [1,1,0,0,0,0|1,0,0]=3 351 B9R1.15 NCC1=C(I)C=CC=C1 1744AJ [1,1,0,0,0,0|2,0,0]=4 352 B9R1.15 NCC1=CC=CC=C1N W5201 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.15 NNC1=NC=CC=C1I Z0677 [1,1,0,0,0,0|2,0,0]=4 354 B9R1.15 OCC1=NC=CC=C1Br W6721 [1,1,0,0,0,0|1,0,0]=3 355 B9R1.15 OCC1=NC=CC=C1Cl Z4931 [1,1,0,0,0,0|1,0,0]=3 356 B9R1.15 [O-][N+]1=C(CCl)C=CC=C1 Y8686 [1,1,0,0,0,0|1,0,1]=4 357 B9R1.7 CC1=CC=C(CCN)S1 5238AJ [0,1,0,0,1,0|2,0,0]=4 358 B9R1.7 CC1=CC=C(CCN)S1 9610AD [0,1,0,0,1,0|2,0,0]=4 359 B9R1.7 CC1=CN(CCN)N=C1 7229AC [0,1,0,0,1,0|2,0,0]=4 360 B9R1.7 CC1=CN=C(CCN)N1 2107AF [0,1,0,0,1,0|2,0,0]=4 361 B9R1.7 CC1=CNC(CCN)=N1 4655AC [0,1,0,0,1,0|2,0,0]=4 362 B9R1.7 CC1=CSC(CCN)=N1 9292AB [0,1,0,0,1,0|2,0,0]=4 363 B9R1.7 CCCC1=CSC(N)=N1 Y6326 [0,1,0,0,1,0|1,0,0]=3 364 B9R1.7 CCCC1=NC(C)=CN1 4781AB [0,1,0,0,1,0|1,0,0]=3 365 B9R1.7 CCCC1=NC(N)=NO1 5513AD [0,1,0,0,1,0|2,0,0]=4 366 B9R1.7 CCCC1=NN=C(N)S1 2373AE [0,1,0,0,1,0|2,0,0]=4 367 B9R1.7 CCCC1=NNC(N)=N1 6472AE [0,1,0,0,1,0|2,0,0]=4 368 B9R1.7 CCCC1=NOC(N)=C1 Z2752 [0,1,0,0,1,0|1,0,0]=3 369 B9R1.7 CCCN1C=C(N)C=N1 0139AD [0,1,0,0,1,0|1,0,0]=3 370 B9R1.7 CCCN1C=C(N)C=N1 V2887 [0,1,0,0,1,0|1,0,0]=3 371 B9R1.7 CCCN1C=CC(I)=N1 Z9713 [0,1,0,0,1,0|1,0,0]=3 372 B9R1.7 CCCN1C=NC(Br)=C1 3912AD [0,1,0,0,1,0|2,0,0]=4 373 B9R1.7 CCOC1=NC(Br)=CS1 Y8398 [0,1,0,0,1,0|2,0,0]=4 374 B9R1.7 CNCC1=CC(Br)=CS1 0077AF [0,1,0,0,1,0|2,0,0]=4 375 B9R1.7 CNCC1=CC(C)=CS1 Y4552 [0,1,0,0,1,0|2,0,0]=4 376 B9R1.7 CNCC1=CC=C(Br)O1 2148AF [0,1,0,0,1,0|2,0,0]=4 377 B9R1.7 CNCC1=CC=C(C)S1 2719AC [0,1,0,0,1,0|2,0,0]=4 378 B9R1.7 CNCC1=CC=C(C)S1 5250AC [0,1,0,0,1,0|2,0,0]=4 379 B9R1.7 CNCC1=NC(C)=CS1 3596AL [0,1,0,0,1,0|2,0,0]=4 380 B9R1.7 COCN1C=C(N)C=N1 0110AA [0,1,0,0,1,0|2,0,0]=4 381 B9R1.7 NCCC1=CC(Br)=CS1 1027AJ [0,1,0,0,1,0|2,0,0]=4 382 B9R1.7 NCCC1=CC(Br)=CS1 1159AJ [0,1,0,0,1,0|2,0,0]=4 383 B9R1.7 NCCC1=CC=C(Br)S1 1209AJ [0,1,0,0,1,0|2,0,0]=4 384 B9R1.11 CC(CO)N1C=CC=N1 6461AD [0,1,0,0,1,0|2,0,0]=4 385 B9R1.11 CCC(=O)C1=CC=CO1 Z5507 [0,1,0,0,1,0|1,0,1]=4 386 B9R1.11 CCC(N)C1=NC=CS1 X2050 [0,1,0,0,1,0|1,0,0]=3 387 B9R1.12 BrCCCN1C=CC=C1 0267AA [0,1,0,0,1,0|1,0,0]=3 388 B9R1.12 CCCCC1=CC=CO1 5552AL [0,1,0,0,1,0|1,0,0]=3 389 B9R1.12 CCCCC1=NN=CO1 6161AC [0,1,0,0,1,0|2,0,0]=4 390 B9R1.12 CCNCC1=CC=CO1 7158AA [0,1,0,0,1,0|1,0,0]=3 391 B9R1.12 CCNCC1=CSC=N1 4173AF [0,1,0,0,1,0|1,0,0]=3 392 B9R1.12 CCOCC1=NC=CN1 V7222 [0,1,0,0,1,0|1,0,0]=3 393 B9R1.12 CNCCC1=CNN=C1 4405AF [0,1,0,0,1,0|2,0,0]=4 394 B9R1.12 N#CCCN1C=CC=N1 1753AF [0,1,0,0,1,0|1,0,1]=4 395 B9R1.12 NCCCC1=CC=CO1 3731AE [0,1,0,0,1,0|1,0,0]=3 396 B9R1.12 NCCCC1=CC=CS1 6482AE [0,1,0,0,1,0|1,0,0]=3 397 B9R1.12 NCCCC1=CNN=C1 7165AD [0,1,0,0,1,0|2,0,0]=4 398 B9R1.12 NCCCN1C=CC=N1 1752AC [0,1,0,0,1,0|1,0,0]=3 399 B9R1.12 OCCCC1=CNN=C1 6612AE [0,1,0,0,1,0|2,0,0]=4 400 B9R1.12 OCCCC1=CON=C1 2312AJ [0,1,0,0,1,0|2,0,0]=4 401 B9R1.13 CC(=O)CC1=CC=CS1 4644AD [0,1,0,0,1,0|1,0,1]=4 402 B9R1.13 CC(C)CN1C=CC=N1 Z0808 [0,1,0,0,1,0|1,0,0]=3 403 B9R1.13 CC(N)CC1=CC=CO1 8493AB [0,1,0,0,1,0|1,0,0]=3 404 B9R1.13 CC(N)CN1C=CN=C1 5070AH [0,1,0,0,1,0|2,0,0]=4 405 B9R1.13 CC(N)CN1C=NC=N1 1709AF [0,1,0,0,1,0|2,0,0]=4 406 B9R1.13 CC(O)CC1=CC=CO1 6519AJ [0,1,0,0,1,0|1,0,0]=3 407 B9R1.13 CN(C)C=C1C=CC=C1 0768AC [0,1,0,0,1,0|1,0,1]=4 408 B9R1.13 CN(C)CC1=CC=CS1 2203AB [0,1,0,0,1,0|2,0,0]=4 409 B9R1.33 CC1=CC=NN1CCO 3041AE [0,1,0,0,1,0|2,0,0]=4 410 B9R1.33 CN1C=CC=C1CCN 1703AL [0,1,0,0,1,0|1,0,1]=4 411 B9R1.33 CN1C=CN=C1CCN X3600 [0,1,0,0,1,0|2,0,0]=4 412 B9R1.33 CNCC1=C(Br)C=CS1 8509AC [0,1,0,0,1,0|2,0,0]=4 413 B9R1.33 CNCC1=C(C)C=CS1 3445AC [0,1,0,0,1,0|2,0,0]=4 414 B9R1.33 CNCC1=C(C)C=CS1 V8159 [0,1,0,0,1,0|2,0,0]=4 415 B9R1.33 CNCC1=CC=CN1C 8584AD [0,1,0,0,1,0|1,0,1]=4 416 B9R1.33 CNCC1=CSC=C1Br 9467AH [0,1,0,0,1,0|2,0,0]=4 417 B9R1.33 CNCC1=NC=CN1C 7296AE [0,1,0,0,1,0|2,0,0]=4 418 B11R1.1 BrCCCC1=CC=C(Br)C=C1 Y4633 [0,2,0,0,0,0|1,0,0]=3 419 B11R1.1 C=CCCC1=CC=C(C)C=C1 6965AD [0,2,0,0,0,0|1,0,1]=4 420 B11R1.1 CC1=CC=C(NCCO)C=C1 9296AD [0,2,0,0,0,0|2,0,0]=4 421 B11R1.1 CC1=CC=C(OCCBr)C=C1 V3999 [0,2,0,0,0,0|2,0,0]=4 422 B11R1.1 CC1=CC=C(OCCCl)C=C1 7057AD [0,2,0,0,0,0|2,0,0]=4 423 B11R1.1 CCCCC1=CC=C(C)C=C1 Z2332 [0,2,0,0,0,0|1,0,0]=3 424 B11R1.1 CCCCC1=CC=C(Cl)N=C1 6440AA [0,2,0,0,0,0|2,0,0]=4 425 B11R1.1 CCCCC1=CN=C(C)C=C1 5821AH [0,2,0,0,0,0|2,0,0]=4 426 B11R1.1 CCCNC1=NC=C(Br)C=C1 Z6268 [0,2,0,0,0,0|0,0,0]=2 427 B11R1.1 CCCOC1=NC=C(Br)C=C1 V8001 [0,2,0,0,0,0|0,0,0]=2 428 B11R1.1 CCCOC1=NC=C(Br)C=N1 V8664 [0,2,0,0,0,0|1,0,0]=3 429 B11R1.1 CCNCC1=CC=C(N)C=C1 7272AJ [0,2,0,0,0,0|1,0,0]=3 430 B11R1.1 CCNCC1=CC=C(O)C=C1 6053AJ [0,2,0,0,0,0|1,0,0]=3 431 B11R1.1 CCNCC1=CN=C(Cl)C=C1 S696 [0,2,0,0,0,0|2,0,0]=4 432 B11R1.1 CCOCC1=CC=C(O)C=C1 Z4904 [0,2,0,0,0,0|1,0,0]=3 433 B11R1.1 CNCCC1=CC=C(Br)C=C1 V7496 [0,2,0,0,0,0|1,0,0]=3 434 B11R1.1 COCCC1=CC=C(Br)C=C1 V6879 [0,2,0,0,0,0|1,0,0]=3 435 B11R1.1 COCOC1=CC=C(Br)C=C1 V4696 [0,2,0,0,0,0|2,0,0]=4 436 B11R1.1 ClCCCC1=CC=C(Br)C=C1 Y9960 [0,2,0,0,0,0|1,0,0]=3 437 B11R1.1 ClCCOC1=CC=C(Cl)C=C1 5523AA [0,2,0,0,0,0|2,0,0]=4 438 B11R1.1 FC1=CC=C(CCCBr)C=C1 V4639 [0,2,0,0,0,0|1,0,0]=3 439 B11R1.1 FCCOC1=CC=C(Br)C=C1 V5244 [0,2,0,0,0,0|2,0,0]=4 440 B11R1.1 NCCCC1=CC=C(Cl)C=C1 9748AA [0,2,0,0,0,0|1,0,0]=3 441 B11R1.1 NCCCC1=CC=C(F)C=C1 3289AD [0,2,0,0,0,0|1,0,0]=3 442 B11R1.1 NCCCC1=CC=C(F)C=C1 7357AC [0,2,0,0,0,0|1,0,0]=3 443 B11R1.1 NCCCC1=CC=C(N)C=C1 9266AB [0,2,0,0,0,0|1,0,0]=3 444 B11R1.1 NCCNC1=CC=C(Br)C=N1 0255AB [0,2,0,0,0,0|1,0,0]=3 445 B11R1.1 NCCNC1=CC=C(Cl)C=C1 4194AD [0,2,0,0,0,0|2,0,0]=4 446 B11R1.1 NCCNC1=CC=C(F)C=C1 4360AJ [0,2,0,0,0,0|2,0,0]=4 447 B11R1.1 NCCOC1=CC=C(Br)C=C1 7657AE [0,2,0,0,0,0|2,0,0]=4 448 B11R1.1 NCCSC1=CC=C(Br)C=C1 8241AE [0,2,0,0,0,0|2,0,0]=4 449 B11R1.1 NCCSC1=CC=C(Cl)C=C1 1627AE [0,2,0,0,0,0|2,0,0]=4 450 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 1755AC [0,2,0,0,0,0|1,0,1]=4 451 B11R1.1 OCCCC1=CC=C(Br)N=C1 0074AC [0,2,0,0,0,0|2,0,0]=4 452 B11R1.1 OCCCC1=CC=C(F)C=C1 V7380 [0,2,0,0,0,0|1,0,0]=3 453 B11R1.1 OCCNC1=NC=C(Br)C=C1 2906AF [0,2,0,0,0,0|1,0,0]=3 454 B11R1.1 OCCNC1=NC=C(Br)C=N1 Z8021 [0,2,0,0,0,0|2,0,0]=4 455 B11R1.1 OCCOC1=NC=C(Br)C=C1 Z0377 [0,2,0,0,0,0|1,0,0]=3 456 B11R1.20 CC(=O)NC1=CC=C(O)C=N1 8000AA [0,2,0,0,0,0|1,0,1]=4 457 B11R1.20 CC(=O)NC1=NC=C(C)C=C1 Y9207 [0,2,0,0,0,0|1,0,1]=4 458 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 V3609 [0,2,0,0,0,0|2,0,0]=4 459 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Z0614 [0,2,0,0,0,0|2,0,0]=4 460 B11R1.20 CC(C)OC1=CN=C(Cl)C=N1 1633AA [0,2,0,0,0,0|2,0,0]=4 461 B11R1.20 CC(C)OC1=NC=C(Cl)C=C1 Z0473 [0,2,0,0,0,0|1,0,0]=3 462 B11R1.20 CC(C)OC1=NC=C(F)C=C1 Z9507 [0,2,0,0,0,0|1,0,0]=3 463 B11R1.20 CC(C)OC1=NC=C(I)C=C1 Z1054 [0,2,0,0,0,0|1,0,0]=3 464 B11R1.20 CC(C)OC1=NN=C(Cl)C=C1 0092AE [0,2,0,0,0,0|2,0,0]=4 465 B11R1.20 CC(C)OC1=NN=C(I)C=C1 8934AA [0,2,0,0,0,0|2,0,0]=4 466 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 W8749 [0,2,0,0,0,0|1,0,1]=4 467 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 9998AA [0,2,0,0,0,0|1,0,1]=4 468 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [0,2,0,0,0,0|2,0,0]=4 469 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [0,2,0,0,0,0|2,0,0]=4 470 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 1437AL [0,2,0,0,0,0|1,0,1]=4 471 B11R1.22 CCC(=O)C1=NC=C(Br)C=N1 Y3142 [0,2,0,0,0,0|1,0,1]=4 472 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 1643AC [0,2,0,0,0,0|1,0,0]=3 473 B11R1.22 CCC(N)C1=CC=C(C)C=C1 5656AD [0,2,0,0,0,0|1,0,0]=3 474 B11R1.22 CCC(N)C1=CC=C(F)C=C1 8597AC [0,2,0,0,0,0|1,0,0]=3 475 B11R1.22 CCC(N)C1=CC=C(F)C=C1 9157AE [0,2,0,0,0,0|1,0,0]=3 476 