0 B8R1.2 ClCC1=NC=CC=N1 F1905-7063 [0,0,0,0,0,0|3,0,0]=3 1 B8R1.2 NCC1=NC=CC=N1 F2147-1534 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.2 NNC1=NC=CN=C1 F8880-0110 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.2 OCC1=CC=NC=C1 F0001-1532 [0,0,0,0,0,0|1,1,0]=2 4 B8R1.2 OCC1=NC=CC=N1 F1910-8474 [0,0,0,0,0,0|2,1,0]=3 5 B8R1.2 OCC1=NC=CN=C1 F9995-1190 [0,0,0,0,0,0|2,1,0]=3 6 B7R1.3 CC1=CC=NC=N1 F0001-1003 [1,0,0,0,0,0|2,0,0]=3 7 B7R1.3 ClC1=CC=CN=N1 F2124-0406 [1,0,0,0,0,0|3,0,0]=4 8 B7R1.3 ClC1=NC=NC=C1 F1967-0821 [1,0,0,0,0,0|3,0,0]=4 9 B7R1.3 NC1=NC=NC=C1 F0001-1551 [1,0,0,0,0,0|3,0,0]=4 10 B7R1.3 OC1=NC=CC=C1 F1995-0210 [1,0,0,0,0,0|1,1,0]=3 11 B9R1.1 C#CC1=NC=C(Br)C=C1 F2167-5076 [0,1,0,0,0,0|2,0,1]=4 12 B9R1.1 C=CC1=CC=C(Cl)C=C1 F0001-0150 [0,1,0,0,0,0|1,0,1]=3 13 B9R1.1 CC1=CC=C(NN)C=C1 F2121-0390 [0,1,0,0,0,0|2,0,0]=3 14 B9R1.1 CNC1=NC=C(Br)C=C1 F8881-1586 [0,1,0,0,0,0|3,0,0]=4 15 B9R1.1 FC1=CC=C(CCl)C=C1 F2190-0253 [0,1,0,0,0,0|1,0,0]=2 16 B9R1.1 NNC1=CC=C(F)C=C1 F2121-0394 [0,1,0,0,0,0|2,0,0]=3 17 B9R1.2 CC1=CC(CCl)=CN=C1 F1910-8464 [0,1,0,0,0,0|2,0,0]=3 18 B9R1.2 CC1=CC=CC(C#N)=N1 F3157-0008 [0,1,0,0,0,0|2,0,1]=4 19 B9R1.2 CC1=CN=CC(CO)=C1 F1910-8475 [0,1,0,0,0,0|1,1,0]=3 20 B9R1.2 CCC1=CC=CC(N)=C1 F0001-1535 [0,1,0,0,0,0|1,0,0]=2 21 B9R1.2 CNC1=NC(Br)=CC=C1 F8889-0577 [0,1,0,0,0,0|3,0,0]=4 22 B9R1.2 ClCC1=CC(Br)=CC=C1 F0001-2247 [0,1,0,0,0,0|1,0,0]=2 23 B9R1.2 N#CC1=CC(O)=NC=C1 F8885-0640 [0,1,0,0,0,0|2,0,1]=4 24 B9R1.2 NCC1=CC=CC(I)=C1 F1967-6740 [0,1,0,0,0,0|1,0,0]=2 25 B9R1.8 BrCCC1=NC=CC=C1 F8884-9163 [0,1,0,0,0,0|2,0,0]=3 26 B9R1.8 CNCC1=CC=NC=C1 F2148-2247 [0,1,0,0,0,0|2,0,0]=3 27 B9R1.8 CNCC1=CN=CC=C1 F2158-0857 [0,1,0,0,0,0|2,0,0]=3 28 B9R1.8 NCCC1=CC=CN=C1 F0001-0713 [0,1,0,0,0,0|2,0,0]=3 29 B9R1.8 O=CCC1=CC=CC=C1 F2190-0653 [0,1,0,0,0,0|0,1,0]=2 30 B9R1.8 OCCC1=CC=NC=C1 