0 B9R1.8 BrCCC1=CC=CC=N1 5125AB [0,0,0,0,0,0|2,0,0]=2 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|4,0,0]=4 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 0916AP [0,0,0,0,0,0|3,0,0]=3 6 B9R1.8 CNCC1=CC=CC=N1 7146AD [0,0,0,0,0,0|3,0,0]=3 7 B9R1.8 CNCC1=CC=NC=C1 7436AH [0,0,0,0,0,0|3,0,0]=3 8 B9R1.8 CNCC1=CC=NC=N1 6023AD [0,0,0,0,0,0|4,0,0]=4 9 B9R1.8 CNCC1=NC=CC=N1 X8879 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.8 CNCC1=NC=CN=C1 X9439 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.8 CNNC1=CC=CC=C1 V2456 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [0,0,0,0,0,0|1,0,2]=3 13 B9R1.8 ClCCC1=NC=CC=C1 X6257 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.8 N#CCC1=CC=NC=C1 Z9553 [0,0,0,0,0,0|1,0,2]=3 15 B9R1.8 NCCC1=CC=CC=C1 5784AL [0,0,0,0,0,0|0,0,0]=0 16 B9R1.8 NCCC1=CCCCC1 X6206 [0,0,0,0,0,0|0,0,4]=4 17 B9R1.8 NCCC1=CN=CC=N1 1878AJ [0,0,0,0,0,0|2,0,0]=2 18 B9R1.8 NCCC1=NC=CC=N1 X3774 [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=CN=CN=C1 2736AD [0,0,0,0,0,0|3,0,0]=3 21 B9R1.8 NOCC1=CC=CN=C1 7306AJ [0,0,0,0,0,0|2,0,0]=2 22 B9R1.8 O=C=NC1=CC=CN=C1 Y9342 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.8 O=CNC1=NC=CC=C1 1807AL [0,0,0,0,0,0|3,0,1]=4 24 B9R1.8 OCCC1=CN=CN=C1 W8980 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.8 O\N=C\C1=CC=NC=C1 W9935 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.8 S=C=NC1=CC=CC=N1 3181AH [0,0,0,0,0,0|3,0,1]=4 27 B9R1.8 SCCC1=CC=NC=C1 9519AJ [0,0,0,0,0,0|2,0,0]=2 28 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 3482AH [0,0,0,0,0,0|2,0,0]=2 29 B8R1.2 BrCC1=NC=CN=C1 5266AJ [1,0,0,0,0,0|3,0,0]=4 30 B8R1.2 Br[Se]C1=CC=CC=C1 8804AL [1,0,0,0,0,0|2,0,0]=3 31 B8R1.2 CC[N+]1=CC=CC=C1 E438 [1,0,0,0,0,0|1,0,0]=2 32 B8R1.2 CNC1=CN=CN=C1 5460AB [1,0,0,0,0,0|3,0,0]=4 33 B8R1.2 COC1=CC=NN=C1 Z5489 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.2 ClCC1=CN=CC=N1 0741AB [1,0,0,0,0,0|3,0,0]=4 35 B8R1.2 ClCC1=NN=CC=C1 2587AB [1,0,0,0,0,0|3,0,0]=4 36 B8R1.2 FCC1=CC=NC=C1 2557AL [1,0,0,0,0,0|2,0,0]=3 37 B8R1.2 NCC1=CC=CC=C1 7149AL [1,0,0,0,0,0|0,0,0]=1 38 B8R1.2 NCC1=CC=NC=C1 Z3385 [1,0,0,0,0,0|1,0,0]=2 39 B8R1.2 NCC1=CC=NC=N1 Y7101 [1,0,0,0,0,0|2,0,0]=3 40 B8R1.2 NCC1=CC=NN=C1 X9904 [1,0,0,0,0,0|2,0,0]=3 41 B8R1.2 NCC1=CN=NC=C1 0175AP [1,0,0,0,0,0|2,0,0]=3 42 B8R1.2 NCC1=NC=NC=C1 9281AB [1,0,0,0,0,0|2,0,0]=3 43 B8R1.2 NCC1=NN=CC=C1 5795AC [1,0,0,0,0,0|2,0,0]=3 44 B8R1.2 NNC1=CC=NC=C1 0864AQ [1,0,0,0,0,0|2,0,0]=3 45 B8R1.2 NNC1=NN=CC=C1 5599AB [1,0,0,0,0,0|3,0,0]=4 46 B8R1.2 NNC1=NN=CC=C1 X0228 [1,0,0,0,0,0|3,0,0]=4 47 B8R1.2 OCC1=CC=NC=N1 W5525 [1,0,0,0,0,0|3,0,0]=4 48 B8R1.2 OCC1=CN=NC=C1 7045AB [1,0,0,0,0,0|3,0,0]=4 49 B8R1.2 OCC1=NC=CN=C1 W7769 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.2 OCC1=NN=CC=C1 W5830 [1,0,0,0,0,0|3,0,0]=4 51 B8R1.2 SCC1=CC=CN=C1 Z2753 [1,0,0,0,0,0|2,0,0]=3 52 B10R1.1 BrC1=CC=C(CCI)C=C1 3237AC [0,1,0,0,0,0|1,0,0]=2 53 B10R1.1 C=CCC1=CC=C(Br)C=C1 7818AD [0,1,0,0,0,0|1,0,1]=3 54 B10R1.1 C=CCC1=CC=C(Cl)C=C1 5641AD [0,1,0,0,0,0|1,0,1]=3 55 B10R1.1 C=CCC1=CC=C(F)C=C1 0990AQ [0,1,0,0,0,0|1,0,1]=3 56 B10R1.1 CC1=CC=C(CCO)C=C1 X8365 [0,1,0,0,0,0|1,0,0]=2 57 B10R1.1 CC1=CC=C(NC=O)C=C1 6608AL [0,1,0,0,0,0|2,0,1]=4 58 B10R1.1 CC1=NC=C(CC#N)C=C1 7400AB [0,1,0,0,0,0|1,0,2]=4 59 B10R1.1 CCCC1=CC=C(C)C=C1 4911AL [0,1,0,0,0,0|1,0,0]=2 60 B10R1.1 CCCC1=CC=C(F)C=C1 2755AE [0,1,0,0,0,0|1,0,0]=2 61 B10R1.1 CCNC1=CC=C(C)C=C1 U343 [0,1,0,0,0,0|2,0,0]=3 62 B10R1.1 CCNC1=CC=C(F)C=C1 5502AB [0,1,0,0,0,0|2,0,0]=3 63 B10R1.1 CCNC1=CC=C(O)C=C1 0115AC [0,1,0,0,0,0|2,0,0]=3 64 B10R1.1 CCNC1=NC=C(Br)C=C1 W8816 [0,1,0,0,0,0|3,0,0]=4 65 B10R1.1 CCOC1=CN=C(Cl)C=C1 Z5197 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.1 CCOC1=CN=C(N)C=C1 W9273 [0,1,0,0,0,0|3,0,0]=4 67 B10R1.1 CCOC1=NC=C(F)C=C1 3377AC [0,1,0,0,0,0|3,0,0]=4 68 B10R1.1 CNCC1=CC=C(Cl)N=C1 9680AL [0,1,0,0,0,0|3,0,0]=4 69 B10R1.1 CNCC1=CC=C(O)C=C1 6057AJ [0,1,0,0,0,0|2,0,0]=3 70 B10R1.1 COCC1=CC=C(I)C=C1 5525AC [0,1,0,0,0,0|2,0,0]=3 71 B10R1.1 N#CCC1=CN=C(Br)C=C1 7149AA [0,1,0,0,0,0|1,0,2]=4 72 B10R1.1 NCCC1=CC=C(Br)C=N1 1783AL [0,1,0,0,0,0|1,0,0]=2 73 B10R1.1 NCCC1=CC=C(Cl)C=C1 1166AJ [0,1,0,0,0,0|0,0,0]=1 74 B10R1.1 NNCC1=CC=C(F)C=C1 0826AC [0,1,0,0,0,0|1,0,0]=2 75 B10R1.1 NOCC1=CC=C(Br)C=C1 5547AB [0,1,0,0,0,0|1,0,0]=2 76 B10R1.1 NOCC1=CC=C(Cl)C=C1 X4802 [0,1,0,0,0,0|1,0,0]=2 77 B10R1.1 O\N=C\C1=CC=C(O)C=C1 6494AE [0,1,0,0,0,0|2,0,1]=4 78 B10R1.4 BrCCC1=CC=CC=C1Br Z7172 [0,1,0,0,0,0|1,0,0]=2 79 B10R1.4 CC1=C(CCN)N=CC=C1 3182AC [0,1,0,0,0,0|1,0,0]=2 80 B10R1.4 CC1=CC=CC=C1CNN 4794AE [0,1,0,0,0,0|1,0,0]=2 81 B10R1.4 CCCC1=C(C)C=CC=C1 4903AL [0,1,0,0,0,0|1,0,0]=2 82 B10R1.4 CCCC1=C(N)C=CC=C1 P410 [0,1,0,0,0,0|1,0,0]=2 83 B10R1.4 CCNC1=C(N)C=CC=N1 0189AE [0,1,0,0,0,0|3,0,0]=4 84 B10R1.4 CCOC1=C(Br)C=NC=C1 V5422 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.4 CCOC1=C(Cl)C=CC=N1 9905AL [0,1,0,0,0,0|3,0,0]=4 86 B10R1.4 CCOC1=C(N)C=CN=C1 Z5305 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.4 CCOC1=C(N)C=NC=C1 W3561 [0,1,0,0,0,0|3,0,0]=4 88 B10R1.4 CCOC1=C(N)N=CC=C1 7078AC [0,1,0,0,0,0|3,0,0]=4 89 B10R1.4 CCOC1=CC=CC=C1N 8719AL [0,1,0,0,0,0|2,0,0]=3 90 B10R1.4 CCOC1=CC=CNC1=O 5869AJ [0,1,0,0,0,0|3,0,0]=4 91 B10R1.4 CCOC1=NC=CC=C1F 3378AC [0,1,0,0,0,0|3,0,0]=4 92 B10R1.4 CNCC1=C(C)C=CC=N1 1508AF [0,1,0,0,0,0|3,0,0]=4 93 B10R1.4 N#CCC1=C(Cl)C=CC=N1 1101AJ [0,1,0,0,0,0|1,0,2]=4 94 B10R1.4 N#CCC1=C(O)C=CC=C1 7309AA [0,1,0,0,0,0|0,0,2]=3 95 B10R1.4 N#CCC1=NC=CC=C1Br 1096AJ [0,1,0,0,0,0|1,0,2]=4 96 B10R1.4 N#CCC1=NC=CC=C1F 1107AJ [0,1,0,0,0,0|1,0,2]=4 97 B10R1.4 NCCC1=CC=CC=C1O Z4391 [0,1,0,0,0,0|0,0,0]=1 98 B10R1.4 NNCC1=CC=CC=C1Cl 4668AE [0,1,0,0,0,0|1,0,0]=2 99 B10R1.4 NOCC1=CC=CC=C1F 7325AD [0,1,0,0,0,0|1,0,0]=2 100 B10R1.4 NOCC1=CC=CC=C1I 3260AC [0,1,0,0,0,0|1,0,0]=2 101 B10R1.4 O=CCC1=CC=CC=C1F 1702AC [0,1,0,0,0,0|1,0,1]=3 102 B10R1.4 ONCC1=CC=CC=C1F Z3766 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.4 O\N=C\C1=C(F)C=CC=C1 6229AB [0,1,0,0,0,0|2,0,1]=4 104 B10R1.4 O\N=C\C1=CC=CC=C1Br 2021AL [0,1,0,0,0,0|2,0,1]=4 105 B10R1.4 O\N=C\C1=CC=CC=C1Cl 1838AE [0,1,0,0,0,0|2,0,1]=4 106 B10R1.10 C=CCC1=CC(Br)=CC=C1 6124AD [0,1,0,0,0,0|1,0,1]=3 107 B10R1.10 CC#CC1=CC=CC(Br)=C1 Y1250 [0,1,0,0,0,0|1,0,2]=4 108 B10R1.10 CC1=CC(CCBr)=CC=C1 0637AQ [0,1,0,0,0,0|1,0,0]=2 109 B10R1.10 CC1=CC=CC(CCO)=N1 Y4754 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.10 CCCC1=CC(C)=CC=C1 4908AL [0,1,0,0,0,0|1,0,0]=2 111 B10R1.10 CCCC1=CC(N)=NC=C1 2922AJ [0,1,0,0,0,0|2,0,0]=3 112 B10R1.10 CCCC1=CC(O)=CC=N1 2583AA [0,1,0,0,0,0|2,0,0]=3 113 B10R1.10 CCCC1=CC=CC(N)=N1 5785AB [0,1,0,0,0,0|2,0,0]=3 114 B10R1.10 CCCC1=NC=CC(N)=N1 1873AJ [0,1,0,0,0,0|3,0,0]=4 115 B10R1.10 CCNC1=CC=CC(Cl)=C1 W3328 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.10 CCNC1=CC=CC(O)=C1 W2908 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.10 CCOC1=CC(=O)C=CN1 0560AA [0,1,0,0,0,0|3,0,0]=4 118 B10R1.10 CCOC1=CC(S)=CC=C1 L529 [0,1,0,0,0,0|2,0,0]=3 