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [0,2,0,0,0,0|1,0,0]=3 477 B11R1.22 CCN(N)C1=CC=C(C)C=C1 4836AL [0,2,0,0,0,0|2,0,0]=4 478 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 1684AB [0,2,0,0,0,0|1,0,0]=3 479 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y6691 [0,2,0,0,0,0|1,0,0]=3 480 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 X9085 [0,2,0,0,0,0|1,0,0]=3 481 B11R1.22 CNC(C)C1=CC=C(F)C=C1 5899AE [0,2,0,0,0,0|2,0,0]=4 482 B11R1.22 COC(C)C1=CC=C(Br)C=C1 6457AE [0,2,0,0,0,0|2,0,0]=4 483 B11R1.22 ClC1=CC=C(C(Br)CBr)C=C1 0999AQ [0,2,0,0,0,0|2,0,0]=4 484 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 9601AB [0,2,0,0,0,0|2,0,0]=4 485 B11R1.22 NCC(O)C1=CC=C(F)C=C1 3928AE [0,2,0,0,0,0|2,0,0]=4 486 B11R1.22 NCC(O)C1=CC=C(F)C=C1 5412AB [0,2,0,0,0,0|2,0,0]=4 487 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 7216AA [0,2,0,0,0,0|1,0,1]=4 488 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 Y4820 [0,2,0,0,0,0|1,0,1]=4 489 B11R1.22 OCC(Cl)C1=CC=C(Cl)C=C1 2030AL [0,2,0,0,0,0|2,0,0]=4 490 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 5554AC [0,2,0,0,0,0|2,0,0]=4 491 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [0,2,0,0,0,0|2,0,0]=4 492 B11R1.81 CCNC1=C(Cl)C=C(Cl)C=C1 4922AH [0,2,0,0,0,0|2,0,0]=4 493 B11R1.81 CCNC1=C(N)C=C(Cl)C=C1 6903AE [0,2,0,0,0,0|2,0,0]=4 494 B11R1.81 CCNC1=C(N)C=C(F)C=C1 V3794 [0,2,0,0,0,0|2,0,0]=4 495 B11R1.81 CCOC1=C(Br)C=C(C)C=C1 Y3561 [0,2,0,0,0,0|2,0,0]=4 496 B11R1.81 CCOC1=C(F)C=C(N)C=N1 Z5272 [0,2,0,0,0,0|1,0,0]=3 497 B11R1.81 CCOC1=C(I)C=C(Br)C=N1 0529AF [0,2,0,0,0,0|1,0,0]=3 498 B11R1.81 CCOC1=CC=C(Cl)C=C1Br Y3880 [0,2,0,0,0,0|2,0,0]=4 499 B11R1.81 CCOC1=CC=C(F)C=C1F Z0530 [0,2,0,0,0,0|2,0,0]=4 500 B11R1.81 CCOC1=CC=C(N)C=C1C 0469AD [0,2,0,0,0,0|2,0,0]=4 501 B11R1.81 CCOC1=NC=C(Br)C=C1Br Z0903 [0,2,0,0,0,0|1,0,0]=3 502 B11R1.81 CCOC1=NC=C(N)C=C1Br Z7984 [0,2,0,0,0,0|1,0,0]=3 503 B11R1.81 CNCC1=CC=C(F)C=C1F 0764AC [0,2,0,0,0,0|2,0,0]=4 504 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 7486AB [0,2,0,0,0,0|2,0,0]=4 505 B11R1.81 NCCC1=CC=C(F)C=C1F 6230AA [0,2,0,0,0,0|2,0,0]=4 506 B11R1.81 NCCC1=NC=C(Cl)C=C1Cl 1080AJ [0,2,0,0,0,0|1,0,0]=3 507 B11R1.83 CCCC1=CC=C(NN)C=C1 1149AE [0,2,0,0,0,0|1,0,0]=3 508 B11R1.83 CCNC1=CC=C(C#N)C=N1 Z6380 [0,2,0,0,0,0|1,0,0]=3 509 B11R1.83 CCOC1=CC=C(NN)C=C1 9336AE [0,2,0,0,0,0|2,0,0]=4 510 B11R1.83 CCOC1=NC=C(C#N)C=C1 8337AC [0,2,0,0,0,0|1,0,0]=3 511 B11R1.83 CCOC1=NC=C(CN)C=C1 6330AE [0,2,0,0,0,0|1,0,0]=3 512 B11R1.83 COCC1=CC=C(CO)C=C1 8790AH [0,2,0,0,0,0|2,0,0]=4 513 B11R1.83 COCC1=CC=C(OC)C=C1 W3311 [0,2,0,0,0,0|2,0,0]=4 514 B11R1.83 COCC1=NC=C(C=O)C=N1 4865AH [0,2,0,0,0,0|2,0,0]=4 515 B11R1.83 N#CC1=CC=C(CCCl)C=C1 4983AA [0,2,0,0,0,0|2,0,0]=4 516 B11R1.83 N#CC1=CC=C(CCN)C=C1 W3652 [0,2,0,0,0,0|2,0,0]=4 517 B11R1.83 NCCC1=CC=C(CO)C=C1 9331AH [0,2,0,0,0,0|2,0,0]=4 518 B11R1.83 O=CC1=CC=C(CCO)C=C1 8288AA [0,2,0,0,0,0|2,0,0]=4 519 B11R1.192 CCNC1=CC(C)=C(C)C=C1 8938AD [0,2,0,0,0,0|2,0,0]=4 520 B11R1.192 CCNC1=CC(F)=C(F)C=C1 3983AD [0,2,0,0,0,0|2,0,0]=4 521 B11R1.192 CCOC1=CC(C)=C(N)C=C1 9507AC [0,2,0,0,0,0|2,0,0]=4 522 B11R1.192 CCOC1=CC(F)=C(N)C=C1 6418AB [0,2,0,0,0,0|2,0,0]=4 523 B11R1.192 CCOC1=CC=C(Br)C(C)=N1 Z0727 [0,2,0,0,0,0|1,0,0]=3 524 B11R1.192 CCOC1=CC=C(N)C(F)=C1 V5603 [0,2,0,0,0,0|2,0,0]=4 525 B11R1.192 CCOC1=CC=C(N)C(N)=C1 X9397 [0,2,0,0,0,0|2,0,0]=4 526 B11R1.192 CCOC1=NC=C(Br)C(C)=C1 Z0729 [0,2,0,0,0,0|1,0,0]=3 527 B11R1.192 CCOC1=NC=C(F)C(N)=N1 Z4887 [0,2,0,0,0,0|2,0,0]=4 528 B11R1.192 FC1=C(Cl)C=C(CCBr)C=C1 4994AA [0,2,0,0,0,0|2,0,0]=4 529 B11R1.192 NCCC1=CC=C(F)C(F)=C1 1164AB [0,2,0,0,0,0|2,0,0]=4 530 B11R1.192 OCCC1=CC=C(F)C(F)=C1 X7944 [0,2,0,0,0,0|2,0,0]=4 531 B11R1.13 CCCC1=C(O)C(O)=CC=C1 2907AB [0,2,0,0,0,0|1,0,0]=3 532 B11R1.13 CCNC1=C(Cl)C(Cl)=CC=C1 4902AH [0,2,0,0,0,0|2,0,0]=4 