0 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 3086 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.61 CC(=O)C1=C(C)C=CC=C1 3090 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 3084 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.61 CC(=O)C1=C(F)C=CC=C1 22574 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.61 CC(=O)C1=C(F)C=NC=C1 33787 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.61 CC(=O)C1=C(I)C=CC=C1 3893 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.61 CC(=O)C1=C(O)C=CC=C1 23010 [0,0,0,0,0,0|1,0,0]=1 7 B10R1.61 CC(=O)C1=CC=CN=C1Cl 14410 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.61 CC(=O)C1=CC=CN=C1F 5049 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.61 CC(=O)C1=CC=CN=C1N 18534 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.61 CC(=O)C1=CC=CNC1=O 23936 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.61 CC(=O)C1=NC=CC=C1Cl 34385 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.61 CC(=O)C1=NC=CC=C1F 1300 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.61 CC(=O)C1=NC=CC=C1N 17729 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.61 CC(=O)C1=NC=CN=C1C 8616 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.61 CC(=O)C1=NC=CN=C1N 33762 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.61 CC(C)C1=C(Br)C=CC=C1 16461 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.61 CC(C)C1=C(I)C=CC=C1 12584 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.61 CC(C)C1=C(O)C=CN=C1 35264 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.61 CC(C)C1=C(S)C=CC=C1 6880 [0,0,0,0,0,0|2,1,1]=4 20 B10R1.61 CC1=C(B(O)O)C=CC=C1 1871 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.61 CC1=C(C(=O)O)C=CC=N1 2458 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.61 CC1=C(C(=O)O)C=CN=C1 19851 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.61 CC1=C(C(=O)O)C=NC=C1 16270 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.61 CC1=C(C(Cl)Cl)C=CC=C1 10210 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.61 CC1=C(C(O)=S)C=CC=C1 10795 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.61 CC1=C([N+](=O)[O-])C=CN=C1 6642 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 6644 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.61 CC1=CC=CC=C1C(=O)Cl 15451 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.61 CC1=CC=CC=C1C(=O)O 15431 [0,0,0,0,0,0|2,0,0]=2 30 B10R1.61 CC1=CC=CN=C1C(=O)O 14396 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.61 CC1=CC=CN=C1C(=O)O 17659 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] 6641 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.61 CC1=NC=CC=C1C(N)=O 22966 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] 6643 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.61 CN(C)C1=C(Br)C=CC=C1 3759 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 5269 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.61 CN(C)C1=C(F)C=CC=C1 5243 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 24734 [0,0,0,0,0,0|2,0,1]=3 39 B10R1.61 C[C@@H](N)C1=C(O)C=CC=C1 23367 [0,0,0,0,0,0|1,0,1]=2 40 B10R1.61 C[C@@H](O)C1=C(Br)C=CC=C1 5686 [0,0,0,0,0,0|2,0,2]=4 41 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 3980 [0,0,0,0,0,0|2,0,2]=4 42 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 24769 [0,0,0,0,0,0|2,0,2]=4 43 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 24731 [0,0,0,0,0,0|2,0,1]=3 44 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 15728 [0,0,0,0,0,0|2,0,1]=3 45 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 5682 [0,0,0,0,0,0|2,0,2]=4 46 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 5670 [0,0,0,0,0,0|2,0,2]=4 47 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 24768 [0,0,0,0,0,0|2,0,2]=4 48 B10R1.61 IC1=C(N(I)I)C=CC=C1 19658 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 3733 [0,0,0,0,0,0|1,0,0]=1 50 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 22133 [0,0,0,0,0,0|2,0,0]=2 51 B10R1.61 NC(=O)C1=C(Cl)C=CC=C1 3617 [0,0,0,0,0,0|1,0,0]=1 52 B10R1.61 NC(=O)C1=C(F)C=CC=C1 3405 [0,0,0,0,0,0|1,0,0]=1 53 B10R1.61 NC(=O)C1=C(F)C=NC=C1 15252 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.61 NC(=O)C1=C(I)C=CC=C1 3299 [0,0,0,0,0,0|1,0,0]=1 55 B10R1.61 NC(=O)C1=C(N)C=CN=C1 3187 [0,0,0,0,0,0|2,0,0]=2 56 B10R1.61 NC(=O)C1=CC=CC=C1N 13631 [0,0,0,0,0,0|1,0,0]=1 57 B10R1.61 NC(=O)C1=CC=CC=C1O 10992 [0,0,0,0,0,0|0,0,0]=0 58 B10R1.61 NC(=O)C1=CC=CN=C1N 14977 [0,0,0,0,0,0|2,0,0]=2 59 B10R1.61 NC(=O)C1=NC=CC=C1N 16893 [0,0,0,0,0,0|2,0,0]=2 60 B10R1.61 NC(=O)C1=NC=CC=C1O 36150 [0,0,0,0,0,0|1,0,0]=1 61 B10R1.61 NC(=O)C1=NC=CN=C1Cl 32162 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.61 NC(=O)C1=NC=CN=C1Cl 32162 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.61 NC(=O)C1=NC=CN=C1O 32110 [0,0,0,0,0,0|2,0,0]=2 64 B10R1.61 NC(=O)c1cccnc1Br 10860 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.61 NC1=C(B(O)O)C=CC=C1 1746 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.61 NC1=C(B(O)O)C=CC=C1 9885 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.61 NC1=C(C(=O)O)C=CC=N1 1216 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.61 NC1=C(C(=O)O)C=CN=C1 16665 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.61 NC1=C(C(=O)O)C=CN=C1 2420 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.61 NC1=C(C(=O)O)N=NC=C1 19684 [0,0,0,0,0,0|4,0,0]=4 71 B10R1.61 NC1=C([N+](=O)[O-])C=CN=C1 6690 [0,0,0,0,0,0|4,0,0]=4 72 B10R1.61 NC1=C([N+](=O)[O-])C=NC=C1 1277 [0,0,0,0,0,0|4,0,0]=4 73 B10R1.61 NC1=CC=CN=C1C(=O)O 2015 [0,0,0,0,0,0|3,0,0]=3 74 B10R1.61 NC1=CC=CN=C1[N+](=O)[O-] 2087 [0,0,0,0,0,0|4,0,0]=4 75 B10R1.61 NC1=CC=NC=C1C(=O)O 1214 [0,0,0,0,0,0|3,0,0]=3 76 B10R1.61 NC1=NC=CC=C1[N+](=O)[O-] 1276 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.61 NC1=NC=CN=C1C(=O)O 8544 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.61 NC1=NC=NC=C1C(=O)O 21834 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 12510 [0,0,0,0,0,0|2,0,0]=2 80 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 2599 [0,0,0,0,0,0|3,0,0]=3 81 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 15054 [0,0,0,0,0,0|2,0,0]=2 82 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 3739 [0,0,0,0,0,0|2,0,0]=2 83 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 18140 [0,0,0,0,0,0|3,0,0]=3 84 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 13576 [0,0,0,0,0,0|3,0,0]=3 85 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 5087 [0,0,0,0,0,0|3,0,0]=3 86 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 2596 [0,0,0,0,0,0|3,0,0]=3 87 B10R1.61 O=C(O)C1=C(F)C=CC=C1 9650 [0,0,0,0,0,0|2,0,0]=2 88 B10R1.61 O=C(O)C1=C(F)C=CN=C1 10434 [0,0,0,0,0,0|3,0,0]=3 89 B10R1.61 O=C(O)C1=C(F)C=NC=C1 3549 [0,0,0,0,0,0|3,0,0]=3 90 B10R1.61 O=C(O)C1=C(F)N=CC=C1 1120 [0,0,0,0,0,0|3,0,0]=3 91 B10R1.61 O=C(O)C1=C(I)C=CC=C1 3924 [0,0,0,0,0,0|2,0,0]=2 92 B10R1.61 O=C(O)C1=C(I)N=CC=C1 34248 [0,0,0,0,0,0|3,0,0]=3 93 B10R1.61 O=C(O)C1=C(O)C=NC=C1 16741 [0,0,0,0,0,0|2,0,0]=2 94 B10R1.61 O=C(O)C1=C(O)N=CC=C1 2597 [0,0,0,0,0,0|2,0,0]=2 95 B10R1.61 O=C(O)C1=C(S)N=CC=C1 21289 [0,0,0,0,0,0|2,1,0]=3 96 B10R1.61 O=C(O)C1=CC=CC=C1S 6841 [0,0,0,0,0,0|1,1,0]=2 97 B10R1.61 O=C(O)C1=CC=CN=C1Br 5071 [0,0,0,0,0,0|3,0,0]=3 98 B10R1.61 O=C(O)C1=CN=CC=C1Cl 12989 [0,0,0,0,0,0|3,0,0]=3 99 B10R1.61 O=C(O)C1=CN=CC=C1I 33396 [0,0,0,0,0,0|3,0,0]=3 100 B10R1.61 O=C(O)C1=NC=CC=C1Br 5070 [0,0,0,0,0,0|3,0,0]=3 101 B10R1.61 O=C(O)C1=NC=CC=C1Cl 12918 [0,0,0,0,0,0|3,0,0]=3 102 B10R1.61 O=C(O)C1=NC=CC=C1F 5140 [0,0,0,0,0,0|3,0,0]=3 103 B10R1.61 O=C(O)C1=NC=CC=C1O 9286 [0,0,0,0,0,0|2,0,0]=2 104 B10R1.61 O=C(O)C1=NC=CN=C1Br 32152 [0,0,0,0,0,0|4,0,0]=4 105 B10R1.61 O=C(O)C1=NC=CN=C1Cl 19770 [0,0,0,0,0,0|4,0,0]=4 106 B10R1.61 O=C(O)C1=NC=CN=C1I 32124 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.61 O=C(O)C1=NC=CN=C1O 8870 [0,0,0,0,0,0|3,0,0]=3 108 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 2270 [0,0,0,0,0,0|2,0,0]=2 109 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 3819 [0,0,0,0,0,0|3,0,0]=3 110 B10R1.61 O=[N+]([O-])C1=C(Br)C=CN=C1 6662 [0,0,0,0,0,0|4,0,0]=4 111 B10R1.61 O=[N+]([O-])C1=C(Br)C=NC=C1 20425 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CN=C1 9253 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 2063 [0,0,0,0,0,0|3,0,0]=3 114 B10R1.61 O=[N+]([O-])C1=C(F)C=CN=C1 6676 [0,0,0,0,0,0|4,0,0]=4 115 B10R1.61 O=[N+]([O-])C1=C(F)C=NC=C1 16797 [0,0,0,0,0,0|4,0,0]=4 116 B10R1.61 O=[N+]([O-])C1=C(I)C=CC=C1 3952 [0,0,0,0,0,0|3,0,0]=3 117 B10R1.61 O=[N+]([O-])C1=C(I)C=CN=C1 6683 [0,0,0,0,0,0|4,0,0]=4 118 B10R1.61 O=[N+]([O-])C1=C(I)C=NC=C1 6633 [0,0,0,0,0,0|4,0,0]=4 119 B10R1.61 O=[N+]([O-])C1=C(O)C=CN=C1 9279 [0,0,0,0,0,0|3,0,0]=3 120 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Br 5955 [0,0,0,0,0,0|4,0,0]=4 121 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Cl 1229 [0,0,0,0,0,0|4,0,0]=4 122 B10R1.61 O=[N+]([O-])C1=CC=CN=C1F 1115 [0,0,0,0,0,0|4,0,0]=4 123 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O 6557 [0,0,0,0,0,0|3,0,0]=3 124 B10R1.61 O=[N+]([O-])C1=CN=CN=C1O 7203 [0,0,0,0,0,0|4,0,0]=4 125 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Br 4502 [0,0,0,0,0,0|4,0,0]=4 126 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Cl 11172 [0,0,0,0,0,0|4,0,0]=4 127 B10R1.61 O=[N+]([O-])C1=NC=CC=C1F 2185 [0,0,0,0,0,0|4,0,0]=4 128 B10R1.61 O=[N+]([O-])C1=NC=CC=C1I 6631 [0,0,0,0,0,0|4,0,0]=4 129 B10R1.61 O=[N+]([O-])C1=NC=CC=C1O 2581 [0,0,0,0,0,0|3,0,0]=3 130 B10R1.61 O=[N+]([O-])c1ccccc1Cl 18481 [0,0,0,0,0,0|3,0,0]=3 131 B10R1.61 O=[N+]([O-])c1ccccc1F 28476 [0,0,0,0,0,0|3,0,0]=3 132 B10R1.61 OB(O)C1=C(Br)C=CC=C1 13095 [0,0,0,0,0,0|3,0,1]=4 133 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 1797 [0,0,0,0,0,0|3,0,1]=4 134 B10R1.61 OB(O)C1=C(F)C=CC=C1 1856 [0,0,0,0,0,0|3,0,1]=4 135 B10R1.61 OB(O)C1=C(I)C=CC=C1 34200 [0,0,0,0,0,0|3,0,1]=4 136 B10R1.61 OB(O)C1=C(O)C=CC=C1 9522 [0,0,0,0,0,0|2,0,1]=3 137 B10R1.61 OB(O)C1=CC=CN=C1O 33718 [0,0,0,0,0,0|3,0,1]=4 138 B9R1.6 CC(=O)C1=CC=CN=C1 1301 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.6 CC(=O)C1=CC=CN=N1 16091 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.6 CC(=O)C1=CC=NC=C1 7542 [1,0,0,0,0,0|2,0,0]=3 141 B9R1.6 CC(=O)C1=CN=CN=C1 13185 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.6 CC(=O)C1=NC=CC=C1 13363 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.6 CC(=O)C1=NC=CC=N1 19777 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.6 CC(=O)C1=NC=CN=C1 8542 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.6 CC(=O)C1=NC=NC=C1 33412 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.6 CC(Cl)C1=CC=CC=C1 10204 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.6 CC(N)C1=CC=CC=C1 21079 [1,0,0,0,0,0|1,0,1]=3 148 B9R1.6 CP(C)C1=CC=CC=C1 6420 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.6 C[C@@H](N)c1ccccc1 6026 [1,0,0,0,0,0|1,0,1]=3 150 B9R1.6 C[C@@H](N)c1ccccc1 6060 [1,0,0,0,0,0|1,0,1]=3 151 B9R1.6 C[C@@H](N)c1ccccc1 9918 [1,0,0,0,0,0|1,0,1]=3 152 B9R1.6 C[C@@H](O)c1ccccc1 6851 [1,0,0,0,0,0|1,0,2]=4 153 B9R1.6 C[C@H](N)c1ccccc1 6025 [1,0,0,0,0,0|1,0,1]=3 154 B9R1.6 C[C@H](N)c1ccccc1 6061 [1,0,0,0,0,0|1,0,1]=3 155 B9R1.6 C[C@H](O)c1ccccc1 6858 [1,0,0,0,0,0|1,0,2]=4 156 B9R1.6 ClP(Cl)C1=CC=CC=C1 6469 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.6 FC(Cl)C1=CC=CC=C1 15923 [1,0,0,0,0,0|2,0,1]=4 158 B9R1.6 N=C(N)C1=CC=CN=C1 17590 [1,0,0,0,0,0|2,0,0]=3 159 B9R1.6 N=C(N)C1=CC=C[NH+]=C1 16743 [1,0,0,0,0,0|2,0,0]=3 160 B9R1.6 N=C(N)C1=CC=NC=C1 17463 [1,0,0,0,0,0|2,0,0]=3 161 B9R1.6 N=C(N)C1=NC=CC=C1 20227 [1,0,0,0,0,0|2,0,0]=3 162 B9R1.6 N=C(N)C1=NC=CN=C1 8599 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.6 NC(=O)C1=CC=NC=C1 6888 [1,0,0,0,0,0|1,0,0]=2 164 B9R1.6 NC(=S)C1=CC=CC=C1 13565 [1,0,0,0,0,0|0,1,0]=2 165 B9R1.6 NC(=S)C1=CC=CC=C1 18582 [1,0,0,0,0,0|0,1,0]=2 166 B9R1.6 O=C(Cl)C1=CC=CC=C1 22045 [1,0,0,0,0,0|1,0,0]=2 167 B9R1.6 O=C(Cl)C1=CC=NC=C1 23974 [1,0,0,0,0,0|2,0,0]=3 168 B9R1.6 O=C(Cl)C1=CN=CC=C1 15186 [1,0,0,0,0,0|2,0,0]=3 169 B9R1.6 O=C(Cl)C1=CN=CN=C1 25063 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.6 O=C(Cl)C1=NC=CC=C1 2059 [1,0,0,0,0,0|2,0,0]=3 171 B9R1.6 O=C(Cl)C1=NC=NC=C1 15402 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.6 O=C(O)C1=CC=CN=N1 22109 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.6 O=C(O)C1=CC=NC=C1 2595 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.6 O=C(O)C1=CN=CC=C1 2594 [1,0,0,0,0,0|2,0,0]=3 175 B9R1.6 O=C(O)C1=CN=CN=C1 2056 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.6 O=C(O)C1=CN=NC=C1 9501 [1,0,0,0,0,0|3,0,0]=4 177 B9R1.6 O=C(O)C1=NC=CC=C1 9774 [1,0,0,0,0,0|2,0,0]=3 178 B9R1.6 O=C(O)C1=NC=CC=N1 9603 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.6 O=C(O)C1=NC=CN=C1 8602 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.6 O=C(O)C1=NC=NC=C1 5297 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.6 O=C([O-])C1=NC=CC=C1 20107 [1,0,0,0,0,0|2,0,0]=3 182 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 6646 [1,0,0,0,0,0|3,0,0]=4 183 B9R1.6 OB(O)C1=CC=CC=C1 1753 [1,0,0,0,0,0|2,0,1]=4 184 B9R1.6 OC(=S)C1=CC=CC=C1 36202 [1,0,0,0,0,0|1,0,1]=3 185 B9R1.15 BrCC1=C(Br)C=CC=C1 16915 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.15 BrCC1=C(I)C=CC=C1 14812 [1,0,0,0,0,0|2,0,1]=4 187 B9R1.15 C#CC1=C(Cl)C=CC=C1 2550 [1,0,0,0,0,0|2,0,1]=4 188 B9R1.15 C=CC1=C(Br)C=CC=C1 23975 [1,0,0,0,0,0|2,0,0]=3 189 B9R1.15 CC1=C(C#N)C=CC=C1 25285 [1,0,0,0,0,0|1,0,2]=4 190 B9R1.15 CC1=C(C=O)C=CC=N1 24064 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.15 CC1=C(CCl)C=CC=C1 7487 [1,0,0,0,0,0|2,0,1]=4 192 B9R1.15 CC1=C(CN)C=CC=C1 10197 [1,0,0,0,0,0|1,0,1]=3 193 B9R1.15 CC1=C(NN)C=CC=C1 22584 [1,0,0,0,0,0|2,0,0]=3 194 B9R1.15 CC1=C(NN)C=CC=C1 6396 [1,0,0,0,0,0|2,0,0]=3 195 B9R1.15 CC1=CC=CC=C1C=O 15511 [1,0,0,0,0,0|1,0,0]=2 196 B9R1.15 CC1=CC=CN=C1C=O 17165 [1,0,0,0,0,0|2,0,0]=3 197 B9R1.15 CC1=CC=NC=C1C=O 18427 [1,0,0,0,0,0|2,0,0]=3 198 B9R1.15 CCC1=C(Br)C=CC=C1 3770 [1,0,0,0,0,0|2,0,1]=4 199 B9R1.15 CCC1=C(I)C=CC=C1 3876 [1,0,0,0,0,0|2,0,1]=4 200 B9R1.15 CCC1=C(N)C=CC=C1 20945 [1,0,0,0,0,0|2,0,1]=4 201 B9R1.15 CCC1=C(N)C=CC=C1 21080 [1,0,0,0,0,0|2,0,1]=4 202 B9R1.15 CCC1=C(O)C=CC=C1 3871 [1,0,0,0,0,0|1,0,1]=3 203 B9R1.15 CCC1=C(S)C=CC=C1 6844 [1,0,0,0,0,0|1,1,1]=4 204 B9R1.15 CNC1=C(F)C=CC=C1 15527 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.15 CNC1=CC=CC=C1N 14987 [1,0,0,0,0,0|3,0,0]=4 206 B9R1.15 COC1=C(Br)C=CC=C1 3725 [1,0,0,0,0,0|3,0,0]=4 207 B9R1.15 COC1=C(Cl)C=CC=C1 3614 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.15 COC1=C(F)C=CC=C1 3473 [1,0,0,0,0,0|3,0,0]=4 209 B9R1.15 COC1=C(I)C=CC=C1 3898 [1,0,0,0,0,0|3,0,0]=4 210 B9R1.15 COC1=C(O)C=CN=C1 34289 [1,0,0,0,0,0|3,0,0]=4 211 B9R1.15 COC1=C(S)C=CC=C1 6816 [1,0,0,0,0,0|2,1,0]=4 212 B9R1.15 COC1=CC=CC=C1O 26545 [1,0,0,0,0,0|2,0,0]=3 213 B9R1.15 COC1=CC=CN=C1O 6543 [1,0,0,0,0,0|3,0,0]=4 214 B9R1.15 CSC1=C(Br)C=CC=C1 10648 [1,0,0,0,0,0|3,0,0]=4 215 B9R1.15 CSC1=C(C)C=CC=C1 10730 [1,0,0,0,0,0|3,0,0]=4 216 B9R1.15 CSC1=C(Cl)C=CC=C1 10643 [1,0,0,0,0,0|3,0,0]=4 217 B9R1.15 CSC1=C(F)C=CC=C1 10638 [1,0,0,0,0,0|3,0,0]=4 218 B9R1.15 CSC1=C(I)C=CC=C1 10668 [1,0,0,0,0,0|3,0,0]=4 219 B9R1.15 CSC1=C(N)C=CC=C1 10633 [1,0,0,0,0,0|3,0,0]=4 220 B9R1.15 CSC1=C(O)C=CC=C1 10666 [1,0,0,0,0,0|2,0,0]=3 221 B9R1.15 ClC1=C(CBr)C=CC=C1 12482 [1,0,0,0,0,0|2,0,1]=4 222 B9R1.15 ClCC1=C(Cl)C=CC=C1 10203 [1,0,0,0,0,0|2,0,1]=4 223 B9R1.15 FC1=C(CBr)C=CC=C1 10383 [1,0,0,0,0,0|2,0,1]=4 224 B9R1.15 FC1=C(CCl)C=CC=C1 2094 [1,0,0,0,0,0|2,0,1]=4 225 B9R1.15 N#CC1=C(Br)C=CC=C1 