F8882-3307 [0,1,0,0,0,0|1,1,0]=3 31 B9R1.8 OCCC1=CN=CC=C1 F1910-8470 [0,1,0,0,0,0|1,1,0]=3 32 B9R1.15 CC1=CC=CC=C1NN F0001-1724 [0,1,0,0,0,0|2,0,0]=3 33 B9R1.15 CC1=CC=CN=C1CCl F8880-5362 [0,1,0,0,0,0|2,0,0]=3 34 B9R1.15 FC1=C(CBr)C=CC=C1 F0001-1217 [0,1,0,0,0,0|1,0,0]=2 35 B7R1.1 C=CC1=CC=CS1 F1967-3023 [0,0,0,0,1,0|2,0,1]=4 36 B7R1.1 NCC1=CSC=C1 F2189-0326 [0,0,0,0,1,0|2,0,0]=3 37 B7R1.1 NCC1=NOC=C1 F8888-3862 [0,0,0,0,1,0|3,0,0]=4 38 B7R1.1 OCC1=CSC=N1 F2173-0020 [0,0,0,0,1,0|2,1,0]=4 39 B7R1.1 OCC1=NC=CS1 F1160-0003 [0,0,0,0,1,0|2,1,0]=4 40 B8R1.3 CC1=CC=C(N)N=N1 F1967-1219 [1,1,0,0,0,0|2,0,0]=4 41 B8R1.3 CC1=CC=C(O)C=C1 F1908-0066 [1,1,0,0,0,0|0,0,0]=2 42 B8R1.3 CC1=CC=C(O)N=N1 F1967-1185 [1,1,0,0,0,0|2,0,0]=4 43 B8R1.3 CC1=CN=C(C)C=N1 F0001-0364 [1,1,0,0,0,0|2,0,0]=4 44 B8R1.3 CC1=NC=C(N)C=N1 F2113-0217 [1,1,0,0,0,0|2,0,0]=4 45 B8R1.3 ClC1=CC=C(Br)C=C1 F0001-0118 [1,1,0,0,0,0|1,0,0]=3 46 B8R1.3 NC1=CC=C(S)C=C1 F0001-0317 [1,1,0,0,0,0|0,0,0]=2 47 B8R1.4 BrC1=CC(I)=CC=N1 F1371-0195 [1,1,0,0,0,0|2,0,0]=4 48 B8R1.4 CC1=CC(=O)NC=N1 F3284-7947 [1,1,0,0,0,0|2,0,0]=4 49 B8R1.4 CC1=CC(Cl)=CC=C1 F0001-0168 [1,1,0,0,0,0|0,0,0]=2 50 B8R1.4 CC1=CC=C[N+]([O-])=C1 F0001-0038 [1,1,0,0,0,0|1,0,0]=3 51 B8R1.4 CC1=CN=CC(C)=N1 F0001-0172 [1,1,0,0,0,0|2,0,0]=4 52 B8R1.4 CC1=NC(N)=CC=N1 F8889-4735 [1,1,0,0,0,0|2,0,0]=4 53 B8R1.4 CC1=NC=CC(O)=N1 F8880-8549 [1,1,0,0,0,0|2,0,0]=4 54 B8R1.4 NC1=CC=CC(N)=C1 F0001-1422 [1,1,0,0,0,0|1,0,0]=3 55 B8R1.5 CN1C=CC=CC1=O F0001-1804 [1,1,0,0,0,0|1,0,0]=3 56 B8R1.5 C[N+]1=CC=CC=C1Cl F3318-0006 [1,1,0,0,0,0|1,0,0]=3 57 B8R1.1 CC1=CC=C(CN)O1 F0001-0484 [0,1,0,0,1,0|2,0,0]=4 58 B8R1.1 CCC1=CC=C(C)S1 F0001-1487 [0,1,0,0,1,0|2,0,0]=4 59 B8R1.1 NCC1=CC=C(Br)S1 F2169-1273 [0,1,0,0,1,0|2,0,0]=4 60 B8R1.7 CC(N)C1=CC=CS1 F3145-1890 [0,1,0,0,1,0|2,0,0]=4 61 B8R1.8 CNCC1=CC=CS1 F2169-1271 [0,1,0,0,1,0|2,0,0]=4 62 B8R1.8 N#CCC1=CSC=C1 F0001-0473 [0,1,0,0,1,0|2,0,0]=4 63 B8R1.8 OCCC1=CC=CS1 F0001-1418 [0,1,0,0,1,0|1,1,0]=4 64 B8R1.8 OCCC1=CSC=C1 F0001-0474 [0,1,0,0,1,0|1,1,0]=4 65 B10R1.1 CCOC1=CC=C(Br)C=C1 F0001-1538 [0,2,0,0,0,0|1,0,0]=3 66 B10R1.1 S=C=NC1=CC=C(Br)C=C1 F1915-0004 [0,2,0,0,0,0|0,0,2]=4 67 B10R1.1 [N-]=[N+]=NC1=CC=C(I)C=C1 F2157-0621 [0,2,0,0,0,0|2,0,0]=4 68 B10R1.3 N#CC1=CC=C(CO)C=C1 F0001-0101 [0,2,0,0,0,0|0,1,0]=3 69 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 F2190-0041 [0,2,0,0,0,0|0,1,1]=4 70 B10R1.13 CN(C)C1=CC=C(N)C=C1 F0001-0728 [0,2,0,0,0,0|2,0,0]=4 71 B10R1.13 CN(C)C1=CC=C(N)C=C1 F2190-0446 [0,2,0,0,0,0|2,0,0]=4 72 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 F3147-3719 [0,2,0,0,0,0|0,1,1]=4 73 B10R1.25 COC1=C(Br)C=C(C)C=C1 F3145-2207 [0,2,0,0,0,0|2,0,0]=4 74 B10R1.25 COC1=CC=C(N)C=C1F F5608-0077 [0,2,0,0,0,0|2,0,0]=4 75 B10R1.25 NCC1=C(F)C=C(F)C=C1 F2190-0536 [0,2,0,0,0,0|1,0,0]=3 76 B10R1.25 OCC1=C(F)C=C(Br)C=C1 F8887-2027 [0,2,0,0,0,0|0,1,0]=3 77 B10R1.176 CC1=CC(C=O)=CC=C1F F0001-0459 [0,2,0,0,0,0|0,1,1]=4 78 B10R1.176 CC1=CC=C(C#N)C=C1C F9995-1329 [0,2,0,0,0,0|1,0,1]=4 79 B10R1.176 COC1=CC(C)=C(Cl)C=C1 F0001-0443 [0,2,0,0,0,0|2,0,0]=4 80 B10R1.176 COC1=CC=C(Cl)C(N)=C1 F5608-0060 [0,2,0,0,0,0|2,0,0]=4 81 B10R1.176 COC1=CC=C(N)C(F)=C1 F0001-1240 [0,2,0,0,0,0|2,0,0]=4 82 B10R1.2 COC1=C(O)C(O)=CC=C1 F0001-2249 [0,2,0,0,0,0|2,0,0]=4 83 B10R1.2 O=CC1=C(Cl)C(Cl)=CC=C1 F0001-1720 [0,2,0,0,0,0|0,1,1]=4 84 B10R1.8 CC1=CC(C)=CC(NN)=C1 F0001-1585 [0,2,0,0,0,0|2,0,0]=4 85 B10R1.8 ClCC1=CC(Cl)=CC(Cl)=C1 F0001-0976 [0,2,0,0,0,0|1,0,0]=3 86 B10R1.10 CC1=CC=CC(N=[N+]=[N-])=C1 F2157-0462 [0,2,0,0,0,0|2,0,0]=4 87 B10R1.10 CCOC1=CC(Br)=CN=C1 F1967-2389 [0,2,0,0,0,0|2,0,0]=4 88 B10R1.10 CCOC1=NC=CC(N)=C1 F8882-6686 [0,2,0,0,0,0|2,0,0]=4 89 B10R1.10 FC1=CC=CC(N=C=S)=C1 