533 B11R1.13 CCOC1=C(I)C(Br)=CC=C1 Z6996 [0,2,0,0,0,0|2,0,0]=4 534 B11R1.13 CCOC1=C(N)C(Br)=CC=C1 Z7005 [0,2,0,0,0,0|2,0,0]=4 535 B11R1.13 CCOC1=C(N)C(C)=CC=N1 6176AA [0,2,0,0,0,0|1,0,0]=3 536 B11R1.13 CNCC1=C(F)C(Br)=CC=C1 Z9436 [0,2,0,0,0,0|2,0,0]=4 537 B11R1.13 CNCC1=C(F)C(F)=CC=C1 7285AJ [0,2,0,0,0,0|2,0,0]=4 538 B11R1.13 CNCC1=CC=CC(Cl)=C1Cl W8144 [0,2,0,0,0,0|2,0,0]=4 539 B11R1.17 C=CCCC1=C(Br)C=CC=C1 8652AE [0,2,0,0,0,0|1,0,1]=4 540 B11R1.17 C=CCNC1=NC=CC=C1N 8458AC [0,2,0,0,0,0|0,0,2]=4 541 B11R1.17 CC1=C(NCCO)C=CC=C1 4010AD [0,2,0,0,0,0|2,0,0]=4 542 B11R1.17 CC1=C(OCCCl)C=CC=C1 7182AD [0,2,0,0,0,0|2,0,0]=4 543 B11R1.17 CC1=CC=CC=C1OCCBr 9799AA [0,2,0,0,0,0|2,0,0]=4 544 B11R1.17 CC1=CC=CC=C1OCCN 8788AD [0,2,0,0,0,0|2,0,0]=4 545 B11R1.17 CCCNC1=C(Cl)C=CC=C1 5500AE [0,2,0,0,0,0|1,0,0]=3 546 B11R1.17 CCCNC1=NC=CC=C1N 3687AE [0,2,0,0,0,0|0,0,0]=2 547 B11R1.17 CCCOC1=NC=CC=C1N 8654AB [0,2,0,0,0,0|0,0,0]=2 548 B11R1.17 CCNCC1=C(O)C=CC=C1 5372AJ [0,2,0,0,0,0|1,0,0]=3 549 B11R1.17 CCNCC1=NC=CC=C1C 4242AF [0,2,0,0,0,0|0,0,0]=2 550 B11R1.17 CCSCC1=CC=CC=C1Br V9925 [0,2,0,0,0,0|1,0,0]=3 551 B11R1.17 CNCCC1=C(F)C=CC=C1 4862AJ [0,2,0,0,0,0|1,0,0]=3 552 B11R1.17 ClC1=CC=CC=C1CCCBr V6557 [0,2,0,0,0,0|1,0,0]=3 553 B11R1.17 FC1=C(OCCBr)C=CC=C1 6522AD [0,2,0,0,0,0|2,0,0]=4 554 B11R1.17 FC1=CC=CC=C1CCCBr Z9473 [0,2,0,0,0,0|1,0,0]=3 555 B11R1.17 N#CCCC1=C(N)C=CC=C1 8000AB [0,2,0,0,0,0|1,0,1]=4 556 B11R1.17 NC1=CC=CC=C1NCCO V8097 [0,2,0,0,0,0|2,0,0]=4 557 B11R1.17 NC1=CC=CC=C1OCCBr V2926 [0,2,0,0,0,0|2,0,0]=4 558 B11R1.17 NC1=CC=CN=C1NCCO 0651AD [0,2,0,0,0,0|1,0,0]=3 559 B11R1.17 NCCOC1=C(Cl)C=CC=C1 8744AD [0,2,0,0,0,0|2,0,0]=4 560 B11R1.17 OCCCC1=C(O)C=CN=C1 0921AD [0,2,0,0,0,0|2,0,0]=4 561 B11R1.17 OCCOC1=CC=CC=C1Br Z2369 [0,2,0,0,0,0|2,0,0]=4 562 B11R1.17 OCCOC1=CC=CC=C1O 6575AB [0,2,0,0,0,0|2,0,0]=4 563 B11R1.41 CCNC1=C(OC)C=CC=C1 0860AF [0,2,0,0,0,0|2,0,0]=4 564 B11R1.41 CCNC1=CC=CC=C1C#N V5011 [0,2,0,0,0,0|2,0,0]=4 565 B11R1.41 CCOC1=C(CO)C=CC=C1 5602AL [0,2,0,0,0,0|2,0,0]=4 566 B11R1.41 CCOC1=CC=CC=C1CCl 9104AB [0,2,0,0,0,0|2,0,0]=4 567 B11R1.41 CCOC1=CC=CC=C1NC 6851AD [0,2,0,0,0,0|2,0,0]=4 568 B11R1.41 CCOC1=CC=CC=C1NN 3391AD [0,2,0,0,0,0|2,0,0]=4 569 B11R1.41 CCOC1=CC=CC=C1OC 1622AL [0,2,0,0,0,0|2,0,0]=4 570 B11R1.41 CCOC1=NC=CC=C1C=O 4245AC [0,2,0,0,0,0|1,0,0]=3 571 B11R1.41 CNCC1=C(CO)C=CC=C1 5373AJ [0,2,0,0,0,0|2,0,0]=4 572 B11R1.86 CC(=O)CC1=CC=CC=C1C 7072AB [0,2,0,0,0,0|1,0,1]=4 573 B11R1.86 CC(=O)CC1=CC=CC=C1O 5670AA [0,2,0,0,0,0|1,0,1]=4 574 B11R1.86 CC(=O)NC1=NC=CC=C1O 9933AD [0,2,0,0,0,0|1,0,1]=4 575 B11R1.86 CC(C)CC1=C(N)C=CC=C1 5195AJ [0,2,0,0,0,0|1,0,0]=3 576 B11R1.86 CC1=CC=CN=C1CC(C)O 9155AE [0,2,0,0,0,0|0,0,0]=2 577 B11R1.86 CN(C)CC1=C(F)C=CC=C1 1557AB [0,2,0,0,0,0|2,0,0]=4 578 B11R1.86 CN(C)CC1=C(N)C=CC=C1 9911AA [0,2,0,0,0,0|2,0,0]=4 579 B11R1.86 CN(C)CC1=C(O)C=CC=C1 8448AD [0,2,0,0,0,0|2,0,0]=4 580 B11R1.182 CCNC1=C(Cl)C=CC(Cl)=C1 4930AH [0,2,0,0,0,0|2,0,0]=4 581 B11R1.182 CCNC1=NC(Br)=CN=C1N X9214 [0,2,0,0,0,0|2,0,0]=4 582 B11R1.182 CCOC1=C(N)C=CC(C)=C1 7919AD [0,2,0,0,0,0|2,0,0]=4 583 B11R1.182 CCOC1=C(N)C=CC(F)=C1 5982AD [0,2,0,0,0,0|2,0,0]=4 584 B11R1.182 CCOC1=CC(Br)=CC=C1C Z0931 [0,2,0,0,0,0|2,0,0]=4 585 B11R1.182 CCOC1=CC(F)=CC=C1N V8042 [0,2,0,0,0,0|2,0,0]=4 586 B11R1.182 CCOC1=CC(N)=CC=C1Cl V8087 [0,2,0,0,0,0|2,0,0]=4 587 B11R1.182 CCOC1=NC(Cl)=CN=C1N 4921AA [0,2,0,0,0,0|2,0,0]=4 588 B11R1.182 CNCC1=CC(Br)=CC=C1F V4011 [0,2,0,0,0,0|2,0,0]=4 589 B11R1.182 CNCC1=CC(Cl)=CC=C1Cl 5047AC [0,2,0,0,0,0|2,0,0]=4 590 B11R1.182 CNCC1=CC(F)=CC=C1O 6161AJ [0,2,0,0,0,0|2,0,0]=4 591 B11R1.222 CCC(=O)C1=NC=CC=C1C V9138 [0,2,0,0,0,0|0,0,1]=3 592 B11R1.222 CC[C@@H](N)C1=CC=CC=C1C W8813 [0,2,0,0,0,0|1,0,0]=3 593 B11R1.222 CC[C@H](N)C1=CC=CC=C1Cl W8965 [0,2,0,0,0,0|1,0,0]=3 594 