119 B10R1.10 CCOC1=CC=CC(N)=N1 Y4042 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.10 CCOC1=NC=CC(Cl)=C1 W8817 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.10 CNCC1=CC(O)=CC=C1 2952AD [0,1,0,0,0,0|2,0,0]=3 122 B10R1.10 CNCC1=NC=CC(C)=C1 8285AC [0,1,0,0,0,0|3,0,0]=4 123 B10R1.10 COCC1=CN=CC(Br)=C1 Z0267 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.10 N#CCC1=CC(O)=CC=C1 5340AH [0,1,0,0,0,0|0,0,2]=3 125 B10R1.10 N#CCC1=NC(Cl)=CC=C1 Y6377 [0,1,0,0,0,0|1,0,2]=4 126 B10R1.10 N#CCC1=NC(F)=CC=C1 3329AB [0,1,0,0,0,0|1,0,2]=4 127 B10R1.10 NCCC1=CC=CC(Br)=N1 5436AB [0,1,0,0,0,0|1,0,0]=2 128 B10R1.10 NCCC1=NC(Br)=CC=C1 5025AA [0,1,0,0,0,0|1,0,0]=2 129 B10R1.10 NNCC1=CC(F)=CC=C1 4670AE [0,1,0,0,0,0|1,0,0]=2 130 B10R1.10 NOCC1=CC(Cl)=CC=C1 3026AB [0,1,0,0,0,0|1,0,0]=2 131 B10R1.10 O=C1C=C(CCO)C=CC1 V0891 [0,1,0,0,0,0|1,0,1]=3 132 B10R1.10 OCCC1=CC=NC(Cl)=C1 1041AJ [0,1,0,0,0,0|2,0,0]=3 133 B10R1.10 O\N=C\C1=CC(Cl)=CC=C1 5550AC [0,1,0,0,0,0|2,0,1]=4 134 B10R1.10 O\N=C\C1=CC(O)=CC=C1 7611AD [0,1,0,0,0,0|2,0,1]=4 135 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 4800AJ [0,1,0,0,0,0|1,0,1]=3 136 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 4836AJ [0,1,0,0,0,0|1,0,1]=3 137 B10R1.15 C=C(CC)C1=CC=CC=C1 0460AB [0,1,0,0,0,0|1,0,1]=3 138 B10R1.15 C=CC(=O)C1=CC=CC=C1 1968AC [0,1,0,0,0,0|1,0,2]=4 139 B10R1.15 CCC(Cl)C1=CC=CC=C1 1017AL [0,1,0,0,0,0|1,0,0]=2 140 B10R1.15 CCC(N)C1=CC=CC=C1 8188AD [0,1,0,0,0,0|1,0,0]=2 141 B10R1.15 CCC(N)C1=CC=CN=C1 4943AJ [0,1,0,0,0,0|2,0,0]=3 142 B10R1.15 CCC(N)C1=CC=CN=C1 4945AJ [0,1,0,0,0,0|2,0,0]=3 143 B10R1.15 CCC(N)C1=CC=NC=C1 4998AJ [0,1,0,0,0,0|2,0,0]=3 144 B10R1.15 CCN(C)C1=CC=CC=N1 5048AL [0,1,0,0,0,0|3,0,0]=4 145 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 7435AJ [0,1,0,0,0,0|1,0,0]=2 146 B10R1.15 CC[C@H](O)C1=CC=CC=C1 7483AJ [0,1,0,0,0,0|1,0,0]=2 147 B10R1.15 CN[C@H](C)C1=CC=CC=C1 O017 [0,1,0,0,0,0|2,0,0]=3 148 B10R1.15 C[C@H](CN)C1=CC=CC=C1 U641 [0,1,0,0,0,0|0,0,0]=1 149 B10R1.15 C\C(=N/N)C1=CC=CC=C1 1678AL [0,1,0,0,0,0|1,0,1]=3 150 B10R1.15 FC(CBr)C1=CC=CC=C1 9366AA [0,1,0,0,0,0|1,0,0]=2 151 B10R1.15 NC(CF)C1=CC=CC=C1 0514AQ [0,1,0,0,0,0|1,0,0]=2 152 B10R1.15 NC(CO)C1=CC=CN=C1 1473AJ [0,1,0,0,0,0|2,0,0]=3 153 B10R1.15 NC(CO)C1=CC=CN=C1 W5825 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.15 NC(CO)C1=CC=NC=C1 1467AJ [0,1,0,0,0,0|2,0,0]=3 155 B10R1.15 NCC(=O)C1=CC=CN=C1 1930AJ [0,1,0,0,0,0|1,0,1]=3 156 B10R1.15 NCC(=O)C1=CC=NC=C1 7230AB [0,1,0,0,0,0|1,0,1]=3 157 B10R1.15 NCC(=O)C1=CN=CC=C1 1455AJ [0,1,0,0,0,0|1,0,1]=3 158 B10R1.15 NCC(N)C1=CC=CC=C1 8359AB [0,1,0,0,0,0|0,0,0]=1 159 B10R1.15 NCC(N)C1=CC=CC=C1 8461AA [0,1,0,0,0,0|0,0,0]=1 160 B10R1.15 NCC(O)C1=CC=CC=N1 1453AJ [0,1,0,0,0,0|1,0,0]=2 161 B10R1.15 NCC(O)C1=CC=CN=C1 5133AH [0,1,0,0,0,0|1,0,0]=2 162 B10R1.15 NCC(O)C1=CC=NC=C1 1457AJ [0,1,0,0,0,0|1,0,0]=2 163 B10R1.15 NCC(O)C1=NC=CC=C1 9384AJ [0,1,0,0,0,0|1,0,0]=2 164 B10R1.15 NC[C@H](O)C1=CC=CN=C1 Z3832 [0,1,0,0,0,0|1,0,0]=2 165 B10R1.15 O=C(CBr)C1=CC=NC=C1 9348AB [0,1,0,0,0,0|2,0,1]=4 166 B10R1.15 O=C(CBr)C1=CN=CC=C1 9347AB [0,1,0,0,0,0|2,0,1]=4 167 B10R1.15 O=C(N[O-])C1=CC=CC=C1 8985AL [0,1,0,0,0,0|2,0,1]=4 168 B10R1.15 OC(CBr)C1=CC=CC=C1 W4218 [0,1,0,0,0,0|1,0,0]=2 169 B10R1.15 O\N=C(\Cl)C1=CC=CC=C1 O705 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.17 C=CCNC1=CC=CN=C1 6927AD [0,1,0,0,0,0|2,0,1]=4 171 B10R1.17 C=CCNC1=CC=NC=C1 8332AC [0,1,0,0,0,0|2,0,1]=4 172 B10R1.17 CCCCC1=CC=NC=C1 Y9365 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.17 CCCCC1=NC=CC=C1 S413 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.17 CCNCC1=CC=CN=C1 Y5832 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.17 CNCCC1=CC=NC=C1 5552AE [0,1,0,0,0,0|1,0,0]=2 176 B10R1.17 CNCCC1=CC=NC=C1 5553AE [0,1,0,0,0,0|1,0,0]=2 177 B10R1.17 CNCCC1=CC=NC=C1 X8552 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.17 N#CCCC1=CC=CC=N1 1449AE [0,1,0,0,0,0|1,0,1]=3 179 B10R1.17 N#CCCC1=CC=NC=C1 2937AC [0,1,0,0,0,0|1,0,1]=3 180 B10R1.17 NCC#CC1=CC=CC=C1 1105AQ [0,1,0,0,0,0|0,0,1]=2 181 B10R1.17 NCCCC1=CC=CC=N1 7820AA [0,1,0,0,0,0|1,0,0]=2 182 B10R1.17 NCCCC1=CC=CN=C1 X2118 [0,1,0,0,0,0|1,0,0]=2 183 B10R1.17 NCCCC1=CC=NC=C1 2037AJ [0,1,0,0,0,0|1,0,0]=2 184 B10R1.17 NCCNC1=CC=CN=C1 4424AJ [0,1,0,0,0,0|1,0,0]=2 185 B10R1.17 NCCOC1=CC=NC=C1 1280AJ [0,1,0,0,0,0|1,0,0]=2 186 B10R1.17 NCCOC1=CC=NC=C1 2194AB [0,1,0,0,0,0|1,0,0]=2 187 B10R1.17 NCCSC1=CC=CC=C1 6800AD [0,1,0,0,0,0|0,0,0]=1 188 B10R1.17 NCCSC1=CC=CC=N1 3135AE [0,1,0,0,0,0|1,0,0]=2 189 B10R1.17 O=CCOC1=CC=CC=C1 0811AB [0,1,0,0,0,0|1,0,1]=3 190 B10R1.17 O=CNNC1=CC=CC=C1 9369AB [0,1,0,0,0,0|2,0,1]=4 191 B10R1.17 OCC#CC1=CC=NC=C1 5668AJ [0,1,0,0,0,0|2,0,1]=4 192 B10R1.17 OCCCC1=CCC=CC1 X3903 [0,1,0,0,0,0|1,0,2]=4 193 B10R1.17 OCCSC1=CC=CC=C1 K990 [0,1,0,0,0,0|1,0,0]=2 194 B10R1.17 OC\C=C\C1=CC=CN=C1 5644AJ [0,1,0,0,0,0|2,0,1]=4 195 B10R1.17 OC\C=C\C1=NC=CC=C1 5626AJ [0,1,0,0,0,0|2,0,1]=4 196 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 Z6329 [0,1,0,0,0,0|0,0,1]=2 197 B10R1.17 [N-]=[N+]=NCC1=CC=CC=N1 6614AE [0,1,0,0,0,0|2,0,1]=4 198 B10R1.18 BrC(Br)=CC1=CC=CC=C1 1551AC [0,1,0,0,0,0|1,0,2]=4 199 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [0,1,0,0,0,0|2,0,1]=4 200 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [0,1,0,0,0,0|1,0,2]=4 201 B10R1.18 CC(C)CC1=CC=NC=C1 6191AJ [0,1,0,0,0,0|2,0,0]=3 202 B10R1.18 CC(C)CC1=NC=CN=C1 R582 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.18 CC(N)CC1=CC=CC=N1 4560AE [0,1,0,0,0,0|1,0,0]=2 204 B10R1.18 CC(N)CC1=CC=NC=C1 4587AH [0,1,0,0,0,0|1,0,0]=2 205 B10R1.18 CC(N)CC1=CN=CC=N1 4220AC [0,1,0,0,0,0|2,0,0]=3 206 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 7881AA [0,1,0,0,0,0|1,0,0]=2 207 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [0,1,0,0,0,0|0,0,1]=2 208 B10R1.18 N=C(N)CC1=NC=CC=C1 0398AD [0,1,0,0,0,0|1,0,1]=3 209 B10R1.18 NC(=S)NC1=CC=CN=C1 9505AD [0,1,0,0,0,0|2,0,1]=4 210 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [0,1,0,0,0,0|2,0,1]=4 211 B10R1.18 S=C(Cl)SC1=CC=CC=C1 5446AD [0,1,0,0,0,0|2,0,1]=4 212 B8R0.1 C=CCNC(=O)CCN 2213AD [0,0,1,0,0,0|2,0,1]=4 213 B10R2.6 C1=CC(C2CC2)=CC=N1 Z0635 [0,0,0,1,0,0|2,0,0]=3 214 B10R2.7 C1=CC2=C(C=C1)CSC2 1903AB [0,0,0,1,0,0|2,0,0]=3 215 B10R2.7 C1=CC2=C(C=C1)ON=C2 1484AL [0,0,0,1,0,0|2,0,1]=4 216 B10R2.7 C1=CC2=C(C=N1)CCN2 1361AJ [0,0,0,1,0,0|1,0,0]=2 217 B10R2.7 C1=CC2=C(C=N1)CNC2 X5477 [0,0,0,1,0,0|3,0,0]=4 218 B10R2.7 C1=CC2=C(C=NN2)N=C1 2555AB [0,0,0,1,0,0|2,0,1]=4 219 B10R2.7 C1=CC2=CON=C2C=C1 5069AL [0,0,0,1,0,0|1,0,2]=4 220 B10R2.7 C1=CC=C2NC=CC2=C1 J70045 [0,0,0,1,0,0|0,0,2]=3 221 B10R2.7 C1=CN=C2CCNC2=C1 1360AJ [0,0,0,1,0,0|1,0,0]=2 222 B10R2.7 C1=CN=C2CNCC2=C1 V7126 [0,0,0,1,0,0|3,0,0]=4 223 B10R2.7 C1=CN=C2CNCC2=C1 W3224 [0,0,0,1,0,0|3,0,0]=4 224 B8R1.8 BrCCC1=CC=CS1 Z5496 [0,0,0,0,1,0|2,0,0]=3 225 B8R1.8 BrCCC1=CSC=C1 W7060 [0,0,0,0,1,0|2,0,0]=3 226 B8R1.8 BrCCN1C=CC=C1 Y4087 [0,0,0,0,1,0|2,0,0]=3 227 B8R1.8 CCCC1=CC=CO1 Z5525 [0,0,0,0,1,0|2,0,0]=3 228 B8R1.8 CCCC1=CSC=C1 Z5466 [0,0,0,0,1,0|2,0,0]=3 229 B8R1.8 CCNC1=CC=CS1 W4294 [0,0,0,0,1,0|3,0,0]=4 230 B8R1.8 CNCC1=COC=C1 7832AD [0,0,0,0,1,0|3,0,0]=4 231 B8R1.8 ClCCC1=CNC=N1 X4176 [0,0,0,0,1,0|3,0,0]=4 232 B8R1.8 ClCCC1=CNN=C1 9537AF [0,0,0,0,1,0|3,0,0]=4 233 B8R1.8 ClCCN1C=CC=C1 X4634 [0,0,0,0,1,0|2,0,0]=3 234 B8R1.8 N#CCC1=CC=CN1 1010AJ [0,0,0,0,1,0|1,0,2]=4 235 B8R1.8 NCCC1=CC=CN1 1070AJ [0,0,0,0,1,0|1,0,0]=2 236 B8R1.8 NCCC1=CC=CN1 5556AB [0,0,0,0,1,0|1,0,0]=2 237 B8R1.8 NCCC1=CON=C1 5076AH [0,0,0,0,1,0|2,0,0]=3 238 B8R1.8 NCCC1=CSC=N1 2066AC [0,0,0,0,1,0|2,0,0]=3 239 B8R1.8 NCCC1=NC=CN1 9985AA [0,0,0,0,1,0|2,0,0]=3 240 B8R1.8 NCCC1=NC=CS1 5806AE [0,0,0,0,1,0|2,0,0]=3 241 B8R1.8 NCCC1=NC=CS1 Y1661 [0,0,0,0,1,0|2,0,0]=3 242 B8R1.8 NCCC1=NC=NN1 1050AJ [0,0,0,0,1,0|3,0,0]=4 243 B8R1.8 NCCC1=NC=NN1 9546AE [0,0,0,0,1,0|3,0,0]=4 244 B8R1.8 NCCC1=NNC=C1 4102AD [0,0,0,0,1,0|2,0,0]=3 245 B8R1.8 NCCN1C=CC=C1 3045AB [0,0,0,0,1,0|1,0,0]=2 246 B8R1.8 NCCN1C=CN=C1 4503AH [0,0,0,0,1,0|2,0,0]=3 247 B8R1.8 NCCN1C=CN=C1 8445AB [0,0,0,0,1,0|2,0,0]=3 248 B8R1.8 NCCN1C=NC=N1 7160AB [0,0,0,0,1,0|3,0,0]=4 249 B8R1.8 NCCN1C=NC=N1 Y5405 [0,0,0,0,1,0|3,0,0]=4 250 B8R1.8 NCCN1C=NN=C1 5228AJ [0,0,0,0,1,0|3,0,0]=4 251 B8R1.8 OCCC1=CSC=C1 J11110 [0,0,0,0,1,0|2,0,0]=3 252 B8R1.8 OCCC1=NNC=C1 1008AJ [0,0,0,0,1,0|3,0,0]=4 253 B7R1.3 CC1=CCC=CC1 7751AF [2,0,0,0,0,0|0,0,2]=4 254 B7R1.3 C[N+]1=CC=CC=C1 1581AB [2,0,0,0,0,0|1,0,0]=3 255 B7R1.3 C[N+]1=CC=CC=C1 K323 [2,0,0,0,0,0|1,0,0]=3 256 B7R1.3 F[N+]1=CC=CC=C1 4861AL [2,0,0,0,0,0|2,0,0]=4 257 B7R1.3 NC1=CC=CC=C1 7089AL [2,0,0,0,0,0|0,0,0]=2 258 B7R1.3 [SeH]C1=CC=CC=C1 8806AL [2,0,0,0,0,0|1,0,0]=3 259 B9R1.1 BrCC1=CN=C(Br)C=C1 Y3534 [1,1,0,0,0,0|2,0,0]=4 260 B9R1.1 C#CC1=CC=C(I)C=C1 1951AC [1,1,0,0,0,0|0,0,2]=4 261 B9R1.1 CC1=CC=C(CS)C=C1 7913AF [1,1,0,0,0,0|1,0,0]=3 262 B9R1.1 CC1=CN=C(CN)C=N1 N635 [1,1,0,0,0,0|2,0,0]=4 263 B9R1.1 CC1=CN=C(CN)N=C1 5734AC [1,1,0,0,0,0|2,0,0]=4 264 B9R1.1 CC1=CN=C(CN)N=C1 8860AH [1,1,0,0,0,0|2,0,0]=4 265 B9R1.1 CC1=NC=C(CCl)C=C1 Y9334 [1,1,0,0,0,0|2,0,0]=4 266 B9R1.1 CC1=NC=C(CCl)C=C1 Z3855 [1,1,0,0,0,0|2,0,0]=4 267 B9R1.1 CC1=NC=C(NN)C=C1 0173AB [1,1,0,0,0,0|2,0,0]=4 268 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [1,1,0,0,0,0|0,0,0]=2 269 B9R1.1 CCC1=CC=C(S)C=C1 S243 [1,1,0,0,0,0|0,0,0]=2 270 B9R1.1 CCC1=CN=C(Cl)C=C1 4992AC [1,1,0,0,0,0|1,0,0]=3 271 B9R1.1 CCC1=CN=C(N)C=N1 X9917 [1,1,0,0,0,0|2,0,0]=4 272 B9R1.1 CCC1=CN=C(N)N=C1 W5969 [1,1,0,0,0,0|2,0,0]=4 273 B9R1.1 CCC1=CNC(=O)C=C1 7602AB [1,1,0,0,0,0|1,0,0]=3 274 B9R1.1 CNC1=CC=C(I)C=C1 W7309 [1,1,0,0,0,0|1,0,0]=3 275 B9R1.1 CNC1=CC=C(N)C=C1 F921 [1,1,0,0,0,0|1,0,0]=3 276 B9R1.1 COC1=CC=C(C)N=C1 8055AB [1,1,0,0,0,0|2,0,0]=4 277 B9R1.1 CSC1=CN=C(Br)C=C1 Z0124 [1,1,0,0,0,0|2,0,0]=4 278 B9R1.1 CSC1=NC=C(Cl)C=C1 Z1031 [1,1,0,0,0,0|2,0,0]=4 279 B9R1.1 C[N+]1=CC=C(CO)C=C1 7356AE [1,1,0,0,0,0|2,0,0]=4 280 B9R1.1 ClC1=NC=C(CBr)C=C1 3738AB [1,1,0,0,0,0|2,0,0]=4 281 B9R1.1 ClCC1=CC=C(I)C=C1 Y6287 [1,1,0,0,0,0|1,0,0]=3 282 B9R1.1 ClCC1=NC=C(Br)C=C1 8626AA [1,1,0,0,0,0|2,0,0]=4 283 B9R1.1 FC1=CN=C(CCl)C=C1 9982AL [1,1,0,0,0,0|2,0,0]=4 284 B9R1.1 N#CC1=CC=C(S)C=C1 V7013 [1,1,0,0,0,0|0,0,2]=4 285 B9R1.1 NC1=CC=C(CO)C=N1 U962 [1,1,0,0,0,0|2,0,0]=4 286 B9R1.1 NCC1=CC=C(I)C=C1 5275AB [1,1,0,0,0,0|0,0,0]=2 287 B9R1.1 NCC1=CC=C(O)C=C1 X6145 [1,1,0,0,0,0|0,0,0]=2 288 B9R1.1 NCC1=CN=C(Cl)C=N1 1378AA [1,1,0,0,0,0|2,0,0]=4 289 B9R1.1 NCC1=NC=C(Br)C=N1 Z4014 [1,1,0,0,0,0|2,0,0]=4 290 B9R1.1 NCC1=NC=C(Cl)C=N1 8838AH [1,1,0,0,0,0|2,0,0]=4 291 B9R1.1 NCC1=NC=C(F)C=C1 Y9474 [1,1,0,0,0,0|1,0,0]=3 292 B9R1.1 O=C1C=CC(=NCl)C=C1 8527AL [1,1,0,0,0,0|2,0,0]=4 293 B9R1.1 OCC1=NC=C(F)C=C1 3321AB [1,1,0,0,0,0|2,0,0]=4 294 B9R1.2 BrCC1=CC(Br)=NC=C1 6323AA [1,1,0,0,0,0|2,0,0]=4 295 B9R1.2 C=CC1=CC(C)=CC=C1 6123AL [1,1,0,0,0,0|0,0,2]=4 296 B9R1.2 CC1=CC(CCl)=NC=C1 4926AB [1,1,0,0,0,0|2,0,0]=4 297 B9R1.2 CC1=CC(CCl)=NC=C1 W8059 [1,1,0,0,0,0|2,0,0]=4 298 B9R1.2 CC1=CC(CN)=CC=N1 6141AC [1,1,0,0,0,0|1,0,0]=3 299 B9R1.2 CC1=CC(CN)=CN=C1 2036AC [1,1,0,0,0,0|1,0,0]=3 300 B9R1.2 CC1=CC(CN)=NC=C1 Y7378 [1,1,0,0,0,0|1,0,0]=3 301 B9R1.2 CC1=CC=NC(CN)=N1 8797AH [1,1,0,0,0,0|2,0,0]=4 302 B9R1.2 CC1=NC(CN)=CC=C1 6493AA [1,1,0,0,0,0|1,0,0]=3 303 B9R1.2 CCC1=CC(Br)=NC=C1 Y5042 [1,1,0,0,0,0|1,0,0]=3 304 B9R1.2 CCC1=CC(F)=CC=C1 0760AC [1,1,0,0,0,0|0,0,0]=2 305 B9R1.2 CCC1=CC(N)=CC=N1 5543AJ [1,1,0,0,0,0|1,0,0]=3 306 B9R1.2 CCC1=CC(N)=NC=N1 3305AC [1,1,0,0,0,0|2,0,0]=4 307 B9R1.2 CCC1=NC(C)=CC=C1 2156AA [1,1,0,0,0,0|1,0,0]=3 308 B9R1.2 CCC1=NC(Cl)=NC=C1 5511AJ [1,1,0,0,0,0|2,0,0]=4 309 B9R1.2 CNC1=CC(N)=CC=C1 6981AB [1,1,0,0,0,0|1,0,0]=3 310 B9R1.2 COC1=CC(=O)NC=C1 W6732 [1,1,0,0,0,0|2,0,0]=4 311 B9R1.2 COC1=CC(C)=CN=C1 2251AC [1,1,0,0,0,0|2,0,0]=4 312 B9R1.2 COC1=CN=CC(I)=C1 1202AF [1,1,0,0,0,0|2,0,0]=4 313 B9R1.2 COC1=CN=CC(N)=C1 2136AJ [1,1,0,0,0,0|2,0,0]=4 314 B9R1.2 COC1=C[N+]([O-])=CC=C1 7428AA [1,1,0,0,0,0|2,0,0]=4 315 B9R1.2 CSC1=NC=CC(Cl)=C1 W5514 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.2 CSC1=NC=CC(N)=C1 6074AJ [1,1,0,0,0,0|2,0,0]=4 317 B9R1.2 ClC1=CC(CBr)=CC=N1 Y1576 [1,1,0,0,0,0|2,0,0]=4 318 B9R1.2 ClCC1=CC(I)=CN=C1 1482AF [1,1,0,0,0,0|2,0,0]=4 319 B9R1.2 ClCC1=CC=CC(Cl)=N1 W9938 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.2 ClCC1=CN=CC(Br)=C1 Z8207 [1,1,0,0,0,0|2,0,0]=4 321 B9R1.2 ClCC1=CN=CC(Cl)=C1 2236AJ [1,1,0,0,0,0|2,0,0]=4 322 B9R1.2 NC1=CC(C=O)=CC=C1 Y7351 [1,1,0,0,0,0|1,0,1]=4 323 B9R1.2 NC1=CC(CO)=CN=C1 Z2689 [1,1,0,0,0,0|2,0,0]=4 324 B9R1.2 NC1=CC(CO)=NC=C1 4757AJ [1,1,0,0,0,0|2,0,0]=4 325 B9R1.2 NC1=CC=CC(C=O)=C1 X3987 [1,1,0,0,0,0|1,0,1]=4 326 B9R1.2 NC1=CC=CC(CF)=C1 5712AJ [1,1,0,0,0,0|1,0,0]=3 327 B9R1.2 NCC1=CC(=O)N=CN1 3412AD [1,1,0,0,0,0|2,0,0]=4 328 B9R1.2 NCC1=CC(Cl)=CN=C1 5679AJ [1,1,0,0,0,0|1,0,0]=3 329 B9R1.2 NCC1=CC(Cl)=NC=C1 7154AA [1,1,0,0,0,0|1,0,0]=3 330 B9R1.2 NCC1=CC(F)=NC=C1 Y4072 [1,1,0,0,0,0|1,0,0]=3 331 B9R1.2 NCC1=CC(I)=CC=C1 5352AH [1,1,0,0,0,0|0,0,0]=2 332 B9R1.2 NCC1=CC(N)=NC=C1 5441AJ [1,1,0,0,0,0|1,0,0]=3 333 B9R1.2 NCC1=CC(N)=NC=N1 3584AF [1,1,0,0,0,0|2,0,0]=4 334 B9R1.2 NCC1=CC=CC(=O)N1 Y7390 [1,1,0,0,0,0|1,0,0]=3 335 B9R1.2 NCC1=CC=CC(Br)=N1 X7041 [1,1,0,0,0,0|1,0,0]=3 336 B9R1.2 NCC1=CC=C[N+]([O-])=C1 2361AL [1,1,0,0,0,0|1,0,0]=3 337 B9R1.2 NCC1=NC(Br)=CC=C1 5367AC [1,1,0,0,0,0|1,0,0]=3 338 B9R1.2 NCC1=NC(F)=CC=C1 Y8188 [1,1,0,0,0,0|1,0,0]=3 339 B9R1.2 NCC1=NC(N)=CC=C1 6407AJ [1,1,0,0,0,0|1,0,0]=3 340 B9R1.2 NCC1=NC=CC(Br)=C1 Z3782 [1,1,0,0,0,0|1,0,0]=3 341 B9R1.2 NNC1=CC(F)=NC=C1 V7913 [1,1,0,0,0,0|2,0,0]=4 342 B9R1.2 O=C1C=C(CO)C=CN1 5374AA [1,1,0,0,0,0|2,0,0]=4 343 B9R1.2 OC1=CC=CC(CBr)=C1 Y9989 [1,1,0,0,0,0|1,0,0]=3 344 B9R1.2 OCC1=CC(Cl)=CN=C1 V0671 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.2 OCC1=CC(I)=CN=C1 8710AE [1,1,0,0,0,0|2,0,0]=4 346 B9R1.2 OCC1=CC(S)=CC=C1 0333AF [1,1,0,0,0,0|1,0,0]=3 347 B9R1.2 OCC1=NC(I)=CC=C1 0674AF [1,1,0,0,0,0|2,0,0]=4 348 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [1,1,0,0,0,0|0,0,0]=2 