0 B9R1.15 C=CC1=NC=CC=C1C BB32-1725 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.15 CC1=C(CN)C=NC=C1 BB31-2786 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.15 CC1=C(CO)C=CN=C1 BB32-1626 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.15 CC1=C(NN)C=CN=C1 BB31-8932 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.15 CC1=NC=CN=C1C=O BB32-1077 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.15 CNC1=C(C)C=CN=C1 BB31-7097 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.15 CNC1=C(N)C=CN=C1 BB32-0831 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.15 CNC1=NC=CC=C1C BB32-0851 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.15 COC1=C(F)C=NC=C1 BB31-8443 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.15 COC1=C(N)C=CN=C1 BB32-2356 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.15 COC1=C(O)C=NC=C1 BB31-8011 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.15 COC1=CC=CN=C1O BB52-8591 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.15 CSC1=C(Br)C=CC=N1 BB32-2292 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.15 CSC1=C(N)N=CC=C1 BB32-0864 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.15 ClCC1=C(Cl)C=CC=N1 BB31-1049 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.15 N#CC1=C(O)C=NC=C1 BB31-6535 [0,0,0,0,0,0|2,0,1]=3 16 B9R1.15 NC1=C(CO)C=CN=C1 BB31-8031 [0,0,0,0,0,0|2,0,2]=4 17 B9R1.15 NC1=CC=CN=C1C=O BB31-4893 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.15 NC1=CC=CN=C1CO BB31-5760 [0,0,0,0,0,0|2,0,2]=4 19 B9R1.15 NC1=NC=CN=C1C=O BB31-5072 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.15 NCC1=C(F)C=CC=N1 BB32-1717 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.15 NCC1=C(F)C=NC=C1 BB31-8560 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.15 NCC1=CC=CN=C1Br BB31-3840 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.15 NCC1=CC=CN=C1F BB31-3839 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.15 NCC1=CC=CN=C1F BB31-6576 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.15 NCC1=CC=CNC1=O BB31-8567 [0,0,0,0,0,0|2,0,2]=4 26 B9R1.15 NNC1=C(I)C=CC=C1 BB32-3554 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.15 O=C1NC=CC=C1CO BB32-1653 [0,0,0,0,0,0|1,0,3]=4 28 B9R1.15 OCC1=C(Cl)C=NC=C1 BB31-5373 [0,0,0,0,0,0|2,0,2]=4 29 B9R1.15 OCC1=C(O)C=NC=C1 BB32-1573 [0,0,0,0,0,0|1,0,2]=3 30 B8R1.2 NCC1=CC=NC=C1 BB32-3106 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.2 NNC1=NC=CC=C1 BB52-0908 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.2 O=CC1=NC=CC=N1 BB31-5137 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.2 O=CC1=NC=NC=C1 BB31-4750 [1,0,0,0,0,0|2,0,0]=3 34 B8R1.2 O=CC1=NN=CC=C1 BB52-3335 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.5 CC1=C(F)C=CN=C1 BB31-4475 [1,0,0,0,0,0|2,0,1]=4 36 B8R1.5 CC1=C(I)C=NC=C1 BB32-1776 [1,0,0,0,0,0|2,0,1]=4 37 B8R1.5 FC1=CC=CN=C1I BB31-2578 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.5 IC1=CC=CN=C1I BB31-5614 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.5 NC1=CC=NNC1=O BB32-2548 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.5 OC1=C(Cl)C=NC=N1 BB32-2752 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.5 OC1=C(O)C=NC=C1 BB31-0244 [1,0,0,0,0,0|1,0,1]=3 42 B8R1.5 SC1=C(Br)C=CC=N1 BB32-3764 [1,0,0,0,0,0|2,1,0]=4 43 B10R1.2 CC1=C(Br)C=NC=C1C=O BB32-1804 [0,1,0,0,0,0|2,0,0]=3 44 B10R1.2 CC1=C(C=O)C=CN=C1Cl BB31-6909 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.2 CNC1=CC=CC(Br)=C1N BB31-0621 [0,1,0,0,0,0|3,0,0]=4 46 B10R1.2 COC1=C(Cl)C(N)=CC=C1 BB31-6645 [0,1,0,0,0,0|3,0,0]=4 47 B10R1.2 COC1=C(N)C(O)=CC=C1 BB31-4933 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.2 COC1=CC=CC(F)=C1C BB31-8931 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.2 COC1=CC=CC(F)=C1Cl BB32-2640 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.2 COC1=CC=CC(I)=C1Br BB31-8698 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.2 N#CC1=CC=CC(Cl)=C1Br BB31-5665 [0,1,0,0,0,0|2,0,1]=4 52 B10R1.2 N#CC1=CC=CC(I)=C1F BB32-1146 [0,1,0,0,0,0|2,0,1]=4 53 B10R1.2 N#CC1=CC=CC(O)=C1Br BB31-4854 [0,1,0,0,0,0|2,0,1]=4 54 B10R1.2 N#CC1=CC=CC(O)=C1F BB31-0003 [0,1,0,0,0,0|2,0,1]=4 55 B10R1.2 N#CC1=CC=CC(O)=C1N BB31-4177 [0,1,0,0,0,0|2,0,1]=4 56 B10R1.2 NC1=C(Br)C=CC=C1CO BB32-1974 [0,1,0,0,0,0|1,0,2]=4 57 B10R1.2 NC1=C(C=O)C=CC=C1O BB31-0088 [0,1,0,0,0,0|1,0,0]=2 58 B10R1.2 NCC1=CC=CC(Br)=C1F BB31-4390 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.2 O=CC1=CC=CC(I)=C1O BB31-4248 [0,1,0,0,0,0|0,0,0]=1 60 B10R1.2 O=CC1=CC=NC(F)=C1Cl BB31-0592 [0,1,0,0,0,0|2,0,0]=3 61 B10R1.2 OCC1=CC=CC(F)=C1Br BB31-8992 [0,1,0,0,0,0|1,0,2]=4 62 B10R1.2 OCC1=CC=CC(F)=C1I BB31-1529 [0,1,0,0,0,0|1,0,2]=4 63 B10R1.4 CC1=C(CON)C=CC=C1 BB31-8696 [0,1,0,0,0,0|1,0,2]=4 64 B10R1.4 CCNC1=C(O)C=CC=C1 BB31-4887 [0,1,0,0,0,0|1,0,1]=3 65 B10R1.4 CNCC1=C(O)C=CC=C1 BB31-5689 [0,1,0,0,0,0|1,0,1]=3 66 B10R1.4 NOCC1=C(Cl)C=CC=C1 BB32-2623 [0,1,0,0,0,0|1,0,2]=4 67 B10R1.4 OCCC1=C(I)C=CC=C1 BB31-4375 [0,1,0,0,0,0|1,0,2]=4 68 B10R1.4 O\N=C\C1=C(F)C=CC=C1 BB31-4287 [0,1,0,0,0,0|1,0,1]=3 69 B10R1.20 C#CC1=C(C#N)C=CC=C1 BB32-1644 [0,1,0,0,0,0|2,0,1]=4 70 B10R1.20 C#CC1=C(CO)C=CC=C1 BB31-8444 [0,1,0,0,0,0|1,0,1]=3 71 B10R1.20 CNC1=NC=CC=C1C=O BB52-1560 [0,1,0,0,0,0|2,0,0]=3 72 B10R1.20 COC1=C(C#N)C=CC=N1 BB52-5808 [0,1,0,0,0,0|2,0,1]=4 73 B10R1.20 COC1=C(C#N)N=CC=C1 BB31-7623 [0,1,0,0,0,0|2,0,1]=4 74 B10R1.20 COC1=C(C=O)C=CN=C1 BB32-0612 [0,1,0,0,0,0|1,0,0]=2 75 B10R1.20 COC1=C(CO)N=CC=C1 BB32-2504 [0,1,0,0,0,0|1,0,2]=4 76 B10R1.20 N#CC1=C(C=O)C=CC=N1 BB31-1904 [0,1,0,0,0,0|2,0,0]=3 77 B10R1.20 N#CC1=C(CN)C=CC=C1 BB31-0354 [0,1,0,0,0,0|2,0,1]=4 78 B10R1.20 N#CC1=C(CN)C=CC=C1 BB32-1359 [0,1,0,0,0,0|2,0,1]=4 79 B10R1.20 OCC1=CC=CN=C1CO BB32-1784 [0,1,0,0,0,0|1,0,2]=4 80 B10R1.25 C#CC1=C(Cl)C=C(Cl)C=C1 BB31-5625 [0,1,0,0,0,0|2,0,1]=4 81 B10R1.25 C#CC1=C(F)C=C(Br)C=C1 BB31-4580 [0,1,0,0,0,0|2,0,1]=4 82 B10R1.25 C#CC1=C(F)C=C(Cl)C=C1 BB31-4055 [0,1,0,0,0,0|2,0,1]=4 83 B10R1.25 CC1=C(C=O)C=CC(F)=N1 BB31-6533 [0,1,0,0,0,0|2,0,0]=3 84 B10R1.25 CC1=C(NN)C=CC(Cl)=C1 BB12-5162 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.25 CC1=CC(C)=C(C=O)C=N1 BB31-0486 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.25 CC1=CC(F)=C(NN)C=C1 BB32-2275 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.25 CC1=CC(N)=C(CO)C=C1 BB31-6811 [0,1,0,0,0,0|1,0,2]=4 88 B10R1.25 CCC1=C(F)C=C(Br)C=C1 BB32-3524 [0,1,0,0,0,0|2,0,1]=4 89 B10R1.25 CCC1=C(N)C=C(Br)C=C1 BB31-2864 [0,1,0,0,0,0|2,0,1]=4 90 B10R1.25 CNC1=C(Cl)C=C(F)C=C1 BB31-6776 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.25 CNC1=C(F)C=C(Br)C=C1 BB32-1250 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.25 CNC1=C(N)C=C(C)C=C1 BB32-2054 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.25 COC1=C(F)C=C(S)C=C1 BB31-6341 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.25 COC1=CN=C(Br)C=C1O BB31-7686 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.25 COC1=NC=C(Br)C=C1O BB31-9713 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.25 CSC1=C(Br)C=C(F)C=C1 BB31-5668 [0,1,0,0,0,0|3,0,0]=4 97 B10R1.25 FC1=CC(I)=C(CBr)C=C1 BB32-3713 [0,1,0,0,0,0|2,0,1]=4 98 B10R1.25 N#CC1=C(Br)C=C(O)C=C1 BB31-8634 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.25 N#CC1=C(O)C=C(N)C=C1 BB31-5029 [0,1,0,0,0,0|1,0,1]=3 100 B10R1.25 N#CC1=NC=C(Br)C=C1O BB31-0434 [0,1,0,0,0,0|2,0,1]=4 101 B10R1.25 NC1=C(C=O)C=CC(Cl)=N1 BB32-2980 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.25 NC1=C(C=O)N=CC(Cl)=N1 BB31-6355 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.25 NC1=CC(Br)=CN=C1C=O BB31-1858 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.25 NC1=CC(Cl)=C(CO)C=C1 BB32-2709 [0,1,0,0,0,0|1,0,2]=4 105 B10R1.25 NCC1=C(O)C=C(Br)C=C1 BB31-9160 [0,1,0,0,0,0|1,0,1]=3 106 B10R1.25 O=CC1=C(Cl)C=C(F)N=C1 BB31-1261 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.25 O=CC1=C(F)N=C(Cl)C=C1 BB31-5262 [0,1,0,0,0,0|2,0,0]=3 108 B10R1.25 O=CC1=CC=C(F)N=C1Cl BB31-0855 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.25 O=CC1=NC=C(Br)C=C1Cl BB31-6419 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.25 O=CC1=NC=C(Br)C=C1F BB31-4775 [0,1,0,0,0,0|2,0,0]=3 111 B10R1.25 O=CC1=NC=C(Cl)N=C1Cl BB31-2038 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 BB31-7669 [0,1,0,0,0,0|2,0,1]=4 113 B10R1.30 C#CC1=C(N)C=CC(C)=C1 BB31-8168 [0,1,0,0,0,0|2,0,1]=4 114 B10R1.30 CC1=CC(C=O)=C(N)N=C1 BB31-0313 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.30 CC1=CC(CO)=C(Br)C=C1 BB32-3813 [0,1,0,0,0,0|1,0,2]=4 116 B10R1.30 CC1=CC(NN)=C(F)C=C1 BB32-1967 [0,1,0,0,0,0|3,0,0]=4 117 B10R1.30 CC1=CC=C(O)C(C=O)=N1 BB32-3694 [0,1,0,0,0,0|1,0,0]=2 118 B10R1.30 CC1=CC=C(O)C(CCl)=N1 BB31-7158 [0,1,0,0,0,0|2,0,1]=4 119 B10R1.30 CC1=NC=C(Cl)C=C1C=O BB31-8278 [0,1,0,0,0,0|2,0,0]=3 120 B10R1.30 CCC1=C(Br)C=CC(I)=C1 BB31-0423 [0,1,0,0,0,0|2,0,1]=4 121 B10R1.30 CCC1=C(O)C=CC(Br)=C1 BB31-3966 [0,1,0,0,0,0|1,0,1]=3 122 B10R1.30 COC1=C(C)C=CC(I)=C1 BB32-1094 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.30 COC1=C(C)C=CC(O)=C1 BB31-4015 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.30 COC1=C(I)C=CC(C)=C1 BB31-7787 [0,1,0,0,0,0|3,0,0]=4 125 B10R1.30 COC1=C(I)C=CC(N)=C1 BB31-9407 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.30 COC1=C(N)C=CC(O)=C1 BB31-5893 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.30 