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 5504AB [0,2,0,0,0,0|2,0,0]=4 595 B11R1.222 NCC(O)C1=CC=CC=C1F 3587AB [0,2,0,0,0,0|2,0,0]=4 596 B11R1.605 CCCC1=C(O)C=CC=C1O 3805AD [0,2,0,0,0,0|1,0,0]=3 597 B11R1.605 CCNC1=C(Cl)C=CC=C1Cl 4936AH [0,2,0,0,0,0|2,0,0]=4 598 B11R1.605 CCOC1=C(C)C=CC=C1N Z9878 [0,2,0,0,0,0|2,0,0]=4 599 B11R1.605 CCOC1=C(N)C=CC=C1Cl 5168AE [0,2,0,0,0,0|2,0,0]=4 600 B11R1.605 OCCC1=C(F)C=CC=C1Cl X8207 [0,2,0,0,0,0|2,0,0]=4 601 B11R1.605 OCCC1=C(F)C=CC=C1F 8621AA [0,2,0,0,0,0|2,0,0]=4 602 B11R1.23 CC(CO)C1=CC=CC(=O)C1 W6317 [0,2,0,0,0,0|2,0,0]=4 603 B11R1.23 CC1=CC=CC(C(O)CN)=C1 7583AB [0,2,0,0,0,0|2,0,0]=4 604 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 2535AE [0,2,0,0,0,0|1,0,0]=3 605 B11R1.23 CCC(N)C1=CC(N)=CC=C1 1913AJ [0,2,0,0,0,0|1,0,0]=3 606 B11R1.23 CCC(N)C1=NC=CC(C)=C1 9648AC [0,2,0,0,0,0|0,0,0]=2 607 B11R1.23 CCS(=O)C1=CC(Br)=CC=C1 V3491 [0,2,0,0,0,0|2,0,0]=4 608 B11R1.23 CC[C@@H](N)C1=CC=CC(F)=C1 X9176 [0,2,0,0,0,0|1,0,0]=3 609 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 9082AH [0,2,0,0,0,0|1,0,0]=3 610 B11R1.23 CNC(=O)C1=NC(Br)=CC=C1 V5271 [0,2,0,0,0,0|1,0,1]=4 611 B11R1.23 COC(=O)C1=NC=CC(O)=C1 4279AJ [0,2,0,0,0,0|1,0,1]=4 612 B11R1.23 NC(CO)C1=CC(Cl)=CC=C1 3155AH [0,2,0,0,0,0|2,0,0]=4 613 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 2712AC [0,2,0,0,0,0|2,0,0]=4 614 B11R1.23 NCC(O)C1=CC(F)=CC=C1 5405AB [0,2,0,0,0,0|2,0,0]=4 615 B11R1.23 N[C@@H](CO)C1=CC(Cl)=CC=C1 N836 [0,2,0,0,0,0|2,0,0]=4 616 B11R1.23 OCC(Cl)C1=CC=CC(Cl)=C1 2029AL [0,2,0,0,0,0|2,0,0]=4 617 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 X3148 [0,2,0,0,0,0|2,0,0]=4 618 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 6985AA [0,2,0,0,0,0|2,0,0]=4 619 B11R1.24 BrCCOC1=CC(Br)=CC=C1 6325AD [0,2,0,0,0,0|2,0,0]=4 620 B11R1.24 C=CCCC1=CC=CC(Cl)=C1 2995AF [0,2,0,0,0,0|1,0,1]=4 621 B11R1.24 CC1=CC(CCCO)=CC=C1 3205AH [0,2,0,0,0,0|1,0,0]=3 622 B11R1.24 CC1=CC(OCCBr)=CC=C1 7438AE [0,2,0,0,0,0|2,0,0]=4 623 B11R1.24 CC1=CC=CC(OCCO)=C1 5007AL [0,2,0,0,0,0|2,0,0]=4 624 B11R1.24 CCCNC1=CC(C)=CC=C1 4247AD [0,2,0,0,0,0|1,0,0]=3 625 B11R1.24 CCCNC1=CC(Cl)=CC=C1 9833AD [0,2,0,0,0,0|1,0,0]=3 626 B11R1.24 CCCNC1=NC=CC(Br)=C1 Z9400 [0,2,0,0,0,0|0,0,0]=2 627 B11R1.24 CCCOC1=NC(C)=CN=C1 0447AC [0,2,0,0,0,0|1,0,0]=3 628 B11R1.24 CCOCC1=NC(N)=CC=N1 3327AB [0,2,0,0,0,0|1,0,0]=3 629 B11R1.24 CNCCC1=CC(C)=CC=C1 V2677 [0,2,0,0,0,0|1,0,0]=3 630 B11R1.24 CNCCC1=CC=CC(Cl)=C1 V6388 [0,2,0,0,0,0|1,0,0]=3 631 B11R1.24 CNCCC1=CC=CC(F)=C1 V6333 [0,2,0,0,0,0|1,0,0]=3 632 B11R1.24 ClC1=CC(CCCBr)=CC=C1 V8963 [0,2,0,0,0,0|1,0,0]=3 633 B11R1.24 ClC1=CC(OCCBr)=CC=C1 7390AE [0,2,0,0,0,0|2,0,0]=4 634 B11R1.24 NC1=CC=CC(C\C=N\O)=N1 3559AF [0,2,0,0,0,0|1,0,1]=4 635 B11R1.24 NCCOC1=CC(Cl)=CC=C1 7394AE [0,2,0,0,0,0|2,0,0]=4 636 B11R1.24 NCCOC1=CC=CC(F)=C1 Z8223 [0,2,0,0,0,0|2,0,0]=4 637 B11R1.24 O=CCCC1=CC=CC(Cl)=C1 3971AD [0,2,0,0,0,0|1,0,1]=4 638 B11R1.24 O=CCCC1=CC=CC(F)=C1 1852AB [0,2,0,0,0,0|1,0,1]=4 639 B11R1.24 OCCCC1=CC(O)=CC=C1 W3104 [0,2,0,0,0,0|1,0,0]=3 640 B11R1.24 OCCCC1=CC=CC(Cl)=C1 V4535 [0,2,0,0,0,0|1,0,0]=3 641 B11R1.24 OCCNC1=NC=NC(Cl)=C1 7594AD [0,2,0,0,0,0|2,0,0]=4 642 B11R1.34 CCCC1=CC(O)=CC(=O)O1 2834AJ [0,2,0,0,0,0|1,0,0]=3 643 B11R1.34 CCNC1=CC(=O)NC(N)=N1 Z2501 [0,2,0,0,0,0|2,0,0]=4 644 B11R1.34 CCNC1=CC(Cl)=CC(Cl)=C1 4259AH [0,2,0,0,0,0|2,0,0]=4 645 B11R1.34 CCOC1=CC(Br)=CC(Br)=C1 Z0144 [0,2,0,0,0,0|2,0,0]=4 646 B11R1.34 CCOC1=CC(Cl)=NC(N)=N1 W9256 [0,2,0,0,0,0|2,0,0]=4 647 B11R1.34 CCOC1=CC(F)=CC(F)=C1 Z0191 [0,2,0,0,0,0|2,0,0]=4 648 B11R1.34 CCOC1=CC(N)=NC(N)=N1 Y4911 [0,2,0,0,0,0|2,0,0]=4 649 B11R1.34 CCOC1=NC(=O)C=C(C)N1 5641AE [0,2,0,0,0,0|2,0,0]=4 650 B11R1.34 CCOC1=NC(Cl)=CC(Cl)=N1 W6132 [0,2,0,0,0,0|2,0,0]=4 651 B11R1.34 CCOC1=NC(Cl)=CC(N)=N1 W5460 [0,2,0,0,0,0|2,0,0]=4 652 B11R1.34 CCOC1=NC(F)=CC(F)=N1 