F0001-1146 [0,2,0,0,0,0|0,0,2]=4 90 B10R1.10 NCCC1=CC(Cl)=CC=C1 F0001-2428 [0,2,0,0,0,0|1,0,0]=3 91 B10R1.10 S=C=NC1=CC(Br)=CC=C1 F2121-0330 [0,2,0,0,0,0|0,0,2]=4 92 B10R1.10 [N-]=[N+]=NC1=CC(Br)=CC=C1 F2157-0574 [0,2,0,0,0,0|2,0,0]=4 93 B10R1.30 CC1=C(C#N)C=C(N)C=C1 F0001-1322 [0,2,0,0,0,0|1,0,1]=4 94 B10R1.30 CC1=CC=C(Cl)C(CN)=C1 F1913-1595 [0,2,0,0,0,0|1,0,0]=3 95 B10R1.30 N#CC1=CC(N)=CC=C1Cl F0001-1028 [0,2,0,0,0,0|1,0,1]=4 96 B10R1.30 NC1=CC=C(Cl)C(CO)=C1 F5608-0066 [0,2,0,0,0,0|0,1,0]=3 97 B10R1.113 CC(=O)C1=CC=CC(C)=C1 F0001-1527 [0,2,0,0,0,0|0,1,1]=4 98 B10R1.113 CC1=CC(C(N)=O)=CC=C1 F3147-3715 [0,2,0,0,0,0|0,1,1]=4 99 B10R1.113 NC(=O)C1=CC(I)=CC=C1 F1084-0309 [0,2,0,0,0,0|0,1,1]=4 100 B10R1.113 NC(=O)C1=CC(N)=CC=C1 F3377-1722 [0,2,0,0,0,0|0,1,1]=4 101 B10R1.113 NC1=CC(B(O)O)=CC=C1 F0001-0936 [0,2,0,0,0,0|1,1,0]=4 102 B10R1.113 O=[N+]([O-])C1=CC(O)=CC=C1 F0001-1455 [0,2,0,0,0,0|1,1,0]=4 103 B10R1.172 COC1=NC=CC(CO)=C1 F8882-4438 [0,2,0,0,0,0|1,1,0]=4 104 B10R1.172 N#CC1=CC(CCl)=CC=C1 F0001-1744 [0,2,0,0,0,0|1,0,0]=3 105 B10R1.172 OCC1=CC=CC(CO)=N1 F0001-0321 [0,2,0,0,0,0|1,1,0]=4 106 B10R1.15 C#CC(O)C1=CC=CC=C1 F0001-1173 [0,2,0,0,0,0|0,1,0]=3 107 B10R1.15 C=CC(O)C1=CC=CC=C1 F8884-0046 [0,2,0,0,0,0|0,1,0]=3 108 B10R1.15 CCC(C)C1=CC=CC=C1 F0001-0456 [0,2,0,0,0,0|1,0,0]=3 109 B10R1.15 O=C(CCl)C1=CC=CN=C1 F2108-0088 [0,2,0,0,0,0|2,0,0]=4 110 B10R1.28 Cl[Si](Cl)(Cl)C1=CC=CC=C1 F0001-2314 [0,2,0,0,0,0|1,1,0]=4 111 B10R1.61 CC1=CC=CC=C1C(N)=O F1084-0675 [0,2,0,0,0,0|0,1,1]=4 112 B10R1.61 CN(C)C1=C(N)C=CC=C1 F1911-3741 [0,2,0,0,0,0|2,0,0]=4 113 B10R1.61 NC(=O)C1=CC=CC=C1Cl F1084-0242 [0,2,0,0,0,0|0,1,1]=4 114 B10R1.61 NC(=S)C1=C(Cl)C=CC=C1 F1967-1439 [0,2,0,0,0,0|0,0,2]=4 115 B10R1.61 O=C(Cl)C1=CC=CC=C1Br F2190-0064 [0,2,0,0,0,0|0,1,1]=4 116 B10R1.4 CC1=CC=CC=C1CNN F2158-0780 [0,2,0,0,0,0|1,0,0]=3 