3744 [1,0,0,0,0,0|1,0,2]=4 226 B9R1.15 N#CC1=C(F)C=CC=C1 1578 [1,0,0,0,0,0|1,0,2]=4 227 B9R1.15 N#CC1=C(I)C=CC=C1 3932 [1,0,0,0,0,0|1,0,2]=4 228 B9R1.15 N#CC1=C(O)C=CC=C1 4803 [1,0,0,0,0,0|0,0,2]=3 229 B9R1.15 N#CC1=CC=CC=C1N 13630 [1,0,0,0,0,0|1,0,2]=4 230 B9R1.15 N#CC1=CC=CN=C1O 20421 [1,0,0,0,0,0|1,0,2]=4 231 B9R1.15 N#CC1=CC=CN=C1O 6539 [1,0,0,0,0,0|1,0,2]=4 232 B9R1.15 N#CC1=CN=CC=C1O 13974 [1,0,0,0,0,0|1,0,2]=4 233 B9R1.15 N#CC1=NC=CC=C1O 9231 [1,0,0,0,0,0|1,0,2]=4 234 B9R1.15 NC1=C(C=O)C=CC=C1 15692 [1,0,0,0,0,0|1,0,0]=2 235 B9R1.15 NC1=C(C=O)C=CN=C1 26765 [1,0,0,0,0,0|2,0,0]=3 236 B9R1.15 NC1=C(C=O)C=NC=C1 7681 [1,0,0,0,0,0|2,0,0]=3 237 B9R1.15 NC1=C(CO)C=CC=C1 7478 [1,0,0,0,0,0|1,0,2]=4 238 B9R1.15 NC1=CC=CN=C1C=O 7680 [1,0,0,0,0,0|2,0,0]=3 239 B9R1.15 NC1=NC=CC=C1C=O 1262 [1,0,0,0,0,0|2,0,0]=3 240 B9R1.15 NCC1=C(Br)C=CC=C1 20398 [1,0,0,0,0,0|1,0,1]=3 241 B9R1.15 NCC1=C(Br)C=CC=C1 3749 [1,0,0,0,0,0|1,0,1]=3 242 B9R1.15 NCC1=C(Cl)C=CC=C1 5800 [1,0,0,0,0,0|1,0,1]=3 243 B9R1.15 NCC1=C(Cl)C=CC=C1 6155 [1,0,0,0,0,0|1,0,1]=3 244 B9R1.15 NCC1=C(F)C=CC=C1 4415 [1,0,0,0,0,0|1,0,1]=3 245 B9R1.15 NCC1=C(N)C=CC=C1 23363 [1,0,0,0,0,0|1,0,1]=3 246 B9R1.15 NCC1=C(O)C=CC=C1 7383 [1,0,0,0,0,0|0,0,1]=2 247 B9R1.15 NCC1=CC=CN=C1Cl 17749 [1,0,0,0,0,0|2,0,1]=4 248 B9R1.15 NCC1=NC=CC=C1O 34602 [1,0,0,0,0,0|1,0,1]=3 249 B9R1.15 NNC1=C(Br)C=CC=C1 4463 [1,0,0,0,0,0|2,0,0]=3 250 B9R1.15 NNC1=C(Cl)C=CC=C1 4482 [1,0,0,0,0,0|2,0,0]=3 251 B9R1.15 NNC1=C(F)C=CC=C1 3347 [1,0,0,0,0,0|2,0,0]=3 252 B9R1.15 NNC1=C(F)C=CC=C1 3350 [1,0,0,0,0,0|2,0,0]=3 253 B9R1.15 NNC1=NC=CC=C1Cl 6444 [1,0,0,0,0,0|3,0,0]=4 254 B9R1.15 NNC1=NC=CC=C1F 19894 [1,0,0,0,0,0|3,0,0]=4 255 B9R1.15 O=CC1=C(Br)C=CC=C1 3727 [1,0,0,0,0,0|1,0,0]=2 256 B9R1.15 O=CC1=C(Br)C=CN=C1 5061 [1,0,0,0,0,0|2,0,0]=3 257 B9R1.15 O=CC1=C(Br)C=NC=C1 5063 [1,0,0,0,0,0|2,0,0]=3 258 B9R1.15 O=CC1=C(Cl)C=CN=C1 7359 [1,0,0,0,0,0|2,0,0]=3 259 B9R1.15 O=CC1=C(Cl)C=NC=C1 25431 [1,0,0,0,0,0|2,0,0]=3 260 B9R1.15 O=CC1=C(F)C=CC=C1 3476 [1,0,0,0,0,0|1,0,0]=2 261 B9R1.15 O=CC1=C(F)C=NC=C1 5137 [1,0,0,0,0,0|2,0,0]=3 262 B9R1.15 O=CC1=C(I)C=CC=C1 3914 [1,0,0,0,0,0|1,0,0]=2 263 B9R1.15 O=CC1=C(O)C=NC=C1 33398 [1,0,0,0,0,0|1,0,0]=2 264 B9R1.15 O=CC1=C(O)N=CC=C1 17177 [1,0,0,0,0,0|1,0,0]=2 265 B9R1.15 O=CC1=CC=CN=C1Br 5057 [1,0,0,0,0,0|2,0,0]=3 266 B9R1.15 O=CC1=CC=CN=C1Cl 31630 [1,0,0,0,0,0|2,0,0]=3 267 B9R1.15 O=CC1=CC=CN=C1Cl 5097 [1,0,0,0,0,0|2,0,0]=3 268 B9R1.15 O=CC1=CC=CN=C1F 5131 [1,0,0,0,0,0|2,0,0]=3 269 B9R1.15 O=CC1=NC=CC=C1Br 15122 [1,0,0,0,0,0|2,0,0]=3 270 B9R1.15 O=CC1=NC=CC=C1Cl 17163 [1,0,0,0,0,0|2,0,0]=3 271 B9R1.15 O=CC1=NC=CC=C1F 5142 [1,0,0,0,0,0|2,0,0]=3 272 B9R1.15 O=CC1=NC=CC=C1O 12415 [1,0,0,0,0,0|1,0,0]=2 273 B9R1.15 O=CC1=NC=CN=C1Cl 32137 [1,0,0,0,0,0|3,0,0]=4 274 B9R1.15 O=CC1=NC=NC=C1Br 21031 [1,0,0,0,0,0|3,0,0]=4 275 B9R1.15 OCC1=C(Br)C=CC=C1 3746 [1,0,0,0,0,0|1,0,2]=4 276 B9R1.15 OCC1=C(Cl)C=CC=C1 3625 [1,0,0,0,0,0|1,0,2]=4 277 B9R1.15 OCC1=C(F)C=CC=C1 3485 [1,0,0,0,0,0|1,0,2]=4 278 B9R1.15 OCC1=C(O)C=CC=C1 21869 [1,0,0,0,0,0|0,0,2]=3 279 B9R1.15 OCC1=NC=CC=C1O 4075 [1,0,0,0,0,0|1,0,2]=4 280 B9R1.15 SCC1=C(Cl)C=CC=C1 6836 [1,0,0,0,0,0|1,1,1]=4 281 B9R1.15 SCc1ccccc1Br 6847 [1,0,0,0,0,0|1,1,1]=4 282 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 19668 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.53 C=CC1=C([N+](=O)[O-])C=CC=C1 23837 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 19789 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 9869 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.53 COC1=C(B(O)O)C=CC=C1 1865 [0,1,0,0,0,0|2,0,1]=4 287 B11R1.53 COC1=C(C(=O)O)C=CC=C1 18488 [0,1,0,0,0,0|1,0,0]=2 288 B11R1.53 COC1=C(C(=O)O)C=CC=N1 20354 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.53 COC1=C(C(=O)O)C=CN=C1 10457 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.53 COC1=C(C(C)=O)C=CC=C1 4278 [0,1,0,0,0,0|1,0,0]=2 291 B11R1.53 COC1=C(C(C)=O)C=NC=C1 33637 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.53 COC1=C(C(C)O)C=CC=C1 25006 [0,1,0,0,0,0|1,0,2]=4 293 B11R1.53 COC1=C(C(N)=S)C=CC=C1 35098 [0,1,0,0,0,0|0,1,0]=2 294 B11R1.53 COC1=C([C@@H](C)N)C=CC=C1 24748 [0,1,0,0,0,0|1,0,1]=3 295 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 24747 [0,1,0,0,0,0|1,0,1]=3 296 B11R1.53 COC1=C([N+](=O)[O-])C=CC=C1 9645 [0,1,0,0,0,0|2,0,0]=3 297 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 14990 [0,1,0,0,0,0|3,0,0]=4 298 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 6689 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.53 COC1=CC=CC=C1C(=O)Cl 26362 [0,1,0,0,0,0|1,0,0]=2 300 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] 3990 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.53 COC1=CC=NC=C1C(=O)O 33397 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.53 COC1=NC=CC=C1C(C)=O 27866 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] 6593 [0,1,0,0,0,0|3,0,0]=4 304 B11R1.53 COC1=NC=CN=C1C(=O)O 27950 [0,1,0,0,0,0|3,0,0]=4 305 B11R1.53 CSC1=C(C(=O)O)C=CC=C1 10324 [0,1,0,0,0,0|1,1,0]=3 306 B11R1.53 CSC1=C([N+](=O)[O-])C=CC=C1 2110 [0,1,0,0,0,0|2,1,0]=4 307 B11R1.53 N#CC1=C(C(=O)O)C=CC=C1 12513 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.53 N#CC1=C(C(=O)O)C=CC=N1 34217 [0,1,0,0,0,0|3,0,0]=4 309 B11R1.53 N#CC1=C(C(=O)O)C=CN=C1 34418 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.53 N#CC1=C([N+](=O)[O-])C=CC=C1 15693 [0,1,0,0,0,0|3,0,0]=4 311 B11R1.53 NNC1=C(C(=O)O)C=CC=C1 6411 [0,1,0,0,0,0|2,0,0]=3 312 B11R1.53 NNC1=C([N+](=O)[O-])C=CC=C1 12859 [0,1,0,0,0,0|3,0,0]=4 313 B11R1.53 NNC1=C([N+](=O)[O-])C=CC=C1 6408 [0,1,0,0,0,0|3,0,0]=4 314 B11R1.53 O=C(O)c1ccccc1CBr 23937 [0,1,0,0,0,0|2,0,0]=3 315 B11R1.53 O=CC1=C(C(=O)O)C=CC=C1 7365 [0,1,0,0,0,0|1,0,1]=3 316 B11R1.53 O=CC1=C([N+](=O)[O-])C=CC=C1 7762 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.53 O=[N+]([O-])C1=C(CBr)C=CC=C1 7493 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.53 O=[N+]([O-])C1=C(CO)C=CC=C1 7474 [0,1,0,0,0,0|2,0,0]=3 319 B11R1.53 OCC1=C(B(O)O)C=CC=C1 1724 [0,1,0,0,0,0|2,0,1]=4 320 B11R1.53 OCC1=C(B(O)O)C=CC=C1 5079 [0,1,0,0,0,0|2,0,1]=4 321 B11R1.87 CC1=C(S(N)(=O)=O)C=CC=C1 10087 [0,1,0,0,0,0|2,0,0]=3 322 B11R1.87 CS(=O)(=O)C1=C(Br)C=CC=C1 16799 [0,1,0,0,0,0|3,0,0]=4 323 B11R1.87 CS(=O)(=O)C1=C(Cl)C=CC=C1 10825 [0,1,0,0,0,0|3,0,0]=4 324 B11R1.87 CS(=O)(=O)C1=C(F)C=CC=C1 10824 [0,1,0,0,0,0|3,0,0]=4 325 B11R1.87 NS(=O)(=O)C1=C(Br)C=CC=C1 13521 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.87 NS(=O)(=O)C1=C(Cl)C=CC=C1 15336 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.87 NS(=O)(=O)C1=C(F)C=CC=C1 11761 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.87 O=S(=O)(Cl)C1=C(Br)C=CC=C1 5054 [0,1,0,0,0,0|3,0,0]=4 329 B11R1.87 O=S(=O)(Cl)C1=C(Cl)C=CC=C1 5074 [0,1,0,0,0,0|3,0,0]=4 330 B11R1.87 O=S(=O)(Cl)C1=C(F)C=CC=C1 5138 [0,1,0,0,0,0|3,0,0]=4 331 B11R1.87 O=S(=O)(Cl)C1=C(I)C=CC=C1 5167 [0,1,0,0,0,0|3,0,0]=4 332 B11R1.87 OC1=C(C(F)(F)F)C=CC=C1 10389 [0,1,0,0,0,0|2,0,1]=4 333 B11R1.156 CC(=O)C1=C(Br)C=CC=C1Cl 31211 [0,1,0,0,0,0|2,0,0]=3 334 B11R1.156 CC(=O)C1=C(Br)C=CC=C1F 31193 [0,1,0,0,0,0|2,0,0]=3 335 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O 24613 [0,1,0,0,0,0|1,0,0]=2 336 B11R1.156 CC(=O)C1=C(C)C=CC=C1C 31230 [0,1,0,0,0,0|2,0,0]=3 337 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl 12362 [0,1,0,0,0,0|2,0,0]=3 338 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F 7110 [0,1,0,0,0,0|2,0,0]=3 339 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1O 31212 [0,1,0,0,0,0|1,0,0]=2 340 B11R1.156 CC(=O)C1=C(Cl)C=NC=C1Cl 34826 [0,1,0,0,0,0|3,0,0]=4 341 B11R1.156 CC(=O)C1=C(F)C=CC=C1C 31223 [0,1,0,0,0,0|2,0,0]=3 342 B11R1.156 CC(=O)C1=C(F)C=CC=C1F 4218 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.156 CC(=O)C1=C(O)C=CC=C1C 31224 [0,1,0,0,0,0|1,0,0]=2 344 B11R1.156 CC(=O)C1=C(O)C=CC=C1O 3378 [0,1,0,0,0,0|1,0,0]=2 345 B11R1.156 CC(=O)c1c(O)cccc1F 28251 [0,1,0,0,0,0|1,0,0]=2 346 B11R1.156 CC(C)C1=C(O)C=CC=C1N 27651 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.156 CC1=C(C(=O)O)C(Br)=NC=C1 23850 [0,1,0,0,0,0|3,0,0]=4 348 B11R1.156 CC1=C(C(=O)O)C(N)=NC=C1 9317 [0,1,0,0,0,0|3,0,0]=4 349 B11R1.156 CC1=C([N+](=O)[O-])C(Br)=CC=C1 15574 [0,1,0,0,0,0|3,0,0]=4 350 B11R1.156 CC1=C([N+](=O)[O-])C(Cl)=CC=C1 2090 [0,1,0,0,0,0|3,0,0]=4 351 B11R1.156 CC1=C([N+](=O)[O-])C(F)=CC=C1 18581 [0,1,0,0,0,0|3,0,0]=4 352 B11R1.156 CC1=C([N+](=O)[O-])C(O)=NC=C1 6548 [0,1,0,0,0,0|3,0,0]=4 353 B11R1.156 CC1=CC=CC(Br)=C1C(=O)O 4715 [0,1,0,0,0,0|2,0,0]=3 354 B11R1.156 CC1=CC=CC(C)=C1C(=O)O 4951 [0,1,0,0,0,0|2,0,0]=3 355 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)O 4568 [0,1,0,0,0,0|2,0,0]=3 356 B11R1.156 CC1=CC=CC(F)=C1C(=O)Cl 28655 [0,1,0,0,0,0|2,0,0]=3 357 B11R1.156 CC1=CC=CC(F)=C1C(=O)O 1331 [0,1,0,0,0,0|2,0,0]=3 358 B11R1.156 CC1=CC=CC(F)=C1C(N)=O 31753 [0,1,0,0,0,0|1,0,0]=2 359 B11R1.156 CC1=CC=CC(N)=C1C(=O)O 4957 [0,1,0,0,0,0|2,0,0]=3 360 B11R1.156 CC1=CC=CC(N)=C1[N+](=O)[O-] 19692 [0,1,0,0,0,0|3,0,0]=4 361 B11R1.156 CC1=CC=CC(O)=C1C(=O)O 19633 [0,1,0,0,0,0|1,0,0]=2 362 B11R1.156 CC1=CC=CC(O)=C1[N+](=O)[O-] 11255 [0,1,0,0,0,0|2,0,0]=3 363 B11R1.156 CC1=CC=NC(Cl)=C1C(N)=O 17640 [0,1,0,0,0,0|2,0,0]=3 364 B11R1.156 CC1=CN=CC(C)=C1C(=O)O 35791 [0,1,0,0,0,0|3,0,0]=4 365 B11R1.156 NC(=O)C1=C(Cl)C=CC=C1I 27570 [0,1,0,0,0,0|1,0,0]=2 366 B11R1.156 NC(=O)C1=C(F)C=CC=C1F 10766 [0,1,0,0,0,0|1,0,0]=2 367 B11R1.156 NC(=O)C1=C(N)C=CC=C1F 4574 [0,1,0,0,0,0|1,0,0]=2 368 B11R1.156 NC1=C(C(=O)O)C(Br)=CC=C1 14048 [0,1,0,0,0,0|2,0,0]=3 369 B11R1.156 NC1=C(C(=O)O)C(Cl)=CC=C1 9876 [0,1,0,0,0,0|2,0,0]=3 370 B11R1.156 NC1=C(C(=O)O)C(F)=CC=C1 1324 [0,1,0,0,0,0|2,0,0]=3 371 B11R1.156 NC1=C([N+](=O)[O-])C(Br)=CC=C1 3139 [0,1,0,0,0,0|3,0,0]=4 372 B11R1.156 NC1=C([N+](=O)[O-])C(Cl)=CC=C1 3117 [0,1,0,0,0,0|3,0,0]=4 373 B11R1.156 NC1=C([N+](=O)[O-])C(F)=CC=C1 28325 [0,1,0,0,0,0|3,0,0]=4 374 B11R1.156 NC1=C([N+](=O)[O-])C(O)=NC=C1 6544 [0,1,0,0,0,0|3,0,0]=4 375 B11R1.156 O=C(Cl)C1=C(Cl)C=CC=C1Cl 18674 [0,1,0,0,0,0|2,0,0]=3 376 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1F 28621 [0,1,0,0,0,0|2,0,0]=3 377 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1I 4963 [0,1,0,0,0,0|2,0,0]=3 378 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br 28611 [0,1,0,0,0,0|2,0,0]=3 379 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Cl 4048 [0,1,0,0,0,0|2,0,0]=3 380 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F 1317 [0,1,0,0,0,0|2,0,0]=3 381 B11R1.156 O=C(O)C1=C(Br)C=CC=C1O 33425 [0,1,0,0,0,0|1,0,0]=2 382 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl 20028 [0,1,0,0,0,0|2,0,0]=3 383 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1F 1372 [0,1,0,0,0,0|2,0,0]=3 384 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O 30488 [0,1,0,0,0,0|1,0,0]=2 385 B11R1.156 O=C(O)C1=C(Cl)C=CN=C1Cl 17746 [0,1,0,0,0,0|3,0,0]=4 386 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1I 26811 [0,1,0,0,0,0|3,0,0]=4 387 B11R1.156 O=C(O)C1=C(F)C=CC=C1F 2274 [0,1,0,0,0,0|2,0,0]=3 388 B11R1.156 O=C(O)C1=C(F)C=CC=C1I 1386 [0,1,0,0,0,0|2,0,0]=3 389 B11R1.156 O=C(O)C1=C(F)C=CC=C1O 4958 [0,1,0,0,0,0|1,0,0]=2 390 B11R1.156 O=C(O)C1=C(F)C=NC=C1F 27955 [0,1,0,0,0,0|3,0,0]=4 391 B11R1.156 O=C(O)C1=C(F)N=CC=C1I 17043 [0,1,0,0,0,0|3,0,0]=4 392 B11R1.156 O=C(O)C1=C(O)C=CC=C1O 21431 [0,1,0,0,0,0|1,0,0]=2 393 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1Br 33414 [0,1,0,0,0,0|3,0,0]=4 394 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1Cl 33261 [0,1,0,0,0,0|3,0,0]=4 395 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1F 18516 [0,1,0,0,0,0|3,0,0]=4 396 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1F 15675 [0,1,0,0,0,0|3,0,0]=4 397 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CN=C1O 6547 [0,1,0,0,0,0|3,0,0]=4 398 B11R1.156 O=[N+]([O-])C1=C(F)C=CC=C1F 4403 [0,1,0,0,0,0|3,0,0]=4 399 B11R1.156 O=[N+]([O-])C1=C(F)C=CC=C1I 22705 [0,1,0,0,0,0|3,0,0]=4 400 B11R1.156 O=[N+]([O-])C1=C(F)C=CC=C1I 29368 [0,1,0,0,0,0|3,0,0]=4 401 B11R1.156 O=[N+]([O-])C1=C(O)C=CC=C1Br 33416 [0,1,0,0,0,0|2,0,0]=3 402 B11R1.156 O=[N+]([O-])C1=C(O)C=CC=C1Cl 16340 [0,1,0,0,0,0|2,0,0]=3 403 B11R1.156 O=[N+]([O-])C1=C(O)C=CC=C1F 4124 [0,1,0,0,0,0|2,0,0]=3 404 B11R1.156 O=[N+]([O-])C1=C(O)C=CC=C1O 36240 [0,1,0,0,0,0|2,0,0]=3 405 B11R1.156 O=[N+]([O-])C1=C(O)C=CN=C1O 5469 [0,1,0,0,0,0|3,0,0]=4 406 B11R1.156 O=[N+]([O-])C1=C(S)C=CC=C1Cl 16916 [0,1,0,0,0,0|2,1,0]=4 407 B11R1.156 OB(O)C1=C(Cl)C=CC=C1O 32633 [0,1,0,0,0,0|2,0,1]=4 408 B11R1.156 OB(O)C1=C(F)C=CC=C1O 32288 [0,1,0,0,0,0|2,0,1]=4 409 B11R1.159 CC(=O)C1=C(C)C(Br)=CC=C1 31204 [0,1,0,0,0,0|2,0,0]=3 410 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 19771 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.159 CC(=O)C1=C(Cl)C(Br)=CC=C1 31198 [0,1,0,0,0,0|2,0,0]=3 412 B11R1.159 CC(=O)C1=C(Cl)C(Cl)=CC=C1 3368 [0,1,0,0,0,0|2,0,0]=3 413 B11R1.159 CC(=O)C1=C(Cl)C(F)=CC=C1 31183 [0,1,0,0,0,0|2,0,0]=3 414 B11R1.159 CC(=O)C1=C(F)C(Br)=CC=C1 4095 [0,1,0,0,0,0|2,0,0]=3 415 B11R1.159 CC(=O)C1=C(F)C(C)=CC=C1 31221 [0,1,0,0,0,0|2,0,0]=3 416 B11R1.159 CC(=O)C1=C(F)C(Cl)=CC=C1 29140 [0,1,0,0,0,0|2,0,0]=3 417 B11R1.159 CC(=O)C1=C(F)C(F)=CC=C1 4211 [0,1,0,0,0,0|2,0,0]=3 418 B11R1.159 CC(=O)C1=C(F)C(O)=CC=C1 33429 [0,1,0,0,0,0|2,0,0]=3 419 B11R1.159 CC(=O)C1=C(N)C(C)=CC=C1 29253 [0,1,0,0,0,0|2,0,0]=3 420 B11R1.159 CC(=O)C1=C(N)C(Cl)=CC=C1 29249 [0,1,0,0,0,0|2,0,0]=3 421 B11R1.159 CC(=O)C1=C(N)C(Cl)=NC=C1 19574 [0,1,0,0,0,0|3,0,0]=4 422 B11R1.159 CC(=O)C1=C(N)C(Cl)=NC=C1 9604 [0,1,0,0,0,0|3,0,0]=4 423 B11R1.159 CC(=O)C1=C(N)C(F)=CC=C1 34667 [0,1,0,0,0,0|2,0,0]=3 424 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 35768 [0,1,0,0,0,0|2,0,0]=3 425 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 29262 [0,1,0,0,0,0|1,0,0]=2 426 B11R1.159 CC(=O)C1=C(O)C(Cl)=CC=C1 31195 [0,1,0,0,0,0|1,0,0]=2 427 B11R1.159 CC(=O)C1=C(O)C(F)=CC=C1 19786 [0,1,0,0,0,0|1,0,0]=2 428 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 3281 [0,1,0,0,0,0|1,0,0]=2 429 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 33767 [0,1,0,0,0,0|1,0,0]=2 430 B11R1.159 CC(=O)c1cccc(N)c1O 10346 [0,1,0,0,0,0|1,0,0]=2 431 B11R1.159 CC(C)C1=C(O)C(O)=CC=C1 34649 [0,1,0,0,0,0|2,0,1]=4 432 B11R1.159 CC(C)C1=CC=CC(Br)=C1O 33834 [0,1,0,0,0,0|2,0,1]=4 433 B11R1.159 CC(C)C1=CC=CC(Cl)=C1O 28112 [0,1,0,0,0,0|2,0,1]=4 434 B11R1.159 CC1=C(Br)C([N+](=O)[O-])=CC=C1 4531 [0,1,0,0,0,0|3,0,0]=4 435 B11R1.159 CC1=C(Br)C=CC=C1[N+](=O)[O-] 3823 [0,1,0,0,0,0|3,0,0]=4 436 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br 4717 [0,1,0,0,0,0|2,0,0]=3 437 B11R1.159 CC1=C(C(=O)O)C=CC=C1Cl 8362 [0,1,0,0,0,0|2,0,0]=3 438 B11R1.159 CC1=C(C(=O)O)C=CC=C1F 1329 [0,1,0,0,0,0|2,0,0]=3 439 B11R1.159 CC1=C(C(=O)O)C=CC=C1I 22968 [0,1,0,0,0,0|2,0,0]=3 440 B11R1.159 CC1=C(C(=O)O)C=CC=C1N 10921 [0,1,0,0,0,0|2,0,0]=3 441 B11R1.159 CC1=C(C(=O)O)C=CC=C1O 15694 [0,1,0,0,0,0|2,0,0]=3 442 B11R1.159 CC1=C(Cl)C=CC=C1[N+](=O)[O-] 14277 [0,1,0,0,0,0|3,0,0]=4 443 B11R1.159 CC1=C(Cl)C=CN=C1C(=O)O 33666 [0,1,0,0,0,0|3,0,0]=4 444 B11R1.159 CC1=C(F)C([N+](=O)[O-])=CC=C1 1591 [0,1,0,0,0,0|3,0,0]=4 445 B11R1.159 CC1=C(F)C=CC=C1[N+](=O)[O-] 1594 [0,1,0,0,0,0|3,0,0]=4 446 B11R1.159 CC1=C(N)C([N+](=O)[O-])=CC=C1 14281 [0,1,0,0,0,0|3,0,0]=4 447 B11R1.159 CC1=C(N)C=CC=C1[N+](=O)[O-] 4480 [0,1,0,0,0,0|3,0,0]=4 448 B11R1.159 CC1=C(O)C=CC=C1[N+](=O)[O-] 2030 [0,1,0,0,0,0|3,0,0]=4 449 B11R1.159 CC1=CC=CC(B(O)O)=C1O 33842 [0,1,0,0,0,0|2,0,1]=4 450 B11R1.159 CC1=CC=CC(C(=O)Cl)=C1C 28637 [0,1,0,0,0,0|2,0,0]=3 451 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br 3805 [0,1,0,0,0,0|2,0,0]=3 452 B11R1.159 