349 B9R1.6 CC(Cl)C1=NC=CC=C1 1002AJ [1,1,0,0,0,0|1,0,0]=3 350 B9R1.6 CC(N)C1=CN=CN=C1 9547AH [1,1,0,0,0,0|2,0,0]=4 351 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [1,1,0,0,0,0|2,0,0]=4 352 B9R1.6 CN(N)C1=NC=CC=C1 Y9071 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [1,1,0,0,0,0|1,0,0]=3 354 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [1,1,0,0,0,0|2,0,0]=4 355 B9R1.6 C[C@@H](O)C1=CN=CC=C1 1829AC [1,1,0,0,0,0|1,0,0]=3 356 B9R1.6 C[C@H](N)C1=CC=CN=C1 2674AB [1,1,0,0,0,0|1,0,0]=3 357 B9R1.6 C[C@H](O)C1=CN=CC=C1 7054AB [1,1,0,0,0,0|1,0,0]=3 358 B9R1.6 ClB(Cl)C1=CC=CC=C1 Z8862 [1,1,0,0,0,0|2,0,0]=4 359 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 Y1609 [1,1,0,0,0,0|2,0,0]=4 360 B9R1.6 FC(F)C1=CC=NC=C1 0239AF [1,1,0,0,0,0|2,0,0]=4 361 B9R1.6 N=C(N)C1=CC=NC=C1 4648AC [1,1,0,0,0,0|1,0,1]=4 362 B9R1.6 NC(=O)C1=CN=CC=C1 1853AE [1,1,0,0,0,0|1,0,1]=4 363 B9R1.6 O=C(Br)C1=CC=CC=C1 9276AB [1,1,0,0,0,0|1,0,1]=4 364 B9R1.6 O=C([O-])C1=CC=CC=C1 V1445 [1,1,0,0,0,0|1,0,1]=4 365 B9R1.6 O=S(O)C1=CC=CC=C1 9279AB [1,1,0,0,0,0|2,0,0]=4 366 B9R1.15 C#CC1=C(O)C=CC=C1 7065AB [1,1,0,0,0,0|0,0,2]=4 367 B9R1.15 C#CC1=CC=CC=C1Br 1939AC [1,1,0,0,0,0|0,0,2]=4 368 B9R1.15 C=CC1=C(C)C=CC=C1 8079AF [1,1,0,0,0,0|0,0,2]=4 369 B9R1.15 C=CC1=CC=CC=C1N Y8954 [1,1,0,0,0,0|0,0,2]=4 370 B9R1.15 CC1=C(CBr)C=NC=C1 Y7235 [1,1,0,0,0,0|2,0,0]=4 371 B9R1.15 CC1=C(CBr)C=NC=C1 Z4138 [1,1,0,0,0,0|2,0,0]=4 372 B9R1.15 CC1=C(CN)C=CN=C1 Y4868 [1,1,0,0,0,0|1,0,0]=3 373 B9R1.15 CC1=C(NN)C=NC=C1 2421AC [1,1,0,0,0,0|2,0,0]=4 374 B9R1.15 CC1=CC=CC=C1[Mg]Br X5408 [1,1,0,0,0,0|2,0,0]=4 375 B9R1.15 CC1=CC=CN=C1CBr Y9115 [1,1,0,0,0,0|2,0,0]=4 376 B9R1.15 CC1=CC=CN=C1CO 0931AC [1,1,0,0,0,0|2,0,0]=4 377 B9R1.15 CC1=NC=CC=C1CCl 8680AB [1,1,0,0,0,0|2,0,0]=4 378 B9R1.15 CC1=NC=CC=C1CN 8679AB [1,1,0,0,0,0|1,0,0]=3 379 B9R1.15 CCC1=C(Br)C=CN=C1 0440AA [1,1,0,0,0,0|1,0,0]=3 380 B9R1.15 CCC1=C(Br)C=NC=C1 W9928 [1,1,0,0,0,0|1,0,0]=3 381 B9R1.15 CCC1=CC=CC=C1C Z4941 [1,1,0,0,0,0|0,0,0]=2 382 B9R1.15 CCC1=CC=CN=C1Cl 6759AC [1,1,0,0,0,0|1,0,0]=3 383 B9R1.15 CCC1=CC=CN=C1N 5897AB [1,1,0,0,0,0|1,0,0]=3 384 B9R1.15 CCC1=CC=CNC1=O 9540AB [1,1,0,0,0,0|1,0,0]=3 385 B9R1.15 CCC1=[N+]([O-])C=CC=C1 7886AF [1,1,0,0,0,0|1,0,0]=3 386 B9R1.15 CNC1=CC=CC=C1Br 0544AC [1,1,0,0,0,0|1,0,0]=3 387 B9R1.15 CNC1=CC=CN=C1Cl N415 [1,1,0,0,0,0|2,0,0]=4 388 B9R1.15 CNC1=CC=CN=C1N 8234AB [1,1,0,0,0,0|2,0,0]=4 389 B9R1.15 COC1=C(Br)C=CN=C1 X8928 [1,1,0,0,0,0|2,0,0]=4 390 B9R1.15 COC1=C(Br)C=CN=C1 X9457 [1,1,0,0,0,0|2,0,0]=4 391 B9R1.15 COC1=C(C)C=NC=C1 V9875 [1,1,0,0,0,0|2,0,0]=4 392 B9R1.15 COC1=C(N)C=CN=C1 Y9329 [1,1,0,0,0,0|2,0,0]=4 393 B9R1.15 COC1=C(O)C=NC=C1 7687AA [1,1,0,0,0,0|2,0,0]=4 394 B9R1.15 COC1=CC=NC=C1I 4852AC [1,1,0,0,0,0|2,0,0]=4 395 B9R1.15 COC1=NC=CC=C1F Z7565 [1,1,0,0,0,0|2,0,0]=4 396 B9R1.15 CSC1=NC=CC=C1Br V6364 [1,1,0,0,0,0|2,0,0]=4 397 B9R1.15 ClCC1=C(Br)C=CC=C1 8546AB [1,1,0,0,0,0|1,0,0]=3 398 B9R1.15 ClCC1=C(Br)C=NC=C1 5826AJ [1,1,0,0,0,0|2,0,0]=4 399 B9R1.15 ClCC1=NC=CC=C1Br V3162 [1,1,0,0,0,0|2,0,0]=4 400 B9R1.15 NC1=C(CCl)C=CC=N1 3369AC [1,1,0,0,0,0|2,0,0]=4 401 B9R1.15 NC1=C(CCl)C=CC=N1 4976AH [1,1,0,0,0,0|2,0,0]=4 402 B9R1.15 NC1=C(CO)C=NC=C1 W3010 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.15 NCC1=C(Cl)C=CC=N1 4102AB [1,1,0,0,0,0|1,0,0]=3 404 B9R1.15 NCC1=C(Cl)C=NC=C1 3709AC [1,1,0,0,0,0|1,0,0]=3 405 B9R1.15 NCC1=C(F)C=NC=C1 W8931 [1,1,0,0,0,0|1,0,0]=3 406 B9R1.15 NCC1=C(I)C=CC=C1 1744AJ [1,1,0,0,0,0|0,0,0]=2 407 B9R1.15 NCC1=CC=CC=C1N W5201 [1,1,0,0,0,0|0,0,0]=2 408 B9R1.15 NCC1=CC=CN=C1Cl 8496AH [1,1,0,0,0,0|1,0,0]=3 409 B9R1.15 NNC1=C(Cl)C=CC=C1 2065AL [1,1,0,0,0,0|1,0,0]=3 410 B9R1.15 NNC1=C(Cl)N=CC=C1 2782AA [1,1,0,0,0,0|2,0,0]=4 411 B9R1.15 NNC1=NC=CC=C1Br V6518 [1,1,0,0,0,0|2,0,0]=4 412 B9R1.15 NNC1=NC=CC=C1I Z0677 [1,1,0,0,0,0|2,0,0]=4 413 B9R1.15 OCC1=C(Br)C=CN=C1 W4176 [1,1,0,0,0,0|2,0,0]=4 414 B9R1.15 OCC1=C(Br)N=CC=C1 5882AA [1,1,0,0,0,0|2,0,0]=4 415 B9R1.15 OCC1=NC=CC=C1Br W6721 [1,1,0,0,0,0|2,0,0]=4 416 B9R1.15 [O-][N+]1=C(CCl)C=CC=C1 Y8686 [1,1,0,0,0,0|2,0,0]=4 417 B9R1.7 CC1=CC=C(CCN)S1 5238AJ [0,1,0,0,1,0|1,0,0]=3 418 B9R1.7 CC1=CC=C(CCN)S1 9610AD [0,1,0,0,1,0|1,0,0]=3 419 B9R1.7 CC1=CN=C(CCN)N1 2107AF [0,1,0,0,1,0|2,0,0]=4 420 B9R1.7 CC1=CNC(CCN)=N1 4655AC [0,1,0,0,1,0|2,0,0]=4 421 B9R1.7 CC1=NC(CCN)=CS1 5300AD [0,1,0,0,1,0|2,0,0]=4 422 B9R1.7 CN1C=C(CCN)C=N1 V7806 [0,1,0,0,1,0|2,0,0]=4 423 B9R1.7 NCCC1=CC(Br)=CS1 1027AJ [0,1,0,0,1,0|1,0,0]=3 424 B9R1.7 NCCC1=CC(Br)=CS1 1159AJ [0,1,0,0,1,0|1,0,0]=3 425 B9R1.7 NCCC1=CC=C(Br)S1 1209AJ [0,1,0,0,1,0|1,0,0]=3 426 B9R1.7 NCCC1=CC=C(Cl)S1 1213AJ [0,1,0,0,1,0|1,0,0]=3 427 B9R1.7 NCCC1=CSC(N)=N1 2275AF [0,1,0,0,1,0|2,0,0]=4 428 B9R1.11 NCC(O)C1=CC=CO1 8969AD [0,1,0,0,1,0|1,0,0]=3 429 B9R1.11 OC[C@@H](O)C1=CC=CO1 1030AL [0,1,0,0,1,0|2,0,0]=4 430 B9R1.12 CCCCC1=CC=CO1 5552AL [0,1,0,0,1,0|2,0,0]=4 431 B9R1.12 CNCCC1=CC=CS1 8340AC [0,1,0,0,1,0|1,0,0]=3 432 B9R1.12 CNCCC1=CNN=C1 4405AF [0,1,0,0,1,0|2,0,0]=4 433 B9R1.12 NCCCC1=CC=CO1 3731AE [0,1,0,0,1,0|1,0,0]=3 434 B9R1.12 NCCCC1=CC=CS1 6482AE [0,1,0,0,1,0|1,0,0]=3 435 B9R1.12 NCCCC1=CNN=C1 7165AD [0,1,0,0,1,0|2,0,0]=4 436 B9R1.12 OCCCC1=CSC=C1 5648AJ [0,1,0,0,1,0|2,0,0]=4 437 B9R1.12 OCCCN1C=CC=C1 1412AL [0,1,0,0,1,0|2,0,0]=4 438 B9R1.13 CC(N)CC1=CC=CO1 8493AB [0,1,0,0,1,0|1,0,0]=3 439 B9R1.13 CC(N)CN1C=CN=C1 5070AH [0,1,0,0,1,0|2,0,0]=4 440 B9R1.13 CC(O)CC1=CC=CO1 6519AJ [0,1,0,0,1,0|2,0,0]=4 441 B9R1.13 N=C(N)CC1=CC=CS1 7341AE [0,1,0,0,1,0|1,0,1]=4 442 B9R1.33 CC1=C(CCN)NC=N1 1677AE [0,1,0,0,1,0|2,0,0]=4 443 B9R1.33 CCCC1=C(C)SC=C1 V3396 [0,1,0,0,1,0|2,0,0]=4 444 B9R1.33 CN1C=CC=C1CCN 1703AL [0,1,0,0,1,0|1,0,0]=3 445 B9R1.33 CN1C=CN=C1CCN X3600 [0,1,0,0,1,0|2,0,0]=4 446 B9R1.33 CN1C=CN=C1CCN Y4448 [0,1,0,0,1,0|2,0,0]=4 447 B9R1.33 CN1C=NC=C1CCN 2460AL [0,1,0,0,1,0|2,0,0]=4 448 B11R1.1 C=CCCC1=CC=C(C)C=C1 6965AD [0,2,0,0,0,0|1,0,0]=3 449 B11R1.1 C=CCOC1=CC=C(N)C=C1 5430AD [0,2,0,0,0,0|1,0,1]=4 450 B11R1.1 CC1=CC=C(CN=[N+]=[N-])C=C1 5559AD [0,2,0,0,0,0|1,0,1]=4 451 B11R1.1 CC1=CC=C(NCCO)C=C1 9296AD [0,2,0,0,0,0|1,0,0]=3 452 B11R1.1 CC1=CC=C(OCCBr)C=C1 V3999 [0,2,0,0,0,0|1,0,0]=3 453 B11R1.1 CC1=CC=C(OCCCl)C=C1 7057AD [0,2,0,0,0,0|1,0,0]=3 454 B11R1.1 CCCCC1=CC=C(C)C=C1 Z2332 [0,2,0,0,0,0|1,0,0]=3 455 B11R1.1 CCCCC1=CC=C(Cl)N=C1 6440AA [0,2,0,0,0,0|2,0,0]=4 456 B11R1.1 CCCCC1=CN=C(C)C=C1 5821AH [0,2,0,0,0,0|2,0,0]=4 457 B11R1.1 CCCNC1=NC=C(Br)C=C1 Z6268 [0,2,0,0,0,0|2,0,0]=4 458 B11R1.1 CCNCC1=CC=C(N)C=C1 7272AJ [0,2,0,0,0,0|1,0,0]=3 459 B11R1.1 CCNCC1=CC=C(O)C=C1 6053AJ [0,2,0,0,0,0|1,0,0]=3 460 B11R1.1 CCNCC1=CN=C(Cl)C=C1 S696 [0,2,0,0,0,0|2,0,0]=4 461 B11R1.1 CNCCC1=CC=C(Br)C=C1 V7496 [0,2,0,0,0,0|0,0,0]=2 462 B11R1.1 CNCCC1=CC=C(N)C=C1 X8249 [0,2,0,0,0,0|0,0,0]=2 463 B11R1.1 CN\N=N\C1=CC=C(C)C=C1 4909AL [0,2,0,0,0,0|2,0,0]=4 464 B11R1.1 ClC1=CC=C(\C=C\CBr)C=C1 1548AL [0,2,0,0,0,0|1,0,1]=4 465 B11R1.1 ClCCCC1=CC=C(Br)C=C1 Y9960 [0,2,0,0,0,0|1,0,0]=3 466 B11R1.1 ClC\C=C\C1=CC=C(Br)C=C1 