8476AA [0,2,0,0,0,0|2,0,0]=4 653 B11R1.34 CCOC1=NC(N)=CC(=O)N1 5133AE [0,2,0,0,0,0|2,0,0]=4 654 B11R1.34 CCOC1=NC(O)=CC(O)=N1 Y4967 [0,2,0,0,0,0|2,0,0]=4 655 B11R1.34 CNCC1=CC(Cl)=CC(Cl)=C1 2304AL [0,2,0,0,0,0|2,0,0]=4 656 B11R1.34 CNCC1=CC(F)=CC(F)=C1 2725AF [0,2,0,0,0,0|2,0,0]=4 657 B11R1.34 NCCC1=CC(F)=CC(F)=C1 3314AB [0,2,0,0,0,0|2,0,0]=4 658 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 Z4417 [0,2,0,0,0,0|1,0,1]=4 659 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 6862AA [0,2,0,0,0,0|1,0,1]=4 660 B11R1.157 CC(=O)CC1=NC(C)=CC=C1 9512AH [0,2,0,0,0,0|0,0,1]=3 661 B11R1.157 CC(=O)CC1=NC=CC(C)=C1 3153AE [0,2,0,0,0,0|0,0,1]=3 662 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 1694AC [0,2,0,0,0,0|1,0,1]=4 663 B11R1.157 CC(C)NC1=NC(Br)=CC=C1 V8760 [0,2,0,0,0,0|1,0,0]=3 664 B11R1.157 CC(C)NC1=NC=NC(Cl)=C1 V9451 [0,2,0,0,0,0|2,0,0]=4 665 B11R1.157 CC(C)OC1=CC=CC(Br)=N1 V6058 [0,2,0,0,0,0|1,0,0]=3 666 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 X7036 [0,2,0,0,0,0|1,0,1]=4 667 B11R1.157 CC1=CC=CC(CC(C)N)=N1 1063AC [0,2,0,0,0,0|0,0,0]=2 668 B11R1.157 CC1=CC=CC(CC(C)O)=N1 7595AE [0,2,0,0,0,0|0,0,0]=2 669 B11R1.189 CCCC1=NC=CC(C#N)=C1 Z2605 [0,2,0,0,0,0|0,0,0]=2 670 B11R1.189 CCOC1=NC=CC(C#N)=C1 1085AF [0,2,0,0,0,0|1,0,0]=3 671 B11R1.189 COCC1=CC(CN)=CC=C1 7382AA [0,2,0,0,0,0|2,0,0]=4 672 B11R1.7 CC(C)(CN)C1=CC=CC=C1 0879AB [0,2,0,0,0,0|2,0,0]=4 673 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Y6483 [0,2,0,0,0,0|2,0,0]=4 674 B11R1.7 CC(O)(CN)C1=CC=CC=C1 4663AH [0,2,0,0,0,0|2,0,0]=4 675 B11R1.7 CCC(F)(F)C1=CC=CC=C1 9060AE [0,2,0,0,0,0|1,0,0]=3 676 B11R1.7 CCS(=O)(=O)C1=CC=CC=C1 M421 [0,2,0,0,0,0|2,0,0]=4 677 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 Y7004 [0,2,0,0,0,0|2,0,0]=4 678 B11R1.7 NCC(F)(F)C1=NC=CC=C1 2429AB [0,2,0,0,0,0|1,0,0]=3 679 B11R1.12 CCC(CC)C1=NC=CC=C1 5008AL [0,2,0,0,0,0|0,0,0]=2 680 B11R1.12 CCC(CN)C1=CC=CC=C1 V4239 [0,2,0,0,0,0|1,0,0]=3 681 B11R1.12 CCC(NC)C1=CC=CC=C1 8595AL [0,2,0,0,0,0|1,0,0]=3 682 B11R1.12 CCC(NN)C1=CC=CC=C1 8342AH [0,2,0,0,0,0|1,0,0]=3 683 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 3045AC [0,2,0,0,0,0|2,0,0]=4 684 B11R1.12 CN[C@H](CO)C1=CC=CC=C1 7034AA [0,2,0,0,0,0|2,0,0]=4 685 B11R1.16 C#CCC(N)C1=CC=CC=C1 2882AA [0,2,0,0,0,0|1,0,1]=4 686 B11R1.16 C=CC[C@@H](N)C1=CC=CC=C1 1033AL [0,2,0,0,0,0|1,0,1]=4 687 B11R1.16 CC(CCN)C1=CC=CC=C1 2059AE [0,2,0,0,0,0|1,0,0]=3 688 B11R1.16 CCCC(N)C1=CC=NC=C1 4969AJ [0,2,0,0,0,0|2,0,0]=4 689 B11R1.16 CCCC(N)C1=CN=CC=C1 4944AJ [0,2,0,0,0,0|2,0,0]=4 690 B11R1.16 CCCC(N)C1=NC=CC=C1 5079AC [0,2,0,0,0,0|0,0,0]=2 691 B11R1.16 CCNC(C)C1=CC=CC=C1 7343AC [0,2,0,0,0,0|1,0,0]=3 692 B11R1.16 CN(CCN)C1=CC=CC=C1 5337AD [0,2,0,0,0,0|2,0,0]=4 693 B11R1.16 CNCC(C)C1=CC=CC=C1 3764AF [0,2,0,0,0,0|1,0,0]=3 694 B11R1.16 CNCC(C)C1=CC=CC=C1 6409AE [0,2,0,0,0,0|1,0,0]=3 695 B11R1.16 ClCCC(Br)C1=CC=CC=C1 V4390 [0,2,0,0,0,0|1,0,0]=3 696 B11R1.16 N#CCC(N)C1=NC=CC=C1 Z9347 [0,2,0,0,0,0|0,0,1]=3 697 B11R1.36 CC(C)C(N)C1=CC=CC=C1 1780AB [0,2,0,0,0,0|1,0,0]=3 698 B11R1.36 CC(C)C(N)C1=CC=CC=N1 9319AH [0,2,0,0,0,0|0,0,0]=2 699 B11R1.36 CC(C)C(N)C1=CC=NC=C1 1775AJ [0,2,0,0,0,0|2,0,0]=4 700 B11R1.36 CC(C)[C@H](O)C1=CC=CC=C1 N145 [0,2,0,0,0,0|1,0,0]=3 701 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 Z5933 [0,2,0,0,0,0|1,0,1]=4 702 B11R1.28 CNCCCC1=CC=CC=C1 1600AB [0,2,0,0,0,0|1,0,0]=3 703 B11R1.28 CNCCCC1=CC=CC=C1 3594AL [0,2,0,0,0,0|1,0,0]=3 704 B11R1.28 CNCCCC1=CC=CC=N1 7821AA [0,2,0,0,0,0|0,0,0]=2 705 B11R1.28 ClCCCOC1=CC=CC=C1 0684AE [0,2,0,0,0,0|1,0,0]=3 706 B11R1.28 ClCCNCC1=CC=CC=C1 3046AE [0,2,0,0,0,0|1,0,0]=3 707 B11R1.28 ClCCNCC1=CC=CC=C1 7007AE [0,2,0,0,0,0|1,0,0]=3 708 B11R1.28 ClCCOCC1=CC=CC=C1 8862AA [0,2,0,0,0,0|1,0,0]=3 709 B11R1.28 N#CCNCC1=CC=CC=C1 3124AB [0,2,0,0,0,0|1,0,1]=4 710 B11R1.28 