CC1=CC=CC(C(=O)O)=C1C 2549 [0,1,0,0,0,0|2,0,0]=3 453 B11R1.159 CC1=CC=CC(C(=O)O)=C1Cl 4566 [0,1,0,0,0,0|2,0,0]=3 454 B11R1.159 CC1=CC=CC(C(=O)O)=C1F 1328 [0,1,0,0,0,0|2,0,0]=3 455 B11R1.159 CC1=CC=CC(C(=O)O)=C1I 12741 [0,1,0,0,0,0|2,0,0]=3 456 B11R1.159 CC1=CC=CC(C(=O)O)=C1N 4950 [0,1,0,0,0,0|2,0,0]=3 457 B11R1.159 CC1=CC=CC(C(N)=O)=C1F 4573 [0,1,0,0,0,0|1,0,0]=2 458 B11R1.159 CC1=CC=CC(C(N)=O)=C1N 26013 [0,1,0,0,0,0|1,0,0]=2 459 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=C1 22279 [0,1,0,0,0,0|1,0,0]=2 460 B11R1.159 NC(=O)C1=C(F)C(F)=CC=C1 25400 [0,1,0,0,0,0|1,0,0]=2 461 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 9761 [0,1,0,0,0,0|2,0,0]=3 462 B11R1.159 NC(=O)C1=C(N)C(F)=CC=C1 28768 [0,1,0,0,0,0|1,0,0]=2 463 B11R1.159 NC(=O)C1=C(N)C(N)=CC=C1 19664 [0,1,0,0,0,0|1,0,0]=2 464 B11R1.159 NC(=S)C1=C(Cl)C(Cl)=CC=C1 22984 [0,1,0,0,0,0|1,1,0]=3 465 B11R1.159 NC1=C(Br)C([N+](=O)[O-])=CC=C1 31045 [0,1,0,0,0,0|3,0,0]=4 466 B11R1.159 NC1=C(Br)C=CC=C1[N+](=O)[O-] 2534 [0,1,0,0,0,0|3,0,0]=4 467 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O 6655 [0,1,0,0,0,0|3,0,0]=4 468 B11R1.159 NC1=C(C(=O)O)C=CC=C1Br 9022 [0,1,0,0,0,0|2,0,0]=3 469 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl 4639 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.159 NC1=C(C(=O)O)C=CC=C1F 1356 [0,1,0,0,0,0|2,0,0]=3 471 B11R1.159 NC1=C(C(=O)O)C=CC=C1F 30459 [0,1,0,0,0,0|2,0,0]=3 472 B11R1.159 NC1=C(C(=O)O)C=CC=C1I 22551 [0,1,0,0,0,0|2,0,0]=3 473 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl 34201 [0,1,0,0,0,0|3,0,0]=4 474 B11R1.159 NC1=C(Cl)C([N+](=O)[O-])=CC=C1 31048 [0,1,0,0,0,0|3,0,0]=4 475 B11R1.159 NC1=C(Cl)C=CC=C1[N+](=O)[O-] 27708 [0,1,0,0,0,0|3,0,0]=4 476 B11R1.159 NC1=C(Cl)C=NC=C1C(=O)O 6656 [0,1,0,0,0,0|3,0,0]=4 477 B11R1.159 NC1=C(F)C([N+](=O)[O-])=CC=C1 31026 [0,1,0,0,0,0|3,0,0]=4 478 B11R1.159 NC1=C(F)C=CC=C1[N+](=O)[O-] 4472 [0,1,0,0,0,0|3,0,0]=4 479 B11R1.159 NC1=C(N)C([N+](=O)[O-])=CC=C1 23467 [0,1,0,0,0,0|3,0,0]=4 480 B11R1.159 NC1=C(O)C([N+](=O)[O-])=CC=C1 33266 [0,1,0,0,0,0|2,0,0]=3 481 B11R1.159 NC1=C(O)C=CC=C1C(=O)O 22539 [0,1,0,0,0,0|2,0,0]=3 482 B11R1.159 NC1=C(O)C=CC=C1[N+](=O)[O-] 3202 [0,1,0,0,0,0|3,0,0]=4 483 B11R1.159 NC1=CC=CC(C(=O)O)=C1Cl 10348 [0,1,0,0,0,0|2,0,0]=3 484 B11R1.159 NC1=CC=CC(C(=O)O)=C1F 2533 [0,1,0,0,0,0|2,0,0]=3 485 B11R1.159 NC1=CC=CC(C(=O)O)=C1N 3145 [0,1,0,0,0,0|2,0,0]=3 486 B11R1.159 NC1=CC=CC(C(=O)O)=C1O 14474 [0,1,0,0,0,0|1,0,0]=2 487 B11R1.159 O=C(Cl)C1=C(Cl)C(Cl)=CC=C1 35261 [0,1,0,0,0,0|2,0,0]=3 488 B11R1.159 O=C(Cl)C1=C(F)C(Br)=CC=C1 28561 [0,1,0,0,0,0|2,0,0]=3 489 B11R1.159 O=C(Cl)C1=C(F)C(Cl)=CC=C1 28588 [0,1,0,0,0,0|2,0,0]=3 490 B11R1.159 O=C(Cl)C1=C(F)C(F)=CC=C1 16225 [0,1,0,0,0,0|2,0,0]=3 491 B11R1.159 O=C(O)C1=C(Br)C(Br)=CC=C1 28610 [0,1,0,0,0,0|2,0,0]=3 492 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 27754 [0,1,0,0,0,0|2,0,0]=3 493 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 33724 [0,1,0,0,0,0|2,0,0]=3 494 B11R1.159 O=C(O)C1=C(Br)C(Cl)=NC=C1 33817 [0,1,0,0,0,0|3,0,0]=4 495 B11R1.159 O=C(O)C1=C(Br)C(F)=CC=C1 1319 [0,1,0,0,0,0|2,0,0]=3 496 B11R1.159 O=C(O)C1=C(Br)C(I)=CC=C1 30460 [0,1,0,0,0,0|2,0,0]=3 497 B11R1.159 O=C(O)C1=C(Br)C(O)=CC=C1 27698 [0,1,0,0,0,0|2,0,0]=3 498 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CC=C1 26335 [0,1,0,0,0,0|2,0,0]=3 499 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=CC=C1 8198 [0,1,0,0,0,0|2,0,0]=3 500 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 22306 [0,1,0,0,0,0|3,0,0]=4 501 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 1369 [0,1,0,0,0,0|2,0,0]=3 502 B11R1.159 O=C(O)C1=C(Cl)C(I)=CC=C1 30702 [0,1,0,0,0,0|2,0,0]=3 503 B11R1.159 O=C(O)C1=C(Cl)C(O)=CC=C1 30633 [0,1,0,0,0,0|2,0,0]=3 504 B11R1.159 O=C(O)C1=C(F)C(Br)=CC=C1 1318 [0,1,0,0,0,0|2,0,0]=3 505 B11R1.159 O=C(O)C1=C(F)C(Cl)=CC=C1 1332 [0,1,0,0,0,0|2,0,0]=3 506 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 17055 [0,1,0,0,0,0|3,0,0]=4 507 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 26679 [0,1,0,0,0,0|3,0,0]=4 508 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 1379 [0,1,0,0,0,0|2,0,0]=3 509 B11R1.159 O=C(O)C1=C(F)C(F)=NC=C1 18431 [0,1,0,0,0,0|3,0,0]=4 510 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 1383 [0,1,0,0,0,0|2,0,0]=3 511 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 4959 [0,1,0,0,0,0|2,0,0]=3 512 B11R1.159 O=C(O)C1=C(I)C(Br)=NC=C1 26925 [0,1,0,0,0,0|3,0,0]=4 513 B11R1.159 O=C(O)C1=C(I)C(F)=CC=C1 1387 [0,1,0,0,0,0|2,0,0]=3 514 B11R1.159 O=C(O)C1=C(I)C(O)=CC=C1 28114 [0,1,0,0,0,0|2,0,0]=3 515 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 28569 [0,1,0,0,0,0|1,0,0]=2 516 B11R1.159 O=C(O)C1=C(O)C(F)=CC=C1 4960 [0,1,0,0,0,0|1,0,0]=2 517 B11R1.159 O=C(O)C1=C(O)C(O)=CC=C1 3119 [0,1,0,0,0,0|1,0,0]=2 518 B11R1.159 O=C(O)C1=CC=CC(=O)N1O 35541 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O 18184 [0,1,0,0,0,0|1,0,0]=2 520 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1Cl 27725 [0,1,0,0,0,0|3,0,0]=4 521 B11R1.159 O=[N+]([O-])C1=C(O)C(Cl)=NC=C1 26563 [0,1,0,0,0,0|3,0,0]=4 522 B11R1.159 O=[N+]([O-])C1=C(O)C(F)=CC=C1 10654 [0,1,0,0,0,0|2,0,0]=3 523 B11R1.159 O=[N+]([O-])C1=C(O)C(O)=CC=C1 23845 [0,1,0,0,0,0|2,0,0]=3 524 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1F 4298 [0,1,0,0,0,0|3,0,0]=4 525 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1I 17287 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1O 3114 [0,1,0,0,0,0|2,0,0]=3 527 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1Br 27709 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1Cl 10770 [0,1,0,0,0,0|3,0,0]=4 529 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1F 2483 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1O 4103 [0,1,0,0,0,0|2,0,0]=3 531 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1Br 1043 [0,1,0,0,0,0|3,0,0]=4 532 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1Cl 1048 [0,1,0,0,0,0|3,0,0]=4 533 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1F 1053 [0,1,0,0,0,0|3,0,0]=4 534 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1I 1057 [0,1,0,0,0,0|3,0,0]=4 535 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1Br 16945 [0,1,0,0,0,0|3,0,0]=4 536 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1Cl 19262 [0,1,0,0,0,0|3,0,0]=4 537 B11R1.159 O=[N+]([O-])C1=CN=CC(Br)=C1O 27164 [0,1,0,0,0,0|3,0,0]=4 538 B11R1.159 O=[N+]([O-])c1cccc(Br)c1Cl 30875 [0,1,0,0,0,0|3,0,0]=4 539 B11R1.159 OB(O)C1=C(O)C(Br)=CC=C1 29584 [0,1,0,0,0,0|2,0,1]=4 540 B11R1.159 OB(O)C1=C(O)C(Cl)=CC=C1 33843 [0,1,0,0,0,0|2,0,1]=4 541 B11R1.159 OB(O)C1=C(O)C(F)=CC=C1 33466 [0,1,0,0,0,0|2,0,1]=4 542 B11R1.166 CC(=O)C1=C(Br)C=C(Br)C=C1 29275 [0,1,0,0,0,0|2,0,0]=3 543 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 29258 [0,1,0,0,0,0|2,0,0]=3 544 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 8533 [0,1,0,0,0,0|2,0,0]=3 545 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 28228 [0,1,0,0,0,0|2,0,0]=3 546 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 29261 [0,1,0,0,0,0|2,0,0]=3 547 B11R1.166 CC(=O)C1=C(C)C=C(Br)C=C1 31226 [0,1,0,0,0,0|2,0,0]=3 548 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 3376 [0,1,0,0,0,0|2,0,0]=3 549 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 29273 [0,1,0,0,0,0|2,0,0]=3 550 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 24792 [0,1,0,0,0,0|2,0,0]=3 551 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 3265 [0,1,0,0,0,0|2,0,0]=3 552 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 13619 [0,1,0,0,0,0|2,0,0]=3 553 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 4187 [0,1,0,0,0,0|2,0,0]=3 554 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 28238 [0,1,0,0,0,0|2,0,0]=3 555 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 29270 [0,1,0,0,0,0|2,0,0]=3 556 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 24789 [0,1,0,0,0,0|2,0,0]=3 557 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 4207 [0,1,0,0,0,0|2,0,0]=3 558 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 4213 [0,1,0,0,0,0|2,0,0]=3 559 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 24419 [0,1,0,0,0,0|2,0,0]=3 560 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 36301 [0,1,0,0,0,0|2,0,0]=3 561 B11R1.166 CC(=O)C1=C(N)C=C(F)C=C1 27374 [0,1,0,0,0,0|2,0,0]=3 562 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 19929 [0,1,0,0,0,0|1,0,0]=2 563 B11R1.166 CC(=O)C1=C(O)C=C(C)C=C1 16935 [0,1,0,0,0,0|1,0,0]=2 564 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 29061 [0,1,0,0,0,0|1,0,0]=2 565 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 13252 [0,1,0,0,0,0|1,0,0]=2 566 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 28229 [0,1,0,0,0,0|1,0,0]=2 567 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 3375 [0,1,0,0,0,0|1,0,0]=2 568 B11R1.166 CC(=O)C1=CC=C(F)N=C1F 18362 [0,1,0,0,0,0|3,0,0]=4 569 B11R1.166 CC(=O)C1=NC=C(F)C=C1F 24328 [0,1,0,0,0,0|3,0,0]=4 570 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 35906 [0,1,0,0,0,0|2,0,1]=4 571 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 4029 [0,1,0,0,0,0|2,0,0]=3 572 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 4570 [0,1,0,0,0,0|2,0,0]=3 573 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 33689 [0,1,0,0,0,0|3,0,0]=4 574 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 1327 [0,1,0,0,0,0|2,0,0]=3 575 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 10626 [0,1,0,0,0,0|3,0,0]=4 576 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 10924 [0,1,0,0,0,0|2,0,0]=3 577 B11R1.166 CC1=C(C(=O)O)C=NC(Cl)=C1 35774 [0,1,0,0,0,0|3,0,0]=4 578 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Br)=C1 31561 [0,1,0,0,0,0|3,0,0]=4 579 B11R1.166 CC1=C([N+](=O)[O-])C=CC(F)=C1 1598 [0,1,0,0,0,0|3,0,0]=4 580 B11R1.166 CC1=C([N+](=O)[O-])C=CC(N)=C1 12456 [0,1,0,0,0,0|3,0,0]=4 581 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 4719 [0,1,0,0,0,0|2,0,0]=3 582 B11R1.166 CC1=CC(Br)=C([N+](=O)[O-])C=C1 31562 [0,1,0,0,0,0|3,0,0]=4 583 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 15441 [0,1,0,0,0,0|2,0,0]=3 584 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 4567 [0,1,0,0,0,0|2,0,0]=3 585 B11R1.166 CC1=CC(Cl)=C([N+](=O)[O-])C=C1 4534 [0,1,0,0,0,0|3,0,0]=4 586 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 1395 [0,1,0,0,0,0|2,0,0]=3 587 B11R1.166 CC1=CC(F)=C([N+](=O)[O-])C=C1 1595 [0,1,0,0,0,0|3,0,0]=4 588 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 30572 [0,1,0,0,0,0|2,0,0]=3 589 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 4952 [0,1,0,0,0,0|2,0,0]=3 590 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 4030 [0,1,0,0,0,0|1,0,0]=2 591 B11R1.166 CC1=CC(N)=C([N+](=O)[O-])C=C1 25695 [0,1,0,0,0,0|3,0,0]=4 592 B11R1.166 CC1=CC(N)=NC=C1C(=O)O 5702 [0,1,0,0,0,0|3,0,0]=4 593 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 32852 [0,1,0,0,0,0|2,0,1]=4 594 B11R1.166 CC1=CC(O)=C([N+](=O)[O-])C=C1 25410 [0,1,0,0,0,0|2,0,0]=3 595 B11R1.166 CC1=CC(O)=CC=C1[N+](=O)[O-] 21648 [0,1,0,0,0,0|3,0,0]=4 596 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 18270 [0,1,0,0,0,0|1,0,0]=2 597 B11R1.166 CC1=CC=C(C(=O)O)C(O)=N1 26524 [0,1,0,0,0,0|2,0,0]=3 598 B11R1.166 CC1=CC=C([N+](=O)[O-])C(O)=N1 1112 [0,1,0,0,0,0|3,0,0]=4 599 B11R1.166 CC1=NC(Cl)=C(C(=O)O)C=C1 11019 [0,1,0,0,0,0|3,0,0]=4 600 B11R1.166 NC(=O)C1=C(Br)C=C(Br)C=C1 28771 [0,1,0,0,0,0|1,0,0]=2 601 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 31609 [0,1,0,0,0,0|1,0,0]=2 602 B11R1.166 NC(=O)C1=C(F)C=C(F)C=C1 3458 [0,1,0,0,0,0|1,0,0]=2 603 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=C1 25784 [0,1,0,0,0,0|1,0,0]=2 604 B11R1.166 NC(=O)C1=CN=C(Cl)N=C1Cl 35712 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.166 NC(=S)C1=C(Cl)C=C(Cl)C=C1 20132 [0,1,0,0,0,0|1,1,0]=3 606 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 13462 [0,1,0,0,0,0|2,0,0]=3 607 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=N1 26435 [0,1,0,0,0,0|3,0,0]=4 608 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 11211 [0,1,0,0,0,0|2,0,0]=3 609 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 1323 [0,1,0,0,0,0|2,0,0]=3 610 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 22552 [0,1,0,0,0,0|2,0,0]=3 611 B11R1.166 NC1=C([N+](=O)[O-])C=CC(Br)=C1 22358 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.166 NC1=C([N+](=O)[O-])C=CC(Cl)=C1 4369 [0,1,0,0,0,0|3,0,0]=4 613 B11R1.166 NC1=C([N+](=O)[O-])C=CC(F)=C1 4476 [0,1,0,0,0,0|3,0,0]=4 614 B11R1.166 NC1=CC(Br)=C([N+](=O)[O-])C=C1 4359 [0,1,0,0,0,0|3,0,0]=4 615 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 3109 [0,1,0,0,0,0|2,0,0]=3 616 B11R1.166 NC1=CC(Cl)=C([N+](=O)[O-])C=C1 9594 [0,1,0,0,0,0|3,0,0]=4 617 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 4693 [0,1,0,0,0,0|2,0,0]=3 618 B11R1.166 NC1=CC(F)=C([N+](=O)[O-])C=C1 4474 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 23542 [0,1,0,0,0,0|1,0,0]=2 620 B11R1.166 O=C(Cl)C1=C(F)C=C(Br)C=C1 25458 [0,1,0,0,0,0|2,0,0]=3 621 B11R1.166 O=C(Cl)C1=C(F)C=C(F)C=C1 35111 [0,1,0,0,0,0|2,0,0]=3 622 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 3856 [0,1,0,0,0,0|2,0,0]=3 623 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 4028 [0,1,0,0,0,0|2,0,0]=3 624 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 1314 [0,1,0,0,0,0|2,0,0]=3 625 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 3586 [0,1,0,0,0,0|2,0,0]=3 626 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 21313 [0,1,0,0,0,0|2,0,0]=3 627 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 18521 [0,1,0,0,0,0|3,0,0]=4 628 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 1370 [0,1,0,0,0,0|2,0,0]=3 629 B11R1.166 O=C(O)C1=C(Cl)C=C(I)C=C1 10153 [0,1,0,0,0,0|2,0,0]=3 630 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 4561 [0,1,0,0,0,0|2,0,0]=3 631 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 1225 [0,1,0,0,0,0|3,0,0]=4 632 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 1313 [0,1,0,0,0,0|2,0,0]=3 633 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 1374 [0,1,0,0,0,0|2,0,0]=3 634 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 1336 [0,1,0,0,0,0|2,0,0]=3 635 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 1384 [0,1,0,0,0,0|2,0,0]=3 636 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 2608 [0,1,0,0,0,0|2,0,0]=3 637 B11R1.166 O=C(O)C1=C(I)C=C(Br)C=C1 13466 [0,1,0,0,0,0|2,0,0]=3 638 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 4018 [0,1,0,0,0,0|2,0,0]=3 639 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 1389 [0,1,0,0,0,0|2,0,0]=3 640 B11R1.166 O=C(O)C1=C(I)C=C(O)C=C1 27646 [0,1,0,0,0,0|2,0,0]=3 641 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 4010 [0,1,0,0,0,0|1,0,0]=2 642 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 3845 [0,1,0,0,0,0|1,0,0]=2 643 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 3493 [0,1,0,0,0,0|1,0,0]=2 644 B11R1.166 O=C(O)C1=C(O)C=C(I)C=C1 3888 [0,1,0,0,0,0|1,0,0]=2 645 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br 14391 [0,1,0,0,0,0|3,0,0]=4 646 B11R1.166 O=C(O)C1=CC=C(F)N=C1F 14392 [0,1,0,0,0,0|3,0,0]=4 647 B11R1.166 O=C(O)C1=CN=C(O)N=C1O 9623 [0,1,0,0,0,0|3,0,0]=4 648 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Br 17568 [0,1,0,0,0,0|3,0,0]=4 649 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl 17527 [0,1,0,0,0,0|3,0,0]=4 650 B11R1.166 O=C(O)C1=NC=C(Br)C=C1O 23193 [0,1,0,0,0,0|2,0,0]=3 651 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl 4005 [0,1,0,0,0,0|3,0,0]=4 652 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F 17534 [0,1,0,0,0,0|3,0,0]=4 653 B11R1.166 