COC1=C(N)C=CC(O)=C1 BB31-5894 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.30 N#CC1=C(N)C=CC(O)=C1 BB31-0452 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.30 NC1=C(C=O)N=C(Br)C=N1 BB31-1358 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.30 NC1=NC=C(Cl)C=C1C=O BB32-2393 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.30 NCC1=C(N)C=CC(Br)=C1 BB31-8668 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.30 O=CC1=C(Br)C=CC(Br)=N1 BB32-0053 [0,1,0,0,0,0|2,0,0]=3 133 B10R1.30 O=CC1=CC(=O)NC=C1Br BB31-0856 [0,1,0,0,0,0|2,0,0]=3 134 B10R1.30 O=CC1=CC(Br)=CN=C1Br BB31-6637 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.30 O=CC1=CC(Cl)=NC=C1O BB31-9241 [0,1,0,0,0,0|1,0,0]=2 136 B10R1.30 OCC1=C(O)C=CC(I)=C1 BB31-9654 [0,1,0,0,0,0|0,0,2]=3 137 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 BB31-7884 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.61 CC(=O)C1=C(Br)C=NC=N1 BB31-1060 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.61 CC(=O)C1=C(O)C=NC=C1 BB32-1019 [0,1,0,0,0,0|1,0,0]=2 140 B10R1.61 CC(=O)C1=CC=CN=C1Br BB31-6615 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.61 CC(C)C1=C(O)C=CC=N1 BB31-4057 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.61 CC(N)C1=C(Br)C=CC=C1 BB31-0378 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.61 CC1=C(C(=N)N)C=CC=C1 BB31-5703 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.61 CN(C)C1=C(F)C=CC=C1 BB32-1594 [0,1,0,0,0,0|3,0,0]=4 145 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 BB31-0478 [0,1,0,0,0,0|2,0,1]=4 146 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 BB31-0488 [0,1,0,0,0,0|2,0,1]=4 147 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 BB31-7807 [0,1,0,0,0,0|2,0,1]=4 148 B10R1.61 C[C@@H](N)C1=C(O)C=CC=C1 BB31-1004 [0,1,0,0,0,0|1,0,1]=3 149 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 BB31-2127 [0,1,0,0,0,0|2,0,1]=4 150 B10R1.61 C[C@H](N)C1=C(O)C=CC=C1 BB31-8099 [0,1,0,0,0,0|1,0,1]=3 151 B10R1.61 N=C(N)C1=C(Cl)C=CC=N1 BB31-9082 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.61 NC(=O)C1=C(F)C=NC=C1 BB32-0426 [0,1,0,0,0,0|2,0,0]=3 153 B10R1.61 NC(=O)C1=C(O)C=NC=C1 BB31-0185 [0,1,0,0,0,0|1,0,0]=2 154 B10R1.61 NC(=O)C1=CC=CN=C1S BB32-2901 [0,1,0,0,0,0|1,1,0]=3 155 B10R1.61 NC1=C(C(=O)O)C=NC=N1 BB52-2193 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.61 NC1=C(C(F)F)C=CC=C1 BB31-2757 [0,1,0,0,0,0|2,0,1]=4 157 B10R1.61 O=C(O)C1=C(Cl)C=NC=N1 BB32-3365 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.61 O=C(O)C1=CC=NNC1=O BB31-4706 [0,1,0,0,0,0|2,0,1]=4 159 B10R1.61 O=[N+]([O-])C1=C(O)C=NC=C1 BB31-9668 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.61 O=[N+]([O-])C1=CC=CN=C1S BB31-5811 [0,1,0,0,0,0|2,1,0]=4 161 B10R1.245 C=CC1=C(C)C=CC=C1C BB31-3794 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.245 CC1=CC=CC(Br)=C1C=O BB31-3622 [0,1,0,0,0,0|1,0,0]=2 163 B10R1.245 CNC1=C(Br)C=CC=C1N BB31-0597 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.245 N#CC1=C(O)C=CN=C1Br BB32-3230 [0,1,0,0,0,0|2,0,1]=4 165 B10R1.245 NC1=CC=CC(F)=C1C=O BB32-0753 [0,1,0,0,0,0|1,0,0]=2 166 B10R1.245 NCC1=C(Br)C=CC=C1F BB31-4389 [0,1,0,0,0,0|2,0,1]=4 167 B10R1.245 NCC1=C(Cl)C=CC=C1N BB31-8233 [0,1,0,0,0,0|2,0,1]=4 168 B10R1.245 O=CC1=C(Br)C=CN=C1F BB31-1818 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.245 O=CC1=C(Cl)C=CN=C1F BB31-0935 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.245 O=CC1=C(Cl)N=CN=C1Cl BB52-1575 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.245 O=CC1=C(F)C=NC=C1F BB31-6509 [0,1,0,0,0,0|2,0,0]=3 172 B10R2.7 C1=CC2=C(C=C1)SCS2 BB32-1488 [0,0,0,1,0,0|2,1,0]=4 173 B10R2.7 C1=CC2=CC=CN2C=C1 BB31-6185 [0,0,0,1,0,0|3,0,0]=4 174 B10R2.7 C1=CN=C2OC=NC2=C1 BB31-6281 [0,0,0,1,0,0|3,0,0]=4 175 B8R1.11 C(=O)C1=C(C)C=NN1 BB05-4543 [0,0,0,0,1,0|3,0,0]=4 176 B8R1.11 CC1=CSC=C1C=O BB32-4004 [0,0,0,0,1,0|2,0,0]=3 177 B8R1.11 CN1C=CN=C1C=O BB52-0221 [0,0,0,0,1,0|3,0,0]=4 178 B8R1.11 O=CC1=C(Br)NC=N1 BB32-2656 [0,0,0,0,1,0|3,0,0]=4 179 B8R1.11 O=CC1=NNC=C1Cl BB32-3176 [0,0,0,0,1,0|3,0,0]=4 180 B7R1.3 O=C1C=COC=C1 BB31-5938 [2,0,0,0,0,0|1,0,0]=3 181 B9R1.1 C#CC1=CC=C(O)C=C1 BB32-1037 [1,1,0,0,0,0|1,0,1]=4 182 B9R1.1 C=CC1=CC=C(I)C=C1 BB31-4240 [1,1,0,0,0,0|1,0,0]=3 183 B9R1.1 C=CC1=CN=C(F)C=C1 BB31-0349 [1,1,0,0,0,0|2,0,0]=4 184 B9R1.1 C=CC1=NC=C(C)C=C1 BB32-1317 [1,1,0,0,0,0|2,0,0]=4 185 B9R1.1 CC1=NC=C(C=O)C=N1 BB52-2214 [1,1,0,0,0,0|2,0,0]=4 186 B9R1.1 NC1=NC=C(C=O)C=N1 BB52-2221 [1,1,0,0,0,0|2,0,0]=4 187 B9R1.1 O=CC1=CNC(=O)N=C1 BB31-3327 [1,1,0,0,0,0|2,0,0]=4 188 B9R1.1 O=CC1=NC=C(Br)C=N1 BB31-5037 [1,1,0,0,0,0|2,0,0]=4 189 B9R1.1 O=CC1=NN=C(Cl)C=C1 BB31-4584 [1,1,0,0,0,0|2,0,0]=4 190 B9R1.2 