Y1270 [0,2,0,0,0,0|1,0,1]=4 467 B11R1.1 FC1=CC=C(CCCBr)C=C1 V4639 [0,2,0,0,0,0|1,0,0]=3 468 B11R1.1 FCCOC1=CC=C(Br)C=C1 V5244 [0,2,0,0,0,0|1,0,0]=3 469 B11R1.1 N#CCOC1=CC=C(F)C=C1 8133AD [0,2,0,0,0,0|0,0,2]=4 470 B11R1.1 NC1=CC=C(CCCO)C=C1 7207AA [0,2,0,0,0,0|1,0,0]=3 471 B11R1.1 NCCCC1=CC=C(F)C=C1 3289AD [0,2,0,0,0,0|0,0,0]=2 472 B11R1.1 NCCCC1=CC=C(F)C=C1 7357AC [0,2,0,0,0,0|0,0,0]=2 473 B11R1.1 NCCCC1=CC=C(N)C=C1 9266AB [0,2,0,0,0,0|0,0,0]=2 474 B11R1.1 NCCNC1=CC=C(Cl)C=C1 4194AD [0,2,0,0,0,0|0,0,0]=2 475 B11R1.1 NCCNC1=CC=C(F)C=C1 4360AJ [0,2,0,0,0,0|0,0,0]=2 476 B11R1.1 O=CNCC1=CC=C(Cl)C=C1 3648AL [0,2,0,0,0,0|1,0,1]=4 477 B11R1.1 OCCCC1=CC=C(Br)N=C1 0074AC [0,2,0,0,0,0|2,0,0]=4 478 B11R1.1 OCCCC1=CC=C(F)C=C1 V7380 [0,2,0,0,0,0|1,0,0]=3 479 B11R1.1 OCCNC1=NC=C(Br)C=C1 2906AF [0,2,0,0,0,0|2,0,0]=4 480 B11R1.1 OCCOC1=NC=C(Br)C=C1 Z0377 [0,2,0,0,0,0|2,0,0]=4 481 B11R1.1 OC\C=C\C1=CC=C(Br)C=C1 8226AC [0,2,0,0,0,0|1,0,1]=4 482 B11R1.1 [N-]=[N+]=NCC1=CC=C(F)C=C1 5092AD [0,2,0,0,0,0|1,0,1]=4 483 B11R1.20 CC(C)CC1=CC=C(N)C=C1 3122AB [0,2,0,0,0,0|1,0,0]=3 484 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 2014AC [0,2,0,0,0,0|2,0,0]=4 485 B11R1.20 CC(C)NC1=CC=C(F)C=C1 W7991 [0,2,0,0,0,0|2,0,0]=4 486 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Z0614 [0,2,0,0,0,0|2,0,0]=4 487 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 4423AJ [0,2,0,0,0,0|1,0,1]=4 488 B11R1.20 FC(F)SC1=CC=C(Br)C=C1 V6143 [0,2,0,0,0,0|2,0,0]=4 489 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 0100AC [0,2,0,0,0,0|1,0,1]=4 490 B11R1.20 NC(=O)NC1=CC=C(O)C=C1 7848AA [0,2,0,0,0,0|1,0,1]=4 491 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 2203AE [0,2,0,0,0,0|1,0,1]=4 492 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 P247 [0,2,0,0,0,0|1,0,1]=4 493 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [0,2,0,0,0,0|0,0,0]=2 494 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [0,2,0,0,0,0|0,0,0]=2 495 B11R1.22 CCC(N)C1=CC=C(C)C=C1 5656AD [0,2,0,0,0,0|1,0,0]=3 496 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 9145AE [0,2,0,0,0,0|1,0,0]=3 497 B11R1.22 CCC(N)C1=CC=C(F)C=C1 8597AC [0,2,0,0,0,0|1,0,0]=3 498 B11R1.22 CCC(N)C1=CC=C(F)C=C1 9157AE [0,2,0,0,0,0|1,0,0]=3 499 B11R1.22 CCN(N)C1=CC=C(C)C=C1 4836AL [0,2,0,0,0,0|2,0,0]=4 500 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 1684AB [0,2,0,0,0,0|1,0,0]=3 501 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y6691 [0,2,0,0,0,0|1,0,0]=3 502 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 X9085 [0,2,0,0,0,0|1,0,0]=3 503 B11R1.22 COC(C)C1=CC=C(Br)C=C1 6457AE [0,2,0,0,0,0|2,0,0]=4 504 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 2630AL [0,2,0,0,0,0|1,0,1]=4 505 B11R1.22 NCC(=O)C1=CC=C(I)C=C1 9286AB [0,2,0,0,0,0|0,0,1]=3 506 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 1817AC [0,2,0,0,0,0|0,0,0]=2 507 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 X4763 [0,2,0,0,0,0|0,0,0]=2 508 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 3000AE [0,2,0,0,0,0|0,0,0]=2 509 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 9601AB [0,2,0,0,0,0|0,0,0]=2 510 B11R1.22 NCC(O)C1=CC=C(F)C=C1 3928AE [0,2,0,0,0,0|0,0,0]=2 511 B11R1.22 NCC(O)C1=CC=C(F)C=C1 5412AB [0,2,0,0,0,0|0,0,0]=2 512 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 X6771 [0,2,0,0,0,0|1,0,0]=3 513 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 5935AC [0,2,0,0,0,0|1,0,1]=4 514 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 9573AB [0,2,0,0,0,0|1,0,1]=4 515 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 Y8738 [0,2,0,0,0,0|1,0,1]=4 516 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 2338AC [0,2,0,0,0,0|1,0,1]=4 517 B11R1.22 OCC(Cl)C1=CC=C(Cl)C=C1 2030AL [0,2,0,0,0,0|1,0,0]=3 518 B11R1.81 C=CCC1=CC=C(F)C=C1Cl X7339 [0,2,0,0,0,0|1,0,1]=4 519 B11R1.81 CC1=CC(F)=CC=C1CC#N X8385 [0,2,0,0,0,0|0,0,2]=4 520 B11R1.81 CC1=CC=C(CC#N)C(C)=C1 8114AE [0,2,0,0,0,0|0,0,2]=4 521 B11R1.81 CCNC1=C(Cl)C=C(Cl)C=C1 4922AH [0,2,0,0,0,0|2,0,0]=4 522 B11R1.81 CCNC1=C(N)C=C(Cl)C=C1 6903AE [0,2,0,0,0,0|2,0,0]=4 523 B11R1.81 CCOC1=CC=C(F)C=C1F Z0530 [0,2,0,0,0,0|2,0,0]=4 524 B11R1.81 CCOC1=CC=C(N)C=C1C 0469AD [0,2,0,0,0,0|2,0,0]=4 525 B11R1.81 N#CCC1=CC=C(O)C=C1O W1996 [0,2,0,0,0,0|0,0,2]=4 526 B11R1.81 NCCC1=CC=C(F)C=C1F 6230AA [0,2,0,0,0,0|0,0,0]=2 527 B11R1.81 NCCC1=CNC(=O)NC1=O 7570AD [0,2,0,0,0,0|2,0,0]=4 528 B11R1.81 NCCC1=NC=C(Cl)C=C1Cl 1080AJ [0,2,0,0,0,0|1,0,0]=3 529 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 1901AL [0,2,0,0,0,0|1,0,0]=3 530 B11R1.81 NOCC1=C(Cl)C=C(Cl)C=C1 7381AB [0,2,0,0,0,0|1,0,0]=3 531 B11R1.81 NOCC1=C(Cl)C=C(F)C=C1 3474AB [0,2,0,0,0,0|1,0,0]=3 532 B11R1.83 CCCC1=CC=C(NN)C=C1 1149AE [0,2,0,0,0,0|1,0,0]=3 533 B11R1.83 COC1=CC=C(CNO)C=C1 7133AB [0,2,0,0,0,0|2,0,0]=4 534 B11R1.83 COC1=NC=C(CCN)C=C1 1228AJ [0,2,0,0,0,0|1,0,0]=3 535 B11R1.83 COCC1=CC=C(CO)C=C1 8790AH [0,2,0,0,0,0|2,0,0]=4 536 B11R1.83 N#CC1=CC=C(CCCl)C=C1 4983AA [0,2,0,0,0,0|1,0,0]=3 537 B11R1.83 NCCC1=CC=C(CO)C=C1 9331AH [0,2,0,0,0,0|0,0,0]=2 538 B11R1.83 NCCC1=CC=C(CO)C=C1 9332AH [0,2,0,0,0,0|0,0,0]=2 539 B11R1.192 C=CCC1=CC(Cl)=C(Cl)C=C1 7092AD [0,2,0,0,0,0|1,0,1]=4 540 B11R1.192 CC1=CC(CC#N)=CC=C1Br V4369 [0,2,0,0,0,0|0,0,2]=4 541 B11R1.192 CCNC1=CC(F)=C(F)C=C1 3983AD [0,2,0,0,0,0|2,0,0]=4 542 B11R1.192 CCOC1=CC(F)=C(N)C=C1 6418AB [0,2,0,0,0,0|2,0,0]=4 543 B11R1.192 CCOC1=CC=C(N)C(N)=C1 X9397 [0,2,0,0,0,0|2,0,0]=4 544 B11R1.192 CNCC1=CC=C(O)C(O)=C1 6058AJ [0,2,0,0,0,0|2,0,0]=4 545 B11R1.192 NOCC1=CC(O)=C(Br)C=C1 SYN5502 [0,2,0,0,0,0|1,0,0]=3 546 B11R1.192 NOCC1=CC=C(Cl)C(Cl)=C1 7654AA [0,2,0,0,0,0|1,0,0]=3 547 B11R1.192 O=CCC1=CC=C(Cl)C(Cl)=C1 W9614 [0,2,0,0,0,0|1,0,1]=4 548 B11R1.13 C=CCC1=C(N)C(N)=CC=C1 4831AD [0,2,0,0,0,0|1,0,1]=4 549 B11R1.13 CC1=C(CC#N)C=CC=C1F 6829AB [0,2,0,0,0,0|0,0,2]=4 550 B11R1.13 CCCC1=C(O)C(O)=CC=C1 2907AB [0,2,0,0,0,0|1,0,0]=3 551 B11R1.13 CCNC1=C(C)C(C)=CC=C1 2873AE [0,2,0,0,0,0|2,0,0]=4 552 B11R1.13 CCNC1=C(Cl)C(Cl)=CC=C1 4902AH [0,2,0,0,0,0|2,0,0]=4 553 B11R1.13 CCOC1=C(I)C(Br)=CC=C1 Z6996 [0,2,0,0,0,0|2,0,0]=4 554 B11R1.13 CCOC1=C(N)C(Br)=CC=C1 Z7005 [0,2,0,0,0,0|2,0,0]=4 555 B11R1.13 CNCC1=C(F)C(Br)=CC=C1 Z9436 [0,2,0,0,0,0|2,0,0]=4 556 B11R1.17 C=CCOC1=C(C)C=CC=C1 7034AL [0,2,0,0,0,0|1,0,1]=4 557 B11R1.17 C=CCOC1=CC=CC=C1N 1709AE [0,2,0,0,0,0|1,0,1]=4 558 B11R1.17 C=CCOC1=CC=CC=C1N 8907AD [0,2,0,0,0,0|1,0,1]=4 559 B11R1.17 CC1=C(CN=C=S)C=CC=C1 5365AD [0,2,0,0,0,0|1,0,1]=4 560 B11R1.17 CC1=C(CN=[N+]=[N-])C=CC=C1 3406AD [0,2,0,0,0,0|1,0,1]=4 561 B11R1.17 CC1=C(NCCO)C=CC=C1 4010AD [0,2,0,0,0,0|1,0,0]=3 562 B11R1.17 CC1=C(OCCCl)C=CC=C1 7182AD [0,2,0,0,0,0|1,0,0]=3 563 B11R1.17 CC1=CC=CC=C1OCCBr 9799AA [0,2,0,0,0,0|1,0,0]=3 564 B11R1.17 CCCCC1=C(N)C=CC=C1 5551AL [0,2,0,0,0,0|1,0,0]=3 565 B11R1.17 CCCNC1=C(Cl)C=CC=C1 5500AE [0,2,0,0,0,0|1,0,0]=3 566 B11R1.17 CCCNC1=NC=CC=C1N 3687AE [0,2,0,0,0,0|2,0,0]=4 567 B11R1.17 CCCOC1=CC=CC=C1N 3820AE [0,2,0,0,0,0|1,0,0]=3 568 B11R1.17 CCCOC1=NC=CC=C1Br V7645 [0,2,0,0,0,0|2,0,0]=4 569 B11R1.17 CCCOC1=NC=CC=C1I W9297 [0,2,0,0,0,0|2,0,0]=4 570 B11R1.17 CCNCC1=NC=CC=C1C 4242AF [0,2,0,0,0,0|2,0,0]=4 571 B11R1.17 ClC1=CC=CC=C1CCCBr V6557 [0,2,0,0,0,0|1,0,0]=3 572 B11R1.17 FC1=CC=CC=C1CCCBr Z9473 [0,2,0,0,0,0|1,0,0]=3 573 B11R1.17 N#CCCC1=C(N)C=CC=C1 8000AB [0,2,0,0,0,0|0,0,1]=3 574 B11R1.17 NC1=C(CCCO)C=CC=C1 8496AB [0,2,0,0,0,0|1,0,0]=3 575 B11R1.17 NC1=C(OCCO)C=CN=C1 Z6720 [0,2,0,0,0,0|2,0,0]=4 576 B11R1.17 NC1=C(OCCO)N=CC=C1 7584AC [0,2,0,0,0,0|2,0,0]=4 577 B11R1.17 NC1=CC=CC=C1OCCBr V2926 [0,2,0,0,0,0|1,0,0]=3 578 B11R1.17 NC1=CC=CN=C1NCCO 0651AD [0,2,0,0,0,0|2,0,0]=4 579 B11R1.17 NCCCN1C=CC=CC1=O 0650AA [0,2,0,0,0,0|1,0,0]=3 580 B11R1.17 NCCOC1=C(Cl)C=CC=C1 8744AD [0,2,0,0,0,0|0,0,0]=2 581 B11R1.17 NCCOC1=CC=CC=C1F Z8222 [0,2,0,0,0,0|0,0,0]=2 582 B11R1.17 OCCCC1=CC=CC=C1Cl V6977 [0,2,0,0,0,0|1,0,0]=3 583 B11R1.17 [N-]=[N+]=NCC1=CC=CC=C1F 6867AE [0,2,0,0,0,0|1,0,1]=4 584 B11R1.41 CCNC1=C(OC)C=CC=C1 0860AF [0,2,0,0,0,0|2,0,0]=4 585 B11R1.41 CCOC1=CC=CC=C1CCl 9104AB [0,2,0,0,0,0|2,0,0]=4 586 B11R1.41 CCOC1=CC=CC=C1NC 6851AD [0,2,0,0,0,0|2,0,0]=4 587 B11R1.41 CCOC1=CC=CC=C1OC 1622AL [0,2,0,0,0,0|2,0,0]=4 588 B11R1.41 CNCC1=C(CO)C=CC=C1 5373AJ [0,2,0,0,0,0|2,0,0]=4 589 B11R1.41 COC1=C(CC=O)C=CC=C1 3932AB [0,2,0,0,0,0|1,0,1]=4 590 B11R1.41 COC1=CC=CC=C1CNN 0742AF [0,2,0,0,0,0|1,0,0]=3 591 B11R1.41 COC1=CC=CC=C1CON 3475AB [0,2,0,0,0,0|1,0,0]=3 592 B11R1.41 COCC1=C(CN)C=CC=C1 1506AF [0,2,0,0,0,0|2,0,0]=4 593 B11R1.41 N#CCC1=CC=CC=C1C=O 8509AH [0,2,0,0,0,0|0,0,2]=4 594 B11R1.86 CC(=O)CC1=CC=CC=C1C 7072AB [0,2,0,0,0,0|1,0,1]=4 595 B11R1.86 CC(C)CC1=C(N)C=CC=C1 5195AJ [0,2,0,0,0,0|1,0,0]=3 596 B11R1.86 CC(C)NC1=CC=CC=C1N Z3346 [0,2,0,0,0,0|2,0,0]=4 597 B11R1.86 CC1=C(NC(=N)N)C=CC=C1 7575AH [0,2,0,0,0,0|1,0,1]=4 598 B11R1.86 CC1=C(NC(=N)N)C=CC=C1 7576AH [0,2,0,0,0,0|1,0,1]=4 599 B11R1.86 CN(C)CC1=C(F)C=CC=C1 1557AB [0,2,0,0,0,0|2,0,0]=4 600 B11R1.86 CN(C)CC1=C(O)C=CC=C1 8448AD [0,2,0,0,0,0|2,0,0]=4 601 B11R1.86 CN(C)CC1=CC=CC=C1N 9984AH [0,2,0,0,0,0|2,0,0]=4 602 B11R1.86 N=C(N)CC1=CC=CC=C1Br 3452AD [0,2,0,0,0,0|0,0,1]=3 603 B11R1.86 N=C(N)CC1=CC=CC=C1Cl V6572 [0,2,0,0,0,0|0,0,1]=3 604 B11R1.86 N=C(N)NC1=C(F)C=CC=C1 5657AB [0,2,0,0,0,0|1,0,1]=4 605 B11R1.86 NC(=S)NC1=CC=CC=C1Br V6496 [0,2,0,0,0,0|1,0,1]=4 606 B11R1.182 C=CCC1=CC(Br)=CC=C1O X6454 [0,2,0,0,0,0|1,0,1]=4 607 B11R1.182 CCNC1=C(Cl)C=CC(Cl)=C1 4930AH [0,2,0,0,0,0|2,0,0]=4 608 B11R1.182 CCOC1=C(N)C=CC(F)=C1 5982AD [0,2,0,0,0,0|2,0,0]=4 609 B11R1.182 CCOC1=CC(Br)=CC=C1C Z0931 [0,2,0,0,0,0|2,0,0]=4 610 B11R1.182 CCOC1=CC(C)=CC=C1Br Z1243 [0,2,0,0,0,0|2,0,0]=4 611 B11R1.182 CCOC1=CC(N)=CC=C1Cl V8087 [0,2,0,0,0,0|2,0,0]=4 612 B11R1.182 CNCC1=CC(Cl)=CC=C1Cl 5047AC [0,2,0,0,0,0|2,0,0]=4 613 B11R1.182 CNCC1=CC(Cl)=CC=C1O 6130AJ [0,2,0,0,0,0|2,0,0]=4 614 B11R1.182 N#CCC1=CC(Br)=CC=C1Cl 1284AA [0,2,0,0,0,0|0,0,2]=4 615 B11R1.182 N#CCC1=CC(N)=CC=C1Cl 0666AF [0,2,0,0,0,0|0,0,2]=4 616 B11R1.182 NOCC1=C(Cl)C=CC(Cl)=C1 0055AE [0,2,0,0,0,0|1,0,0]=3 617 B11R1.182 N\N=C\C1=CC(Br)=CC=C1F 2890AL [0,2,0,0,0,0|1,0,1]=4 618 B11R1.222 CC1=C(C(O)CN)C=CC=C1 5054AH [0,2,0,0,0,0|0,0,0]=2 619 B11R1.222 CC1=CC=CC=C1C(=O)CN X6576 [0,2,0,0,0,0|0,0,1]=3 620 B11R1.222 CCC(=O)C1=C(N)C=CC=C1 9392AH [0,2,0,0,0,0|1,0,1]=4 621 B11R1.222 CCN(N)C1=C(C)C=CC=C1 4838AL [0,2,0,0,0,0|2,0,0]=4 622 B11R1.222 CC[C@@H](N)C1=CC=CC=C1C W8813 [0,2,0,0,0,0|1,0,0]=3 623 B11R1.222 CC[C@H](N)C1=CC=CC=C1Cl W8965 [0,2,0,0,0,0|1,0,0]=3 624 B11R1.222 CNC(C)C1=CC=CC=C1Cl W6646 [0,2,0,0,0,0|2,0,0]=4 625 B11R1.222 NCC(O)C1=CC=CC=C1F 3587AB [0,2,0,0,0,0|0,0,0]=2 626 B11R1.605 CC1=CC=CC(C)=C1CC#N 5409AE [0,2,0,0,0,0|0,0,2]=4 627 B11R1.605 CCNC1=C(Cl)C=CC=C1Cl 4936AH [0,2,0,0,0,0|2,0,0]=4 628 B11R1.605 CCOC1=C(C)C=CC=C1N Z9878 [0,2,0,0,0,0|2,0,0]=4 629 B11R1.605 CCOC1=C(N)C=CC=C1Cl 5168AE [0,2,0,0,0,0|2,0,0]=4 630 B11R1.605 NC1=CC=CC(Cl)=C1CCO 0188AA [0,2,0,0,0,0|1,0,0]=3 631 B11R1.605 NNCC1=C(Cl)C=CC=C1Cl 4669AE [0,2,0,0,0,0|1,0,0]=3 632 B11R1.605 NNCC1=C(Cl)C=CC=C1F 8275AC [0,2,0,0,0,0|1,0,0]=3 633 B11R1.605 NNCC1=C(F)C=CC=C1Cl 0343AD [0,2,0,0,0,0|1,0,0]=3 634 B11R1.605 NOCC1=C(F)C=CC=C1Cl 5750AC [0,2,0,0,0,0|1,0,0]=3 635 B11R1.605 OCCC1=C(F)C=CC=C1F 8621AA [0,2,0,0,0,0|1,0,0]=3 636 B11R1.23 CC(CO)C1=CC=CC(=O)C1 W6317 [0,2,0,0,0,0|1,0,1]=4 637 B11R1.23 CC1=CC(C(=O)CN)=CC=C1 0979AC [0,2,0,0,0,0|0,0,1]=3 638 B11R1.23 CC1=CC=CC(C(O)CN)=C1 7583AB [0,2,0,0,0,0|0,0,0]=2 639 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 2535AE [0,2,0,0,0,0|1,0,0]=3 640 B11R1.23 CCC(N)C1=CC(N)=CC=C1 1913AJ [0,2,0,0,0,0|1,0,0]=3 641 B11R1.23 CCC(N)C1=NC=CC(C)=C1 9648AC [0,2,0,0,0,0|2,0,0]=4 642 B11R1.23 CCN(C)C1=CC(N)=CC=C1 9949AH [0,2,0,0,0,0|2,0,0]=4 643 B11R1.23 CC[C@@H](N)C1=CC=CC(F)=C1 X9176 [0,2,0,0,0,0|1,0,0]=3 644 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 9082AH [0,2,0,0,0,0|1,0,0]=3 645 B11R1.23 CNC(C)C1=CC=CC(Cl)=C1 W3261 [0,2,0,0,0,0|2,0,0]=4 646 B11R1.23 NC(CO)C1=CC(Cl)=CC=C1 3155AH [0,2,0,0,0,0|1,0,0]=3 647 B11R1.23 NCC(=O)C1=CC(F)=CC=C1 5755AC [0,2,0,0,0,0|0,0,1]=3 648 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 V2280 [0,2,0,0,0,0|0,0,1]=3 649 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 2712AC [0,2,0,0,0,0|0,0,0]=2 650 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 7584AB [0,2,0,0,0,0|0,0,0]=2 651 B11R1.23 NCC(O)C1=CC(F)=CC=C1 5405AB [0,2,0,0,0,0|0,0,0]=2 652 B11R1.23 NC[C@@H](O)C1=CC=CC(Cl)=C1 X5098 [0,2,0,0,0,0|0,0,0]=2 653 B11R1.23 N[C@@H](CO)C1=CC(Cl)=CC=C1 N836 [0,2,0,0,0,0|1,0,0]=3 654 B11R1.23 O=C(CCl)C1=CC=CC(F)=C1 7664AB [0,2,0,0,0,0|1,0,1]=4 655 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 X3148 [0,2,0,0,0,0|1,0,0]=3 656 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 6985AA [0,2,0,0,0,0|1,0,0]=3 657 B11R1.24 C=CCCC1=CC=CC(Cl)=C1 2995AF [0,2,0,0,0,0|1,0,0]=3 658 B11R1.24 C=CCOC1=CC(N)=CC=C1 7698AC [0,2,0,0,0,0|1,0,1]=4 659 B11R1.24 CC1=CC(CCCO)=CC=C1 3205AH [0,2,0,0,0,0|1,0,0]=3 660 B11R1.24 CC1=CC(CN=C=O)=CC=C1 C935 [0,2,0,0,0,0|1,0,1]=4 661 B11R1.24 CC1=CC(OCCBr)=CC=C1 7438AE [0,2,0,0,0,0|1,0,0]=3 662 B11R1.24 CC1=CC=CC(CSC#N)=C1 1828AE [0,2,0,0,0,0|0,0,2]=4 663 B11R1.24 CC1=CC=CC(OCCO)=C1 5007AL [0,2,0,0,0,0|1,0,0]=3 664 B11R1.24 CCCCC1=CC=CC(N)=N1 Y4830 [0,2,0,0,0,0|2,0,0]=4 665 B11R1.24 CCCNC1=CC(C)=CC=C1 4247AD [0,2,0,0,0,0|1,0,0]=3 666 B11R1.24 CCCNC1=CC(Cl)=CC=C1 9833AD [0,2,0,0,0,0|1,0,0]=3 667 B11R1.24 CCCOC1=CC=CC(N)=C1 3821AE [0,2,0,0,0,0|1,0,0]=3 668 B11R1.24 CNCCC1=CC=CC(F)=C1 V6333 [0,2,0,0,0,0|0,0,0]=2 669 B11R1.24 ClC1=CC(CCCBr)=CC=C1 V8963 [0,2,0,0,0,0|1,0,0]=3 670 B11R1.24 N#CCCC1=CC=CC(Br)=C1 1944AE [0,2,0,0,0,0|0,0,1]=3 671 B11R1.24 NCCCC1=CC=CC(Cl)=C1 HTS033081 [0,2,0,0,0,0|0,0,0]=2 672 B11R1.24 NCCOC1=CC(Br)=CN=C1 2060AA [0,2,0,0,0,0|1,0,0]=3 673 B11R1.24 NCCOC1=CC=CC(F)=C1 Z8223 [0,2,0,0,0,0|0,0,0]=2 674 B11R1.24 O=C=NCC1=CC=CC(F)=C1 7636AC [0,2,0,0,0,0|1,0,1]=4 675 B11R1.24 O=CCCC1=CC=CC(Cl)=C1 3971AD [0,2,0,0,0,0|1,0,0]=3 676 B11R1.24 O=CCCC1=CC=CC(F)=C1 1852AB [0,2,0,0,0,0|1,0,0]=3 677 B11R1.24 OCC#CC1=CC=CC(Cl)=C1 Y4129 [0,2,0,0,0,0|1,0,1]=4 678 B11R1.24 OCCCC1=CC=CC(Cl)=C1 V4535 [0,2,0,0,0,0|1,0,0]=3 679 B11R1.34 C=CCC1=CC(Cl)=CC(Cl)=C1 9319AE [0,2,0,0,0,0|1,0,1]=4 680 B11R1.34 CCCC1=CC(O)=CC(=O)O1 2834AJ [0,2,0,0,0,0|2,0,0]=4 681 B11R1.34 CCNC1=CC(Cl)=CC(Cl)=C1 4259AH [0,2,0,0,0,0|2,0,0]=4 682 B11R1.34 CNCC1=CC(Cl)=CC(Cl)=C1 2304AL [0,2,0,0,0,0|2,0,0]=4 683 B11R1.34 CNCC1=CC(F)=CC(F)=C1 2725AF [0,2,0,0,0,0|2,0,0]=4 684 B11R1.34 N#CCC1=CC(Br)=CC(Br)=C1 X2657 [0,2,0,0,0,0|0,0,2]=4 685 B11R1.34 N#CCC1=CC(Cl)=CC(F)=C1 6683AB [0,2,0,0,0,0|0,0,2]=4 686 B11R1.157 CC(C)CC1=CC=CC(N)=C1 5897AA [0,2,0,0,0,0|1,0,0]=3 687 B11R1.157 CC1=CC=CC(CC(C)N)=N1 1063AC [0,2,0,0,0,0|1,0,0]=3 688 B11R1.157 FC1=CC=CC(OC(F)F)=C1 1093AE [0,2,0,0,0,0|2,0,0]=4 689 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 9927AB [0,2,0,0,0,0|0,0,1]=3 690 B11R1.157 N=C(N)NC1=CC(Cl)=CC=C1 9218AB [0,2,0,0,0,0|1,0,1]=4 691 B11R1.157 NC(=O)NC1=CC(N)=CC=C1 2129AB [0,2,0,0,0,0|1,0,1]=4 692 B11R1.157 NC(=S)NC1=CC=CC(Br)=C1 Y8238 [0,2,0,0,0,0|1,0,1]=4 693 B11R1.189 C=CCC1=CC(C#N)=CC=C1 6708AE [0,2,0,0,0,0|1,0,1]=4 694 B11R1.189 CCCC1=NC=CC(C#N)=C1 Z2605 [0,2,0,0,0,0|2,0,0]=4 695 B11R1.189 COC1=CC=CC(CNN)=C1 3225AC [0,2,0,0,0,0|1,0,0]=3 696 B11R1.189 COC1=CC=CC(CON)=C1 4968AB [0,2,0,0,0,0|1,0,0]=3 697 B11R1.189 N#CC1=CC=CC(CCO)=C1 0016AB [0,2,0,0,0,0|1,0,0]=3 698 B11R1.7 CC(O)(CN)C1=CC=CC=C1 4663AH [0,2,0,0,0,0|0,0,0]=2 699 B11R1.7 NCC(F)(F)C1=CC=CC=C1 V5700 [0,2,0,0,0,0|0,0,0]=2 700 B11R1.7 NCC(F)(F)C1=NC=CC=C1 2429AB [0,2,0,0,0,0|1,0,0]=3 701 B11R1.12 CCC(CN)C1=CC=CC=C1 V4239 [0,2,0,0,0,0|0,0,0]=2 702 B11R1.12 CCC(NN)C1=CC=CC=C1 8342AH [0,2,0,0,0,0|1,0,0]=3 703 B11R1.12 CN[C@H](CO)C1=CC=CC=C1 7034AA [0,2,0,0,0,0|1,0,0]=3 704 B11R1.12 CO[C@@H](CO)C1=CC=CC=C1 9242AA [0,2,0,0,0,0|1,0,0]=3 705 B11R1.12 NCC(CO)C1=CC=CC=C1 2344AL [0,2,0,0,0,0|0,0,0]=2 706 B11R1.16 C#CCC(N)C1=CC=CC=C1 2882AA [0,2,0,0,0,0|1,0,0]=3 707 B11R1.16 CC(CCN)C1=CC=CC=C1 2059AE [0,2,0,0,0,0|0,0,0]=2 708 B11R1.16 CCCC(N)C1=CN=CC=C1 4944AJ [0,2,0,0,0,0|2,0,0]=4 709 B11R1.16 CCCC(N)C1=NC=CC=C1 5079AC [0,2,0,0,0,0|2,0,0]=4 710 B11R1.16 CCNC(C)C1=CC=CC=C1 7343AC [0,2,0,0,0,0|1,0,0]=3 711 B11R1.16 CN(CCN)C1=CC=CC=C1 3619AL [0,2,0,0,0,0|0,0,0]=2 712 B11R1.16 CNCC(C)C1=CC=CC=C1 3764AF [0,2,0,0,0,0|0,0,0]=2 713 B11R1.16 CNCC(C)C1=CC=CC=C1 6409AE [0,2,0,0,0,0|0,0,0]=2 714 B11R1.16 CNOC(=O)C1=CC=CC=C1 8702AL [0,2,0,0,0,0|1,0,1]=4 715 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 V8983 [0,2,0,0,0,0|1,0,0]=3 716 B11R1.16 COC[C@H](N)C1=CC=CC=C1 V7107 [0,2,0,0,0,0|1,0,0]=3 717 B11R1.16 ClCCC(Br)C1=CC=CC=C1 V4390 [0,2,0,0,0,0|1,0,0]=3 718 B11R1.16 N#CCC(N)C1=NC=CC=C1 Z9347 [0,2,0,0,0,0|1,0,1]=4 719 B11R1.16 NCC[C@@H](O)C1=CC=CC=C1 8991AH [0,2,0,0,0,0|0,0,0]=2 720 B11R1.16 NCC[C@H](O)C1=CC=CC=C1 9158AH [0,2,0,0,0,0|0,0,0]=2 721 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 2006AC [0,2,0,0,0,0|1,0,1]=4 722 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Y8969 [0,2,0,0,0,0|1,0,1]=4 723 B11R1.36 CC(=O)C(O)C1=CC=CC=C1 5136AJ [0,2,0,0,0,0|1,0,1]=4 724 B11R1.36 CC(C)C(N)C1=CC=CC=C1 1780AB [0,2,0,0,0,0|1,0,0]=3 725 B11R1.36 CC(C)C(N)C1=CC=CN=C1 1772AJ [0,2,0,0,0,0|2,0,0]=4 726 B11R1.36 CC(C)C(N)C1=CC=NC=C1 1775AJ [0,2,0,0,0,0|2,0,0]=4 727 B11R1.36 CC(C)[C@@H](N)C1=CC=CC=C1 7205AB [0,2,0,0,0,0|1,0,0]=3 728 B11R1.36 CC(C)[C@H](O)C1=CC=CC=C1 N145 [0,2,0,0,0,0|1,0,0]=3 729 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 9111AE [0,2,0,0,0,0|0,0,1]=3 730 B11R1.36 O=C(C1=CC=CC=C1)C(Cl)Cl L006 [0,2,0,0,0,0|1,0,1]=4 731 B11R1.36 O=C(C1=CC=CC=C1)C(F)F 2418AE [0,2,0,0,0,0|1,0,1]=4 732 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 7920AA [0,2,0,0,0,0|1,0,1]=4 733 B11R1.28 C=CCC#CC1=CC=CC=C1 1010AQ [0,2,0,0,0,0|1,0,1]=4 734 B11R1.28 C=CCOBrC1=CC=CC=C1 X5225 [0,2,0,0,0,0|1,0,1]=4 735 B11R1.28 CCOCCC1=NC=CC=C1 Y8563 [0,2,0,0,0,0|2,0,0]=4 736 B11R1.28 CNCCCC1=CC=CC=C1 1600AB [0,2,0,0,0,0|0,0,0]=2 737 B11R1.28 ClCCCOC1=CC=CC=C1 0684AE [0,2,0,0,0,0|1,0,0]=3 738 B11R1.28 ClCCNCC1=CC=CC=C1 3046AE [0,2,0,0,0,0|1,0,0]=3 739 B11R1.28 ClCCNCC1=CC=CC=C1 7007AE [0,2,0,0,0,0|1,0,0]=3 740 B11R1.28 N#CN\C=N\C1=CC=CC=C1 8847AB [0,2,0,0,0,0|1,0,1]=4 741 B11R1.28 NCCCCC1=CC=CC=C1 9681AD [0,2,0,0,0,0|0,0,0]=2 742 B11R1.28 NOCOCC1=CC=CC=C1 2357AF [0,2,0,0,0,0|0,0,0]=2 743 B11R1.28 O=CCCCC1=CC=CC=C1 6150AD [0,2,0,0,0,0|1,0,0]=3 744 B11R1.28 OCCCCC1=CC=CN=C1 5963AJ [0,2,0,0,0,0|2,0,0]=4 745 B11R1.28 OCCCCC1=CC=NC=C1 5977AJ [0,2,0,0,0,0|2,0,0]=4 746 B11R1.28 OCCNCC1=CC=CC=N1 0192AC [0,2,0,0,0,0|2,0,0]=4 747 B11R1.28 S=C=NCCC1=CC=CC=C1 J70186 [0,2,0,0,0,0|0,0,1]=3 748 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y7506 [0,2,0,0,0,0|0,0,0]=2 749 B11R1.40 CC(CN)CC1=CC=CC=C1 2217AC [0,2,0,0,0,0|0,0,0]=2 750 B11R1.40 CC(CN)OC1=CC=CC=C1 Y9709 [0,2,0,0,0,0|0,0,0]=2 751 B11R1.40 N#CC(Br)CC1=CC=CC=C1 V6952 [0,2,0,0,0,0|0,0,1]=3 752 B11R1.40 N#CC(F)SC1=CC=CC=C1 7940AL [0,2,0,0,0,0|0,0,2]=4 753 B11R1.40 N#CC(N)CC1=CC=CC=C1 V6584 [0,2,0,0,0,0|0,0,0]=2 754 B11R1.40 N#CC(N)CC1=CC=CC=C1 V9283 [0,2,0,0,0,0|0,0,0]=2 755 B11R1.40 NNC(=O)CC1=CC=CC=N1 7900AE [0,2,0,0,0,0|1,0,1]=4 756 B11R1.40 NNC(=O)CC1=CC=CN=C1 9337AJ [0,2,0,0,0,0|1,0,1]=4 757 B11R1.40 NNC(=O)CC1=CC=NC=C1 Y5522 [0,2,0,0,0,0|1,0,1]=4 758 B11R1.40 O=C(CCl)OC1=CC=CC=C1 R105 [0,2,0,0,0,0|1,0,1]=4 759 B11R1.40 O=C(CS)NC1=CC=CC=C1 4177AE [0,2,0,0,0,0|1,0,1]=4 760 B11R1.91 CC(=N)NCC1=CC=CC=C1 1916AH [0,2,0,0,0,0|0,0,2]=4 761 B11R1.91 CC(=O)COC1=CC=CC=C1 X5334 [0,2,0,0,0,0|1,0,1]=4 762 B11R1.91 CC(Cl)COC1=CC=CC=C1 4945AL [0,2,0,0,0,0|1,0,0]=3 763 B11R1.91 CC(N)COC1=CC=CC=C1 4356AB [0,2,0,0,0,0|0,0,0]=2 764 B11R1.91 N=C(N)CCC1=CC=CC=C1 8227AD [0,2,0,0,0,0|0,0,0]=2 765 B11R1.91 N=C(N)CSC1=CC=CC=C1 0460AF [0,2,0,0,0,0|0,0,1]=3 766 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2381AJ [0,2,0,0,0,0|0,0,2]=4 767 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2382AJ [0,2,0,0,0,0|0,0,2]=4 768 B11R1.91 NC(=O)CCC1=NC=CC=C1 5628AJ [0,2,0,0,0,0|1,0,0]=3 769 B11R1.91 NC(=[NH2+])SCC1=CC=CC=C1 AMTEC014 [0,2,0,0,0,0|0,0,1]=3 770 B11R1.91 NC(N)=NCC1=CC=CC=C1 7568AD [0,2,0,0,0,0|0,0,1]=3 771 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 5351AA [0,2,0,0,0,0|2,0,0]=4 772 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 7156AL [0,2,0,0,0,0|2,0,0]=4 773 B11R1.509 C[Si](C)(Cl)CC1=CC=CC=C1 7150AL [0,2,0,0,0,0|1,1,0]=4 774 B9R2.2 C1=CN(C2CC2)C=C1 4548AE [0,0,0,1,1,0|2,0,0]=4 775 B11R2.34 BrC1=CC=C(C2CO2)C=C1 1753AL [0,1,0,1,0,0|1,0,0]=3 776 B11R2.34 ClC1=CC=C(C2CC2)C=C1 V3884 [0,1,0,1,0,0|1,0,0]=3 777 B11R2.34 FC1=CC=C(C2CC2)C=C1 V3957 [0,1,0,1,0,0|1,0,0]=3 778 B11R2.36 BrC1=CC2=C(C=C1)CCN2 V2379 [0,1,0,1,0,0|0,0,0]=2 779 B11R2.36 BrC1=CC2=C(C=C1)COC2 3099AJ [0,1,0,1,0,0|2,0,0]=4 780 B11R2.36 BrC1=CC=C2CCNC2=C1 3136AA [0,1,0,1,0,0|0,0,0]=2 781 B11R2.36 CC1=CC=C2CCNC2=C1 3598AJ [0,1,0,1,0,0|0,0,0]=2 782 B11R2.36 ClC1=CC2=C(C=C1)CNC2 0868AC [0,1,0,1,0,0|2,0,0]=4 783 B11R2.36 ClC1=CC2=C(C=C1)CNC2 