O=C([O-])C1=C(F)C=C(F)C=C1 29707 [0,1,0,0,0,0|2,0,0]=3 654 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(F)C=C1 4277 [0,1,0,0,0,0|3,0,0]=4 655 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(O)C=C1 33263 [0,1,0,0,0,0|3,0,0]=4 656 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(Cl)C=C1 15890 [0,1,0,0,0,0|3,0,0]=4 657 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(O)C=C1 28366 [0,1,0,0,0,0|3,0,0]=4 658 B11R1.166 O=[N+]([O-])C1=C(F)C=C(Br)C=C1 2226 [0,1,0,0,0,0|3,0,0]=4 659 B11R1.166 O=[N+]([O-])C1=C(F)C=C(Cl)C=C1 1051 [0,1,0,0,0,0|3,0,0]=4 660 B11R1.166 O=[N+]([O-])C1=C(F)C=C(F)C=C1 2288 [0,1,0,0,0,0|3,0,0]=4 661 B11R1.166 O=[N+]([O-])C1=C(F)C=C(I)C=C1 27694 [0,1,0,0,0,0|3,0,0]=4 662 B11R1.166 O=[N+]([O-])C1=C(F)C=C(O)C=C1 2101 [0,1,0,0,0,0|3,0,0]=4 663 B11R1.166 O=[N+]([O-])C1=C(I)C=C(Br)C=C1 27306 [0,1,0,0,0,0|3,0,0]=4 664 B11R1.166 O=[N+]([O-])C1=C(I)C=C(F)C=C1 20409 [0,1,0,0,0,0|3,0,0]=4 665 B11R1.166 O=[N+]([O-])C1=C(I)C=C(I)C=C1 19890 [0,1,0,0,0,0|3,0,0]=4 666 B11R1.166 O=[N+]([O-])C1=C(O)C=C(Br)C=C1 16073 [0,1,0,0,0,0|2,0,0]=3 667 B11R1.166 O=[N+]([O-])C1=C(O)C=C(F)C=C1 2371 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.166 O=[N+]([O-])C1=C(O)C=C(O)C=C1 27732 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)N=C1O 6555 [0,1,0,0,0,0|3,0,0]=4 670 B11R1.166 O=[N+]([O-])c1ccc(F)cc1Cl 4342 [0,1,0,0,0,0|3,0,0]=4 671 B11R1.166 OB(O)C1=C(O)C=C(Cl)C=C1 33194 [0,1,0,0,0,0|2,0,1]=4 672 B11R1.166 OB(O)C1=C(O)C=C(F)C=C1 32850 [0,1,0,0,0,0|2,0,1]=4 673 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 23873 [0,1,0,0,0,0|2,0,0]=3 674 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 3214 [0,1,0,0,0,0|2,0,0]=3 675 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 29260 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.167 CC(=O)C1=C(Cl)C=CC(Cl)=C1 10586 [0,1,0,0,0,0|2,0,0]=3 677 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 4193 [0,1,0,0,0,0|2,0,0]=3 678 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=C1 16430 [0,1,0,0,0,0|2,0,0]=3 679 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 4237 [0,1,0,0,0,0|2,0,0]=3 680 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 8394 [0,1,0,0,0,0|2,0,0]=3 681 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 29131 [0,1,0,0,0,0|2,0,0]=3 682 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 29152 [0,1,0,0,0,0|2,0,0]=3 683 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 15742 [0,1,0,0,0,0|2,0,0]=3 684 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 15829 [0,1,0,0,0,0|2,0,0]=3 685 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 26324 [0,1,0,0,0,0|2,0,0]=3 686 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 33711 [0,1,0,0,0,0|2,0,0]=3 687 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 3913 [0,1,0,0,0,0|1,0,0]=2 688 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 16936 [0,1,0,0,0,0|1,0,0]=2 689 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 3353 [0,1,0,0,0,0|1,0,0]=2 690 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 3356 [0,1,0,0,0,0|1,0,0]=2 691 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 17597 [0,1,0,0,0,0|1,0,0]=2 692 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 3377 [0,1,0,0,0,0|1,0,0]=2 693 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F 30415 [0,1,0,0,0,0|3,0,0]=4 694 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl 27246 [0,1,0,0,0,0|3,0,0]=4 695 B11R1.167 CC(C)C1=C(O)C=CC(Br)=C1 34492 [0,1,0,0,0,0|2,0,1]=4 696 B11R1.167 CC(C)C1=C(O)C=CC(Cl)=C1 27613 [0,1,0,0,0,0|2,0,1]=4 697 B11R1.167 CC1=C(C(=O)Cl)C=C(F)C=C1 31959 [0,1,0,0,0,0|2,0,0]=3 698 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 4728 [0,1,0,0,0,0|2,0,0]=3 699 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 4578 [0,1,0,0,0,0|2,0,0]=3 700 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 1326 [0,1,0,0,0,0|2,0,0]=3 701 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 4520 [0,1,0,0,0,0|2,0,0]=3 702 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 4980 [0,1,0,0,0,0|2,0,0]=3 703 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 25813 [0,1,0,0,0,0|2,0,0]=3 704 B11R1.167 CC1=C(C(N)=O)C=C(F)C=C1 26344 [0,1,0,0,0,0|1,0,0]=2 705 B11R1.167 CC1=C([N+](=O)[O-])C=C(Br)C=C1 10403 [0,1,0,0,0,0|3,0,0]=4 706 B11R1.167 CC1=C([N+](=O)[O-])C=C(Cl)C=C1 18919 [0,1,0,0,0,0|3,0,0]=4 707 B11R1.167 CC1=C([N+](=O)[O-])C=C(F)C=C1 1596 [0,1,0,0,0,0|3,0,0]=4 708 B11R1.167 CC1=C([N+](=O)[O-])C=C(I)C=C1 15938 [0,1,0,0,0,0|3,0,0]=4 709 B11R1.167 CC1=C([N+](=O)[O-])C=C(N)C=C1 14491 [0,1,0,0,0,0|3,0,0]=4 710 B11R1.167 CC1=C([N+](=O)[O-])C=C(O)C=C1 1480 [0,1,0,0,0,0|3,0,0]=4 711 B11R1.167 CC1=CC(B(O)O)=C(O)C=C1 32853 [0,1,0,0,0,0|2,0,1]=4 712 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 2166 [0,1,0,0,0,0|2,0,0]=3 713 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 28638 [0,1,0,0,0,0|2,0,0]=3 714 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 12501 [0,1,0,0,0,0|2,0,0]=3 715 B11R1.167 CC1=CC(C(=O)O)=C(Cl)N=C1 33728 [0,1,0,0,0,0|3,0,0]=4 716 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 4750 [0,1,0,0,0,0|2,0,0]=3 717 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 4975 [0,1,0,0,0,0|2,0,0]=3 718 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 4954 [0,1,0,0,0,0|2,0,0]=3 719 B11R1.167 CC1=CC(C(=O)[O-])=C(I)C=C1 29722 [0,1,0,0,0,0|2,0,0]=3 720 B11R1.167 CC1=CC(C(N)=O)=C(N)C=C1 13743 [0,1,0,0,0,0|1,0,0]=2 721 B11R1.167 CC1=CC([N+](=O)[O-])=C(Br)C=C1 9585 [0,1,0,0,0,0|3,0,0]=4 722 B11R1.167 CC1=CC([N+](=O)[O-])=C(C)C=C1 25914 [0,1,0,0,0,0|3,0,0]=4 723 B11R1.167 CC1=CC([N+](=O)[O-])=C(Cl)C=C1 19752 [0,1,0,0,0,0|3,0,0]=4 724 B11R1.167 CC1=CC([N+](=O)[O-])=C(F)C=C1 1597 [0,1,0,0,0,0|3,0,0]=4 725 B11R1.167 CC1=CC([N+](=O)[O-])=C(I)C=C1 4550 [0,1,0,0,0,0|3,0,0]=4 726 B11R1.167 CC1=CC([N+](=O)[O-])=C(O)C=C1 12745 [0,1,0,0,0,0|2,0,0]=3 727 B11R1.167 CC1=CC=C(Cl)N=C1C(=O)O 26729 [0,1,0,0,0,0|3,0,0]=4 728 B11R1.167 CC1=CC=C(O)C(C(=O)O)=N1 34738 [0,1,0,0,0,0|2,0,0]=3 729 B11R1.167 CC1=CC=C(O)C([N+](=O)[O-])=N1 6630 [0,1,0,0,0,0|3,0,0]=4 730 B11R1.167 CC1=CN=C(O)C([N+](=O)[O-])=C1 1204 [0,1,0,0,0,0|3,0,0]=4 731 B11R1.167 NC(=O)C1=C(Cl)C=CC(F)=C1 9137 [0,1,0,0,0,0|1,0,0]=2 732 B11R1.167 NC(=O)C1=C(F)C=CC(Cl)=C1 9136 [0,1,0,0,0,0|1,0,0]=2 733 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 13624 [0,1,0,0,0,0|1,0,0]=2 734 B11R1.167 NC(=O)C1=C(N)C=CC(F)=C1 25959 [0,1,0,0,0,0|1,0,0]=2 735 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl 29043 [0,1,0,0,0,0|2,0,0]=3 736 B11R1.167 NC(=O)C1=CC(Cl)=CC=C1O 25792 [0,1,0,0,0,0|0,0,0]=1 737 B11R1.167 NC(=O)C1=NC(Cl)=CC=C1N 19596 [0,1,0,0,0,0|2,0,0]=3 738 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 3719 [0,1,0,0,0,0|2,0,0]=3 739 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=N1 5708 [0,1,0,0,0,0|3,0,0]=4 740 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 3575 [0,1,0,0,0,0|2,0,0]=3 741 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=N1 5716 [0,1,0,0,0,0|3,0,0]=4 742 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 1322 [0,1,0,0,0,0|2,0,0]=3 743 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 2543 [0,1,0,0,0,0|2,0,0]=3 744 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 15307 [0,1,0,0,0,0|2,0,0]=3 745 B11R1.167 NC1=C([N+](=O)[O-])C=C(Br)C=C1 3817 [0,1,0,0,0,0|3,0,0]=4 746 B11R1.167 NC1=C([N+](=O)[O-])C=C(Cl)C=C1 12851 [0,1,0,0,0,0|3,0,0]=4 747 B11R1.167 NC1=C([N+](=O)[O-])C=C(F)C=C1 3421 [0,1,0,0,0,0|3,0,0]=4 748 B11R1.167 NC1=C([N+](=O)[O-])C=C(I)C=C1 28329 [0,1,0,0,0,0|3,0,0]=4 749 B11R1.167 NC1=C([N+](=O)[O-])C=C(O)C=C1 1481 [0,1,0,0,0,0|3,0,0]=4 750 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=C1 4637 [0,1,0,0,0,0|2,0,0]=3 751 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 4654 [0,1,0,0,0,0|2,0,0]=3 752 B11R1.167 NC1=CC(C(=O)O)=C(Cl)N=C1 34240 [0,1,0,0,0,0|3,0,0]=4 753 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 1325 [0,1,0,0,0,0|2,0,0]=3 754 B11R1.167 NC1=CC([N+](=O)[O-])=C(Br)C=C1 2613 [0,1,0,0,0,0|3,0,0]=4 755 B11R1.167 NC1=CC([N+](=O)[O-])=C(Cl)C=C1 21906 [0,1,0,0,0,0|3,0,0]=4 756 B11R1.167 NC1=CC([N+](=O)[O-])=C(F)C=C1 4475 [0,1,0,0,0,0|3,0,0]=4 757 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O 1249 [0,1,0,0,0,0|3,0,0]=4 758 B11R1.167 NC1=CN=C(F)C=C1C(=O)O 2998 [0,1,0,0,0,0|3,0,0]=4 759 B11R1.167 NC1=NC=C(Br)C(C(=O)O)=C1 9753 [0,1,0,0,0,0|3,0,0]=4 760 B11R1.167 Nc1ccc(O)c(C(=O)O)c1 17623 [0,1,0,0,0,0|1,0,0]=2 761 B11R1.167 O=C(Cl)C1=C(F)C=CC(Cl)=C1 28590 [0,1,0,0,0,0|2,0,0]=3 762 B11R1.167 O=C(Cl)C1=C(F)C=CC(I)=C1 2131 [0,1,0,0,0,0|2,0,0]=3 763 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 3859 [0,1,0,0,0,0|2,0,0]=3 764 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 3584 [0,1,0,0,0,0|2,0,0]=3 765 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 1315 [0,1,0,0,0,0|2,0,0]=3 766 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 3787 [0,1,0,0,0,0|2,0,0]=3 767 B11R1.167 O=C(O)C1=C(Br)C=CC(O)=C1 30462 [0,1,0,0,0,0|2,0,0]=3 768 B11R1.167 O=C(O)C1=C(Br)N=CC(Br)=C1 20950 [0,1,0,0,0,0|3,0,0]=4 769 B11R1.167 O=C(O)C1=C(Br)N=CC(F)=C1 19483 [0,1,0,0,0,0|3,0,0]=4 770 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 3587 [0,1,0,0,0,0|2,0,0]=3 771 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 3685 [0,1,0,0,0,0|2,0,0]=3 772 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 1371 [0,1,0,0,0,0|2,0,0]=3 773 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 3649 [0,1,0,0,0,0|2,0,0]=3 774 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=C1 16487 [0,1,0,0,0,0|2,0,0]=3 775 B11R1.167 O=C(O)C1=C(Cl)N=CC(Br)=C1 12967 [0,1,0,0,0,0|3,0,0]=4 776 B11R1.167 O=C(O)C1=C(Cl)N=CC(Cl)=C1 2601 [0,1,0,0,0,0|3,0,0]=4 777 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 9827 [0,1,0,0,0,0|3,0,0]=4 778 B11R1.167 O=C(O)C1=C(Cl)N=CC(O)=C1 32399 [0,1,0,0,0,0|3,0,0]=4 779 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 1312 [0,1,0,0,0,0|2,0,0]=3 780 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 1375 [0,1,0,0,0,0|2,0,0]=3 781 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 4935 [0,1,0,0,0,0|2,0,0]=3 782 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 1385 [0,1,0,0,0,0|2,0,0]=3 783 B11R1.167 O=C(O)C1=C(F)C=CC(O)=C1 2260 [0,1,0,0,0,0|2,0,0]=3 784 B11R1.167 O=C(O)C1=C(F)N=CC(Br)=C1 17103 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.167 O=C(O)C1=C(F)N=CC(Cl)=C1 14328 [0,1,0,0,0,0|3,0,0]=4 786 B11R1.167 O=C(O)C1=C(F)N=CC(F)=C1 22311 [0,1,0,0,0,0|3,0,0]=4 787 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 3789 [0,1,0,0,0,0|2,0,0]=3 788 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 3818 [0,1,0,0,0,0|2,0,0]=3 789 B11R1.167 O=C(O)C1=C(I)C=CC(F)=C1 1391 [0,1,0,0,0,0|2,0,0]=3 790 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 3838 [0,1,0,0,0,0|2,0,0]=3 791 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 1382 [0,1,0,0,0,0|1,0,0]=2 792 B11R1.167 O=C(O)C1=C(O)C=CC(I)=C1 3889 [0,1,0,0,0,0|1,0,0]=2 793 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 14414 [0,1,0,0,0,0|1,0,0]=2 794 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=C1 2602 [0,1,0,0,0,0|2,0,0]=3 795 B11R1.167 O=C(O)C1=C(O)N=CC(Cl)=C1 12990 [0,1,0,0,0,0|2,0,0]=3 796 B11R1.167 O=C(O)C1=C(O)N=CC(F)=C1 10622 [0,1,0,0,0,0|2,0,0]=3 797 B11R1.167 O=C(O)C1=C(S)C=CC(F)=C1 24688 [0,1,0,0,0,0|1,1,0]=3 798 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl 13559 [0,1,0,0,0,0|3,0,0]=4 799 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1F 2565 [0,1,0,0,0,0|3,0,0]=4 800 B11R1.167 O=C(O)C1=CC(F)=NC=C1Cl 15263 [0,1,0,0,0,0|3,0,0]=4 801 B11R1.167 O=C(O)C1=CC(F)=NC=C1F 22304 [0,1,0,0,0,0|3,0,0]=4 802 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Br 33810 [0,1,0,0,0,0|3,0,0]=4 803 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Cl 29223 [0,1,0,0,0,0|3,0,0]=4 804 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br 22158 [0,1,0,0,0,0|3,0,0]=4 805 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Cl 20339 [0,1,0,0,0,0|3,0,0]=4 806 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F 17057 [0,1,0,0,0,0|3,0,0]=4 807 B11R1.167 O=C(O)C1=NC(F)=CC=C1F 11892 [0,1,0,0,0,0|3,0,0]=4 808 B11R1.167 O=C([O-])C1=C(F)C=CC(F)=C1 28620 [0,1,0,0,0,0|2,0,0]=3 809 B11R1.167 O=C([O-])C1=C(O)C=CC(Br)=C1 25682 [0,1,0,0,0,0|1,0,0]=2 810 B11R1.167 O=C([O-])C1=C(O)C=CC(Br)=C1 26261 [0,1,0,0,0,0|1,0,0]=2 811 B11R1.167 O=C1C=C(C(=O)O)C(O)=CN1 23617 [0,1,0,0,0,0|2,0,0]=3 812 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(Br)=C1 3899 [0,1,0,0,0,0|3,0,0]=4 813 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(F)=C1 1044 [0,1,0,0,0,0|3,0,0]=4 814 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(O)=C1 22664 [0,1,0,0,0,0|3,0,0]=4 815 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(Cl)=C1 10760 [0,1,0,0,0,0|3,0,0]=4 816 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(F)=C1 1049 [0,1,0,0,0,0|3,0,0]=4 817 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(O)=C1 10459 [0,1,0,0,0,0|3,0,0]=4 818 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(Br)=C1 1046 [0,1,0,0,0,0|3,0,0]=4 819 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(Cl)=C1 4347 [0,1,0,0,0,0|3,0,0]=4 820 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(F)=C1 2289 [0,1,0,0,0,0|3,0,0]=4 821 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(I)=C1 28473 [0,1,0,0,0,0|3,0,0]=4 822 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(O)=C1 2151 [0,1,0,0,0,0|3,0,0]=4 823 B11R1.167 O=[N+]([O-])C1=C(I)C=CC(Br)=C1 26443 [0,1,0,0,0,0|3,0,0]=4 824 B11R1.167 O=[N+]([O-])C1=C(I)C=CC(F)=C1 1058 [0,1,0,0,0,0|3,0,0]=4 825 B11R1.167 O=[N+]([O-])C1=C(I)C=CC(I)=C1 17584 [0,1,0,0,0,0|3,0,0]=4 826 B11R1.167 O=[N+]([O-])C1=C(I)C=CC(O)=C1 23788 [0,1,0,0,0,0|3,0,0]=4 827 B11R1.167 O=[N+]([O-])C1=C(O)C=CC(Br)=C1 4099 [0,1,0,0,0,0|2,0,0]=3 828 B11R1.167 O=[N+]([O-])C1=C(O)C=CC(F)=C1 1503 [0,1,0,0,0,0|2,0,0]=3 829 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1O 1176 [0,1,0,0,0,0|3,0,0]=4 830 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1O 6553 [0,1,0,0,0,0|3,0,0]=4 831 B11R1.167 O=[N+]([O-])C1=CC(F)=CN=C1O 2975 [0,1,0,0,0,0|3,0,0]=4 832 B11R1.167 O=[N+]([O-])C1=CC(I)=CN=C1O 27151 [0,1,0,0,0,0|3,0,0]=4 833 B11R1.167 O=[N+]([O-])C1=CC(O)=CN=C1O 5520 [0,1,0,0,0,0|3,0,0]=4 834 B11R1.167 O=[N+]([O-])c1cc(Br)ccc1Cl 21797 [0,1,0,0,0,0|3,0,0]=4 835 B11R1.167 O=[N+]([O-])c1cc(Cl)ccc1Br 3593 [0,1,0,0,0,0|3,0,0]=4 836 B11R1.167 OB(O)C1=C(O)C=CC(Cl)=C1 19653 [0,1,0,0,0,0|2,0,1]=4 837 B11R1.167 OB(O)C1=C(O)C=CC(F)=C1 19871 [0,1,0,0,0,0|2,0,1]=4 838 B11R1.222 CCC(=O)C1=C(F)C=CC=C1 19917 [0,1,0,0,0,0|2,0,0]=3 839 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 21422 [0,1,0,0,0,0|1,0,0]=2 840 B11R1.222 CNC(=O)C1=C(N)N=CC=C1 15000 [0,1,0,0,0,0|2,0,0]=3 841 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 3956 [0,1,0,0,0,0|2,0,0]=3 842 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 17290 [0,1,0,0,0,0|3,0,0]=4 843 B11R1.222 COC(=O)C1=C(C)N=CC=C1 2218 [0,1,0,0,0,0|3,0,0]=4 844 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 3707 [0,1,0,0,0,0|2,0,0]=3 845 B11R1.222 COC(=O)C1=C(Cl)N=CC=C1 15917 [0,1,0,0,0,0|3,0,0]=4 846 B11R1.222 COC(=O)C1=C(F)C=CC=C1 3565 [0,1,0,0,0,0|2,0,0]=3 847 B11R1.222 COC(=O)C1=C(F)N=CC=C1 10628 [0,1,0,0,0,0|3,0,0]=4 848 B11R1.222 COC(=O)C1=C(I)C=CC=C1 10568 [0,1,0,0,0,0|2,0,0]=3 849 B11R1.222 COC(=O)C1=C(N)C=NC=C1 9599 [0,1,0,0,0,0|3,0,0]=4 850 B11R1.222 COC(=O)C1=C(N)C=NC=C1 9760 [0,1,0,0,0,0|3,0,0]=4 851 B11R1.222 COC(=O)C1=C(N)N=CC=C1 16778 [0,1,0,0,0,0|3,0,0]=4 852 B11R1.222 COC(=O)C1=CC=CC=C1C 15492 [0,1,0,0,0,0|2,0,0]=3 853 B11R1.222 