C=CC1=CC=CC(N)=C1 BB31-5821 [1,1,0,0,0,0|1,0,0]=3 191 B9R1.2 C=CC1=NC=CC(Br)=C1 BB32-2820 [1,1,0,0,0,0|2,0,0]=4 192 B9R1.2 CC1=CN=CC(C=O)=N1 BB31-0483 [1,1,0,0,0,0|2,0,0]=4 193 B9R1.2 CNC1=CC=CC(I)=C1 BB32-3582 [1,1,0,0,0,0|2,0,0]=4 194 B9R1.2 CNC1=CC=CC(O)=C1 BB31-2612 [1,1,0,0,0,0|2,0,0]=4 195 B9R1.2 O=CC1=CC=CC(=O)N1 BB32-1723 [1,1,0,0,0,0|1,0,0]=3 196 B9R1.2 O=CC1=CN=CC(O)=C1 BB31-6018 [1,1,0,0,0,0|1,0,0]=3 197 B9R1.6 C=C(C)C1=CC=CN=C1 BB32-0833 [1,1,0,0,0,0|2,0,0]=4 198 B9R1.6 CC(=O)C1=NC=NC=C1 BB32-1309 [1,1,0,0,0,0|2,0,0]=4 199 B9R1.6 CC(=O)C1=NN=CC=C1 BB31-8246 [1,1,0,0,0,0|2,0,0]=4 200 B9R1.8 N\N=C\C1=CC=CC=C1 BB32-2520 [1,1,0,0,0,0|1,0,0]=3 201 B9R1.3 CC1=C(Br)C=CNC1=O BB31-0862 [1,1,0,0,0,0|2,0,0]=4 202 B9R1.3 CC1=C(O)C(Br)=NC=C1 BB31-0863 [1,1,0,0,0,0|1,0,1]=4 203 B9R1.3 CC1=CC=CC(I)=C1Cl BB31-0462 [1,1,0,0,0,0|1,0,1]=4 204 B9R1.3 CN1C=CC=C(N)C1=O BB32-1576 [1,1,0,0,0,0|2,0,0]=4 205 B9R1.3 CN1C=CC=C(O)C1=O BB31-7773 [1,1,0,0,0,0|1,0,0]=3 206 B9R1.3 NC1=C(Cl)C(=O)NC=C1 BB32-2542 [1,1,0,0,0,0|2,0,0]=4 207 B9R1.3 NC1=C(O)C(Cl)=NC=C1 BB31-0848 [1,1,0,0,0,0|2,0,0]=4 208 B9R1.3 NC1=C(O)C=CN=C1Cl BB31-1030 [1,1,0,0,0,0|2,0,0]=4 209 B9R1.3 NC1=C(O)C=CN=C1O BB31-9017 [1,1,0,0,0,0|2,0,0]=4 210 B9R1.3 NC1=CC=CC(Br)=C1I BB32-0544 [1,1,0,0,0,0|2,0,0]=4 211 B9R1.3 NC1=CC=CC(F)=C1I BB31-7303 [1,1,0,0,0,0|2,0,0]=4 212 B9R1.3 O=C1NC=CC(O)=C1Cl BB31-8462 [1,1,0,0,0,0|2,0,0]=4 213 B9R1.3 OC1=C(Cl)C(Cl)=NC=C1 BB31-0557 [1,1,0,0,0,0|2,0,0]=4 214 B9R1.3 OC1=C(Cl)C=CN=C1Cl BB32-1522 [1,1,0,0,0,0|2,0,0]=4 215 B9R1.3 OC1=C(F)C=CN=C1Cl BB31-0865 [1,1,0,0,0,0|2,0,0]=4 216 B9R1.3 OC1=C(I)C=CC=C1Br BB31-3795 [1,1,0,0,0,0|1,0,0]=3 217 B9R1.3 OC1=CC=CC(I)=C1Br BB31-6599 [1,1,0,0,0,0|1,0,0]=3 218 B9R1.3 OC1=CC=CC(O)=C1F BB31-8000 [1,1,0,0,0,0|1,0,0]=3 219 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 BB12-5186 [1,1,0,0,0,0|1,0,1]=4 220 B9R1.69 CC1=C(I)C=CC(Cl)=C1 BB12-5187 [1,1,0,0,0,0|1,0,1]=4 221 B9R1.69 CC1=C(O)C=C(I)C=C1 BB32-0594 [1,1,0,0,0,0|0,0,1]=3 222 B9R1.69 CC1=C(O)C=CC(I)=N1 BB31-8589 [1,1,0,0,0,0|1,0,1]=4 223 B9R1.69 CC1=C(O)C=NC(N)=C1 BB31-9444 [1,1,0,0,0,0|1,0,1]=4 224 B9R1.69 CC1=CC(Br)=C(O)C=N1 BB31-1251 [1,1,0,0,0,0|2,0,0]=4 225 B9R1.69 CC1=CC(Cl)=NC=C1O BB31-0849 [1,1,0,0,0,0|1,0,1]=4 226 B9R1.69 CC1=CC(F)=NC=C1O BB31-0866 [1,1,0,0,0,0|1,0,1]=4 227 B9R1.69 CC1=CC(O)=C(Br)C=N1 BB31-1304 [1,1,0,0,0,0|2,0,0]=4 228 B9R1.69 CC1=CC=C(O)C(Cl)=N1 BB32-1593 [1,1,0,0,0,0|2,0,0]=4 229 B9R1.69 CC1=CN=C(Br)C=C1O BB31-0861 [1,1,0,0,0,0|1,0,1]=4 230 B9R1.69 CC1=CN=C(F)C(O)=C1 BB31-8941 [1,1,0,0,0,0|2,0,0]=4 231 B9R1.69 CN1C=C(I)C=CC1=O BB31-5265 [1,1,0,0,0,0|2,0,0]=4 232 B9R1.69 CN1C=C(N)C=CC1=O BB32-1828 [1,1,0,0,0,0|2,0,0]=4 233 B9R1.69 CN1C=CC(=O)C(O)=C1 BB32-2601 [1,1,0,0,0,0|1,0,0]=3 234 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 BB12-5244 [1,1,0,0,0,0|2,0,0]=4 235 B9R1.69 NC1=C(Cl)C=CC(I)=C1 BB31-3310 [1,1,0,0,0,0|2,0,0]=4 236 B9R1.69 NC1=C(F)C=C(S)C=C1 BB31-7926 [1,1,0,0,0,0|2,0,0]=4 237 B9R1.69 NC1=C(I)C=CC(Cl)=C1 BB12-5243 [1,1,0,0,0,0|2,0,0]=4 238 B9R1.69 NC1=C(N)C=C(O)C=C1 BB32-3404 [1,1,0,0,0,0|2,0,0]=4 239 B9R1.69 NC1=C(O)C=C(I)C=C1 BB31-6317 [1,1,0,0,0,0|1,0,0]=3 240 B9R1.69 NC1=C(O)C=CC(Cl)=N1 BB32-0852 [1,1,0,0,0,0|2,0,0]=4 241 B9R1.69 NC1=C(S)C=C(Br)C=C1 BB31-4234 [1,1,0,0,0,0|1,1,0]=4 242 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 BB12-5224 [1,1,0,0,0,0|2,0,0]=4 243 B9R1.69 NC1=CC(Cl)=C(I)C=C1 BB12-5223 [1,1,0,0,0,0|2,0,0]=4 244 B9R1.69 NC1=CC(Cl)=NC=C1O BB31-2379 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.69 NC1=CC(F)=C(N)C=C1 BB31-2635 [1,1,0,0,0,0|2,0,0]=4 246 B9R1.69 NC1=NC=C(F)C=C1O BB31-0079 [1,1,0,0,0,0|2,0,0]=4 247 B9R1.69 O=C1C=C(O)C(F)=CN1 BB32-1976 [1,1,0,0,0,0|2,0,0]=4 248 B9R1.69 O=C1NC(Cl)=CC=C1F BB31-2050 [1,1,0,0,0,0|2,0,0]=4 249 B9R1.69 OC1=C(Br)C=C(I)C=C1 BB31-9816 [1,1,0,0,0,0|1,0,0]=3 250 B9R1.69 OC1=C(Br)C=NC(Cl)=C1 BB31-1340 [1,1,0,0,0,0|2,0,0]=4 251 B9R1.69 OC1=C(F)N=C(Br)C=C1 BB31-6683 [1,1,0,0,0,0|2,0,0]=4 252 B9R1.69 OC1=C(I)C=C(F)C=N1 BB31-9104 [1,1,0,0,0,0|2,0,0]=4 253 B9R1.69 OC1=C(I)C=C(I)C=C1 BB31-3948 [1,1,0,0,0,0|1,0,0]=3 254 B9R1.69 OC1=CC(Br)=C(I)C=C1 BB31-5276 [1,1,0,0,0,0|2,0,0]=4 255 B9R1.69 OC1=CC(Br)=NC=C1Br BB31-9253 [1,1,0,0,0,0|2,0,0]=4 256 B9R1.69 OC1=CC(Br)=NC=C1Cl BB31-1342 [1,1,0,0,0,0|2,0,0]=4 257 B9R1.69 OC1=CC(Cl)=NC=C1Cl BB31-4686 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.69 OC1=CC(F)=CN=C1Br BB31-8902 [1,1,0,0,0,0|2,0,0]=4 259 B9R1.69 OC1=CC(S)=C(O)C=C1 BB31-4519 [1,1,0,0,0,0|0,1,0]=3 260 B9R1.69 OC1=CN=C(Cl)C=C1Cl BB31-1365 [1,1,0,0,0,0|2,0,0]=4 261 B9R1.69 OC1=CN=C(F)C=C1F BB32-0226 [1,1,0,0,0,0|2,0,0]=4 262 B9R1.69 OC1=NC=C(I)C=C1Br BB32-3259 [1,1,0,0,0,0|2,0,0]=4 263 B9R1.14 COC1=C(C=O)OC=C1 BB32-1842 [0,1,0,0,1,0|1,0,0]=3 264 B9R1.41 CC(=O)C1=CNC=C1C BB31-4047 [0,1,0,0,1,0|2,0,0]=4 265 B9R1.41 NC(=O)C1=C(Br)C=CS1 BB31-6931 [0,1,0,0,1,0|2,0,0]=4 266 B9R1.41 NC(=O)C1=C(N)SC=C1 BB52-8541 [0,1,0,0,1,0|2,0,0]=4 267 B9R1.41 NC(=O)C1=CC=CN1N BB31-3190 [0,1,0,0,1,0|2,0,0]=4 268 B9R1.41 NC1=C(C(=O)O)C=CS1 BB32-3009 [0,1,0,0,1,0|2,0,0]=4 269 B9R1.41 O=C(O)C1=C(Br)C=CN1 BB31-2563 [0,1,0,0,1,0|2,0,0]=4 270 B9R1.41 O=C(O)C1=C(Br)OC=C1 BB31-3871 [0,1,0,0,1,0|2,0,0]=4 271 B11R1.8 CC1=CC(C=O)=C(O)C(C)=C1 BB31-4280 [0,2,0,0,0,0|0,0,0]=2 272 B11R1.8 O=CC1=C(O)C(Cl)=CC(Br)=C1 BB17-0345 [0,2,0,0,0,0|0,0,0]=2 273 B11R1.8 O=CC1=CC(Cl)=CC(F)=C1F BB31-3667 [0,2,0,0,0,0|1,0,0]=3 274 B11R1.8 O=CC1=CC(I)=CC(I)=C1I BB32-2274 [0,2,0,0,0,0|1,0,0]=3 275 B11R1.72 O=CC1=C(F)C=CC(F)=C1O BB32-2394 [0,2,0,0,0,0|0,0,0]=2 276 B11R1.72 O=CC1=C(F)C=CC(O)=C1F BB31-7573 [0,2,0,0,0,0|1,0,0]=3 277 B11R1.72 O=CC1=C(O)C=CC(F)=C1Br BB32-0116 [0,2,0,0,0,0|0,0,0]=2 278 B11R1.72 O=CC1=C(O)C=CC(F)=C1F BB32-0442 [0,2,0,0,0,0|0,0,0]=2 279 B11R1.159 CC(=O)C1=CC=CC(F)=C1Br BB31-3133 [0,2,0,0,0,0|1,0,0]=3 280 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O BB31-7750 [0,2,0,0,0,0|2,0,0]=4 281 B11R1.159 CN1C(=O)C=CC=C1C(=O)O BB32-3280 [0,2,0,0,0,0|2,0,0]=4 282 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=N1 BB31-0329 [0,2,0,0,0,0|2,0,0]=4 283 B11R1.159 NC(=O)C1=CC=CC(Br)=C1N BB31-5159 [0,2,0,0,0,0|1,0,0]=3 284 B11R1.159 NC(=O)C1=CC=CC(Cl)=C1N BB32-0637 [0,2,0,0,0,0|1,0,0]=3 285 B11R1.159 NC(=S)C1=CC=CC(Cl)=C1Cl BB31-5611 [0,2,0,0,0,0|1,1,0]=4 286 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O BB31-4895 [0,2,0,0,0,0|2,0,0]=4 287 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1Br BB32-1820 [0,2,0,0,0,0|2,0,0]=4 288 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1Cl BB32-1563 [0,2,0,0,0,0|2,0,0]=4 289 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1F BB32-1075 [0,2,0,0,0,0|2,0,0]=4 290 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1O BB31-4894 [0,2,0,0,0,0|1,0,0]=3 291 B11R1.159 O=C(O)C1=C(F)C(I)=NC=C1 BB31-8024 [0,2,0,0,0,0|2,0,0]=4 292 B11R1.159 O=C(O)C1=CC=NC(Cl)=C1Br BB32-0268 [0,2,0,0,0,0|2,0,0]=4 293 B11R1.159 O=C(O)C1=CC=NC(F)=C1Cl BB31-6933 [0,2,0,0,0,0|2,0,0]=4 294 B11R1.159 O=C(O)C1=CN=CC(Br)=C1Cl BB31-1242 [0,2,0,0,0,0|2,0,0]=4 295 B11R1.159 O=C(O)C1=CN=CC(Br)=C1I BB31-5995 [0,2,0,0,0,0|2,0,0]=4 296 B11R1.159 O=C(O)C1=CN=CC(Br)=C1O BB31-8460 [0,2,0,0,0,0|1,0,0]=3 297 B11R1.159 O=[N+]([O-])C1=C(O)C(Cl)=NC=C1 BB31-2939 [0,2,0,0,0,0|2,0,0]=4 298 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1I BB31-3855 [0,2,0,0,0,0|2,0,0]=4 299 B11R1.265 COC1=C(Br)C=NC=C1C=O BB31-1859 [0,2,0,0,0,0|1,0,0]=3 300 B11R1.265 COC1=CC=CC(I)=C1C#N BB32-3792 [0,2,0,0,0,0|1,0,1]=4 301 B11R1.265 N#CC1=C(F)C=CC=C1C=O BB32-0052 [0,2,0,0,0,0|1,0,0]=3 302 B11R1.267 N#CC1=C(Br)C(C=O)=CC=C1 BB32-2843 [0,2,0,0,0,0|1,0,0]=3 303 B11R1.267 N#CC1=C(F)C(C=O)=CC=C1 BB31-9848 [0,2,0,0,0,0|1,0,0]=3 304 B11R1.278 CC1=C(C)C(O)=C(C=O)C=C1 BB31-4427 [0,2,0,0,0,0|0,0,0]=2 305 B11R1.278 CC1=C(F)C=CC(C=O)=C1Cl BB31-1475 [0,2,0,0,0,0|1,0,0]=3 306 B11R1.278 O=CC1=C(F)C(F)=C(I)C=C1 BB31-6474 [0,2,0,0,0,0|1,0,0]=3 307 B11R1.278 O=CC1=C(O)C(O)=C(Br)C=C1 BB32-3866 [0,2,0,0,0,0|0,0,0]=2 308 B11R1.278 O=CC1=CC=C(F)C(F)=C1Cl BB31-1530 [0,2,0,0,0,0|1,0,0]=3 309 B11R1.278 O=CC1=CC=C(O)C(F)=C1F BB31-5613 [0,2,0,0,0,0|1,0,0]=3 310 B11R1.17 C#CCOC1=C(O)C=CC=C1 BB31-2647 [0,2,0,0,0,0|1,0,1]=4 311 B11R1.17 CCNCC1=C(O)C=CC=C1 BB31-9257 [0,2,0,0,0,0|1,0,1]=4 312 B11R1.17 COCCC1=C(O)C=CC=C1 BB32-1663 [0,2,0,0,0,0|0,0,2]=4 313 B11R1.41 C=CCC1=C(OC)C=CC=C1 BB31-5643 [0,2,0,0,0,0|1,0,0]=3 314 B11R1.41 CCOC1=C(C=O)C=CC=N1 BB31-6380 [0,2,0,0,0,0|1,0,0]=3 315 B11R1.41 CCOC1=C(C=O)C=NC=C1 BB31-2306 [0,2,0,0,0,0|1,0,0]=3 316 B11R1.41 CNCC1=C(CO)C=CC=C1 BB31-5635 [0,2,0,0,0,0|1,0,1]=4 317 B11R1.41 COC1=C(CC=O)C=CC=C1 BB31-5558 [0,2,0,0,0,0|0,0,0]=2 318 B11R1.41 COC1=C(CCBr)C=CC=C1 BB32-1701 [0,2,0,0,0,0|1,0,1]=4 319 B11R1.41 N#CC1=C(CCO)C=CC=C1 BB31-7734 [0,2,0,0,0,0|1,0,1]=4 320 B11R1.81 O=CNC1=C(Br)C=C(Br)C=N1 BB32-2813 [0,2,0,0,0,0|2,0,0]=4 321 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 BB31-8198 [0,2,0,0,0,0|1,0,0]=3 322 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 BB12-7660 [0,2,0,0,0,0|1,0,0]=3 323 B11R1.86 NC(=S)NC1=NC=CC=C1O BB52-4893 [0,2,0,0,0,0|1,1,0]=4 324 B11R1.86 O=C(O)CC1=C(Cl)C=CC=N1 BB31-5786 [0,2,0,0,0,0|2,0,0]=4 325 B11R1.86 O=C(O)CC1=C(F)C=CC=N1 BB31-0028 [0,2,0,0,0,0|2,0,0]=4 326 B11R1.86 O=C(O)CN1C=CC=CC1=O BB52-8012 [0,2,0,0,0,0|1,0,1]=4 327 B11R1.182 CCOC1=C(O)C=CC(Br)=C1 BB32-1746 [0,2,0,0,0,0|1,0,1]=4 328 B11R1.182 