5317AA [0,1,0,1,0,0|2,0,0]=4 784 B11R2.36 ClC1=CC2=C(C=C1)CNC2 W9372 [0,1,0,1,0,0|2,0,0]=4 785 B11R2.36 ClC1=CC2=C(C=N1)CCN2 1608AB [0,1,0,1,0,0|1,0,0]=3 786 B11R2.36 ClC1=CC=C2CC=CC2=C1 5224AB [0,1,0,1,0,0|1,0,1]=4 787 B11R2.36 ClC1=CC=C2CCCC2=N1 2919AA [0,1,0,1,0,0|2,0,0]=4 788 B11R2.36 FC1=CC2=C(C=C1)CCC2 Z4670 [0,1,0,1,0,0|1,0,0]=3 789 B11R2.36 FC1=CC2=C(C=C1)CCN2 Z5776 [0,1,0,1,0,0|0,0,0]=2 790 B11R2.36 FC1=CC2=C(C=C1)OCC2 1865AB [0,1,0,1,0,0|1,0,0]=3 791 B11R2.36 FC1=CC=C2NCCC2=C1 3212AJ [0,1,0,1,0,0|0,0,0]=2 792 B11R2.36 IC1=CC2=C(C=C1)CCC2 3759AD [0,1,0,1,0,0|1,0,0]=3 793 B11R2.36 IC1=CC2=C(C=C1)NCC2 3233AJ [0,1,0,1,0,0|0,0,0]=2 794 B11R2.36 IC1=CC=C2NCCC2=C1 3234AJ [0,1,0,1,0,0|0,0,0]=2 795 B11R2.36 NC1=CC2=C(C=C1)CCN2 9087AD [0,1,0,1,0,0|0,0,0]=2 796 B11R2.36 NC1=CC2=C(C=C1)CNC2 6912AB [0,1,0,1,0,0|2,0,0]=4 797 B11R2.36 NC1=CC2=C(C=C1)NC=C2 5783AH [0,1,0,1,0,0|0,0,2]=4 798 B11R2.36 NC1=CC2=C(CCC2)N=C1 5954AD [0,1,0,1,0,0|2,0,0]=4 799 B11R2.36 NC1=CC=C2CNCC2=C1 6301AB [0,1,0,1,0,0|2,0,0]=4 800 B11R2.36 O=C1C=CC2=C(CCC2)N1 V8629 [0,1,0,1,0,0|2,0,0]=4 801 B11R2.36 OC1=CC=C2CCOC2=C1 W4735 [0,1,0,1,0,0|1,0,0]=3 802 B11R2.36 OC1=CC=C2OCCC2=C1 X7949 [0,1,0,1,0,0|1,0,0]=3 803 B11R2.10 IC1=CC2=CC=CC=C2N1 2333AB [0,1,0,1,0,0|0,0,2]=4 804 B11R2.10 NC1=CC2=C(C=CC=C2)N1 U958 [0,1,0,1,0,0|0,0,2]=4 805 B11R2.10 NC1=CC2=CC=CC=C2S1 W6356 [0,1,0,1,0,0|0,0,2]=4 806 B11R2.10 NC1=NC2=C(C=CC=C2)S1 5495AL [0,1,0,1,0,0|1,0,1]=4 807 B11R2.10 NN1N=C2C=CC=CC2=N1 5496AL [0,1,0,1,0,0|2,0,0]=4 808 B11R2.10 O=C1CC2=C(C=CC=N2)N1 3636AB [0,1,0,1,0,0|1,0,1]=4 809 B11R2.10 O=C1CC2=C(C=NC=C2)N1 3015AB [0,1,0,1,0,0|1,0,1]=4 810 B11R2.20 C1=CC2=C(C=C1)CNNC2 5003AJ [0,1,0,1,0,0|1,0,0]=3 811 B11R2.20 C1=CC2=C(C=C1)OCCN2 6903AC [0,1,0,1,0,0|0,0,0]=2 812 B11R2.20 C1=CC2=C(C=N1)CCCO2 5895AE [0,1,0,1,0,0|2,0,0]=4 813 B11R2.20 C1=CC2=C(C=N1)CCNC2 W5369 [0,1,0,1,0,0|1,0,0]=3 814 B11R2.20 C1=CC2=C(C=N1)CNCC2 X9919 [0,1,0,1,0,0|1,0,0]=3 815 B11R2.20 C1=CC2=C(C=N1)NCCO2 2081AJ [0,1,0,1,0,0|1,0,0]=3 816 B11R2.20 C1=CC2=C(C=N1)OCCN2 6547AD [0,1,0,1,0,0|1,0,0]=3 817 B11R2.20 C1=CC2=C(CCNC2)N=C1 W8563 [0,1,0,1,0,0|1,0,0]=3 818 B11R2.20 C1=CC2=C(CNCC2)N=C1 Z4098 [0,1,0,1,0,0|1,0,0]=3 819 B11R2.20 C1=CC2=C(N=C1)OCCN2 8778AC [0,1,0,1,0,0|1,0,0]=3 820 B11R2.20 C1=CC2=C(N=C1)OCCO2 P322 [0,1,0,1,0,0|2,0,0]=4 821 B11R2.20 C1=CC=C2CCN=CC2=C1 3596AB [0,1,0,1,0,0|0,0,1]=3 822 B11R2.20 C1=CC=C2SCCNC2=C1 X7913 [0,1,0,1,0,0|0,0,0]=2 823 B11R2.20 C1=CN=C2CCCOC2=C1 8439AE [0,1,0,1,0,0|2,0,0]=4 824 B11R2.20 C1=CN=C2OCCCC2=C1 2080AJ [0,1,0,1,0,0|2,0,0]=4 825 B11R2.20 C1=NC=C2CCNCC2=C1 9567AH [0,1,0,1,0,0|1,0,0]=3 826 B11R2.20 C1=NC=C2CNCCC2=C1 6197AB [0,1,0,1,0,0|1,0,0]=3 827 B11R2.55 BrC1=C(C2CC2)C=CC=C1 8539AB [0,1,0,1,0,0|1,0,0]=3 828 B11R2.55 ClC1=C(C2CO2)C=CC=C1 U890 [0,1,0,1,0,0|1,0,0]=3 829 B11R2.55 NC1=CC=CC=C1C2CC2 Z0502 [0,1,0,1,0,0|1,0,0]=3 830 B11R2.106 BrC1=C2CCNC2=CC=C1 3117AA [0,1,0,1,0,0|0,0,0]=2 831 B11R2.106 BrC1=C2CCOC2=CC=C1 2682AJ [0,1,0,1,0,0|1,0,0]=3 832 B11R2.106 BrC1=C2NCCC2=CC=C1 3688AJ [0,1,0,1,0,0|0,0,0]=2 833 B11R2.106 CC1=C2CCNC2=CC=C1 3110AA [0,1,0,1,0,0|0,0,0]=2 834 B11R2.106 CC1=C2N=CNC2=CC=C1 6207AJ [0,1,0,1,0,0|1,0,1]=4 835 B11R2.106 CC1=C2NCCC2=CC=C1 0068AC [0,1,0,1,0,0|0,0,0]=2 836 B11R2.106 CC1=CC=CC2=C1CNC2 Y9957 [0,1,0,1,0,0|2,0,0]=4 837 B11R2.106 CC1=CC=CC2=C1N=CN2 6206AJ [0,1,0,1,0,0|1,0,1]=4 838 B11R2.106 ClC1=CC=CC2=C1CCO2 2671AL [0,1,0,1,0,0|1,0,0]=3 839 B11R2.106 ClC1=NC=CC2=C1CCN2 6698AB [0,1,0,1,0,0|1,0,0]=3 840 B11R2.106 FC1=C2OCOC2=CC=C1 V9421 [0,1,0,1,0,0|2,0,0]=4 841 B11R2.106 FC1=CC=CC2=C1CCN2 Y9446 [0,1,0,1,0,0|0,0,0]=2 842 B11R2.106 IC1=C2CCNC2=CC=C1 3116AA [0,1,0,1,0,0|0,0,0]=2 843 B11R2.106 IC1=C2NC=CC2=CC=C1 4944AC [0,1,0,1,0,0|0,0,2]=4 844 B11R2.106 IC1=CC=CC2=C1CCN2 Y4772 [0,1,0,1,0,0|0,0,0]=2 845 B11R2.106 IC1=CC=CC2=C1NN=C2 Y4807 [0,1,0,1,0,0|1,0,1]=4 846 B11R2.106 NC1=C2CCCC2=NC=C1 Z5126 [0,1,0,1,0,0|2,0,0]=4 847 B11R2.106 NC1=C2NCCC2=CC=C1 4155AJ [0,1,0,1,0,0|0,0,0]=2 848 B11R2.106 NC1=CC=CC2=C1CNC2 5573AC [0,1,0,1,0,0|2,0,0]=4 849 B11R2.106 NC1=CC=CC2=C1CNC2 5585AC [0,1,0,1,0,0|2,0,0]=4 850 B11R2.106 NC1=CC=CC2=C1N=NN2 6063AD [0,1,0,1,0,0|2,0,0]=4 851 B11R2.106 O=C1C=CC=C2NCCN12 0091AA [0,1,0,1,0,0|1,0,0]=3 852 B11R2.106 OC1=C2N=NNC2=CC=C1 V1458 [0,1,0,1,0,0|2,0,0]=4 853 B11R2.106 [O-][N+]1=CC=CC2=C1CCC2 2974AL [0,1,0,1,0,0|2,0,0]=4 854 B11R2.988 NCC1CC2=C1C=CC=C2 7180AC [0,1,0,1,0,0|0,0,0]=2 855 B11R2.988 OCC1=CC2=CC=CC=C21 K959 [0,1,0,1,0,0|1,0,1]=4 856 B11R2.35 BrC1=CC(C2CC2)=NC=C1 1717AA [0,1,0,1,0,0|2,0,0]=4 857 B11R2.35 ClC1=CC([C@@H]2CO2)=CC=C1 I069 [0,1,0,1,0,0|1,0,0]=3 858 B11R2.1 NC1=CSC2=CC=CC=C12 Y5306 [0,1,0,1,0,0|0,0,2]=4 859 B11R2.1 NC1=NCC2=C1C=CC=C2 V4519 [0,1,0,1,0,0|0,0,1]=3 860 B11R2.1 NC1CCC2=CC=CN=C21 3374AJ [0,1,0,1,0,0|1,0,0]=3 861 B11R2.1 NC1COC2=CC=CC=C21 1367AJ [0,1,0,1,0,0|0,0,0]=2 862 B11R2.1 NC1COC2=CC=CC=C21 4904AH [0,1,0,1,0,0|0,0,0]=2 863 B11R2.1 NN1N=CC2=CC=CC=C21 3874AB [0,1,0,1,0,0|1,0,1]=4 864 B11R2.1 N[C@H]1COC2=C1C=CC=C2 1110AL [0,1,0,1,0,0|0,0,0]=2 865 B11R2.1 O=C1CCC2=C1C=CN=C2 4302AB [0,1,0,1,0,0|2,0,0]=4 866 B11R2.1 O=C1CCC2=C1C=NC=C2 W6676 [0,1,0,1,0,0|2,0,0]=4 867 B11R2.1 OC1COC2=C1C=CC=N2 7095AA [0,1,0,1,0,0|2,0,0]=4 868 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 C126 [0,1,0,1,0,0|1,0,0]=3 869 B11R2.1 O[C@H]1CCC2=CC=CN=C21 4628AC [0,1,0,1,0,0|2,0,0]=4 870 B11R2.4 NC1CC1C2=CC=CC=C2 2168AL [0,1,0,1,0,0|0,0,0]=2 871 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 8373AH [0,1,0,1,0,0|0,0,0]=2 872 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8412AH [0,1,0,1,0,0|0,0,0]=2 873 B11R2.40 NC1(C2=CC=CC=C2)CC1 X2090 [0,1,0,1,0,0|1,0,0]=3 874 B11R2.40 NC1(C2=CC=NC=C2)CC1 2692AD [0,1,0,1,0,0|2,0,0]=4 875 B11R2.40 NC1(C2=CN=CC=C2)CC1 6906AB [0,1,0,1,0,0|2,0,0]=4 876 B11R2.40 NC1(C2=NC=CC=C2)CC1 6037AB [0,1,0,1,0,0|2,0,0]=4 877 B11R2.239 C1=CC(C2CNC2)=CC=N1 4510AA [0,1,0,1,0,0|1,0,0]=3 878 B11R2.239 C1=CC=C(C2CNC2)N=C1 0585AB [0,1,0,1,0,0|1,0,0]=3 879 B11R2.238 C1=CC=C(NC2CC2)C=C1 Z3373 [0,1,0,1,0,0|1,0,0]=3 880 B7R1.1 CCC1=CC=NO1 3273AB [1,0,0,0,1,0|2,0,0]=4 881 B7R1.1 CCC1=CNC=N1 6226AL [1,0,0,0,1,0|2,0,0]=4 882 B7R1.1 CCC1=NNC=C1 6654AA [1,0,0,0,1,0|2,0,0]=4 883 B7R1.1 COC1=CC=CO1 2109AL [1,0,0,0,1,0|2,0,0]=4 884 B7R1.1 NCC1=CC=CN1 W7617 [1,0,0,0,1,0|1,0,0]=3 885 B7R1.1 NCC1=CC=NO1 6076AB [1,0,0,0,1,0|2,0,0]=4 886 B7R1.1 NCC1=CN=CS1 7784AH [1,0,0,0,1,0|2,0,0]=4 887 B7R1.1 NCC1=CNC=C1 4647AC [1,0,0,0,1,0|1,0,0]=3 888 B7R1.1 NCC1=CNC=N1 1263AC [1,0,0,0,1,0|2,0,0]=4 889 B7R1.1 NCC1=CNC=N1 W7724 [1,0,0,0,1,0|2,0,0]=4 890 B7R1.1 NCC1=COC=C1 Y9148 [1,0,0,0,1,0|1,0,0]=3 891 B7R1.1 NCC1=COC=N1 Y1477 [1,0,0,0,1,0|2,0,0]=4 892 B7R1.1 NCC1=CON=C1 8978AA [1,0,0,0,1,0|2,0,0]=4 893 B7R1.1 NCC1=CSC=C1 Z3907 [1,0,0,0,1,0|1,0,0]=3 894 B7R1.1 NCC1=CSC=N1 0159AD [1,0,0,0,1,0|2,0,0]=4 895 B7R1.1 NCC1=CSC=N1 8187AA [1,0,0,0,1,0|2,0,0]=4 896 B7R1.1 NCC1=NC=CO1 0960AA [1,0,0,0,1,0|2,0,0]=4 897 B7R1.1 NCC1=NOC=C1 3959AJ [1,0,0,0,1,0|2,0,0]=4