COC(=O)C1=CC=CC=C1N 13629 [0,1,0,0,0,0|2,0,0]=3 854 B11R1.222 COC(=O)C1=CC=CC=C1S 10565 [0,1,0,0,0,0|1,1,0]=3 855 B11R1.222 COC(=O)C1=CC=CN=C1Br 14383 [0,1,0,0,0,0|3,0,0]=4 856 B11R1.222 COC(=O)C1=CC=CNC1=O 19579 [0,1,0,0,0,0|2,0,1]=4 857 B11R1.222 COC(=O)C1=CN=CC=C1C 21351 [0,1,0,0,0,0|3,0,0]=4 858 B11R1.222 COC(=O)C1=CN=CC=C1N 25347 [0,1,0,0,0,0|3,0,0]=4 859 B11R1.222 COC(=O)C1=CN=CN=C1O 21479 [0,1,0,0,0,0|3,0,0]=4 860 B11R1.222 COC(=O)C1=NC=CC=C1Cl 32244 [0,1,0,0,0,0|3,0,0]=4 861 B11R1.222 COC(=O)C1=NC=CC=C1O 25563 [0,1,0,0,0,0|2,0,0]=3 862 B11R1.222 NC1=C(C(=O)CBr)C=CC=C1 29244 [0,1,0,0,0,0|2,0,0]=3 863 B11R1.222 NCC(=O)C1=C(Cl)C=CC=C1 29248 [0,1,0,0,0,0|1,0,0]=2 864 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 29130 [0,1,0,0,0,0|1,0,0]=2 865 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 19367 [0,1,0,0,0,0|1,0,2]=4 866 B11R1.222 NC[C@@H](O)C1=C(Cl)C=CC=C1 19368 [0,1,0,0,0,0|1,0,2]=4 867 B11R1.222 NNC(=O)C1=C(Br)C=CC=C1 3742 [0,1,0,0,0,0|1,0,0]=2 868 B11R1.222 NNC(=O)C1=C(F)C=CC=C1 3481 [0,1,0,0,0,0|1,0,0]=2 869 B11R1.222 NNC(=O)C1=CC=CC=C1O 22912 [0,1,0,0,0,0|0,0,0]=1 870 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 16835 [0,1,0,0,0,0|2,0,0]=3 871 B11R1.222 O=C(CBr)c1ccccc1Cl 11080 [0,1,0,0,0,0|2,0,0]=3 872 B11R1.222 O=CC(=O)C1=CC=CCC1=S 12133 [0,1,0,0,0,0|1,1,1]=4 873 B11R2.1 BrC1=CNC2=CC=CC=C12 11087 [0,0,0,1,0,0|3,0,0]=4 874 B11R2.1 BrC1=COC2=C1C=CC=C2 28021 [0,0,0,1,0,0|2,0,0]=3 875 B11R2.1 BrC1=CSC2=C1C=CC=C2 13106 [0,0,0,1,0,0|2,1,0]=4 876 B11R2.1 BrC1=NNC2=CC=CC=C21 11861 [0,0,0,1,0,0|2,0,1]=4 877 B11R2.1 CC1=CCC2=CC=CC=C12 15081 [0,0,0,1,0,0|3,0,0]=4 878 B11R2.1 CC1=CNC2=CC=CC=C12 7505 [0,0,0,1,0,0|3,0,0]=4 879 B11R2.1 CC1=CSC2=C1C=CC=C2 13547 [0,0,0,1,0,0|2,1,0]=4 880 B11R2.1 CC1=NNC2=CC=CC=C21 7820 [0,0,0,1,0,0|2,0,1]=4 881 B11R2.1 ClC1=CNC2=CC=CC=C12 25672 [0,0,0,1,0,0|3,0,0]=4 882 B11R2.1 ClC1=NOC2=C1C=CC=C2 8716 [0,0,0,1,0,0|1,0,1]=3 883 B11R2.1 ClC1=NSC2=C1C=CC=C2 22324 [0,0,0,1,0,0|1,1,1]=4 884 B11R2.1 IC1=NNC2=CC=CC=C21 11868 [0,0,0,1,0,0|2,0,1]=4 885 B11R2.1 NC1=NCc2ccccc21 31698 [0,0,0,1,0,0|2,0,0]=3 886 B11R2.1 NC1=NNC2=C1C=NC=C2 32586 [0,0,0,1,0,0|3,0,0]=4 887 B11R2.1 NC1=NNC2=CC=CC=C21 11848 [0,0,0,1,0,0|2,0,0]=3 888 B11R2.1 NC1=NNC2=CN=CC=C21 33377 [0,0,0,1,0,0|3,0,0]=4 889 B11R2.1 NC1=NNC2=NC=CC=C12 18838 [0,0,0,1,0,0|3,0,0]=4 890 B11R2.1 NC1=NOC2=C1C=CC=C2 14511 [0,0,0,1,0,0|1,0,0]=2 891 B11R2.1 NC1CCC2=CC=CC=C21 10981 [0,0,0,1,0,0|2,0,1]=4 892 B11R2.1 NC1COC2=NC=CC=C21 34572 [0,0,0,1,0,0|2,0,1]=4 893 B11R2.1 NN1N=NC2=C1C=CC=C2 19954 [0,0,0,1,0,0|3,0,0]=4 894 B11R2.1 N[C@@H]1CCC2=CC=CC=C21 21741 [0,0,0,1,0,0|2,0,1]=4 895 B11R2.1 N[C@H]1CCc2ccccc21 12577 [0,0,0,1,0,0|2,0,1]=4 896 B11R2.1 N[C@H]1CCc2ccccc21 23853 [0,0,0,1,0,0|2,0,1]=4 897 B11R2.1 O=C1CCC2=CC=CC=C12 5339 [0,0,0,1,0,0|2,0,0]=3 898 B11R2.1 O=C1CCc2ncccc21 26187 [0,0,0,1,0,0|3,0,0]=4 899 B11R2.1 O=C1COC2=C1C=CC=C2 7023 [0,0,0,1,0,0|1,0,0]=2 900 B11R2.1 O=C1COC2=C1C=NC=C2 24176 [0,0,0,1,0,0|2,0,0]=3 901 B11R2.1 O=C1COC2=CN=CC=C12 24154 [0,0,0,1,0,0|2,0,0]=3 902 B11R2.1 O=C1COC2=NC=CC=C12 24153 [0,0,0,1,0,0|2,0,0]=3 903 B11R2.1 O=C1CSC2=C1C=CC=C2 23797 [0,0,0,1,0,0|1,1,0]=3 904 B11R2.1 O=C1NCC2=CC=CC=C12 25108 [0,0,0,1,0,0|1,0,0]=2 905 B11R2.1 O=C1NN=C2C=CC=CN12 9282 [0,0,0,1,0,0|2,0,0]=3 906 B11R2.1 O=C1NNC2=CC=CC=C12 28083 [0,0,0,1,0,0|1,0,0]=2 907 B11R2.1 O=C1NSC2=C1C=CC=C2 15685 [0,0,0,1,0,0|0,1,0]=2 908 B11R2.1 O=C1OCC2=CC=CC=C12 22169 [0,0,0,1,0,0|2,0,0]=3 909 B11R2.1 O=C1SSC2=C1C=CC=C2 32197 [0,0,0,1,0,0|1,1,0]=3 910 B11R2.1 OC1=CNC2=CC=CC=C12 7264 [0,0,0,1,0,0|2,0,1]=4 911 B11R2.1 OC1=NOC2=C1C=CC=C2 27626 [0,0,0,1,0,0|0,0,2]=3 912 B9R1.41 CC(=O)C1=C(Br)C=CS1 7280 [0,0,0,0,1,0|3,0,0]=4 913 B9R1.41 CC(=O)C1=C(C)C=CS1 5186 [0,0,0,0,1,0|3,0,0]=4 914 B9R1.41 CC(=O)C1=C(I)C=CS1 34469 [0,0,0,0,1,0|3,0,0]=4 915 B9R1.41 CC(=O)C1=C(N)C=CS1 20830 [0,0,0,0,1,0|3,0,0]=4 916 B9R1.41 CC(=O)C1=CC=CN1C 27052 [0,0,0,0,1,0|3,0,0]=4 917 B9R1.41 CC(=O)C1=CNC=C1C 22818 [0,0,0,0,1,0|3,0,0]=4 918 B9R1.41 CC1=C(C(=O)Cl)SC=C1 5561 [0,0,0,0,1,0|3,0,0]=4 919 B9R1.41 CC1=C(C(=O)O)SC=C1 5182 [0,0,0,0,1,0|3,0,0]=4 920 B9R1.41 CC1=C(C(N)=O)SC=C1 16135 [0,0,0,0,1,0|2,0,0]=3 921 B9R1.41 CC1=CSC=C1C(=O)O 24253 [0,0,0,0,1,0|3,0,0]=4 922 B9R1.41 CN1C=CC=C1C(=O)O 9181 [0,0,0,0,1,0|3,0,0]=4 923 B9R1.41 NC(=O)C1=C(Br)C=CS1 16136 [0,0,0,0,1,0|2,0,0]=3 924 B9R1.41 NC(=O)C1=C(N)C=CS1 5242 [0,0,0,0,1,0|2,0,0]=3 925 B9R1.41 NC(=O)C1=C(N)N=CN1 26011 [0,0,0,0,1,0|3,0,0]=4 926 B9R1.41 NC(=O)C1=C(N)NC=N1 14475 [0,0,0,0,1,0|3,0,0]=4 927 B9R1.41 NC(=O)C1=C(N)NC=N1 9129 [0,0,0,0,1,0|3,0,0]=4 928 B9R1.41 NC(=O)C1=C(N)OC=N1 14695 [0,0,0,0,1,0|3,0,0]=4 929 B9R1.41 NC(=O)C1=C(N)SC=N1 25297 [0,0,0,0,1,0|3,0,0]=4 930 B9R1.41 NC(=O)C1=C(N)SN=C1 31704 [0,0,0,0,1,0|3,0,0]=4 931 B9R1.41 NC(=O)C1=C(O)NC=N1 13970 [0,0,0,0,1,0|2,0,0]=3 932 B9R1.41 NC(=O)C1=CC=CN1N 22288 [0,0,0,0,1,0|2,0,0]=3 933 B9R1.41 NC(=O)C1=CNN=C1N 14012 [0,0,0,0,1,0|3,0,0]=4 934 B9R1.41 NC(=O)C1=CNN=C1N 35101 [0,0,0,0,1,0|3,0,0]=4 935 B9R1.41 O=C(Cl)C1=C(Cl)C=CS1 5480 [0,0,0,0,1,0|3,0,0]=4 936 B9R1.41 O=C(O)C1=C(Br)C=CS1 10096 [0,0,0,0,1,0|3,0,0]=4 937 B9R1.41 O=C(O)C1=C(Br)SC=C1 32434 [0,0,0,0,1,0|3,0,0]=4 938 B9R1.41 O=C(O)C1=C(Cl)C=CS1 5491 [0,0,0,0,1,0|3,0,0]=4 939 B9R1.41 O=C(O)C1=C(Cl)SC=C1 32436 [0,0,0,0,1,0|3,0,0]=4 940 B9R1.41 O=C(O)C1=CSC=C1Br 33364 [0,0,0,0,1,0|3,0,0]=4 941 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 23388 [0,0,0,0,0,1|2,0,0]=3 942 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 28140 [0,0,0,0,0,1|2,0,0]=3 943 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 28149 [0,0,0,0,0,1|2,0,0]=3 944 B11R1.86 CC(=O)NC1=C(N)C=NC=C1 9601 [0,0,0,0,0,1|3,0,0]=4 945 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 3830 [0,0,0,0,0,1|1,0,0]=2 946 B11R1.86 CC(=O)NC1=C(O)C=CN=C1 26792 [0,0,0,0,0,1|2,0,0]=3 947 B11R1.86 CC(=O)NC1=C(O)C=NC=C1 26790 [0,0,0,0,0,1|2,0,0]=3 948 B11R1.86 CC(=O)NC1=NC=CC=C1Br 25022 [0,0,0,0,0,1|3,0,0]=4 949 B11R1.86 CC(=O)NC1=NC=CC=C1O 26791 [0,0,0,0,0,1|2,0,0]=3 950 B11R1.86 CC(=O)OC1=C(Br)C=CC=C1 3055 [0,0,0,0,0,1|2,0,0]=3 951 B11R1.86 CC(=O)OC1=C(F)C=CC=C1 3059 [0,0,0,0,0,1|2,0,0]=3 952 B11R1.86 CC(=O)OC1=C(I)C=CC=C1 3062 [0,0,0,0,0,1|2,0,0]=3 953 B11R1.86 CC(C)OC1=C(O)C=CC=C1 13205 [0,0,0,0,0,1|2,0,1]=4 954 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 20124 [0,0,0,0,0,1|2,0,0]=3 955 B11R1.86 CC1=C(CC(N)=O)C=CC=C1 17571 [0,0,0,0,0,1|1,0,0]=2 956 B11R1.86 NC(=S)NC1=C(Br)C=CC=C1 14267 [0,0,0,0,0,1|1,1,0]=3 957 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 7214 [0,0,0,0,0,1|2,0,0]=3 958 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 16509 [0,0,0,0,0,1|2,0,0]=3 959 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 4164 [0,0,0,0,0,1|2,0,0]=3 960 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 2552 [0,0,0,0,0,1|2,0,0]=3 961 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 20030 [0,0,0,0,0,1|1,0,0]=2 962 B8R1.2 BrCC1=CC=CC=C1 13143 [2,0,0,0,0,0|1,0,1]=4 963 B8R1.2 C#CC1=CC=CC=C1 15340 [2,0,0,0,0,0|1,0,1]=4 964 B8R1.2 C=CC1=NC=CC=C1 23910 [2,0,0,0,0,0|2,0,0]=4 965 B8R1.2 COC1=CC=CC=C1 12830 [2,0,0,0,0,0|2,0,0]=4 966 B8R1.2 COC1=CC=CC=C1 17272 [2,0,0,0,0,0|2,0,0]=4 967 B8R1.2 CSC1=CC=CC=C1 10578 [2,0,0,0,0,0|2,0,0]=4 968 B8R1.2 N#Cc1ccccc1 25507 [2,0,0,0,0,0|0,0,2]=4 969 B8R1.2 NCC1=CC=CC=C1 25530 [2,0,0,0,0,0|0,0,1]=3 970 B8R1.2 NCC1=CC=CN=C1 11140 [2,0,0,0,0,0|1,0,1]=4 971 B8R1.2 NCC1=CC=NC=C1 12407 [2,0,0,0,0,0|1,0,1]=4 972 B8R1.2 NCC1=NC=CC=C1 11142 [2,0,0,0,0,0|1,0,1]=4 973 B8R1.2 NNC1=CC=CC=C1 22925 [2,0,0,0,0,0|1,0,0]=3 974 B8R1.2 NNC1=CC=NC=C1 16313 [2,0,0,0,0,0|2,0,0]=4 975 B8R1.2 NNC1=NC=CC=C1 22630 [2,0,0,0,0,0|2,0,0]=4 976 B8R1.2 O=CC1=CC=CN=C1 1124 [2,0,0,0,0,0|1,0,0]=3 977 B8R1.2 O=CC1=CC=CN=N1 23311 [2,0,0,0,0,0|2,0,0]=4 978 B8R1.2 O=CC1=CC=NC=C1 11745 [2,0,0,0,0,0|1,0,0]=3 979 B8R1.2 O=CC1=CN=CN=C1 5298 [2,0,0,0,0,0|2,0,0]=4 980 B8R1.2 O=CC1=NC=CC=C1 11741 [2,0,0,0,0,0|1,0,0]=3 981 B8R1.2 O=CC1=NC=CC=N1 23190 [2,0,0,0,0,0|2,0,0]=4 982 B8R1.2 O=CC1=NC=CN=C1 32140 [2,0,0,0,0,0|2,0,0]=4 983 B8R1.2 SCC1=CC=CC=C1 6835 [2,0,0,0,0,0|0,1,1]=4 984 B8R1.5 BrC1=C(Br)C=CC=C1 3852 [2,0,0,0,0,0|2,0,0]=4 985 B8R1.5 BrC1=C(I)C=CC=C1 19983 [2,0,0,0,0,0|2,0,0]=4 986 B8R1.5 BrC1=C(I)C=CC=C1 2278 [2,0,0,0,0,0|2,0,0]=4 987 B8R1.5 CC1=C(Br)C=CC=C1 3834 [2,0,0,0,0,0|1,0,1]=4 988 B8R1.5 CC1=C(Cl)C=CC=C1 19748 [2,0,0,0,0,0|1,0,1]=4 989 B8R1.5 CC1=C(I)C=CC=C1 9516 [2,0,0,0,0,0|1,0,1]=4 990 B8R1.5 CC1=C(N)C=CN=C1 1119 [2,0,0,0,0,0|2,0,0]=4 991 B8R1.5 CC1=C(N)C=NC=C1 1278 [2,0,0,0,0,0|2,0,0]=4 992 B8R1.5 CC1=C(O)C=NC=C1 15184 [2,0,0,0,0,0|1,0,1]=4 993 B8R1.5 CC1=C(S)C=CC=C1 6806 [2,0,0,0,0,0|0,1,1]=4 994 B8R1.5 CC1=CC=CC=C1N 20202 [2,0,0,0,0,0|1,0,0]=3 995 B8R1.5 CC1=CC=CC=C1O 15714 [2,0,0,0,0,0|0,0,1]=3 996 B8R1.5 CC1=CC=CN=C1N 1217 [2,0,0,0,0,0|2,0,0]=4 997 B8R1.5 CC1=CC=CN=C1O 14401 [2,0,0,0,0,0|1,0,1]=4 998 B8R1.5 CC1=CC=CN=C1O 8871 [2,0,0,0,0,0|1,0,1]=4 999 B8R1.5 CC1=NC=CC=C1N 2076 [2,0,0,0,0,0|2,0,0]=4 1000 B8R1.5 CC1=NC=CC=C1O 6626 [2,0,0,0,0,0|1,0,1]=4 1001 B8R1.5 CN1C=CC=CC1=O 25381 [2,0,0,0,0,0|2,0,0]=4 1002 B8R1.5 ClC1=C(Br)C=CC=C1 3582 [2,0,0,0,0,0|2,0,0]=4 1003 B8R1.5 ClC1=C(Cl)C=CC=C1 16667 [2,0,0,0,0,0|2,0,0]=4 1004 B8R1.5 ClC1=C(I)C=CC=C1 3646 [2,0,0,0,0,0|2,0,0]=4 1005 B8R1.5 FC1=C(Br)C=CC=C1 3215 [2,0,0,0,0,0|2,0,0]=4 1006 B8R1.5 FC1=C(Cl)C=CC=C1 3418 [2,0,0,0,0,0|2,0,0]=4 1007 B8R1.5 FC1=C(F)C=CC=C1 2307 [2,0,0,0,0,0|2,0,0]=4 1008 B8R1.5 FC1=C(I)C=CC=C1 3496 [2,0,0,0,0,0|2,0,0]=4 1009 B8R1.5 FC1=C(S)C=CC=C1 5428 [2,0,0,0,0,0|1,1,0]=4 1010 B8R1.5 IC1=C(I)C=CC=C1 3831 [2,0,0,0,0,0|2,0,0]=4 1011 B8R1.5 NC1=C(Br)C=CC=C1 3722 [2,0,0,0,0,0|1,0,0]=3 1012 B8R1.5 NC1=C(Br)C=CN=C1 6658 [2,0,0,0,0,0|2,0,0]=4 1013 B8R1.5 NC1=C(Br)C=NC=C1 1242 [2,0,0,0,0,0|2,0,0]=4 1014 B8R1.5 NC1=C(Cl)C=CC=C1 19107 [2,0,0,0,0,0|1,0,0]=3 1015 B8R1.5 NC1=C(Cl)C=CN=C1 6665 [2,0,0,0,0,0|2,0,0]=4 1016 B8R1.5 NC1=C(Cl)C=NC=C1 6653 [2,0,0,0,0,0|2,0,0]=4 1017 B8R1.5 NC1=C(F)C=CC=C1 15382 [2,0,0,0,0,0|1,0,0]=3 1018 B8R1.5 NC1=C(F)C=CC=C1 5245 [2,0,0,0,0,0|1,0,0]=3 1019 B8R1.5 NC1=C(F)C=NC=C1 1261 [2,0,0,0,0,0|2,0,0]=4 1020 B8R1.5 NC1=C(F)C=NC=C1 26667 [2,0,0,0,0,0|2,0,0]=4 1021 B8R1.5 NC1=C(I)C=CC=C1 10573 [2,0,0,0,0,0|1,0,0]=3 1022 B8R1.5 NC1=C(I)C=CN=C1 6681 [2,0,0,0,0,0|2,0,0]=4 1023 B8R1.5 NC1=C(I)C=NC=C1 6632 [2,0,0,0,0,0|2,0,0]=4 1024 B8R1.5 NC1=C(N)C=CC=C1 32376 [2,0,0,0,0,0|1,0,0]=3 1025 B8R1.5 NC1=C(N)C=NC=C1 1295 [2,0,0,0,0,0|2,0,0]=4 1026 B8R1.5 NC1=C(O)C=CN=C1 6679 [2,0,0,0,0,0|1,0,0]=3 1027 B8R1.5 NC1=C(O)C=NC=C1 6654 [2,0,0,0,0,0|1,0,0]=3 1028 B8R1.5 NC1=C(S)C=CC=C1 5424 [2,0,0,0,0,0|0,1,0]=3 1029 B8R1.5 NC1=CC=CN=C1Br 5766 [2,0,0,0,0,0|2,0,0]=4 1030 B8R1.5 NC1=CC=CN=C1Cl 1096 [2,0,0,0,0,0|2,0,0]=4 1031 B8R1.5 NC1=CC=CN=C1F 1259 [2,0,0,0,0,0|2,0,0]=4 1032 B8R1.5 NC1=CC=CN=C1I 9292 [2,0,0,0,0,0|2,0,0]=4 1033 B8R1.5 NC1=CC=CN=C1N 1296 [2,0,0,0,0,0|2,0,0]=4 1034 B8R1.5 NC1=CC=CN=C1N 5394 [2,0,0,0,0,0|2,0,0]=4 1035 B8R1.5 NC1=CC=CN=C1O 1263 [2,0,0,0,0,0|1,0,0]=3 1036 B8R1.5 NC1=NC=CC=C1Br 1241 [2,0,0,0,0,0|2,0,0]=4 1037 B8R1.5 NC1=NC=CC=C1Cl 5562 [2,0,0,0,0,0|2,0,0]=4 1038 B8R1.5 NC1=NC=CC=C1F 2976 [2,0,0,0,0,0|2,0,0]=4 1039 B8R1.5 NC1=NC=CC=C1I 1265 [2,0,0,0,0,0|2,0,0]=4 1040 B8R1.5 NC1=NC=CC=C1O 2574 [2,0,0,0,0,0|1,0,0]=3 1041 B8R1.5 NC1=NC=CC=C1S 16432 [2,0,0,0,0,0|1,1,0]=4 1042 B8R1.5 NC1=NC=CN=C1O 27948 [2,0,0,0,0,0|2,0,0]=4 1043 B8R1.5 Nc1ccccc1N 23346 [2,0,0,0,0,0|1,0,0]=3 1044 B8R1.5 O=C1C=COC=C1O 25209 [2,0,0,0,0,0|1,0,0]=3 1045 B8R1.5 OC1=C(Br)C=CC=C1 3841 [2,0,0,0,0,0|1,0,0]=3 1046 B8R1.5 OC1=C(Br)C=CN=C1 6661 [2,0,0,0,0,0|2,0,0]=4 1047 B8R1.5 OC1=C(Br)C=NC=C1 6678 [2,0,0,0,0,0|2,0,0]=4 1048 B8R1.5 OC1=C(Cl)C=CC=C1 12600 [2,0,0,0,0,0|1,0,0]=3 1049 B8R1.5 OC1=C(Cl)C=CN=C1 6669 [2,0,0,0,0,0|2,0,0]=4 1050 B8R1.5 OC1=C(Cl)C=NC=C1 6680 [2,0,0,0,0,0|2,0,0]=4 1051 B8R1.5 OC1=C(F)C=CC=C1 2313 [2,0,0,0,0,0|1,0,0]=3 1052 B8R1.5 OC1=C(I)C=CC=C1 3963 [2,0,0,0,0,0|1,0,0]=3 1053 B8R1.5 OC1=C(S)C=CC=C1 6827 [2,0,0,0,0,0|0,1,0]=3 1054 B8R1.5 OC1=CC=CN=C1Br 2572 [2,0,0,0,0,0|2,0,0]=4 1055 B8R1.5 OC1=CC=CN=C1Cl 2577 [2,0,0,0,0,0|2,0,0]=4 1056 B8R1.5 OC1=CC=CN=C1F 6290 [2,0,0,0,0,0|2,0,0]=4 1057 B8R1.5 OC1=CC=CN=C1I 6571 [2,0,0,0,0,0|2,0,0]=4 1058 B8R1.5 OC1=CC=CN=C1O 2580 [2,0,0,0,0,0|1,0,1]=4 1059 B8R1.5 OC1=NC=CC=C1Br 1177 [2,0,0,0,0,0|2,0,0]=4 1060 B8R1.5 OC1=NC=CC=C1Cl 6538 [2,0,0,0,0,0|2,0,0]=4 1061 B8R1.5 OC1=NC=CC=C1F 1200 [2,0,0,0,0,0|2,0,0]=4 1062 B8R1.5 OC1=NC=CC=C1I 6701 [2,0,0,0,0,0|2,0,0]=4 1063 B8R1.5 SC1=C(Br)C=CC=C1 4009 [2,0,0,0,0,0|1,1,0]=4 1064 B8R1.5 SC1=C(Cl)C=CC=C1 6776 [2,0,0,0,0,0|1,1,0]=4 1065 B8R1.5 [O-][N+]1=CC=CC=C1O 26927 [2,0,0,0,0,0|1,0,1]=4 1066 B10R1.13 C=C(C)C1=CC=C(O)C=C1 27834 [1,1,0,0,0,0|2,0,0]=4 1067 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 3294 [1,1,0,0,0,0|1,0,0]=3 1068 B10R1.13 CC(=O)C1=CC=C(C)C=C1 3326 [1,1,0,0,0,0|1,0,0]=3 1069 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 3297 [1,1,0,0,0,0|1,0,0]=3 1070 B10R1.13 CC(=O)C1=CC=C(F)C=C1 10587 [1,1,0,0,0,0|1,0,0]=3 1071 B10R1.13 CC(=O)C1=CC=C(I)C=C1 3323 [1,1,0,0,0,0|1,0,0]=3 1072 B10R1.13 CC(=O)C1=CC=C(N)C=C1 3288 [1,1,0,0,0,0|1,0,0]=3 1073 B10R1.13 CC(=O)C1=CC=C(O)C=C1 3311 [1,1,0,0,0,0|1,0,0]=3 1074 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 5959 [1,1,0,0,0,0|2,0,0]=4 1075 B10R1.13 CC(=O)C1=CN=C(C)C=C1 14412 [1,1,0,0,0,0|2,0,0]=4 1076 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 14411 [1,1,0,0,0,0|2,0,0]=4 1077 B10R1.13 CC(=O)C1=CN=C(O)C=C1 29236 [1,1,0,0,0,0|2,0,0]=4 1078 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 20326 [1,1,0,0,0,0|2,0,0]=4 1079 B10R1.13 CC(=O)C1=NC=C(C)C=C1 16371 [1,1,0,0,0,0|2,0,0]=4 1080 B10R1.13 CC(=O)C1=NC=C(N)C=C1 33797 [1,1,0,0,0,0|2,0,0]=4 1081 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 27544 [1,1,0,0,0,0|1,0,1]=4 1082 B10R1.13 CC(N)C1=CC=C(F)C=C1 3425 [1,1,0,0,0,0|1,0,1]=4 1083 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 15455 [1,1,0,0,0,0|1,0,0]=3 1084 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15433 [1,1,0,0,0,0|1,0,0]=3 1085 B10R1.13 CC1=CC=C(C(N)=O)C=C1 27569 [1,1,0,0,0,0|0,0,0]=2 1086 B10R1.13 CC1=CC=C(C(O)=S)C=C1 10665 [1,1,0,0,0,0|1,0,1]=4 1087 B10R1.13 CC1=CC=C(S(=O)O)C=C1 35986 [1,1,0,0,0,0|2,0,0]=4 1088 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 35988 [1,1,0,0,0,0|2,0,0]=4 1089 B10R1.13 CC1=CN=C(C(=O)O)C=C1 22648 [1,1,0,0,0,0|2,0,0]=4 1090 B10R1.13 CC1=NC=C(C(=O)O)C=C1 1218 [1,1,0,0,0,0|2,0,0]=4 1091 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 15222 [1,1,0,0,0,0|1,0,1]=4 1092 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 15219 [1,1,0,0,0,0|1,0,1]=4 1093 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 2454 [1,1,0,0,0,0|1,0,1]=4 1094 B10R1.13 C[C@@H](N)c1ccc(Br)cc1 14234 [1,1,0,0,0,0|1,0,1]=4 1095 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 15221 [1,1,0,0,0,0|1,0,1]=4 1096 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 15218 [1,1,0,0,0,0|1,0,1]=4 1097 B10R1.13 C[C@H](N)c1ccc(Br)cc1 5736 [1,1,0,0,0,0|1,0,1]=4 1098 B10R1.13 Cc1ccc([C@@H](C)N)cc1 8021 [1,1,0,0,0,0|1,0,1]=4 1099 B10R1.13 Cc1ccc([S@@](N)=O)cc1 9914 [1,1,0,0,0,0|1,0,0]=3 1100 B10R1.13 Cc1ccc([S@](N)=O)cc1 9913 [1,1,0,0,0,0|1,0,0]=3 1101 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 25824 [1,1,0,0,0,0|1,0,0]=3 1102 B10R1.13 N=C(N)C1=CC=C(N)C=C1 13445 [1,1,0,0,0,0|1,0,0]=3 1103 B10R1.13 N=C(N)C1=CC=C(O)C=C1 18174 [1,1,0,0,0,0|1,0,0]=3 1104 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 3737 [1,1,0,0,0,0|0,0,0]=2 1105 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 3619 [1,1,0,0,0,0|0,0,0]=2 1106 B10R1.13 NC(=O)C1=CC=C(Cl)N=N1 35945 [1,1,0,0,0,0|2,0,0]=4 1107 B10R1.13 NC(=O)C1=CC=C(F)C=C1 3407 [1,1,0,0,0,0|0,0,0]=2 1108 B10R1.13 NC(=O)C1=CC=C(N)C=C1 35461 [1,1,0,0,0,0|0,0,0]=2 1109 B10R1.13 NC(=O)C1=NC=C(Cl)N=C1 32127 [1,1,0,0,0,0|2,0,0]=4 1110 B10R1.13 NC(=O)C1=NC=C(N)C=C1 17853 [1,1,0,0,0,0|1,0,0]=3 1111 B10R1.13 NC(=O)C1=NC=C(N)C=N1 25348 [1,1,0,0,0,0|2,0,0]=4 1112 B10R1.13 NC(=O)C1=NC=C(N)N=C1 32178 [1,1,0,0,0,0|2,0,0]=4 1113 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 10912 [1,1,0,0,0,0|0,1,0]=3 1114 B10R1.13 NC(=S)C1=CC=C(N)C=C1 13560 [1,1,0,0,0,0|0,1,0]=3 1115 B10R1.13 NC(=S)C1=CC=C(O)C=C1 13555 [1,1,0,0,0,0|0,1,0]=3 1116 B10R1.13 NC1=CC=C(C(=O)O)C=C1 13422 [1,1,0,0,0,0|1,0,0]=3 1117 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 2098 [1,1,0,0,0,0|2,0,0]=4 1118 B10R1.13 NC1=CN=C(C(=O)O)C=C1 15896 [1,1,0,0,0,0|2,0,0]=4 1119 B10R1.13 NC1=CN=C(C(=O)O)C=C1 17661 [1,1,0,0,0,0|2,0,0]=4 1120 B10R1.13 NC1=NC=C(C(=O)O)C=C1 2417 [1,1,0,0,0,0|2,0,0]=4 1121 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 16513 [1,1,0,0,0,0|1,0,0]=3 1122 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 14145 [1,1,0,0,0,0|1,0,0]=3 1123 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 19744 [1,1,0,0,0,0|1,0,0]=3 1124 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 27236 [1,1,0,0,0,0|1,0,0]=3 1125 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 18665 [1,1,0,0,0,0|2,0,0]=4 1126 B10R1.13 O=C(Cl)C1=CN=C(F)C=C1 5141 [1,1,0,0,0,0|2,0,0]=4 1127 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 3741 [1,1,0,0,0,0|1,0,0]=3 1128 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 8985 [1,1,0,0,0,0|1,0,0]=3 1129 B10R1.13 O=C(O)C1=CC=C(F)C=C1 8221 [1,1,0,0,0,0|1,0,0]=3 1130 B10R1.13 O=C(O)C1=CC=C(I)C=C1 3928 [1,1,0,0,0,0|1,0,0]=3 1131 B10R1.13 O=C(O)C1=CC=C(O)C=C1 16819 [1,1,0,0,0,0|1,0,0]=3 1132 B10R1.13 O=C(O)C1=CC=C(S)C=C1 6842 [1,1,0,0,0,0|1,0,0]=3 1133 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 1122 [1,1,0,0,0,0|2,0,0]=4 1134 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 2600 [1,1,0,0,0,0|2,0,0]=4 1135 B10R1.13 O=C(O)C1=CN=C(F)C=C1 1121 [1,1,0,0,0,0|2,0,0]=4 1136 B10R1.13 O=C(O)C1=CN=C(O)C=C1 15641 [1,1,0,0,0,0|2,0,0]=4 1137 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 9212 [1,1,0,0,0,0|2,0,0]=4 1138 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 10379 [1,1,0,0,0,0|2,0,0]=4 1139 B10R1.13 O=C(O)C1=NC=C(F)C=C1 14387 [1,1,0,0,0,0|2,0,0]=4 1140 B10R1.13 O=C(O)C1=NC=C(I)C=C1 27836 [1,1,0,0,0,0|2,0,0]=4 1141 B10R1.13 O=C(O)C1=NC=C(O)C=C1 10094 [1,1,0,0,0,0|2,0,0]=4 1142 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 24616 [1,1,0,0,0,0|2,0,0]=4 1143 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 2286 [1,1,0,0,0,0|2,0,0]=4 1144 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 4436 [1,1,0,0,0,0|2,0,0]=4 1145 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 19727 [1,1,0,0,0,0|2,0,0]=4 1146 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 5422 [1,1,0,0,0,0|2,0,0]=4 1147 B10R1.13 O=[N+]([O-])c1ccc(Br)cc1 27491 [1,1,0,0,0,0|2,0,0]=4 1148 B10R1.15 C=CC(=O)C1=CC=CC=C1 19662 [1,1,0,0,0,0|1,0,0]=3 1149 B10R1.15 C=CS(=O)C1=CC=CC=C1 15339 [1,1,0,0,0,0|2,0,0]=4 1150 B10R1.15 CC(CN)C1=CC=CC=C1 16143 [1,1,0,0,0,0|1,0,1]=4 1151 B10R1.15 CCC(=O)C1=CC=CN=C1 27239 [1,1,0,0,0,0|2,0,0]=4 1152 B10R1.15 CCC(N)C1=CC=CC=C1 21078 [1,1,0,0,0,0|1,0,1]=4 1153 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 5668 [1,1,0,0,0,0|1,0,1]=4 1154 B10R1.15 CNC(=O)C1=CC=CC=C1 35135 [1,1,0,0,0,0|0,0,0]=2 1155 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 18717 [1,1,0,0,0,0|1,0,1]=4 1156 B10R1.15 COC(=O)C1=CC=NC=C1 11729 [1,1,0,0,0,0|2,0,0]=4 1157 B10R1.15 COC(=O)C1=CN=CC=C1 11724 [1,1,0,0,0,0|2,0,0]=4 1158 B10R1.15 COC(=O)C1=NC=CC=C1 15906 [1,1,0,0,0,0|2,0,0]=4 1159 B10R1.15 C[C@H](CN)C1=CC=CC=C1 21084 [1,1,0,0,0,0|1,0,1]=4 1160 B10R1.15 N#CC(N)c1ccccc1 28208 [1,1,0,0,0,0|1,0,1]=4 1161 B10R1.15 NCC(=O)C1=CC=CC=C1 10002 [1,1,0,0,0,0|0,0,0]=2 1162 B10R1.15 NCC(=O)C1=CC=CC=C1 21792 [1,1,0,0,0,0|0,0,0]=2 1163 B10R1.15 NCC(=O)C1=CC=CC=C1 3247 [1,1,0,0,0,0|0,0,0]=2 1164 B10R1.15 NCC(O)C1=CC=CC=C1 44911 [1,1,0,0,0,0|0,0,2]=4 1165 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 13836 [1,1,0,0,0,0|0,0,2]=4 1166 B10R1.15 NC[C@H](O)C1=CC=CC=C1 14747 [1,1,0,0,0,0|0,0,2]=4 1167 B10R1.15 NNC(=O)C1=CN=CN=C1 25061 [1,1,0,0,0,0|2,0,0]=4 1168 B10R1.15 NNC(=O)C1=NC=CC=C1 23651 [1,1,0,0,0,0|1,0,0]=3 1169 B10R1.15 NNC(=O)c1ccccc1 21535 [1,1,0,0,0,0|0,0,0]=2 1170 B10R1.15 N[C@@H](CO)c1ccccc1 6081 [1,1,0,0,0,0|0,0,2]=4 1171 B10R1.15 N[C@H](CO)c1ccccc1 6080 [1,1,0,0,0,0|0,0,2]=4 1172 B10R1.15 N\C(=N/O)C1=CC=CC=C1 12481 [1,1,0,0,0,0|0,0,1]=3 1173 B10R1.15 O=C(CBr)C1=CC=CC=C1 3257 [1,1,0,0,0,0|1,0,0]=3 1174 B10R1.15 O=C(CBr)C1=NC=CC=C1 21374 [1,1,0,0,0,0|2,0,0]=4 1175 B10R1.15 O=C(CCl)C1=CC=CC=C1 29268 [1,1,0,0,0,0|1,0,0]=3 1176 B10R1.15 O=C(CF)C1=CC=CC=C1 3472 [1,1,0,0,0,0|1,0,0]=3 1177 B10R1.15 O=C(CO)C1=CC=CC=C1 23011 [1,1,0,0,0,0|1,0,0]=3 1178 B10R1.28 CC(C)(N)C1=CC=CC=C1 19654 [1,1,0,0,0,0|1,0,1]=4 1179 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 10862 [1,1,0,0,0,0|2,0,0]=4 1180 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 23308 [1,1,0,0,0,0|2,0,0]=4 1181 B10R1.28 O=P(Cl)(Cl)C1=CC=CC=C1 6464 [1,1,0,0,0,0|2,0,0]=4 1182 B10R1.28 O=P(O)(O)C1=CC=CC=C1 21303 [1,1,0,0,0,0|2,0,0]=4 1183 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 10441 [1,1,0,0,0,0|2,0,0]=4 1184 B10R1.28 O=S(=O)(F)C1=CC=CC=C1 14507 [1,1,0,0,0,0|2,0,0]=4 1185 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 21767 [1,1,0,0,0,0|2,0,0]=4 1186 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 3087 [1,1,0,0,0,0|1,0,0]=3 1187 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 15626 [1,1,0,0,0,0|2,0,0]=4 1188 B10R1.113 CC(=O)C1=CC(C)=CC=C1 4279 [1,1,0,0,0,0|1,0,0]=3 1189 B10R1.113 CC(=O)C1=CC(C)=CN=C1 26484 [1,1,0,0,0,0|2,0,0]=4 1190 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 27309 [1,1,0,0,0,0|1,0,0]=3 1191 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 3085 [1,1,0,0,0,0|1,0,0]=3 1192 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 6177 [1,1,0,0,0,0|2,0,0]=4 1193 B10R1.113 CC(=O)C1=CC(F)=CC=C1 4232 [1,1,0,0,0,0|1,0,0]=3 1194 B10R1.113 CC(=O)C1=CC(F)=CN=C1 34208 [1,1,0,0,0,0|2,0,0]=4 1195 B10R1.113 CC(=O)C1=CC(I)=CC=C1 3895 [1,1,0,0,0,0|1,0,0]=3 1196 B10R1.113 CC(=O)C1=CC(N)=CC=C1 6391 [1,1,0,0,0,0|1,0,0]=3 1197 B10R1.113 CC(=O)C1=CC(O)=CC=C1 3284 [1,1,0,0,0,0|1,0,0]=3 1198 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 13351 [1,1,0,0,0,0|2,0,0]=4 1199 B10R1.113 CC(=O)C1=NC(C)=CC=C1 9826 [1,1,0,0,0,0|2,0,0]=4 1200 B10R1.113 CC(=O)C1=NC=CC(C)=C1 4045 [1,1,0,0,0,0|2,0,0]=4 1201 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 19518 [1,1,0,0,0,0|2,0,0]=4 1202 B10R1.113 CC(N)C1=CC(F)=CC=C1 24339 [1,1,0,0,0,0|1,0,1]=4 1203 B10R1.113 CC1=CC(C(=O)Cl)=CN=C1 14338 [1,1,0,0,0,0|2,0,0]=4 1204 B10R1.113 CC1=CC(C(=O)O)=CC=C1 15435 [1,1,0,0,0,0|1,0,0]=3 1205 B10R1.113 CC1=CC(C(=O)O)=CN=C1 11961 [1,1,0,0,0,0|2,0,0]=4 1206 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 15456 [1,1,0,0,0,0|1,0,0]=3 1207 B10R1.113 CC1=CC=CC(C(=O)O)=N1 12414 [1,1,0,0,0,0|2,0,0]=4 1208 B10R1.113 CC1=CC=CC(C(=O)O)=N1 18834 [1,1,0,0,0,0|2,0,0]=4 1209 B10R1.113 CC1=CC=CC(C(O)=S)=C1 28685 [1,1,0,0,0,0|1,0,1]=4 1210 B10R1.113 CC1=NC=CC(C(=O)O)=C1 13978 [1,1,0,0,0,0|2,0,0]=4 1211 B10R1.113 C[C@@H](N)C1=CC(Cl)=CC=C1 24741 [1,1,0,0,0,0|1,0,1]=4 1212 B10R1.113 C[C@@H](N)C1=CC(F)=CC=C1 24730 [1,1,0,0,0,0|1,0,1]=4 1213 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 14235 [1,1,0,0,0,0|1,0,1]=4 1214 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 24746 [1,1,0,0,0,0|1,0,1]=4 1215 B10R1.113 C[C@H](N)C1=CC(Cl)=CC=C1 24735 [1,1,0,0,0,0|1,0,1]=4 1216 B10R1.113 C[C@H](N)C1=CC(F)=CC=C1 25216 [1,1,0,0,0,0|1,0,1]=4 1217 B10R1.113 N=C(N)C1=CC(Br)=CC=C1 25825 [1,1,0,0,0,0|1,0,0]=3 1218 B10R1.113 N=C(N)C1=CC(Br)=CC=C1 25933 [1,1,0,0,0,0|1,0,0]=3 1219 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 3734 [1,1,0,0,0,0|0,0,0]=2 1220 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 16641 [1,1,0,0,0,0|1,0,0]=3 1221 B10R1.113 NC(=O)C1=CC(Cl)=CC=C1 3618 [1,1,0,0,0,0|0,0,0]=2 1222 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 16074 [1,1,0,0,0,0|1,0,0]=3 1223 B10R1.113 NC(=O)C1=CC(I)=CC=C1 3301 [1,1,0,0,0,0|0,0,0]=2 1224 B10R1.113 NC(=O)C1=CC(N)=CC=C1 28767 [1,1,0,0,0,0|0,0,0]=2 1225 B10R1.113 NC(=O)C1=CC(N)=NC=C1 16603 [1,1,0,0,0,0|1,0,0]=3 1226 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 1212 [1,1,0,0,0,0|1,0,0]=3 1227 B10R1.113 NC(=O)C1=NC(Cl)=CN=C1 32143 [1,1,0,0,0,0|2,0,0]=4 1228 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 9223 [1,1,0,0,0,0|1,0,0]=3 1229 B10R1.113 NC(=O)C1=NC=CC(F)=C1 14534 [1,1,0,0,0,0|1,0,0]=3 1230 B10R1.113 NC(=S)C1=CC(Cl)=CC=C1 20134 [1,1,0,0,0,0|0,1,0]=3 1231 B10R1.113 NC(=S)C1=CC(F)=CC=C1 35675 [1,1,0,0,0,0|0,1,0]=3 1232 B10R1.113 NC1=CC(C(=O)O)=CN=C1 15914 [1,1,0,0,0,0|2,0,0]=4 1233 B10R1.113 NC1=CC(C(=O)O)=NC=C1 22241 [1,1,0,0,0,0|2,0,0]=4 1234 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 24745 [1,1,0,0,0,0|2,0,0]=4 1235 B10R1.113 NC1=CC=CC(C(=O)O)=N1 7686 [1,1,0,0,0,0|2,0,0]=4 1236 B10R1.113 NC1=NC=CC(C(=O)O)=C1 2426 [1,1,0,0,0,0|2,0,0]=4 1237 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 13574 [1,1,0,0,0,0|1,0,0]=3 1238 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 16064 [1,1,0,0,0,0|2,0,0]=4 1239 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 19742 [1,1,0,0,0,0|1,0,0]=3 1240 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 3740 [1,1,0,0,0,0|1,0,0]=3 1241 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 9211 [1,1,0,0,0,0|2,0,0]=4 1242 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 8991 [1,1,0,0,0,0|1,0,0]=3 1243 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 2598 [1,1,0,0,0,0|2,0,0]=4 1244 B10R1.113 O=C(O)C1=CC(F)=CC=C1 3480 [1,1,0,0,0,0|1,0,0]=3 1245 B10R1.113 O=C(O)C1=CC(F)=NC=C1 3548 [1,1,0,0,0,0|2,0,0]=4 1246 B10R1.113 O=C(O)C1=CC(I)=CC=C1 3925 [1,1,0,0,0,0|1,0,0]=3 1247 B10R1.113 O=C(O)C1=CC(I)=NC=C1 16692 [1,1,0,0,0,0|2,0,0]=4 1248 B10R1.113 O=C(O)C1=CC(O)=CC=C1 9161 [1,1,0,0,0,0|1,0,0]=3 1249 B10R1.113 O=C(O)C1=CC(O)=NC=C1 16780 [1,1,0,0,0,0|2,0,0]=4 1250 B10R1.113 O=C(O)C1=CC(S)=CC=C1 5566 [1,1,0,0,0,0|1,0,0]=3 1251 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 29232 [1,1,0,0,0,0|2,0,0]=4 1252 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 9222 [1,1,0,0,0,0|2,0,0]=4 1253 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 1211 [1,1,0,0,0,0|2,0,0]=4 1254 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 11089 [1,1,0,0,0,0|2,0,0]=4 1255 B10R1.113 O=C(O)C1=CN=CC(F)=C1 10942 [1,1,0,0,0,0|2,0,0]=4 1256 B10R1.113 O=C(O)C1=CN=CC(O)=C1 2415 [1,1,0,0,0,0|2,0,0]=4 1257 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 2422 [1,1,0,0,0,0|2,0,0]=4 1258 B10R1.113 O=C(O)C1=NC(F)=CC=C1 13570 [1,1,0,0,0,0|2,0,0]=4 1259 B10R1.113 O=C(O)C1=NC(I)=CC=C1 9290 [1,1,0,0,0,0|2,0,0]=4 1260 B10R1.113 O=C(O)C1=NC(O)=CC=C1 2421 [1,1,0,0,0,0|2,0,0]=4 1261 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 4064 [1,1,0,0,0,0|2,0,0]=4 1262 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 12731 [1,1,0,0,0,0|2,0,0]=4 1263 B10R1.113 O=C(O)C1=NC=CC(I)=C1 27885 [1,1,0,0,0,0|2,0,0]=4 1264 B10R1.113 O=C(O)C1=NC=CC(O)=C1 17131 [1,1,0,0,0,0|2,0,0]=4 1265 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 26798 [1,1,0,0,0,0|2,0,0]=4 1266 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 3820 [1,1,0,0,0,0|2,0,0]=4 1267 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 10642 [1,1,0,0,0,0|2,0,0]=4 1268 B10R1.113 O=[N+]([O-])C1=CC=CC(I)=C1 3954 [1,1,0,0,0,0|2,0,0]=4 1269 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 17999 [1,1,0,0,0,0|2,0,0]=4 1270 B10R1.2 CC1=C(Br)C=CN=C1C=O 27808 [1,1,0,0,0,0|2,0,0]=4 1271 B10R1.2 CC1=C(C=O)C=CC=C1Br 30964 [1,1,0,0,0,0|1,0,0]=3 1272 B10R1.2 CC1=C(C=O)C=CC=C1Cl 28399 [1,1,0,0,0,0|1,0,0]=3 1273 B10R1.2 CC1=C(C=O)C=CC=C1F 1453 [1,1,0,0,0,0|1,0,0]=3 1274 B10R1.2 CC1=C(C=O)C=CC=C1O 30949 [1,1,0,0,0,0|1,0,0]=3 1275 B10R1.2 CC1=C(C=O)C=CN=C1Cl 33749 [1,1,0,0,0,0|2,0,0]=4 1276 B10R1.2 CC1=C(Cl)C=CN=C1C=O 33533 [1,1,0,0,0,0|2,0,0]=4 1277 B10R1.2 CC1=CC=CC(C=O)=C1Br 30978 [1,1,0,0,0,0|1,0,0]=3 1278 B10R1.2 CC1=CC=CC(C=O)=C1C 3080 [1,1,0,0,0,0|1,0,0]=3 1279 B10R1.2 CC1=CC=CC(C=O)=C1Cl 28398 [1,1,0,0,0,0|1,0,0]=3 1280 B10R1.2 CC1=CC=CC(C=O)=C1F 1450 [1,1,0,0,0,0|1,0,0]=3 1281 B10R1.2 CC1=CC=CC(C=O)=C1O 14264 [1,1,0,0,0,0|0,0,0]=2 1282 B10R1.2 CC1=CC=CC(CN)=C1Cl 31260 [1,1,0,0,0,0|1,0,1]=4 1283 B10R1.2 CC1=CC=CC(CN)=C1F 31262 [1,1,0,0,0,0|1,0,1]=4 1284 B10R1.2 CC1=CC=CC(NN)=C1C 6398 [1,1,0,0,0,0|2,0,0]=4 1285 B10R1.2 CCC1=C(O)C(O)=CC=C1 33193 [1,1,0,0,0,0|1,0,1]=4 1286 B10R1.2 CCC1=CC=CC(Br)=C1O 33831 [1,1,0,0,0,0|1,0,1]=4 1287 B10R1.2 CCC1=CC=CC(Cl)=C1O 27841 [1,1,0,0,0,0|1,0,1]=4 1288 B10R1.2 COC1=CC=CC(Br)=C1O 33838 [1,1,0,0,0,0|2,0,0]=4 1289 B10R1.2 COC1=CC=CC(Cl)=C1O 28111 [1,1,0,0,0,0|2,0,0]=4 1290 B10R1.2 COC1=CC=CC(F)=C1O 3878 [1,1,0,0,0,0|2,0,0]=4 1291 B10R1.2 COC1=CC=CC(N)=C1O 33268 [1,1,0,0,0,0|2,0,0]=4 1292 B10R1.2 N#CC1=C(O)C(Br)=CC=C1 30801 [1,1,0,0,0,0|0,0,2]=4 1293 B10R1.2 N#CC1=C(O)C(Cl)=CC=C1 27384 [1,1,0,0,0,0|0,0,2]=4 1294 B10R1.2 N#CC1=C(O)C(F)=CC=C1 33421 [1,1,0,0,0,0|0,0,2]=4 1295 B10R1.2 N#CC1=C(O)C(N)=CC=C1 28119 [1,1,0,0,0,0|0,0,2]=4 1296 B10R1.2 N#CC1=C(O)C(O)=CC=C1 28105 [1,1,0,0,0,0|0,0,2]=4 1297 B10R1.2 NCC1=C(Cl)C(Cl)=CC=C1 16713 [1,1,0,0,0,0|1,0,1]=4 1298 B10R1.2 NCC1=C(Cl)C(F)=CC=C1 31240 [1,1,0,0,0,0|1,0,1]=4 1299 B10R1.2 NCC1=C(F)C(Cl)=CC=C1 25441 [1,1,0,0,0,0|1,0,1]=4 1300 B10R1.2 NCC1=C(F)C(F)=CC=C1 7356 [1,1,0,0,0,0|1,0,1]=4 1301 B10R1.2 NNC1=C(Cl)C(Cl)=CC=C1 7561 [1,1,0,0,0,0|2,0,0]=4 1302 B10R1.2 NNC1=C(F)C(Cl)=CC=C1 1081 [1,1,0,0,0,0|2,0,0]=4 1303 B10R1.2 O=CC1=C(Br)C(Br)=CC=C1 29209 [1,1,0,0,0,0|1,0,0]=3 1304 B10R1.2 O=CC1=C(Br)C(Cl)=CC=C1 27512 [1,1,0,0,0,0|1,0,0]=3 1305 B10R1.2 O=CC1=C(Br)C(F)=CC=C1 1417 [1,1,0,0,0,0|1,0,0]=3 1306 B10R1.2 O=CC1=C(Br)C(O)=CC=C1 20855 [1,1,0,0,0,0|1,0,0]=3 1307 B10R1.2 O=CC1=C(Cl)C(Cl)=CC=C1 3079 [1,1,0,0,0,0|1,0,0]=3 1308 B10R1.2 O=CC1=C(Cl)C(Cl)=NC=C1 17122 [1,1,0,0,0,0|2,0,0]=4 1309 B10R1.2 O=CC1=C(Cl)C(F)=CC=C1 1432 [1,1,0,0,0,0|1,0,0]=3 1310 B10R1.2 O=CC1=C(F)C(Br)=CC=C1 22500 [1,1,0,0,0,0|1,0,0]=3 1311 B10R1.2 O=CC1=C(F)C(Cl)=CC=C1 1408 [1,1,0,0,0,0|1,0,0]=3 1312 B10R1.2 O=CC1=C(F)C(Cl)=NC=C1 5088 [1,1,0,0,0,0|2,0,0]=4 1313 B10R1.2 O=CC1=C(F)C(F)=CC=C1 1436 [1,1,0,0,0,0|1,0,0]=3 1314 B10R1.2 O=CC1=C(F)C(O)=CC=C1 27364 [1,1,0,0,0,0|1,0,0]=3 1315 B10R1.2 O=CC1=C(I)C(F)=CC=C1 1439 [1,1,0,0,0,0|1,0,0]=3 1316 B10R1.2 O=CC1=C(O)C(Br)=CC=C1 17016 [1,1,0,0,0,0|0,0,0]=2 1317 B10R1.2 O=CC1=C(O)C(Cl)=CC=C1 13405 [1,1,0,0,0,0|0,0,0]=2 1318 B10R1.2 O=CC1=C(O)C(Cl)=NC=C1 33694 [1,1,0,0,0,0|1,0,0]=3 1319 B10R1.2 O=CC1=C(O)C(F)=CC=C1 4215 [1,1,0,0,0,0|0,0,0]=2 1320 B10R1.2 O=CC1=C(O)C(I)=CC=C1 33715 [1,1,0,0,0,0|0,0,0]=2 1321 B10R1.2 O=CC1=C(O)C(O)=CC=C1 6561 [1,1,0,0,0,0|0,0,0]=2 1322 B10R1.2 O=CC1=CN=CC(Br)=C1Cl 34832 [1,1,0,0,0,0|2,0,0]=4 1323 B10R1.4 CCOC1=C(O)C=CC=C1 9505 [1,1,0,0,0,0|1,0,1]=4 1324 B10R1.4 NCCC1=C(Br)C=CC=C1 22238 [1,1,0,0,0,0|1,0,1]=4 1325 B10R1.4 NCCC1=C(F)C=CC=C1 27340 [1,1,0,0,0,0|1,0,1]=4 1326 B10R1.4 NCCC1=C(O)C=CC=C1 16394 [1,1,0,0,0,0|0,0,1]=3 1327 B10R1.4 NNCC1=C(F)C=CC=C1 35094 [1,1,0,0,0,0|1,0,1]=4 1328 B10R1.4 NNCc1ccccc1F 34909 [1,1,0,0,0,0|1,0,1]=4 1329 B10R1.4 N\N=C\C1=CC=CC=C1O 22926 [1,1,0,0,0,0|0,0,0]=2 1330 B10R1.4 O=C=NC1=C(F)C=CC=C1 4455 [1,1,0,0,0,0|1,0,1]=4 1331 B10R1.4 OCCC1=C(O)C=CC=C1 31971 [1,1,0,0,0,0|0,0,2]=4 