CNCC1=C(O)C=CC(F)=C1 BB31-1974 [0,2,0,0,0,0|1,0,1]=4 329 B11R1.222 CC1=C(C(=O)C=O)C=CC=C1 BB32-3322 [0,2,0,0,0,0|1,0,0]=3 330 B11R1.222 CC1=C(N(C)C=O)C=CC=C1 BB31-1907 [0,2,0,0,0,0|1,0,0]=3 331 B11R1.222 CCC(=O)C1=C(Cl)N=CC=C1 BB52-7664 [0,2,0,0,0,0|2,0,0]=4 332 B11R1.222 CNC(=O)C1=NC=CC=C1O BB31-1334 [0,2,0,0,0,0|1,0,0]=3 333 B11R1.605 CCCC1=C(O)C=CC=C1O BB31-2128 [0,2,0,0,0,0|1,0,1]=4 334 B11R1.37 C#CC1=C(C=O)C=CC(F)=C1 BB31-6867 [0,2,0,0,0,0|1,0,0]=3 335 B11R1.37 CCC1=C(CO)C=C(Br)C=C1 BB31-5271 [0,2,0,0,0,0|1,0,1]=4 336 B11R1.37 COC1=C(CN)C=C(Cl)C=C1 BB32-2047 [0,2,0,0,0,0|1,0,1]=4 337 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 BB32-0755 [0,2,0,0,0,0|2,0,0]=4 338 B11R1.37 COC1=CC(Cl)=NC=C1C=O BB32-0302 [0,2,0,0,0,0|1,0,0]=3 339 B11R1.37 N#CC1=C(C=O)C=CC(Br)=C1 BB32-2296 [0,2,0,0,0,0|1,0,0]=3 340 B11R1.37 O=CC1=C(C=O)C=C(Br)C=C1 BB31-1925 [0,2,0,0,0,0|0,0,1]=3 341 B11R1.37 OCC1=C(CO)C=C(Br)C=C1 BB31-8250 [0,2,0,0,0,0|0,0,2]=4 342 B11R1.37 OCC1=C(CO)C=C(Cl)C=C1 BB31-8428 [0,2,0,0,0,0|0,0,2]=4 343 B11R1.53 C#CC1=C(C(C)=O)C=CC=C1 BB31-9300 [0,2,0,0,0,0|1,0,0]=3 344 B11R1.53 C=CC1=C([N+](=O)[O-])C=CC=C1 BB32-3396 [0,2,0,0,0,0|1,0,1]=4 345 B11R1.53 CC(C)C1=C(C=O)C=CC=C1 BB31-4875 [0,2,0,0,0,0|1,0,0]=3 346 B11R1.53 CC(O)C1=C(C#N)C=CC=C1 BB31-3613 [0,2,0,0,0,0|1,0,1]=4 347 B11R1.53 CCC1=C(C(=O)O)C=CC=N1 BB31-5819 [0,2,0,0,0,0|2,0,0]=4 348 B11R1.53 CN(C)C1=C(CO)C=CC=C1 BB32-2780 [0,2,0,0,0,0|2,0,0]=4 349 B11R1.53 CNC1=C(C(C)=O)C=CC=C1 BB32-0506 [0,2,0,0,0,0|1,0,0]=3 350 B11R1.53 COC1=C(C(=N)N)C=CC=C1 BB32-0582 [0,2,0,0,0,0|1,0,0]=3 351 B11R1.53 COC1=C(C(N)=O)C=NC=C1 BB31-7215 [0,2,0,0,0,0|1,0,0]=3 352 B11R1.53 N#CC1=CC=CN=C1C(=O)O BB31-5787 [0,2,0,0,0,0|2,0,0]=4 353 B11R1.53 NCC1=C(B(O)O)C=CC=C1 BB31-4306 [0,2,0,0,0,0|1,0,1]=4 354 B11R1.53 NCC1=C([N+](=O)[O-])C=CC=C1 BB31-3977 [0,2,0,0,0,0|2,0,0]=4 355 B11R1.53 O=CC1=C([N+](=O)[O-])C=CC=N1 BB31-0330 [0,2,0,0,0,0|1,0,1]=4 356 B11R1.53 O=CC1=C([N+](=O)[O-])C=NC=C1 BB32-0640 [0,2,0,0,0,0|1,0,1]=4 357 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=N1 BB31-2675 [0,2,0,0,0,0|2,0,0]=4 358 B11R1.166 CC(=O)C1=C(F)C=C(F)C=N1 BB31-9256 [0,2,0,0,0,0|2,0,0]=4 359 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 BB32-1815 [0,2,0,0,0,0|1,0,0]=3 360 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=N1 BB31-9078 [0,2,0,0,0,0|2,0,0]=4 361 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Cl)=C1 BB12-5188 [0,2,0,0,0,0|2,0,0]=4 362 B11R1.166 CC1=CC(Br)=NC=C1C(=O)O BB31-9293 [0,2,0,0,0,0|2,0,0]=4 363 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 BB31-4356 [0,2,0,0,0,0|1,0,1]=4 364 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 BB52-5680 [0,2,0,0,0,0|1,0,1]=4 365 B11R1.166 CC1=CN=C(C(=O)O)C(C)=C1 BB32-2407 [0,2,0,0,0,0|2,0,0]=4 366 B11R1.166 CC1=NC(N)=C(C(N)=O)C=C1 BB31-9907 [0,2,0,0,0,0|2,0,0]=4 367 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)C=N1 BB32-2608 [0,2,0,0,0,0|2,0,0]=4 368 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 BB31-1326 [0,2,0,0,0,0|1,0,0]=3 369 B11R1.166 NC1=C(C(=O)O)C=CC(O)=C1 BB32-1819 [0,2,0,0,0,0|1,0,0]=3 370 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O BB32-2526 [0,2,0,0,0,0|2,0,0]=4 371 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)N=C1 BB31-1269 [0,2,0,0,0,0|2,0,0]=4 372 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 BB17-0814 [0,2,0,0,0,0|1,0,0]=3 373 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=N1 BB31-1821 [0,2,0,0,0,0|2,0,0]=4 374 B11R1.166 O=C(O)C1=C(Cl)C=C(O)N=C1 BB31-7039 [0,2,0,0,0,0|2,0,0]=4 375 B11R1.166 O=C(O)C1=C(Cl)N=C(Br)C=C1 BB31-6039 [0,2,0,0,0,0|2,0,0]=4 376 B11R1.166 O=C(O)C1=C(I)C=C(Br)N=C1 BB31-1405 [0,2,0,0,0,0|2,0,0]=4 377 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Br BB31-7929 [0,2,0,0,0,0|2,0,0]=4 378 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl BB31-5224 [0,2,0,0,0,0|2,0,0]=4 379 B11R1.277 CC1=C(Br)C=C(F)C(C=O)=C1 BB31-7423 [0,2,0,0,0,0|1,0,0]=3 380 B11R1.277 CC1=CC(Br)=C(C)C=C1C=O BB31-8540 [0,2,0,0,0,0|1,0,0]=3 381 B11R1.277 N#CC1=CC(F)=C(F)C=C1O BB31-5877 [0,2,0,0,0,0|1,0,1]=4 382 B11R1.277 NC1=CC(Cl)=C(Br)C=C1C=O BB31-9421 [0,2,0,0,0,0|1,0,0]=3 383 B11R1.277 O=CC1=CC(Cl)=C(Cl)C=C1O BB31-5876 [0,2,0,0,0,0|0,0,0]=2 384 B11R1.277 O=CC1=CC(F)=C(Br)C=C1O BB32-0032 [0,2,0,0,0,0|0,0,0]=2 385 B11R1.277 O=CC1=CC(F)=C(Cl)C=C1O BB31-9171 [0,2,0,0,0,0|0,0,0]=2 386 B11R1.277 O=CC1=CC(F)=C(O)C=C1F BB31-4865 [0,2,0,0,0,0|1,0,0]=3 387 B11R1.279 CCC1=CC(O)=C(C=O)C=C1 BB31-3289 [0,2,0,0,0,0|0,0,0]=2 388 B11R1.279 COC1=CC(N)=C(C=O)C=C1 BB32-3011 [0,2,0,0,0,0|1,0,0]=3 389 B11R1.279 COC1=NC(C)=C(C=O)C=C1 BB31-2972 [0,2,0,0,0,0|2,0,0]=4 390 B11R1.279 N#CC1=CC(O)=C(C=O)C=C1 BB31-4713 [0,2,0,0,0,0|0,0,0]=2 391 B11R1.464 CC1=C(C=O)C(Cl)=NC(Cl)=C1 BB31-7559 [0,2,0,0,0,0|2,0,0]=4 392 B11R1.464 CC1=NC(O)=C(C=O)C(=O)N1 BB31-2691 [0,2,0,0,0,0|2,0,0]=4 393 B11R1.464 O=CC1=C(Br)C=C(Cl)C=C1F BB31-0362 [0,2,0,0,0,0|1,0,0]=3 394 B11R1.464 O=CC1=C(Br)C=C(F)C=C1F BB32-0357 [0,2,0,0,0,0|1,0,0]=3 395 B11R1.464 O=CC1=C(Cl)C=C(F)C=C1F BB32-0117 [0,2,0,0,0,0|1,0,0]=3 396 B11R1.464 O=CC1=C(F)C=C(Br)C=C1O BB32-0069 [0,2,0,0,0,0|0,0,0]=2 397 B11R1.464 O=CC1=C(F)C=C(I)C=C1F BB31-0424 [0,2,0,0,0,0|1,0,0]=3 398 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=N1 BB31-3520 [0,2,0,0,0,0|2,0,0]=4 399 B11R1.167 CC(=O)C1=C(Br)C=CC(N)=C1 BB31-2893 [0,2,0,0,0,0|1,0,0]=3 400 B11R1.167 CC(=O)C1=C(Br)C=CC(O)=C1 BB31-9255 [0,2,0,0,0,0|1,0,0]=3 401 B11R1.167 CC(=O)C1=C(O)C=CC(I)=C1 BB31-7249 [0,2,0,0,0,0|0,0,0]=2 402 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl BB31-6408 [0,2,0,0,0,0|2,0,0]=4 403 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 BB31-9291 [0,2,0,0,0,0|2,0,0]=4 404 B11R1.167 CC1=C(C(N)=O)C=C(N)C=C1 BB32-2564 [0,2,0,0,0,0|1,0,0]=3 405 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 BB31-6434 [0,2,0,0,0,0|2,0,0]=4 406 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 BB32-2207 [0,2,0,0,0,0|2,0,0]=4 407 B11R1.167 CC1=CC=C(C)C(C(=O)O)=N1 BB31-6680 [0,2,0,0,0,0|2,0,0]=4 408 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 BB31-9003 [0,2,0,0,0,0|2,0,0]=4 409 B11R1.167 CC1=CNC(=O)C(C(=O)O)=C1 BB32-1929 [0,2,0,0,0,0|1,0,1]=4 410 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 BB31-4824 [0,2,0,0,0,0|2,0,0]=4 411 B11R1.167 NC(=O)C1=CC(F)=CN=C1Cl BB31-6917 [0,2,0,0,0,0|2,0,0]=4 412 B11R1.167 NC1=CC(C(=O)O)=C(N)C=C1 BB31-0664 [0,2,0,0,0,0|1,0,0]=3 413 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 BB31-7675 [0,2,0,0,0,0|2,0,0]=4 414 B11R1.167 NC1=NC=C(F)C=C1C(=O)O BB31-1355 [0,2,0,0,0,0|2,0,0]=4 415 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=N1 BB31-5086 [0,2,0,0,0,0|2,0,0]=4 416 B11R1.167 O=C(O)C1=C(Br)C=NC(O)=C1 BB31-7503 [0,2,0,0,0,0|2,0,0]=4 417 B11R1.167 O=C(O)C1=C(I)C=CC(O)=C1 BB32-3325 [0,2,0,0,0,0|1,0,0]=3 418 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=N1 BB31-4987 [0,2,0,0,0,0|1,0,0]=3 419 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F BB31-6005 [0,2,0,0,0,0|2,0,0]=4 420 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1O BB32-2578 [0,2,0,0,0,0|2,0,0]=4 421 B11R1.167 O=C(O)C1=CC(F)=CN=C1O BB31-6534 [0,2,0,0,0,0|1,0,0]=3 422 B11R1.167 O=C(O)C1=CC(I)=CN=C1Cl BB32-3008 [0,2,0,0,0,0|2,0,0]=4 423 B11R1.167 O=C(O)C1=CC(O)=CN=C1Cl BB32-1940 [0,2,0,0,0,0|2,0,0]=4 424 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(Cl)=C1 BB12-5241 [0,2,0,0,0,0|2,0,0]=4 425 B11R1.167 O=[N+]([O-])C1=C(I)C=CC(Cl)=C1 BB12-5242 [0,2,0,0,0,0|2,0,0]=4 426 B11R1.280 C#CC1=CC(C=O)=C(O)C=C1 BB31-4729 [0,2,0,0,0,0|0,0,0]=2 427 B11R1.280 COC1=CC(C=O)=C(Cl)C=N1 BB31-9280 [0,2,0,0,0,0|2,0,0]=4 428 B11R1.280 COC1=CC(C=O)=C(F)C=N1 BB31-4730 [0,2,0,0,0,0|2,0,0]=4 429 B11R1.280 COC1=CN=C(F)C(C=O)=C1 BB31-0879 [0,2,0,0,0,0|2,0,0]=4 430 B11R1.280 COC1=NC(C=O)=C(Br)C=C1 BB31-8077 [0,2,0,0,0,0|2,0,0]=4 431 B11R1.280 N#CC1=C(O)C=CC(C=O)=C1 BB31-7068 [0,2,0,0,0,0|1,0,1]=4 432 B11R1.280 N#CC1=CC(C#N)=C(O)C=C1 BB31-4953 [0,2,0,0,0,0|1,0,1]=4 433 B11R1.280 N#CC1=CC(C=O)=C(O)C=C1 BB31-5791 [0,2,0,0,0,0|0,0,0]=2 434 B11R1.87 CC(C)(O)C1=C(O)C=CC=C1 BB32-1207 [0,2,0,0,0,0|0,0,2]=4 435 B11R1.87 NC1=C(S(=O)(=O)F)C=CC=C1 BB32-2074 [0,2,0,0,0,0|2,0,0]=4 436 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O BB32-2577 [0,2,0,0,0,0|0,0,0]=2 437 B11R1.156 CC(=O)C1=C(Cl)C=CN=C1Cl BB31-1083 [0,2,0,0,0,0|2,0,0]=4 438 B11R1.156 CC(=O)C1=C(Cl)C=NC=C1Cl BB31-5116 [0,2,0,0,0,0|2,0,0]=4 439 B11R1.156 CC(C)C1=C(F)C=CC=C1O BB32-0055 [0,2,0,0,0,0|1,0,1]=4 440 B11R1.156 CC1=CC=NC(N)=C1C(=O)O BB32-1592 [0,2,0,0,0,0|2,0,0]=4 441 B11R1.156 CC1=CC=NC(O)=C1C(=O)O BB32-1780 [0,2,0,0,0,0|1,0,0]=3 442 B11R1.156 N=C(N)C1=C(F)C=CC=C1F BB31-6942 [0,2,0,0,0,0|2,0,0]=4 443 B11R1.156 NC(=O)C1=C(F)C=CC=C1O BB31-3258 [0,2,0,0,0,0|0,0,0]=2 444 B11R1.156 NC1=C(C(=O)O)C(Br)=NC=C1 BB31-9321 [0,2,0,0,0,0|2,0,0]=4 445 B11R1.156 NC1=C(C(=O)O)C(Cl)=NC=C1 BB31-0249 [0,2,0,0,0,0|2,0,0]=4 446 B11R1.156 NC1=NC=CC(Cl)=C1C(=O)O BB32-3306 [0,2,0,0,0,0|2,0,0]=4 447 B11R1.156 O=C(O)C1=C(Br)C=CN=C1Br BB31-1607 [0,2,0,0,0,0|2,0,0]=4 448 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1F BB31-7590 [0,2,0,0,0,0|2,0,0]=4 449 B11R1.156 O=C(O)C1=C(I)C=CC=C1Br BB31-0291 [0,2,0,0,0,0|1,0,0]=3 450 B9R1.11 O=CC(=O)C1=CC=CO1 BB31-8251 [0,0,1,1,0,0|1,0,0]=3 451 B11R2.106 BrC1=C2C=COC2=CC=C1 BB31-1852 [0,1,0,1,0,0|1,0,0]=3 452 B11R2.106 BrC1=C2N=COC2=CC=C1 BB31-7671 [0,1,0,1,0,0|1,0,1]=4 