NOCOCC1=CC=CC=C1 2357AF [0,2,0,0,0,0|2,0,0]=4 711 B11R1.28 OCCCCC1=CC=CN=C1 5963AJ [0,2,0,0,0,0|2,0,0]=4 712 B11R1.28 OCCCCC1=CC=NC=C1 5977AJ [0,2,0,0,0,0|2,0,0]=4 713 B11R1.28 OCCCCC1=NC=CC=C1 6014AJ [0,2,0,0,0,0|0,0,0]=2 714 B11R1.28 OCCNCC1=CC=CC=N1 0192AC [0,2,0,0,0,0|0,0,0]=2 715 B11R1.28 OCCNCC1=CC=CN=C1 8414AE [0,2,0,0,0,0|2,0,0]=4 716 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y7506 [0,2,0,0,0,0|1,0,1]=4 717 B11R1.40 CC(C#N)NC1=CC=CC=C1 5308AJ [0,2,0,0,0,0|2,0,0]=4 718 B11R1.40 CC(CN)CC1=CC=CC=C1 2217AC [0,2,0,0,0,0|1,0,0]=3 719 B11R1.40 CC(CN)OC1=CC=CC=C1 Y9709 [0,2,0,0,0,0|2,0,0]=4 720 B11R1.40 CCC(=O)OC1=CC=CC=C1 8795AL [0,2,0,0,0,0|1,0,1]=4 721 B11R1.40 CNC(C)CC1=NC=CN=C1 3718AF [0,2,0,0,0,0|1,0,0]=3 722 B11R1.40 COC(=O)CC1=NC=NC=C1 Y1676 [0,2,0,0,0,0|1,0,1]=4 723 B11R1.91 CC(=N)NCC1=CC=CC=C1 1916AH [0,2,0,0,0,0|1,0,1]=4 724 B11R1.91 CC(=N)SCC1=CC=CC=C1 3158AL [0,2,0,0,0,0|1,0,1]=4 725 B11R1.91 CC(C)NCC1=CN=CC=C1 7190AJ [0,2,0,0,0,0|2,0,0]=4 726 B11R1.91 CC(Cl)COC1=CC=CC=C1 4945AL [0,2,0,0,0,0|1,0,0]=3 727 B11R1.91 CC(N)COC1=CC=CC=C1 4356AB [0,2,0,0,0,0|1,0,0]=3 728 B11R1.91 N=C(N)CCC1=CC=CC=C1 8227AD [0,2,0,0,0,0|1,0,1]=4 729 B11R1.91 NC(=O)CCC1=NC=CC=C1 5628AJ [0,2,0,0,0,0|0,0,1]=3 730 B11R1.91 O=C(O)CCC1=NC=CC=C1 V3472 [0,2,0,0,0,0|0,0,1]=3 731 B11R1.91 O=C(O)CCC1=NC=CC=N1 6060AB [0,2,0,0,0,0|1,0,1]=4 732 B11R1.91 O=C(O)CSC1=NC=CC=C1 7051AC [0,2,0,0,0,0|1,0,1]=4 733 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 5351AA [0,2,0,0,0,0|2,0,0]=4 734 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 7156AL [0,2,0,0,0,0|2,0,0]=4 735 B11R1.509 C[Si](C)(Cl)CC1=CC=CC=C1 7150AL [0,2,0,0,0,0|1,1,0]=4 736 B9R2.2 C1=CN(C2CC2)C=C1 4548AE [0,0,0,1,1,0|1,0,0]=3 737 B9R2.2 C1=CN(C2CC2)C=N1 3906AD [0,0,0,1,1,0|2,0,0]=4 738 B9R2.2 C1=CNC(C2CC2)=N1 5533AJ [0,0,0,1,1,0|1,0,0]=3 739 B9R2.2 C1=NNC(C2CC2)=N1 1040AD [0,0,0,1,1,0|2,0,0]=4 740 B9R2.3 C1=NN2CCCC2=C1 1601AA [0,0,0,1,1,0|1,0,0]=3 741 B11R2.34 BrC1=CC=C(C2CC2)N=C1 8560AB [0,1,0,1,0,0|0,0,0]=2 742 B11R2.34 BrC1=CC=C(C2CC2)N=N1 2208AJ [0,1,0,1,0,0|1,0,0]=3 743 B11R2.34 BrC1=CC=C(C2CO2)C=C1 1753AL [0,1,0,1,0,0|2,0,0]=4 744 B11R2.34 ClC1=CC=C(C2CO2)C=C1 0625AQ [0,1,0,1,0,0|2,0,0]=4 745 B11R2.34 ClC1=NC=C(C2CC2)C=C1 Y3582 [0,1,0,1,0,0|2,0,0]=4 746 B11R2.34 FC1=CC=C(C2CO2)C=C1 0449AQ [0,1,0,1,0,0|2,0,0]=4 747 B11R2.34 NC1=CN=C(C2CC2)N=C1 2502AA [0,1,0,1,0,0|1,0,0]=3 748 B11R2.36 BrC1=CC=C2CCNC2=C1 3136AA [0,1,0,1,0,0|2,0,0]=4 749 B11R2.36 CC1=CC=C2CCNC2=C1 3598AJ [0,1,0,1,0,0|2,0,0]=4 750 B11R2.36 CC1=NC=C2CSCC2=N1 U689 [0,1,0,1,0,0|2,0,0]=4 751 B11R2.36 ClC1=CC2=C(C=C1)CNC2 0868AC [0,1,0,1,0,0|2,0,0]=4 752 B11R2.36 FC1=CC2=C(C=C1)CCC2 Z4670 [0,1,0,1,0,0|1,0,0]=3 753 B11R2.36 FC1=CC2=C(C=C1)CCN2 Z5776 [0,1,0,1,0,0|2,0,0]=4 754 B11R2.36 FC1=CC2=C(C=C1)CNC2 8495AB [0,1,0,1,0,0|2,0,0]=4 755 B11R2.36 FC1=CC=C2NCCC2=C1 3212AJ [0,1,0,1,0,0|2,0,0]=4 756 B11R2.36 IC1=CC2=C(C=C1)CCC2 3759AD [0,1,0,1,0,0|1,0,0]=3 757 B11R2.36 IC1=CC2=C(C=C1)NCC2 3233AJ [0,1,0,1,0,0|2,0,0]=4 758 B11R2.36 IC1=CC=C2NCCC2=C1 3234AJ [0,1,0,1,0,0|2,0,0]=4 759 B11R2.36 NC1=CC2=C(C=C1)CCN2 9087AD [0,1,0,1,0,0|2,0,0]=4 760 B11R2.36 NC1=CC2=C(C=C1)NCC2 5784AH [0,1,0,1,0,0|2,0,0]=4 761 B11R2.36 NC1=CC=C2OCCC2=C1 Z7258 [0,1,0,1,0,0|2,0,0]=4 762 B11R2.36 NC1=NC2=C(C=N1)CCO2 1793AF [0,1,0,1,0,0|2,0,0]=4 763 B11R2.36 NC1=NC=C2CCCC2=N1 8566AC [0,1,0,1,0,0|1,0,0]=3 764 B11R2.36 NC1=NC=C2SCCC2=N1 0585AQ [0,1,0,1,0,0|2,0,0]=4 765 B11R2.36 O=C1C=CC2=C(CCC2)N1 V8629 [0,1,0,1,0,0|0,0,1]=3 766 B11R2.36 OC1=CC=C2CCOC2=C1 W4735 [0,1,0,1,0,0|2,0,0]=4 767 B11R2.36 OC1=CC=C2OCCC2=C1 X7949 [0,1,0,1,0,0|2,0,0]=4 768 B11R2.10 CC1=CC2=NC=CC=C2N1 W8141 [0,1,0,1,0,0|0,0,2]=4 769 B11R2.20 C1=CC2=C(C=C1)CNNC2 5003AJ [0,1,0,1,0,0|2,0,0]=4 770 B11R2.20 C1=CC2=C(C=C1)OCCN2 6903AC [0,1,0,1,0,0|2,0,0]=4 771 B11R2.20 