1332 B10R1.4 O\N=C\C1=C(Br)C=CC=C1 3731 [1,1,0,0,0,0|1,0,1]=4 1333 B10R1.4 O\N=C\C1=C(F)C=CC=C1 28431 [1,1,0,0,0,0|1,0,1]=4 1334 B10R1.20 CCC1=C(C=O)C=CC=C1 3074 [1,1,0,0,0,0|1,0,0]=3 1335 B10R1.20 CCC1=C(NN)C=CC=C1 6412 [1,1,0,0,0,0|2,0,0]=4 1336 B10R1.20 COC1=C(C#N)C=CC=C1 4812 [1,1,0,0,0,0|0,0,2]=4 1337 B10R1.20 COC1=C(C=O)C=CC=C1 7413 [1,1,0,0,0,0|0,0,0]=2 1338 B10R1.20 COC1=C(C=O)C=CN=C1 33676 [1,1,0,0,0,0|1,0,0]=3 1339 B10R1.20 COC1=C(C=O)C=NC=C1 15264 [1,1,0,0,0,0|1,0,0]=3 1340 B10R1.20 COC1=C(CBr)C=CC=C1 14738 [1,1,0,0,0,0|1,0,1]=4 1341 B10R1.20 COC1=C(CCl)C=CC=C1 4651 [1,1,0,0,0,0|1,0,1]=4 1342 B10R1.20 COC1=C(CN)C=CC=C1 7402 [1,1,0,0,0,0|0,0,1]=3 1343 B10R1.20 COC1=C(CO)C=CC=C1 7736 [1,1,0,0,0,0|0,0,2]=4 1344 B10R1.20 COC1=C(NN)C=CC=C1 16110 [1,1,0,0,0,0|1,0,0]=3 1345 B10R1.20 COC1=C(NN)C=CC=C1 4496 [1,1,0,0,0,0|1,0,0]=3 1346 B10R1.20 COC1=C(OC)C=CC=C1 15018 [1,1,0,0,0,0|2,0,0]=4 1347 B10R1.20 COC1=C(SC)C=CC=C1 10651 [1,1,0,0,0,0|2,0,0]=4 1348 B10R1.20 COC1=NC=CC=C1C=O 15124 [1,1,0,0,0,0|1,0,0]=3 1349 B10R1.20 CSC1=C(C=O)C=CC=C1 10676 [1,1,0,0,0,0|0,1,0]=3 1350 B10R1.20 N#CC1=C(C=O)C=CC=C1 7409 [1,1,0,0,0,0|1,0,0]=3 1351 B10R1.20 N#CC1=C(C=O)C=NC=C1 33546 [1,1,0,0,0,0|2,0,0]=4 1352 B10R1.20 N#CC1=C(C=O)N=CC=C1 33688 [1,1,0,0,0,0|2,0,0]=4 1353 B10R1.20 N#CC1=C(CN)C=CC=C1 31759 [1,1,0,0,0,0|1,0,1]=4 1354 B10R1.20 N#CC1=NC=CC=C1C=O 33784 [1,1,0,0,0,0|2,0,0]=4 1355 B10R1.20 NCC1=C(CO)C=CC=C1 16185 [1,1,0,0,0,0|0,0,1]=3 1356 B10R1.20 OCC1=CC=CC=C1CO 22613 [1,1,0,0,0,0|0,0,2]=4 1357 B10R1.25 CC1=C(C=O)C=CC(Br)=C1 25414 [1,1,0,0,0,0|1,0,0]=3 1358 B10R1.25 CC1=C(C=O)C=CC(Br)=N1 34417 [1,1,0,0,0,0|2,0,0]=4 1359 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 23457 [1,1,0,0,0,0|1,0,0]=3 1360 B10R1.25 CC1=C(C=O)C=CC(F)=C1 1456 [1,1,0,0,0,0|1,0,0]=3 1361 B10R1.25 CC1=C(C=O)C=CC(F)=N1 17087 [1,1,0,0,0,0|2,0,0]=4 1362 B10R1.25 CC1=C(C=O)C=CC(O)=C1 3910 [1,1,0,0,0,0|1,0,0]=3 1363 B10R1.25 CC1=C(CN)C=CC(Br)=C1 19930 [1,1,0,0,0,0|1,0,1]=4 1364 B10R1.25 CC1=C(CN)C=CC(O)=C1 27617 [1,1,0,0,0,0|1,0,1]=4 1365 B10R1.25 CC1=CC(C)=C(C=O)C=C1 3070 [1,1,0,0,0,0|1,0,0]=3 1366 B10R1.25 CC1=CC(C)=C(NN)C=C1 6399 [1,1,0,0,0,0|2,0,0]=4 1367 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 17007 [1,1,0,0,0,0|1,0,0]=3 1368 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 28906 [1,1,0,0,0,0|2,0,0]=4 1369 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 35435 [1,1,0,0,0,0|2,0,0]=4 1370 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 4481 [1,1,0,0,0,0|2,0,0]=4 1371 B10R1.25 CC1=CC(F)=C(C=O)C=C1 1451 [1,1,0,0,0,0|1,0,0]=3 1372 B10R1.25 CC1=CC(O)=C(C#N)C=C1 30774 [1,1,0,0,0,0|0,0,2]=4 1373 B10R1.25 CC1=CC=C(C=O)C(C)=N1 13948 [1,1,0,0,0,0|2,0,0]=4 1374 B10R1.25 CC1=CC=C(C=O)C(O)=C1 8154 [1,1,0,0,0,0|0,0,0]=2 1375 B10R1.25 CC1=NC(Cl)=CC=C1C=O 35550 [1,1,0,0,0,0|2,0,0]=4 1376 B10R1.25 COC1=C(O)C=C(Br)C=C1 26431 [1,1,0,0,0,0|2,0,0]=4 1377 B10R1.25 COC1=C(O)C=C(C)C=C1 31088 [1,1,0,0,0,0|2,0,0]=4 1378 B10R1.25 COC1=C(O)C=C(F)C=C1 3882 [1,1,0,0,0,0|2,0,0]=4 1379 B10R1.25 COC1=C(O)C=C(N)C=C1 3112 [1,1,0,0,0,0|2,0,0]=4 1380 B10R1.25 COc1ccc(Cl)cc1O 31127 [1,1,0,0,0,0|2,0,0]=4 1381 B10R1.25 N#CC1=C(O)C=C(Br)C=C1 3781 [1,1,0,0,0,0|0,0,2]=4 1382 B10R1.25 N#CC1=C(O)C=C(Cl)C=C1 28727 [1,1,0,0,0,0|0,0,2]=4 1383 B10R1.25 N#CC1=C(O)C=C(F)C=C1 26276 [1,1,0,0,0,0|0,0,2]=4 1384 B10R1.25 N#CC1=C(O)C=C(N)C=C1 27615 [1,1,0,0,0,0|0,0,2]=4 1385 B10R1.25 N#CC1=C(O)C=C(O)C=C1 13114 [1,1,0,0,0,0|0,0,2]=4 1386 B10R1.25 NC1=C(C=O)C=CC(F)=C1 27192 [1,1,0,0,0,0|1,0,0]=3 1387 B10R1.25 NC1=C(C=O)C=NC(Cl)=C1 22052 [1,1,0,0,0,0|2,0,0]=4 1388 B10R1.25 NC1=CC(I)=C(C=O)C=C1 16530 [1,1,0,0,0,0|1,0,0]=3 1389 B10R1.25 NC1=NC=C(C=O)C(Cl)=C1 23578 [1,1,0,0,0,0|2,0,0]=4 1390 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 25411 [1,1,0,0,0,0|1,0,1]=4 1391 B10R1.25 NCC1=C(F)C=C(Br)C=C1 12660 [1,1,0,0,0,0|1,0,1]=4 1392 B10R1.25 NCC1=C(F)C=C(Br)C=C1 4709 [1,1,0,0,0,0|1,0,1]=4 1393 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 27456 [1,1,0,0,0,0|1,0,1]=4 1394 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 3428 [1,1,0,0,0,0|1,0,1]=4 1395 B10R1.25 NCC1=C(F)C=C(F)C=C1 4399 [1,1,0,0,0,0|1,0,1]=4 1396 B10R1.25 NNC1=C(Cl)C=C(Cl)C=C1 4486 [1,1,0,0,0,0|2,0,0]=4 1397 B10R1.25 NNC1=C(Cl)C=C(Cl)C=C1 7524 [1,1,0,0,0,0|2,0,0]=4 1398 B10R1.25 NNC1=C(Cl)C=C(F)C=C1 4469 [1,1,0,0,0,0|2,0,0]=4 1399 B10R1.25 NNC1=C(F)C=C(Br)C=C1 4467 [1,1,0,0,0,0|2,0,0]=4 1400 B10R1.25 NNC1=C(F)C=C(F)C=C1 3498 [1,1,0,0,0,0|2,0,0]=4 1401 B10R1.25 NNC1=C(F)C=C(I)C=C1 3359 [1,1,0,0,0,0|2,0,0]=4 1402 B10R1.25 O=CC1=C(Br)C=C(Br)C=C1 28404 [1,1,0,0,0,0|1,0,0]=3 1403 B10R1.25 O=CC1=C(Br)C=C(Cl)C=C1 16872 [1,1,0,0,0,0|1,0,0]=3 1404 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 2877 [1,1,0,0,0,0|1,0,0]=3 1405 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 30961 [1,1,0,0,0,0|1,0,0]=3 1406 B10R1.25 O=CC1=C(Br)C=C(O)C=C1 28099 [1,1,0,0,0,0|1,0,0]=3 1407 B10R1.25 O=CC1=C(Br)N=C(Br)C=C1 27605 [1,1,0,0,0,0|2,0,0]=4 1408 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 24612 [1,1,0,0,0,0|1,0,0]=3 1409 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 1433 [1,1,0,0,0,0|1,0,0]=3 1410 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 7366 [1,1,0,0,0,0|1,0,0]=3 1411 B10R1.25 O=CC1=C(F)C=C(Br)C=C1 1421 [1,1,0,0,0,0|1,0,0]=3 1412 B10R1.25 O=CC1=C(F)C=C(Cl)C=C1 1435 [1,1,0,0,0,0|1,0,0]=3 1413 B10R1.25 O=CC1=C(F)C=C(F)C=C1 2903 [1,1,0,0,0,0|1,0,0]=3 1414 B10R1.25 O=CC1=C(F)C=C(I)C=C1 4219 [1,1,0,0,0,0|1,0,0]=3 1415 B10R1.25 O=CC1=C(F)C=C(O)C=C1 1442 [1,1,0,0,0,0|1,0,0]=3 1416 B10R1.25 O=CC1=C(I)C=C(Cl)C=C1 22996 [1,1,0,0,0,0|1,0,0]=3 1417 B10R1.25 O=CC1=C(I)C=C(F)C=C1 22995 [1,1,0,0,0,0|1,0,0]=3 1418 B10R1.25 O=CC1=C(I)C=C(O)C=C1 28098 [1,1,0,0,0,0|1,0,0]=3 1419 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 16944 [1,1,0,0,0,0|0,0,0]=2 1420 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 22142 [1,1,0,0,0,0|0,0,0]=2 1421 B10R1.25 O=CC1=C(O)C=C(F)C=C1 8483 [1,1,0,0,0,0|0,0,0]=2 1422 B10R1.25 O=CC1=C(O)C=C(O)C=C1 8218 [1,1,0,0,0,0|0,0,0]=2 1423 B10R1.25 O=CC1=CC=C(Cl)N=C1Cl 5103 [1,1,0,0,0,0|2,0,0]=4 1424 B10R1.25 O=CC1=CC=C(F)N=C1F 18894 [1,1,0,0,0,0|2,0,0]=4 1425 B10R1.25 O=CC1=CN=C(Br)C=C1O 24436 [1,1,0,0,0,0|1,0,0]=3 1426 B10R1.25 O=CC1=NC=C(Br)C=C1F 36116 [1,1,0,0,0,0|2,0,0]=4 1427 B10R1.25 OCC1=C(O)C=C(Br)C=C1 15237 [1,1,0,0,0,0|0,0,2]=4 1428 B10R1.30 C=CC1=C(Br)C=CC(F)=C1 16646 [1,1,0,0,0,0|2,0,0]=4 1429 B10R1.30 CC1=C(C=O)C=C(Br)C=C1 10353 [1,1,0,0,0,0|1,0,0]=3 1430 B10R1.30 CC1=C(C=O)C=C(Cl)C=C1 33750 [1,1,0,0,0,0|1,0,0]=3 1431 B10R1.30 CC1=C(C=O)C=C(F)C=C1 1458 [1,1,0,0,0,0|1,0,0]=3 1432 B10R1.30 CC1=C(C=O)C=C(I)C=C1 26001 [1,1,0,0,0,0|1,0,0]=3 1433 B10R1.30 CC1=C(C=O)C=C(O)C=C1 30957 [1,1,0,0,0,0|1,0,0]=3 1434 B10R1.30 CC1=C(NN)C=C(F)C=C1 1087 [1,1,0,0,0,0|2,0,0]=4 1435 B10R1.30 CC1=CC(C#N)=C(O)C=C1 27632 [1,1,0,0,0,0|0,0,2]=4 1436 B10R1.30 CC1=CC(C=O)=C(Br)C=C1 16748 [1,1,0,0,0,0|1,0,0]=3 1437 B10R1.30 CC1=CC(C=O)=C(F)C=C1 1452 [1,1,0,0,0,0|1,0,0]=3 1438 B10R1.30 CC1=CC(C=O)=C(F)N=C1 17125 [1,1,0,0,0,0|2,0,0]=4 1439 B10R1.30 CC1=CC(C=O)=C(N)N=C1 27245 [1,1,0,0,0,0|2,0,0]=4 1440 B10R1.30 CC1=CC(CN)=C(C)C=C1 7405 [1,1,0,0,0,0|1,0,1]=4 1441 B10R1.30 CC1=CC(NN)=C(C)C=C1 6400 [1,1,0,0,0,0|2,0,0]=4 1442 B10R1.30 CC1=CC=C(Cl)N=C1C=O 26730 [1,1,0,0,0,0|2,0,0]=4 1443 B10R1.30 CC1=CC=C(O)C(C=O)=C1 15680 [1,1,0,0,0,0|0,0,0]=2 1444 B10R1.30 CC1=CC=C(O)C(C=O)=N1 33531 [1,1,0,0,0,0|1,0,0]=3 1445 B10R1.30 CNC1=C(O)C=CC(N)=C1 20872 [1,1,0,0,0,0|2,0,0]=4 1446 B10R1.30 COC1=C(O)C=CC(Br)=C1 17271 [1,1,0,0,0,0|2,0,0]=4 1447 B10R1.30 COC1=C(O)C=CC(Cl)=C1 3665 [1,1,0,0,0,0|2,0,0]=4 1448 B10R1.30 COC1=C(O)C=CC(F)=C1 3880 [1,1,0,0,0,0|2,0,0]=4 1449 B10R1.30 COC1=C(O)C=CC(I)=C1 17587 [1,1,0,0,0,0|2,0,0]=4 1450 B10R1.30 COC1=C(O)C=CC(N)=C1 14144 [1,1,0,0,0,0|2,0,0]=4 1451 B10R1.30 COC1=C(O)C=CC(N)=C1 33372 [1,1,0,0,0,0|2,0,0]=4 1452 B10R1.30 N#CC1=C(O)C=CC(Br)=C1 3782 [1,1,0,0,0,0|0,0,2]=4 1453 B10R1.30 N#CC1=C(O)C=CC(Cl)=C1 33422 [1,1,0,0,0,0|0,0,2]=4 1454 B10R1.30 N#CC1=C(O)C=CC(I)=C1 20368 [1,1,0,0,0,0|0,0,2]=4 1455 B10R1.30 NC1=C(C=O)C=C(Br)C=C1 19693 [1,1,0,0,0,0|1,0,0]=3 1456 B10R1.30 NC1=C(C=O)C=C(Cl)C=C1 16498 [1,1,0,0,0,0|1,0,0]=3 1457 B10R1.30 NC1=C(C=O)C=C(Cl)C=C1 16499 [1,1,0,0,0,0|1,0,0]=3 1458 B10R1.30 NC1=C(C=O)C=C(Cl)C=C1 7364 [1,1,0,0,0,0|1,0,0]=3 1459 B10R1.30 NC1=C(C=O)C=C(Cl)C=N1 19530 [1,1,0,0,0,0|2,0,0]=4 1460 B10R1.30 NC1=NC=C(I)C=C1C=O 26814 [1,1,0,0,0,0|2,0,0]=4 1461 B10R1.30 NCC1=C(Br)C=CC(F)=C1 3225 [1,1,0,0,0,0|1,0,1]=4 1462 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 23431 [1,1,0,0,0,0|1,0,1]=4 1463 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 31261 [1,1,0,0,0,0|1,0,1]=4 1464 B10R1.30 NCC1=C(Cl)C=CC(F)=C1 4371 [1,1,0,0,0,0|1,0,1]=4 1465 B10R1.30 NCC1=C(F)C=CC(Br)=C1 3227 [1,1,0,0,0,0|1,0,1]=4 1466 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 4378 [1,1,0,0,0,0|1,0,1]=4 1467 B10R1.30 NCC1=C(F)C=CC(F)=C1 4401 [1,1,0,0,0,0|1,0,1]=4 1468 B10R1.30 NCc1cc(Br)ccc1Br 31252 [1,1,0,0,0,0|1,0,1]=4 1469 B10R1.30 NNC1=C(Cl)C=CC(Cl)=C1 7525 [1,1,0,0,0,0|2,0,0]=4 1470 B10R1.30 NNC1=C(Cl)C=CC(F)=C1 28905 [1,1,0,0,0,0|2,0,0]=4 1471 B10R1.30 NNC1=C(F)C=CC(Cl)=C1 4471 [1,1,0,0,0,0|2,0,0]=4 1472 B10R1.30 NNC1=C(F)C=CC(F)=C1 1082 [1,1,0,0,0,0|2,0,0]=4 1473 B10R1.30 NNC1=C(F)C=CC(F)=C1 2467 [1,1,0,0,0,0|2,0,0]=4 1474 B10R1.30 O=CC1=C(Br)C=CC(Br)=C1 30882 [1,1,0,0,0,0|1,0,0]=3 1475 B10R1.30 O=CC1=C(Br)C=CC(Cl)=C1 19849 [1,1,0,0,0,0|1,0,0]=3 1476 B10R1.30 O=CC1=C(Br)C=CC(F)=C1 1418 [1,1,0,0,0,0|1,0,0]=3 1477 B10R1.30 O=CC1=C(Br)C=CC(I)=C1 30930 [1,1,0,0,0,0|1,0,0]=3 1478 B10R1.30 O=CC1=C(Br)C=CC(O)=C1 14430 [1,1,0,0,0,0|1,0,0]=3 1479 B10R1.30 O=CC1=C(Cl)C=CC(Br)=C1 10373 [1,1,0,0,0,0|1,0,0]=3 1480 B10R1.30 O=CC1=C(Cl)C=CC(Cl)=C1 3081 [1,1,0,0,0,0|1,0,0]=3 1481 B10R1.30 O=CC1=C(Cl)C=CC(F)=C1 1410 [1,1,0,0,0,0|1,0,0]=3 1482 B10R1.30 O=CC1=C(Cl)C=CC(O)=C1 30918 [1,1,0,0,0,0|1,0,0]=3 1483 B10R1.30 O=CC1=C(Cl)N=CC(Br)=C1 26433 [1,1,0,0,0,0|2,0,0]=4 1484 B10R1.30 O=CC1=C(Cl)N=CC(Cl)=C1 17151 [1,1,0,0,0,0|2,0,0]=4 1485 B10R1.30 O=CC1=C(Cl)N=CC(F)=C1 17053 [1,1,0,0,0,0|2,0,0]=4 1486 B10R1.30 O=CC1=C(F)C=CC(Br)=C1 2879 [1,1,0,0,0,0|1,0,0]=3 1487 B10R1.30 O=CC1=C(F)C=CC(Cl)=C1 1411 [1,1,0,0,0,0|1,0,0]=3 1488 B10R1.30 O=CC1=C(F)C=CC(Cl)=N1 15230 [1,1,0,0,0,0|2,0,0]=4 1489 B10R1.30 O=CC1=C(F)C=CC(F)=C1 1437 [1,1,0,0,0,0|1,0,0]=3 1490 B10R1.30 O=CC1=C(F)C=CC(I)=C1 4222 [1,1,0,0,0,0|1,0,0]=3 1491 B10R1.30 O=CC1=C(F)C=CC(O)=C1 16486 [1,1,0,0,0,0|1,0,0]=3 1492 B10R1.30 O=CC1=C(F)N=CC(Br)=C1 17162 [1,1,0,0,0,0|2,0,0]=4 1493 B10R1.30 O=CC1=C(F)N=CC(Cl)=C1 10594 [1,1,0,0,0,0|2,0,0]=4 1494 B10R1.30 O=CC1=C(I)C=CC(Br)=C1 17023 [1,1,0,0,0,0|1,0,0]=3 1495 B10R1.30 O=CC1=C(I)C=CC(Cl)=C1 22997 [1,1,0,0,0,0|1,0,0]=3 1496 B10R1.30 O=CC1=C(I)C=CC(F)=C1 1441 [1,1,0,0,0,0|1,0,0]=3 1497 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 3779 [1,1,0,0,0,0|0,0,0]=2 1498 B10R1.30 O=CC1=C(O)C=CC(F)=C1 1444 [1,1,0,0,0,0|0,0,0]=2 1499 B10R1.30 O=CC1=C(O)C=CC(I)=C1 22695 [1,1,0,0,0,0|0,0,0]=2 1500 B10R1.30 O=CC1=C(O)C=CC(O)=C1 2285 [1,1,0,0,0,0|0,0,0]=2 1501 B10R1.30 O=CC1=CC(Br)=NC=C1Br 34567 [1,1,0,0,0,0|2,0,0]=4 1502 B10R1.30 O=CC1=CC(Br)=NC=C1Cl 34447 [1,1,0,0,0,0|2,0,0]=4 1503 B10R1.30 O=CC1=CC(Cl)=CC=C1O 8203 [1,1,0,0,0,0|0,0,0]=2 1504 B10R1.30 O=CC1=CC(Cl)=NC=C1Br 33761 [1,1,0,0,0,0|2,0,0]=4 1505 B10R1.30 O=CC1=CC(Cl)=NC=C1Cl 13556 [1,1,0,0,0,0|2,0,0]=4 1506 B10R1.30 O=CC1=CC(Cl)=NC=C1F 15227 [1,1,0,0,0,0|2,0,0]=4 1507 B10R1.30 O=CC1=CC(Cl)=NC=C1O 23615 [1,1,0,0,0,0|1,0,0]=3 1508 B10R1.30 O=CC1=NC(Br)=CC=C1F 16798 [1,1,0,0,0,0|2,0,0]=4 1509 B10R1.30 O=CC1=NC(Cl)=CC=C1Br 33668 [1,1,0,0,0,0|2,0,0]=4 1510 B10R1.30 O=CC1=NC(Cl)=CC=C1Cl 13557 [1,1,0,0,0,0|2,0,0]=4 1511 B10R1.30 OCC1=CC(Br)=CC=C1O 22564 [1,1,0,0,0,0|0,0,2]=4 1512 B10R1.245 C=CC1=C(F)C=CC=C1F 25426 [1,1,0,0,0,0|2,0,0]=4 1513 B10R1.245 CC1=C(C=O)C(O)=CC=C1 22141 [1,1,0,0,0,0|0,0,0]=2 1514 B10R1.245 CC1=CC=CC(C)=C1C=O 28414 [1,1,0,0,0,0|1,0,0]=3 1515 B10R1.245 CC1=CC=CC(C)=C1CN 7406 [1,1,0,0,0,0|1,0,1]=4 1516 B10R1.245 CC1=CC=CC(Cl)=C1C=O 19866 [1,1,0,0,0,0|1,0,0]=3 1517 B10R1.245 CC1=CC=CC(F)=C1C=O 10067 [1,1,0,0,0,0|1,0,0]=3 1518 B10R1.245 CC1=CC=CC(O)=C1C#N 30777 [1,1,0,0,0,0|0,0,2]=4 1519 B10R1.245 CC1=CC=NC(Cl)=C1C=O 34386 [1,1,0,0,0,0|2,0,0]=4 1520 B10R1.245 CCC1=C(O)C=CC=C1N 28129 [1,1,0,0,0,0|1,0,1]=4 1521 B10R1.245 COC1=C(O)C=CC=C1Br 28106 [1,1,0,0,0,0|2,0,0]=4 1522 B10R1.245 COC1=C(O)C=CC=C1Cl 27362 [1,1,0,0,0,0|2,0,0]=4 1523 B10R1.245 COC1=C(O)C=CC=C1F 33437 [1,1,0,0,0,0|2,0,0]=4 1524 B10R1.245 CSC1=C(O)C=CC=C1Br 27603 [1,1,0,0,0,0|2,0,0]=4 1525 B10R1.245 N#CC1=C(Br)C=CC=C1O 28720 [1,1,0,0,0,0|0,0,2]=4 1526 B10R1.245 N#CC1=C(Cl)C=CC=C1O 25376 [1,1,0,0,0,0|0,0,2]=4 1527 B10R1.245 N#CC1=C(F)C=CC=C1O 2223 [1,1,0,0,0,0|0,0,2]=4 1528 B10R1.245 NCC1=C(Cl)C=CC=C1Cl 15690 [1,1,0,0,0,0|1,0,1]=4 1529 B10R1.245 NCC1=C(Cl)C=CC=C1F 19391 [1,1,0,0,0,0|1,0,1]=4 1530 B10R1.245 NCC1=C(F)C=CC=C1F 2235 [1,1,0,0,0,0|1,0,1]=4 1531 B10R1.245 NCC1=C(N)C=CC=C1F 4705 [1,1,0,0,0,0|1,0,1]=4 1532 B10R1.245 NNC1=C(Cl)C=CC=C1F 3509 [1,1,0,0,0,0|2,0,0]=4 1533 B10R1.245 NNC1=C(F)C=CC=C1F 1083 [1,1,0,0,0,0|2,0,0]=4 1534 B10R1.245 NNc1c(F)cccc1F 28907 [1,1,0,0,0,0|2,0,0]=4 1535 B10R1.245 O=CC1=C(Br)C=CC=C1Cl 27373 [1,1,0,0,0,0|1,0,0]=3 1536 B10R1.245 O=CC1=C(Br)C=CC=C1F 1419 [1,1,0,0,0,0|1,0,0]=3 1537 B10R1.245 O=CC1=C(Br)C=CC=C1O 17006 [1,1,0,0,0,0|0,0,0]=2 1538 B10R1.245 O=CC1=C(Br)C=NC=C1Br 17139 [1,1,0,0,0,0|2,0,0]=4 1539 B10R1.245 O=CC1=C(Cl)C=CC=C1Cl 8225 [1,1,0,0,0,0|1,0,0]=3 1540 B10R1.245 O=CC1=C(Cl)C=CC=C1F 1434 [1,1,0,0,0,0|1,0,0]=3 1541 B10R1.245 O=CC1=C(Cl)C=CC=C1O 17008 [1,1,0,0,0,0|0,0,0]=2 1542 B10R1.245 O=CC1=C(Cl)C=NC=C1Cl 5101 [1,1,0,0,0,0|2,0,0]=4 1543 B10R1.245 O=CC1=C(Cl)N=CC=C1Cl 22521 [1,1,0,0,0,0|2,0,0]=4 1544 B10R1.245 O=CC1=C(F)C=CC=C1F 1438 [1,1,0,0,0,0|1,0,0]=3 1545 B10R1.245 O=CC1=C(F)C=CC=C1O 8482 [1,1,0,0,0,0|0,0,0]=2 1546 B10R1.245 O=CC1=C(F)C=NC=C1F 5102 [1,1,0,0,0,0|2,0,0]=4 1547 B10R1.245 O=CC1=C(F)N=CC=C1Br 32482 [1,1,0,0,0,0|2,0,0]=4 1548 B10R1.245 O=CC1=C(F)N=CC=C1I 29106 [1,1,0,0,0,0|2,0,0]=4 1549 B10R1.245 O=CC1=C(I)C=CC=C1Cl 22998 [1,1,0,0,0,0|1,0,0]=3 1550 B10R1.245 O=CC1=C(I)C=CC=C1F 1445 [1,1,0,0,0,0|1,0,0]=3 1551 B10R1.245 O=CC1=C(I)C=CN=C1Cl 8084 [1,1,0,0,0,0|2,0,0]=4 1552 B10R1.245 O=CC1=C(I)C=CN=C1F 15242 [1,1,0,0,0,0|2,0,0]=4 1553 B10R1.245 O=CC1=C(O)C=CC=C1I 30989 [1,1,0,0,0,0|0,0,0]=2 1554 B10R1.149 COC(=O)C1=C(O)C=CS1 7744 [0,1,0,0,1,0|2,0,0]=4 1555 B12R1.75 CC(=O)OC1=C(C#N)C=CC=C1 13326 [0,1,0,0,0,1|2,0,0]=4 1556 B12R1.75 COC1=C(CC(C)=O)C=CC=C1 23387 [0,1,0,0,0,1|1,0,0]=3 1557 B12R1.75 COC1=C(NC(C)=O)C=CC=C1 3319 [0,1,0,0,0,1|1,0,0]=3 1558 B12R1.75 N#CC1=C(CC(=O)O)C=CC=C1 28857 [0,1,0,0,0,1|2,0,0]=4 1559 B12R1.75 NCC1=C(CC(=O)O)C=CC=C1 22177 [0,1,0,0,0,1|2,0,0]=4 1560 B12R1.124 CC(C(=O)O)C1=C(Cl)C=CC=C1 23462 [0,1,0,0,0,1|2,0,0]=4 1561 B12R1.124 NC(C(=O)O)C1=C(Br)C=CC=C1 31443 [0,1,0,0,0,1|2,0,0]=4 1562 B12R1.124 NC(C(=O)O)C1=C(Cl)C=CC=C1 12338 [0,1,0,0,0,1|2,0,0]=4 1563 B12R1.124 NC(C(=O)O)C1=C(O)C=CC=C1 19644 [0,1,0,0,0,1|1,0,0]=3 1564 B12R1.124 N[C@@H](C(=O)O)c1ccccc1Cl 12292 [0,1,0,0,0,1|2,0,0]=4 1565 B12R1.124 N[C@H](C(=O)O)C1=C(Cl)C=CC=C1 5744 [0,1,0,0,0,1|2,0,0]=4 1566 B12R1.124 O=C(O)C(Br)C1=C(Cl)C=CC=C1 22144 [0,1,0,0,0,1|2,0,0]=4 1567 B12R1.124 O=C(O)C(Br)C1=C(Cl)C=CC=C1 23671 [0,1,0,0,0,1|2,0,0]=4 1568 B12R1.124 O=C(O)C(O)C1=C(Cl)C=CC=C1 15895 [0,1,0,0,0,1|2,0,0]=4 1569 B12R1.124 O=C(O)[C@@H](O)C1=C(Cl)C=CC=C1 5743 [0,1,0,0,0,1|2,0,0]=4 1570 B12R1.124 O=C(O)[C@H](O)C1=C(Cl)C=CC=C1 5742 [0,1,0,0,0,1|2,0,0]=4 1571 B12R1.127 