453 B11R2.106 BrC1=C2ON=CC2=CC=C1 BB31-1469 [0,1,0,1,0,0|1,0,0]=3 454 B11R2.106 CC1=C2C=NNC2=CC=C1 BB51-3310 [0,1,0,1,0,0|2,0,0]=4 455 B11R2.106 CC1=CC=CC2=C1C=CS2 BB31-8339 [0,1,0,1,0,0|1,1,0]=4 456 B11R2.106 CC1=CC=CC2=C1N=CS2 BB31-4601 [0,1,0,1,0,0|1,1,0]=4 457 B11R2.106 CC1=CC=CC2=C1NC=N2 BB31-2558 [0,1,0,1,0,0|2,0,0]=4 458 B11R2.106 ClC1=C2NC=NC2=CC=C1 BB52-4226 [0,1,0,1,0,0|2,0,0]=4 459 B11R2.106 FC1=C2C=NNC2=CC=C1 BB51-3312 [0,1,0,1,0,0|2,0,0]=4 460 B11R2.106 IC1=C2C=CNC2=CC=C1 BB31-6853 [0,1,0,1,0,0|2,0,0]=4 461 B11R2.106 IC1=C2C=NNC2=CC=C1 BB31-6452 [0,1,0,1,0,0|2,0,0]=4 462 B11R2.106 IC1=C2OCOC2=CC=C1 BB31-8623 [0,1,0,1,0,0|2,0,0]=4 463 B11R2.106 NC1=C2OC=CC2=CC=C1 BB31-6061 [0,1,0,1,0,0|1,0,0]=3 464 B11R2.106 NC1=C2OC=CC2=CC=C1 BB54-5249 [0,1,0,1,0,0|1,0,0]=3 465 B11R2.106 NC1=C2SC=NC2=CC=C1 BB31-7880 [0,1,0,1,0,0|2,0,0]=4 466 B11R2.106 NC1=CC=CC2=C1C=CS2 BB31-3417 [0,1,0,1,0,0|1,1,0]=4 467 B11R2.106 NC1=CC=CC2=C1N=CS2 BB31-8933 [0,1,0,1,0,0|1,1,0]=4 468 B11R2.106 OC1=C2N=NNC2=CC=C1 BB31-5942 [0,1,0,1,0,0|2,0,0]=4 469 B11R2.106 OC1=C2OC=CC2=CC=C1 BB32-2267 [0,1,0,1,0,0|1,0,0]=3 470 B11R2.106 OC1=CC=CC2=C1CCO2 BB31-2818 [0,1,0,1,0,0|0,0,2]=4 471 B11R2.106 OC1=CC=CC2=C1N=CO2 BB31-8021 [0,1,0,1,0,0|0,0,1]=3 472 B11R2.106 OC1=NC=CC2=C1N=CN2 BB31-7969 [0,1,0,1,0,0|2,0,0]=4 473 B11R2.10 BrC1=CC2=C(C=CC=C2)N1 BB31-2458 [0,1,0,1,0,0|2,0,0]=4 474 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 BB32-2216 [0,1,0,1,0,0|1,0,0]=3 475 B11R2.10 CC1=NC2=C(C=CN=C2)O1 BB32-3909 [0,1,0,1,0,0|2,0,0]=4 476 B11R2.10 ClC1=NC2=C(N=CC=C2)O1 BB31-3097 [0,1,0,1,0,0|2,0,0]=4 477 B11R2.10 IC1=CC2=C(C=CC=C2)N1 BB31-4420 [0,1,0,1,0,0|2,0,0]=4 478 B11R2.10 IC1=CC2=C(C=CC=C2)S1 BB32-1612 [0,1,0,1,0,0|1,1,0]=4 479 B11R2.10 NC1=NC2=C(C=CN=C2)O1 BB31-0566 [0,1,0,1,0,0|2,0,0]=4 480 B11R2.10 NC1=NC2=CC=CC=C2O1 BB52-8718 [0,1,0,1,0,0|1,0,0]=3 481 B11R2.10 NC1=NC2=CC=CN=C2O1 BB31-7785 [0,1,0,1,0,0|2,0,0]=4 482 B11R2.10 O=C1CC2=C(C=CC=N2)N1 BB31-4947 [0,1,0,1,0,0|2,0,0]=4 483 B11R2.10 O=C1CC2=C(C=NC=C2)N1 BB32-2391 [0,1,0,1,0,0|2,0,0]=4 484 B11R2.10 O=C1NC2=C(C=NC=C2)O1 BB32-3787 [0,1,0,1,0,0|1,0,0]=3 485 B11R2.10 O=C1O[N+]2=C(C=CC=C2)S1 BB31-5543 [0,1,0,1,0,0|1,0,0]=3 486 B11R2.10 S=C1CC2=C(C=CC=C2)N1 BB32-2281 [0,1,0,1,0,0|1,1,0]=4 487 B11R2.10 S=C1NC2=C(N=CC=C2)O1 BB31-3391 [0,1,0,1,0,0|1,1,0]=4 488 B11R2.20 C1=CC=C2OCCNC2=C1 BB51-1682 [0,1,0,1,0,0|1,0,1]=4 489 B11R2.20 C1=CC=C2SCC=NC2=C1 BB52-7621 [0,1,0,1,0,0|1,1,0]=4 490 B11R2.1 BrC1=COC2=CC=CN=C12 BB31-7324 [0,1,0,1,0,0|2,0,0]=4 491 B11R2.1 CC1=NOC2=C1C=CC=C2 BB31-4705 [0,1,0,1,0,0|1,0,0]=3 492 B11R2.1 ClC1=CNC2=C1C=CC=C2 BB31-3376 [0,1,0,1,0,0|2,0,0]=4 493 B11R2.1 NC1=CNC2=C1C=CC=C2 BB32-3019 [0,1,0,1,0,0|2,0,0]=4 494 B11R2.1 NC1=NOC2=C1C=CN=C2 BB31-0385 [0,1,0,1,0,0|2,0,0]=4 495 B11R2.1 NC1=NOC2=NC=CC=C12 BB52-5781 [0,1,0,1,0,0|2,0,0]=4 496 B11R2.1 O=C1CCC2=C1C=NC=C2 BB31-4897 [0,1,0,1,0,0|2,0,0]=4 497 B11R2.1 O=C1COC2=C1C=CN=C2 BB31-9000 [0,1,0,1,0,0|1,0,0]=3 498 B11R2.1 O=C1CSC2=C1C=CC=C2 BB31-1622 [0,1,0,1,0,0|0,1,0]=3 499 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 BB31-5413 [0,1,0,1,0,0|1,0,1]=4 500 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 BB31-4659 [0,1,0,1,0,0|1,0,1]=4 501 B11R2.36 BrC1=CC2=C(C=C1)CC=C2 BB31-6902 [0,1,0,1,0,0|2,0,0]=4 502 B11R2.36 BrC1=CC2=C(C=CC2)C=C1 BB31-4988 [0,1,0,1,0,0|2,0,0]=4 503 B11R2.36 BrC1=CN=C2OC=CC2=C1 BB31-8157 [0,1,0,1,0,0|2,0,0]=4 504 B11R2.36 CC1=CC=C2NN=CC2=C1 BB51-3313 [0,1,0,1,0,0|2,0,0]=4 505 B11R2.36 ClC1=CC2=C(C=C1)CCO2 BB31-4520 [0,1,0,1,0,0|1,0,1]=4 506 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 BB31-4209 [0,1,0,1,0,0|1,0,0]=3 507 B11R2.36 ClC1=CC2=CON=C2C=C1 BB32-2796 [0,1,0,1,0,0|1,0,1]=4 508 B11R2.36 ClC1=CC=C2NN=CC2=C1 BB51-3314 [0,1,0,1,0,0|2,0,0]=4 509 B11R2.36 ClC1=NC2=C(C=C1)OC=C2 BB31-3608 [0,1,0,1,0,0|2,0,0]=4 510 B11R2.36 NC1=CC2=C(C=C1)CCO2 BB32-3369 [0,1,0,1,0,0|1,0,1]=4 511 B11R2.36 NC1=CC2=C(C=C1)OCO2 BB31-4396 [0,1,0,1,0,0|2,0,0]=4 512 B11R2.36 NC1=CC2=C(C=C1)ON=C2 BB31-7628 [0,1,0,1,0,0|1,0,0]=3 513 B11R2.36 NC1=CC2=C(C=C1)SN=C2 BB32-2586 [0,1,0,1,0,0|1,1,0]=4 514 B11R2.36 NC1=CC2=C(C=CO2)C=C1 BB31-9315 [0,1,0,1,0,0|1,0,0]=3 515 B11R2.36 NC1=CC2=C(C=CS2)C=C1 BB32-2692 [0,1,0,1,0,0|1,1,0]=4 516 B11R2.36 OC1=CC2=C(C=C1)C=NO2 BB52-6184 [0,1,0,1,0,0|1,0,0]=3 517 B11R2.36 OC1=CC2=C(C=C1)CCO2 BB31-4258 [0,1,0,1,0,0|1,0,1]=4 518 B11R2.36 OC1=CC2=C(C=C1)OC=N2 BB32-0783 [0,1,0,1,0,0|2,0,0]=4 519 B11R2.36 OC1=CC2=C(C=C1)SC=C2 BB32-0598 [0,1,0,1,0,0|1,1,0]=4 520 B11R2.36 OC1=CC2=C(C=CO2)C=C1 BB31-1913 [0,1,0,1,0,0|1,0,0]=3 521 B7R1.1 O=CC1=CN=CO1 BB31-8199 [1,0,0,0,1,0|2,0,0]=4 522 B7R1.1 O=CC1=NC=CO1 BB31-4873 [1,0,0,0,1,0|2,0,0]=4