C1=CC2=C(C=N1)CCNC2 W5369 [0,1,0,1,0,0|2,0,0]=4 772 B11R2.20 C1=CC2=C(CCNC2)N=C1 W8563 [0,1,0,1,0,0|0,0,0]=2 773 B11R2.20 C1=CC2=C(CNCC2)N=C1 6451AA [0,1,0,1,0,0|0,0,0]=2 774 B11R2.20 C1=CC2=C(CNCC2)N=C1 Z4098 [0,1,0,1,0,0|0,0,0]=2 775 B11R2.20 C1=CC=C2CCN=CC2=C1 3596AB [0,1,0,1,0,0|1,0,1]=4 776 B11R2.20 C1=CN=C2CCCOC2=C1 8439AE [0,1,0,1,0,0|0,0,0]=2 777 B11R2.20 C1=NC=C2CCNCC2=C1 9567AH [0,1,0,1,0,0|2,0,0]=4 778 B11R2.20 C1=NC=NC2=C1CNCC2 W4126 [0,1,0,1,0,0|1,0,0]=3 779 B11R2.20 C1=NC=NC2=C1CNCC2 W4399 [0,1,0,1,0,0|1,0,0]=3 780 B11R2.55 BrC1=C(C2CC2)C=CC=C1 8539AB [0,1,0,1,0,0|1,0,0]=3 781 B11R2.55 FC1=NC=CC=C1C2CC2 Y3884 [0,1,0,1,0,0|2,0,0]=4 782 B11R2.55 NC1=CC=CC=C1C2CC2 Z0502 [0,1,0,1,0,0|1,0,0]=3 783 B11R2.106 BrC1=C2NCCC2=CC=C1 3688AJ [0,1,0,1,0,0|2,0,0]=4 784 B11R2.106 BrC1=CC=CC2=C1CNC2 X9689 [0,1,0,1,0,0|2,0,0]=4 785 B11R2.106 CC1=C2CCNC2=CC=C1 3110AA [0,1,0,1,0,0|2,0,0]=4 786 B11R2.106 CC1=C2NCCC2=CC=C1 0068AC [0,1,0,1,0,0|2,0,0]=4 787 B11R2.106 CC1=CC=CC2=C1CNC2 Y9957 [0,1,0,1,0,0|2,0,0]=4 788 B11R2.106 ClC1=CC=CC2=C1CCO2 2671AL [0,1,0,1,0,0|2,0,0]=4 789 B11R2.106 FC1=CC=CC2=C1CCN2 Y9446 [0,1,0,1,0,0|2,0,0]=4 790 B11R2.106 IC1=C2CCNC2=CC=C1 3116AA [0,1,0,1,0,0|2,0,0]=4 791 B11R2.106 IC1=CC=CC2=C1CCN2 Y4772 [0,1,0,1,0,0|2,0,0]=4 792 B11R2.106 NC1=C2CCCC2=NC=C1 Z5126 [0,1,0,1,0,0|0,0,0]=2 793 B11R2.106 NC1=CC=CC2=C1CNC2 5573AC [0,1,0,1,0,0|2,0,0]=4 794 B11R2.106 NC1=NC=NC2=C1CCC2 8863AD [0,1,0,1,0,0|1,0,0]=3 795 B11R2.106 O=C1C=CC=C2NCCN12 0091AA [0,1,0,1,0,0|1,0,1]=4 796 B11R2.35 BrC1=CC(C2CC2)=CN=C1 Y3583 [0,1,0,1,0,0|2,0,0]=4 797 B11R2.35 BrC1=CC(C2CC2)=NC=C1 1717AA [0,1,0,1,0,0|0,0,0]=2 798 B11R2.35 ClC1=CC([C@@H]2CO2)=CC=C1 I069 [0,1,0,1,0,0|2,0,0]=4 799 B11R2.35 NC1=NC=CC(C2CC2)=N1 X6397 [0,1,0,1,0,0|1,0,0]=3 800 B11R2.1 CN1C=NC2=NC=CC=C21 W6041 [0,1,0,1,0,0|1,0,1]=4 801 B11R2.1 NC1CCC2=C1N=CC=C2 9677AA [0,1,0,1,0,0|0,0,0]=2 802 B11R2.1 NC1CCC2=CC=CN=C21 3374AJ [0,1,0,1,0,0|0,0,0]=2 803 B11R2.1 NC1COC2=CC=CC=C21 4904AH [0,1,0,1,0,0|2,0,0]=4 804 B11R2.1 N[C@H]1COC2=C1C=CC=C2 1110AL [0,1,0,1,0,0|2,0,0]=4 805 B11R2.1 O=C1CCC2=NC=CC=C12 4182AA [0,1,0,1,0,0|0,0,1]=3 806 B11R2.1 OC1COC2=C1C=CC=N2 7095AA [0,1,0,1,0,0|1,0,0]=3 807 B11R2.1 O[C@H]1CCC2=CC=CN=C21 4628AC [0,1,0,1,0,0|0,0,0]=2 808 B11R2.4 NC1CC1C2=CC=CC=C2 2168AL [0,1,0,1,0,0|1,0,0]=3 809 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8297AH [0,1,0,1,0,0|1,0,0]=3 810 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8412AH [0,1,0,1,0,0|1,0,0]=3 811 B11R2.40 NC1(C2=CN=CC=C2)CC1 6906AB [0,1,0,1,0,0|2,0,0]=4 812 B11R2.40 NC1(C2=NC=CC=C2)CC1 6037AB [0,1,0,1,0,0|0,0,0]=2 813 B7R1.1 BrCC1=COC=N1 1429AA [1,0,0,0,1,0|2,0,0]=4 814 B7R1.1 BrCC1=NC=CN1 1423AC [1,0,0,0,1,0|2,0,0]=4 815 B7R1.1 CCC1=CC=NO1 3273AB [1,0,0,0,1,0|2,0,0]=4 816 B7R1.1 CCC1=CNC=N1 6226AL [1,0,0,0,1,0|1,0,0]=3 817 B7R1.1 CCC1=CNN=C1 5501AD [1,0,0,0,1,0|2,0,0]=4 818 B7R1.1 CCC1=NN=CO1 5828AA [1,0,0,0,1,0|2,0,0]=4 819 B7R1.1 CCC1=NNC=C1 6654AA [1,0,0,0,1,0|1,0,0]=3 820 B7R1.1 CNC1=NC=CO1 6947AC [1,0,0,0,1,0|2,0,0]=4 821 B7R1.1 COC1=CC=CO1 2109AL [1,0,0,0,1,0|2,0,0]=4 822 B7R1.1 CSC1=CNC=N1 X6327 [1,0,0,0,1,0|2,0,0]=4 823 B7R1.1 CSC1=NC=CO1 6777AD [1,0,0,0,1,0|2,0,0]=4 824 B7R1.1 ClCC1=COC=N1 0393AC [1,0,0,0,1,0|2,0,0]=4 825 B7R1.1 ClCC1=NC=CS1 1126AC [1,0,0,0,1,0|2,0,0]=4 826 B7R1.1 ClCC1=NC=CS1 W5535 [1,0,0,0,1,0|2,0,0]=4 827 B7R1.1 NCC1=CC=CN1 W7617 [1,0,0,0,1,0|1,0,1]=4 828 B7R1.1 NCC1=COC=C1 Y7389 [1,0,0,0,1,0|2,0,0]=4 829 B7R1.1 NCC1=COC=C1 Y9148 [1,0,0,0,1,0|2,0,0]=4 830 B7R1.1 NCC1=COC=N1 Y1477 [1,0,0,0,1,0|2,0,0]=4 831 B7R1.1 NCC1=CSC=C1 Z3907 [1,0,0,0,1,0|2,0,0]=4 832 B7R1.1 NCC1=CSC=N1 0159AD [1,0,0,0,1,0|2,0,0]=4 833 B7R1.1 NCC1=NC=CN1 1371AB [1,0,0,0,1,0|2,0,0]=4 834 B7R1.1 NCC1=NC=CO1 0960AA [1,0,0,0,1,0|2,0,0]=4 835 B7R1.1 OCC1=NNC=C1 X6393 [1,0,0,0,1,0|2,0,0]=4