117 B10R1.4 CC1=CC=CC=C1N=[N+]=[N-] F2157-0463 [0,2,0,0,0,0|2,0,0]=4 118 B10R1.4 CCOC1=C(C)C=CC=C1 F8883-7586 [0,2,0,0,0,0|1,0,0]=3 119 B10R1.4 FC1=C(N=C=S)C=CC=C1 F1915-0005 [0,2,0,0,0,0|0,0,2]=4 120 B10R1.4 NNCC1=CC=CC=C1F F2158-0782 [0,2,0,0,0,0|1,0,0]=3 121 B10R1.4 OCCC1=C(Br)C=CC=C1 F0001-0153 [0,2,0,0,0,0|0,1,0]=3 122 B10R1.4 S=C=NC1=CC=CC=C1Br F2121-0332 [0,2,0,0,0,0|0,0,2]=4 123 B10R1.4 [N-]=[N+]=NC1=C(F)C=CC=C1 F2157-0464 [0,2,0,0,0,0|2,0,0]=4 124 B10R1.17 C#CCOC1=CC=CC=C1 F8882-4982 [0,2,0,0,0,0|1,0,0]=3 125 B10R1.17 CCCCC1=CC=CC=C1 F0001-0089 [0,2,0,0,0,0|1,0,0]=3 126 B10R1.17 CNCCC1=NC=CC=C1 F2158-0901 [0,2,0,0,0,0|2,0,0]=4 127 B10R1.17 NCCOC1=CN=CC=C1 F8881-5754 [0,2,0,0,0,0|2,0,0]=4 128 B10R1.17 NCCOC1=NC=CC=C1 F2147-1481 [0,2,0,0,0,0|2,0,0]=4 129 B10R1.17 O=CNCC1=CC=CC=C1 F1984-0386 [0,2,0,0,0,0|0,1,0]=3 130 B10R1.17 OCC#CC1=CC=NC=C1 F8883-4477 [0,2,0,0,0,0|1,1,0]=4 131 B10R1.17 OCC#CC1=CN=CC=C1 F8882-3475 [0,2,0,0,0,0|1,1,0]=4 132 B10R1.17 OCC#CC1=NC=CC=C1 F8885-6318 [0,2,0,0,0,0|1,1,0]=4 133 B10R1.18 CC(=O)CC1=CN=CC=C1 F8886-6819 [0,2,0,0,0,0|1,1,0]=4 134 B10R1.18 NC(=O)CC1=CC=CC=C1 F1084-0941 [0,2,0,0,0,0|0,1,0]=3 135 B10R1.20 CNC1=NC=CC=C1CO F2124-0029 [0,2,0,0,0,0|1,1,0]=4 136 B10R1.20 COC1=C(CCl)C=CC=C1 F0001-1820 [0,2,0,0,0,0|1,0,0]=3 137 B10R1.20 N#CC1=C(CCl)C=CC=C1 F0001-1609 [0,2,0,0,0,0|1,0,0]=3 138 B10R1.245 N#CC1=C(Cl)C=CC=C1F F0001-1772 [0,2,0,0,0,0|1,0,1]=4 139 B10R1.245 NCC1=C(Cl)C=CC=C1Cl F0001-1756 [0,2,0,0,0,0|1,0,0]=3 140 B10R2.7 C1=CC=C2CNCC2=C1 F2158-0930 [0,1,0,1,0,0|1,0,0]=3 141 B10R2.7 C1=CC=C2NN=CC2=C1 F0918-7060 [0,1,0,1,0,0|1,0,1]=4 142 B10R2.7 C1=CN=C2CNCC2=C1 F2167-3868 [0,1,0,1,0,0|2,0,0]=4 143 B10R2.7 C1=NC=C2CNCC2=C1 F2167-3866 [0,1,0,1,0,0|2,0,0]=4 144 B6R1.2 CC1=CC=NO1 F0001-2561 [1,0,0,0,1,0|2,0,0]=4 145 B6R1.2 CC1=CNC=C1 F8889-1676 [1,0,0,0,1,0|1,0,0]=3