CC(=O)NC1=C(I)C=CC(F)=C1 31770 [0,1,0,0,0,1|2,0,0]=4 1572 B12R1.127 CC(=O)NC1=C(O)C=CC(C)=C1 2366 [0,1,0,0,0,1|1,0,0]=3 1573 B12R1.127 CC(=O)NC1=CC(I)=CN=C1O 26795 [0,1,0,0,0,1|2,0,0]=4 1574 B12R1.127 CC1=C(CC(=O)O)C=C(Br)C=C1 31473 [0,1,0,0,0,1|2,0,0]=4 1575 B12R1.127 CC1=CC(CC(=O)O)=C(Br)C=C1 31486 [0,1,0,0,0,1|2,0,0]=4 1576 B12R1.127 CC1=CC(CC(=O)O)=C(C)C=C1 22525 [0,1,0,0,0,1|2,0,0]=4 1577 B12R1.127 O=C(O)CC1=C(Br)C=CC(Br)=C1 24114 [0,1,0,0,0,1|2,0,0]=4 1578 B12R1.127 O=C(O)CC1=C(Br)C=CC(Cl)=C1 12486 [0,1,0,0,0,1|2,0,0]=4 1579 B12R1.127 O=C(O)CC1=C(Br)C=CC(F)=C1 16327 [0,1,0,0,0,1|2,0,0]=4 1580 B12R1.127 O=C(O)CC1=C(Cl)C=CC(Br)=C1 31534 [0,1,0,0,0,1|2,0,0]=4 1581 B12R1.127 O=C(O)CC1=C(Cl)C=CC(F)=C1 2711 [0,1,0,0,0,1|2,0,0]=4 1582 B12R1.127 O=C(O)CC1=C(F)C=CC(Br)=C1 2706 [0,1,0,0,0,1|2,0,0]=4 1583 B12R1.127 O=C(O)CC1=C(F)C=CC(Cl)=C1 7141 [0,1,0,0,0,1|2,0,0]=4 1584 B12R1.127 O=C(O)CC1=C(F)C=CC(F)=C1 4151 [0,1,0,0,0,1|2,0,0]=4 1585 B12R1.127 O=C(O)CC1=C(O)C=CC(Br)=C1 31442 [0,1,0,0,0,1|1,0,0]=3 1586 B12R1.224 CC(=O)NC1=C(O)C(I)=CN=C1 26796 [0,1,0,0,0,1|2,0,0]=4 1587 B12R1.224 CC(=O)NC1=C(O)C(I)=NC=C1 26793 [0,1,0,0,0,1|2,0,0]=4 1588 B12R1.224 CC1=C(CC(=O)O)C=CC=C1Br 31487 [0,1,0,0,0,1|2,0,0]=4 1589 B12R1.224 CC1=C(CC(=O)O)C=CC=C1F 24112 [0,1,0,0,0,1|2,0,0]=4 1590 B12R1.224 CC1=C(CC(=O)O)C=CC=C1I 31545 [0,1,0,0,0,1|2,0,0]=4 1591 B12R1.224 CC1=CC=CC(CC(=O)O)=C1Br 31485 [0,1,0,0,0,1|2,0,0]=4 1592 B12R1.224 CC1=CC=CC(CC(=O)O)=C1C 2466 [0,1,0,0,0,1|2,0,0]=4 1593 B12R1.224 O=C(O)CC1=C(Br)C(Cl)=CC=C1 31465 [0,1,0,0,0,1|2,0,0]=4 1594 B12R1.224 O=C(O)CC1=C(Cl)C(Br)=CC=C1 31467 [0,1,0,0,0,1|2,0,0]=4 1595 B12R1.224 O=C(O)CC1=C(Cl)C(Cl)=CC=C1 26145 [0,1,0,0,0,1|2,0,0]=4 1596 B12R1.224 O=C(O)CC1=C(Cl)C(F)=CC=C1 31456 [0,1,0,0,0,1|2,0,0]=4 1597 B12R1.224 O=C(O)CC1=C(F)C(Br)=CC=C1 31427 [0,1,0,0,0,1|2,0,0]=4 1598 B12R1.224 O=C(O)CC1=C(F)C(Cl)=CC=C1 7138 [0,1,0,0,0,1|2,0,0]=4 1599 B12R1.224 O=C(O)CC1=C(F)C(F)=CC=C1 1916 [0,1,0,0,0,1|2,0,0]=4 1600 B12R1.233 CC(=O)NC1=C(F)C=C(Br)C=C1 14886 [0,1,0,0,0,1|2,0,0]=4 1601 B12R1.233 CC1=C(CC(=O)O)C=CC(Br)=C1 31490 [0,1,0,0,0,1|2,0,0]=4 1602 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 4174 [0,1,0,0,0,1|2,0,0]=4 1603 B12R1.233 Cc1ccc(CC(=O)O)c(C)c1 26355 [0,1,0,0,0,1|2,0,0]=4 1604 B12R1.233 NC1=CC(F)=C(CC(=O)O)C=C1 28844 [0,1,0,0,0,1|2,0,0]=4 1605 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 11165 [0,1,0,0,0,1|2,0,0]=4 1606 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 2703 [0,1,0,0,0,1|2,0,0]=4 1607 B12R1.233 O=C(O)CC1=C(Cl)C=C(Br)C=C1 31433 [0,1,0,0,0,1|2,0,0]=4 1608 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 15026 [0,1,0,0,0,1|2,0,0]=4 1609 B12R1.233 O=C(O)CC1=C(Cl)C=C(F)C=C1 2710 [0,1,0,0,0,1|2,0,0]=4 1610 B12R1.233 O=C(O)CC1=C(F)C=C(Br)C=C1 13742 [0,1,0,0,0,1|2,0,0]=4 1611 B12R1.233 O=C(O)CC1=C(F)C=C(Cl)C=C1 4292 [0,1,0,0,0,1|2,0,0]=4 1612 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 4093 [0,1,0,0,0,1|2,0,0]=4 1613 B12R1.233 O=C(O)CC1=C(F)C=C(O)C=C1 4194 [0,1,0,0,0,1|2,0,0]=4 1614 B12R1.233 O=C(O)CC1=C(O)C=C(Br)C=C1 31469 [0,1,0,0,0,1|1,0,0]=3 1615 B12R1.233 O=C(O)CC1=C(O)C=C(O)C=C1 15519 [0,1,0,0,0,1|1,0,0]=3 1616 B12R1.371 COC(=O)CC1=C(Br)C=CC=C1 25827 [0,1,0,0,0,1|2,0,0]=4 1617 B12R1.371 O=C(CCl)NC1=C(F)C=CC=C1 8396 [0,1,0,0,0,1|2,0,0]=4 1618 B12R1.1009 CC1=CC=CC(C)=C1CC(=O)O 31501 [0,1,0,0,0,1|2,0,0]=4 1619 B12R1.1009 O=C(O)CC1=C(Br)C=CC=C1Br 31422 [0,1,0,0,0,1|2,0,0]=4 1620 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1Cl 4323 [0,1,0,0,0,1|2,0,0]=4 1621 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1F 4254 [0,1,0,0,0,1|2,0,0]=4 1622 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1F 8397 [0,1,0,0,0,1|2,0,0]=4 1623 B12R1.46 CC1=CC([N+](=O)[O-])=C(CO)C=C1 31321 [0,2,0,0,0,0|2,0,0]=4 1624 B12R1.46 CCC1=C(C(=O)O)C=C(Br)C=C1 30676 [0,2,0,0,0,0|2,0,0]=4 1625 B12R1.46 COC1=C(C(=O)Cl)C=C(Cl)C=C1 2109 [0,2,0,0,0,0|1,0,0]=3 1626 B12R1.46 COC1=C(C(=O)O)C=C(Br)C=C1 2676 [0,2,0,0,0,0|1,0,0]=3 1627 B12R1.46 COC1=C(C(=O)O)C=C(Br)C=N1 16564 [0,2,0,0,0,0|2,0,0]=4 1628 B12R1.46 COC1=C(C(=O)O)C=C(Cl)C=C1 2680 [0,2,0,0,0,0|1,0,0]=3 1629 B12R1.46 COC1=C(C(=O)O)C=C(Cl)C=N1 26868 [0,2,0,0,0,0|2,0,0]=4 1630 B12R1.46 COC1=C(C(=O)O)C=C(F)C=C1 2677 [0,2,0,0,0,0|1,0,0]=3 1631 B12R1.46 COC1=C(C(=O)O)C=C(F)C=N1 10625 [0,2,0,0,0,0|2,0,0]=4 1632 B12R1.46 COC1=C(C(C)=O)C=C(Br)C=C1 29263 [0,2,0,0,0,0|1,0,0]=3 1633 B12R1.46 COC1=C(C(C)=O)C=C(Br)C=C1 35096 [0,2,0,0,0,0|1,0,0]=3 1634 B12R1.46 COC1=C(C(C)=O)C=C(Cl)C=C1 33633 [0,2,0,0,0,0|1,0,0]=3 1635 B12R1.46 COC1=C(C(C)=O)C=C(F)C=C1 29154 [0,2,0,0,0,0|1,0,0]=3 1636 B12R1.46 COC1=C([N+](=O)[O-])C=C(Br)C=C1 5341 [0,2,0,0,0,0|2,0,0]=4 1637 B12R1.46 COC1=C([N+](=O)[O-])C=C(C)C=C1 13079 [0,2,0,0,0,0|2,0,0]=4 1638 B12R1.46 COC1=C([N+](=O)[O-])C=C(Cl)C=C1 2626 [0,2,0,0,0,0|2,0,0]=4 1639 B12R1.46 COC1=C([N+](=O)[O-])C=C(F)C=C1 1966 [0,2,0,0,0,0|2,0,0]=4 1640 B12R1.46 COC1=C([N+](=O)[O-])C=C(N)C=C1 14815 [0,2,0,0,0,0|2,0,0]=4 1641 B12R1.46 COC1=C([N+](=O)[O-])C=C(O)C=C1 20534 [0,2,0,0,0,0|2,0,0]=4 1642 B12R1.46 N#CC1=C(C(=O)O)C=C(Br)C=C1 28551 [0,2,0,0,0,0|2,0,0]=4 1643 B12R1.46 N#CC1=C(C(=O)O)C=C(F)C=C1 4599 [0,2,0,0,0,0|2,0,0]=4 1644 B12R1.46 O=CC1=C(C(=O)O)C=C(Cl)C=C1 16943 [0,2,0,0,0,0|1,0,1]=4 1645 B12R1.46 O=[N+]([O-])C1=C(CO)C=CC(Br)=C1 31287 [0,2,0,0,0,0|2,0,0]=4 1646 B12R1.46 O=[N+]([O-])C1=C(CO)C=CC(Cl)=C1 4901 [0,2,0,0,0,0|2,0,0]=4 1647 B12R1.46 O=[N+]([O-])C1=C(CO)C=CC(F)=C1 28802 [0,2,0,0,0,0|2,0,0]=4 1648 B12R1.57 CC1=CC(C#N)=C(C(=O)O)C=C1 30634 [0,2,0,0,0,0|2,0,0]=4 1649 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=C1 20561 [0,2,0,0,0,0|1,0,0]=3 1650 B12R1.57 COC1=C(C(=O)O)C=CC(C)=C1 30703 [0,2,0,0,0,0|1,0,0]=3 1651 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=C1 24655 [0,2,0,0,0,0|1,0,0]=3 1652 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=N1 32487 [0,2,0,0,0,0|2,0,0]=4 1653 B12R1.57 COC1=C(C(=O)O)C=CC(F)=C1 4969 [0,2,0,0,0,0|1,0,0]=3 1654 B12R1.57 COC1=C(C(=O)O)C=CC(F)=N1 27962 [0,2,0,0,0,0|2,0,0]=4 1655 B12R1.57 COC1=C(C(=O)O)C=CC(N)=C1 4934 [0,2,0,0,0,0|1,0,0]=3 1656 B12R1.57 COC1=C(C(=O)O)C=CC(O)=C1 27704 [0,2,0,0,0,0|1,0,0]=3 1657 B12R1.57 COC1=C(C(C)=O)C=CC(Br)=C1 31217 [0,2,0,0,0,0|1,0,0]=3 1658 B12R1.57 COC1=C(C(C)=O)C=CC(F)=C1 13459 [0,2,0,0,0,0|1,0,0]=3 1659 B12R1.57 COC1=C(C(C)=O)C=CC(N)=C1 31215 [0,2,0,0,0,0|1,0,0]=3 1660 B12R1.57 COC1=C([N+](=O)[O-])C=CC(Br)=C1 28358 [0,2,0,0,0,0|2,0,0]=4 1661 B12R1.57 COC1=C([N+](=O)[O-])C=CC(Cl)=C1 21674 [0,2,0,0,0,0|2,0,0]=4 1662 B12R1.57 COC1=C([N+](=O)[O-])C=CC(Cl)=C1 4104 [0,2,0,0,0,0|2,0,0]=4 1663 B12R1.57 COC1=C([N+](=O)[O-])C=CC(F)=C1 4140 [0,2,0,0,0,0|2,0,0]=4 1664 B12R1.57 COC1=C([N+](=O)[O-])C=CC(N)=C1 23901 [0,2,0,0,0,0|2,0,0]=4 1665 B12R1.57 COC1=C([N+](=O)[O-])C=CC(O)=C1 19798 [0,2,0,0,0,0|2,0,0]=4 1666 B12R1.57 COC1=CC(Cl)=NC=C1C(=O)O 18814 [0,2,0,0,0,0|2,0,0]=4 1667 B12R1.57 COc1cc(C)ccc1[N+](=O)[O-] 26673 [0,2,0,0,0,0|2,0,0]=4 1668 B12R1.57 N#CC1=C(C(=O)O)C=CC(Br)=C1 30640 [0,2,0,0,0,0|2,0,0]=4 1669 B12R1.57 N#CC1=C(C(=O)O)C=CC(N)=C1 30727 [0,2,0,0,0,0|2,0,0]=4 1670 B12R1.57 O=[N+]([O-])C1=C(CO)C=C(Cl)C=C1 16085 [0,2,0,0,0,0|2,0,0]=4 1671 B12R1.76 N#CC1=C(S(N)(=O)=O)C=CC=C1 11785 [0,2,0,0,0,0|2,0,0]=4 1672 B12R1.77 C#CC1=C(C(=O)OC)C=CC=C1 35564 [0,2,0,0,0,0|2,0,0]=4 1673 B12R1.77 CNC1=C(C(=O)OC)C=CC=C1 13627 [0,2,0,0,0,0|2,0,0]=4 1674 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 30507 [0,2,0,0,0,0|1,0,1]=4 1675 B12R1.77 COC(=O)C1=C(CBr)C=CC=C1 12369 [0,2,0,0,0,0|2,0,0]=4 1676 B12R1.77 COC(=O)C1=C(OC)C=CC=C1 20353 [0,2,0,0,0,0|1,0,0]=3 1677 B12R1.77 COC(=O)C1=CN=CC=C1OC 33526 [0,2,0,0,0,0|2,0,0]=4 1678 B12R1.77 COC(=O)c1ccccc1C#N 24574 [0,2,0,0,0,0|2,0,0]=4 1679 B12R1.77 COc1ccccc1C(=O)CN 20067 [0,2,0,0,0,0|0,0,0]=2 1680 B12R1.87 COC1=C(Br)C=CC=C1[N+](=O)[O-] 16795 [0,2,0,0,0,0|2,0,0]=4 1681 B12R1.87 COC1=C(C(=O)O)C=CC=C1Br 30470 [0,2,0,0,0,0|1,0,0]=3 1682 B12R1.87 COC1=C(C(=O)O)C=CC=C1Cl 30473 [0,2,0,0,0,0|1,0,0]=3 1683 B12R1.87 COC1=C(C(=O)O)C=CC=C1F 28650 [0,2,0,0,0,0|1,0,0]=3 1684 B12R1.87 COC1=C(C(=O)O)C=CC=C1I 35142 [0,2,0,0,0,0|1,0,0]=3 1685 B12R1.87 COC1=C(C(=O)O)C=CC=C1N 33269 [0,2,0,0,0,0|1,0,0]=3 1686 B12R1.87 COC1=C(C(C)=O)C=CC=C1Br 33634 [0,2,0,0,0,0|1,0,0]=3 1687 B12R1.87 COC1=C(C(C)=O)C=CC=C1O 34254 [0,2,0,0,0,0|1,0,0]=3 1688 B12R1.87 COC1=C(Cl)C=CC=C1[N+](=O)[O-] 26285 [0,2,0,0,0,0|2,0,0]=4 1689 B12R1.87 COC1=C(F)C=CC=C1[N+](=O)[O-] 10683 [0,2,0,0,0,0|2,0,0]=4 1690 B12R1.87 COC1=C(N)C=CC=C1[N+](=O)[O-] 25733 [0,2,0,0,0,0|2,0,0]=4 1691 B12R1.261 CC(=O)C1=C(B(O)O)C=CC=C1 5373 [0,2,0,0,0,0|1,0,0]=3 1692 B12R1.261 CC(=O)C1=C(C(C)=O)C=CC=C1 24179 [0,2,0,0,0,0|1,0,1]=4 1693 B12R1.261 CC(C)C1=C(C(=O)O)C=CC=C1 19980 [0,2,0,0,0,0|2,0,0]=4 1694 B12R1.261 CS(=O)C1=C(B(O)O)C=CC=C1 1874 [0,2,0,0,0,0|2,0,0]=4 1695 B12R1.261 NC(=O)C1=C(B(O)O)C=CC=C1 1766 [0,2,0,0,0,0|0,0,0]=2 1696 B12R1.261 NC(=O)C1=C([N+](=O)[O-])C=NC=C1 9762 [0,2,0,0,0,0|1,0,1]=4 1697 B12R1.261 O=C(O)C1=C(B(O)O)C=CC=C1 5201 [0,2,0,0,0,0|1,0,0]=3 1698 B12R1.261 O=C(O)C1=C(C(=O)O)C=NC=C1 2419 [0,2,0,0,0,0|2,0,0]=4 1699 B12R1.261 O=C(O)C1=C(C(F)F)C=CC=C1 30464 [0,2,0,0,0,0|2,0,0]=4 1700 B12R1.261 O=C(O)C1=C(I(=O)=O)C=CC=C1 13864 [0,2,0,0,0,0|1,0,1]=4 1701 B12R1.261 O=C(O)C1=C([N+](=O)[O-])C=CC=C1 22385 [0,2,0,0,0,0|1,0,1]=4 1702 B12R1.261 O=C(O)C1=CC=CN=C1C(=O)O 8035 [0,2,0,0,0,0|2,0,0]=4 1703 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)O 35845 [0,2,0,0,0,0|1,0,0]=3 1704 B12R1.261 O=[N+]([O-])C1=C(B(O)O)C=CC=C1 16455 [0,2,0,0,0,0|2,0,0]=4 1705 B12R1.283 C=CCC1=C(C(=O)O)C=CC=C1 16218 [0,2,0,0,0,0|2,0,0]=4 1706 B12R1.283 CCOC1=C(C(=N)N)C=CC=C1 11862 [0,2,0,0,0,0|1,0,0]=3 1707 B12R1.283 CCOC1=C(C(=O)O)C=CC=C1 20122 [0,2,0,0,0,0|1,0,0]=3 1708 B12R1.283 CCOC1=C(C(=O)O)C=CC=N1 16563 [0,2,0,0,0,0|2,0,0]=4 1709 B12R1.283 CCOC1=C(C(C)=O)C=CC=C1 13191 [0,2,0,0,0,0|1,0,0]=3 1710 B12R1.283 CCOC1=C([N+](=O)[O-])C=CC=C1 3186 [0,2,0,0,0,0|2,0,0]=4 1711 B12R1.283 O=[N+]([O-])C1=C(CCO)C=CC=C1 29211 [0,2,0,0,0,0|2,0,0]=4 1712 B12R1.437 CCC1=C(C(=O)O)C(F)=CC=C1 19695 [0,2,0,0,0,0|2,0,0]=4 1713 B12R1.437 CCC1=C(C(=O)O)C(O)=CC=C1 19709 [0,2,0,0,0,0|1,0,0]=3 1714 B12R1.437 CCC1=CC=CC(N)=C1C(N)=O 19694 [0,2,0,0,0,0|1,0,0]=3 1715 B12R1.437 COC1=C(C(=O)O)C(C)=CC=C1 25223 [0,2,0,0,0,0|1,0,0]=3 1716 B12R1.437 COC1=C(C(=O)O)C(O)=CC=C1 18380 [0,2,0,0,0,0|1,0,0]=3 1717 B12R1.437 COC1=C(C(C)=O)C(C)=CC=C1 34134 [0,2,0,0,0,0|1,0,0]=3 1718 B12R1.437 COC1=C([N+](=O)[O-])C(C)=CC=C1 12903 [0,2,0,0,0,0|2,0,0]=4 1719 B12R1.437 COC1=CC=CC(Br)=C1C(=O)O 11265 [0,2,0,0,0,0|1,0,0]=3 1720 B12R1.437 COC1=CC=CC(Br)=C1C(C)=O 33635 [0,2,0,0,0,0|1,0,0]=3 1721 B12R1.437 COC1=CC=CC(Br)=C1[N+](=O)[O-] 25239 [0,2,0,0,0,0|2,0,0]=4 1722 B12R1.437 COC1=CC=CC(C)=C1C(N)=O 28776 [0,2,0,0,0,0|0,0,0]=2 1723 B12R1.437 COC1=CC=CC(Cl)=C1C(=O)O 33426 [0,2,0,0,0,0|1,0,0]=3 1724 B12R1.437 COC1=CC=CC(Cl)=C1C(N)=O 19927 [0,2,0,0,0,0|0,0,0]=2 1725 B12R1.437 COC1=CC=CC(F)=C1C(=O)O 4967 [0,2,0,0,0,0|1,0,0]=3 1726 B12R1.437 COC1=CC=CC(F)=C1C(C)=O 29153 [0,2,0,0,0,0|1,0,0]=3 1727 B12R1.437 COC1=CC=CC(F)=C1[N+](=O)[O-] 33415 [0,2,0,0,0,0|2,0,0]=4 1728 B12R1.437 COC1=CC=CC(N)=C1C(=O)O 4706 [0,2,0,0,0,0|1,0,0]=3 1729 B12R1.437 COC1=CC=CC(N)=C1[N+](=O)[O-] 33265 [0,2,0,0,0,0|2,0,0]=4 1730 B12R1.437 COC1=CC=CC(O)=C1C(C)=O 16677 [0,2,0,0,0,0|1,0,0]=3 1731 B12R1.437 N#CC1=CC=CC(Br)=C1C(=O)O 30723 [0,2,0,0,0,0|2,0,0]=4 1732 B12R1.437 O=[N+]([O-])C1=C(CO)C=CC=C1Cl 27445 [0,2,0,0,0,0|2,0,0]=4 1733 B12R1.437 O=[N+]([O-])C1=C(CO)C=CC=C1F 28800 [0,2,0,0,0,0|2,0,0]=4 1734 B12R1.126 CC1=C(S(N)(=O)=O)C=CC(Br)=C1 31406 [0,2,0,0,0,0|2,0,0]=4 1735 B12R1.126 CC1=C(S(N)(=O)=O)C=CC(F)=C1 11765 [0,2,0,0,0,0|2,0,0]=4 1736 B12R1.126 CC1=CC(N)=C(S(N)(=O)=O)C=C1 19799 [0,2,0,0,0,0|2,0,0]=4 1737 B12R1.126 NS(=O)(=O)C1=C(Cl)C=C(Br)C=C1 11768 [0,2,0,0,0,0|2,0,0]=4 1738 B12R1.126 NS(=O)(=O)C1=C(F)C=C(Br)C=C1 11790 [0,2,0,0,0,0|2,0,0]=4 1739 B12R1.126 NS(=O)(=O)C1=C(F)C=C(F)C=C1 11764 [0,2,0,0,0,0|2,0,0]=4 1740 B12R1.126 Nc1ccc(S(N)(=O)=O)c(F)c1 23892 [0,2,0,0,0,0|2,0,0]=4 1741 B12R1.128 CC1=CC=C(N)C=C1S(N)(=O)=O 14390 [0,2,0,0,0,0|2,0,0]=4 1742 B12R1.128 NS(=O)(=O)C1=C(F)C=CC(Cl)=C1 11786 [0,2,0,0,0,0|2,0,0]=4 1743 B12R1.128 O=S(=O)([O-])C1=C(O)C=CC(O)=C1 29410 [0,2,0,0,0,0|2,0,0]=4 1744 B12R1.228 NC1=CC=CC(S(N)(=O)=O)=C1O 34628 [0,2,0,0,0,0|1,0,0]=3 1745 B12R1.1010 NS(=O)(=O)C1=C(F)C=CC=C1F 11779 [0,2,0,0,0,0|2,0,0]=4 1746 B12R1.894 CC(=O)C1=C(Cl)C(C)=CC=C1F 7113 [0,2,0,0,0,0|2,0,0]=4 1747 B12R1.894 CC(=O)C1=C(Cl)C(Cl)=CC=C1F 29142 [0,2,0,0,0,0|2,0,0]=4 1748 B12R1.894 CC(=O)C1=C(Cl)C(F)=CC=C1Cl 8532 [0,2,0,0,0,0|2,0,0]=4 1749 B12R1.894 CC(=O)C1=C(F)C(C)=CC=C1Cl 7114 [0,2,0,0,0,0|2,0,0]=4 1750 B12R1.894 CC(=O)C1=C(F)C(Cl)=CC=C1F 4317 [0,2,0,0,0,0|2,0,0]=4 1751 B12R1.894 CC(=O)C1=C(F)C(F)=CC=C1F 4285 [0,2,0,0,0,0|2,0,0]=4 1752 B12R1.894 CC1=CC=C(Br)C(C)=C1C(=O)O 30750 [0,2,0,0,0,0|2,0,0]=4 1753 B12R1.894 CC1=CC=C(C)C(C(=O)O)=C1N 23113 [0,2,0,0,0,0|2,0,0]=4 1754 B12R1.894 Cc1c(Br)cnc(N)c1C(N)=O 5709 [0,2,0,0,0,0|2,0,0]=4 1755 B12R1.894 NC(=O)c1c(F)ccc(O)c1F 27308 [0,2,0,0,0,0|1,0,0]=3 1756 B12R1.894 NC1=C(C(=O)O)C(Br)=CC=C1F 35614 [0,2,0,0,0,0|2,0,0]=4 1757 B12R1.894 NC1=C(C(=O)O)C(Cl)=C(Cl)C=C1 17206 [0,2,0,0,0,0|2,0,0]=4 1758 B12R1.894 NC1=CC=C(F)C(C(=O)O)=C1F 8200 [0,2,0,0,0,0|2,0,0]=4 1759 B12R1.894 NC1=CC=C(F)C(F)=C1C(=O)O 28518 [0,2,0,0,0,0|2,0,0]=4 1760 B12R1.894 O=C(Cl)C1=C(F)C(F)=CC=C1F 28696 [0,2,0,0,0,0|2,0,0]=4 1761 B12R1.894 O=C(O)C1=C(Br)C(F)=CC=C1F 28552 [0,2,0,0,0,0|2,0,0]=4 1762 B12R1.894 O=C(O)C1=C(Cl)C(F)=CC=C1Cl 28615 [0,2,0,0,0,0|2,0,0]=4 1763 B12R1.894 O=C(O)C1=C(Cl)C(F)=CC=C1F 8530 [0,2,0,0,0,0|2,0,0]=4 1764 B12R1.894 O=C(O)C1=C(Cl)C=CC(Cl)=C1O 35908 [0,2,0,0,0,0|1,0,0]=3 1765 B12R1.894 O=C(O)C1=C(F)C(Cl)=CC=C1F 8531 [0,2,0,0,0,0|2,0,0]=4 1766 B12R1.894 O=C(O)C1=C(F)C(F)=CC=C1Br 28556 [0,2,0,0,0,0|2,0,0]=4 1767 B12R1.894 O=C(O)C1=C(F)C(F)=CC=C1F 1344 [0,2,0,0,0,0|2,0,0]=4 1768 B12R1.894 O=C(O)C1=C(F)C(I)=CC=C1F 30539 [0,2,0,0,0,0|2,0,0]=4 1769 B12R1.894 O=C(O)C1=C(O)C(Br)=CC=C1Br 33934 [0,2,0,0,0,0|1,0,0]=3 1770 B12R1.894 O=[N+]([O-])C1=C(F)C=CC(F)=C1O 31107 [0,2,0,0,0,0|2,0,0]=4 1771 B12R1.1000 CC(=O)C1=C(F)C=C(Br)C=C1F 31233 [0,2,0,0,0,0|2,0,0]=4 1772 B12R1.1000 CC(=O)C1=C(F)C=C(Br)C=C1O 29168 [0,2,0,0,0,0|1,0,0]=3 1773 B12R1.1000 CC(=O)C1=C(F)C=C(Cl)C=C1F 29139 [0,2,0,0,0,0|2,0,0]=4 1774 B12R1.1000 CC(=O)C1=C(F)C=C(F)C=C1F 4290 [0,2,0,0,0,0|2,0,0]=4 1775 B12R1.1000 CC(=O)C1=C(O)C=C(C)C=C1O 3379 [0,2,0,0,0,0|1,0,0]=3 1776 B12R1.1000 CC(=O)C1=C(O)C=C(C)OC1=O 9713 [0,2,0,0,0,0|2,0,0]=4 1777 B12R1.1000 CC(=O)C1=C(O)C=C(O)C=C1O 3402 [0,2,0,0,0,0|1,0,0]=3 1778 B12R1.1000 CC1=CC(Br)=CC(C)=C1C(=O)O 25876 [0,2,0,0,0,0|2,0,0]=4 1779 B12R1.1000 CC1=CC(Br)=CC(F)=C1C(=O)O 28567 [0,2,0,0,0,0|2,0,0]=4 1780 B12R1.1000 CC1=CC(C)=C(C(=O)Cl)C(C)=C1 13234 [0,2,0,0,0,0|2,0,0]=4 1781 B12R1.1000 CC1=CC(C)=C(C(=O)O)C(C)=C1 13263 [0,2,0,0,0,0|2,0,0]=4 1782 B12R1.1000 CC1=CC(C)=C(C(N)=O)C(N)=N1 14459 [0,2,0,0,0,0|2,0,0]=4 1783 B12R1.1000 CC1=CC(F)=CC(Br)=C1C(=O)O 1363 [0,2,0,0,0,0|2,0,0]=4 1784 B12R1.1000 CC1=CC(F)=CC(C)=C1C(=O)O 4955 [0,2,0,0,0,0|2,0,0]=4 1785 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(C)=C1 27604 [0,2,0,0,0,0|1,0,0]=3 1786 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(O)=C1 3124 [0,2,0,0,0,0|1,0,0]=3 1787 B12R1.1000 CC1=CC(O)=CC(C)=C1C(=O)O 18280 [0,2,0,0,0,0|2,0,0]=4 1788 B12R1.1000 CC1=CC(O)=CC(O)=C1C(=O)O 44839 [0,2,0,0,0,0|1,0,0]=3 1789 B12R1.1000 NC1=C(C(=O)O)C(Cl)=CC(Cl)=C1 17204 [0,2,0,0,0,0|2,0,0]=4 1790 B12R1.1000 NC1=C(C(=O)O)C(F)=CC(F)=C1 19803 [0,2,0,0,0,0|2,0,0]=4 1791 B12R1.1000 O=C(Cl)C1=C(F)C=C(F)C=C1F 28700 [0,2,0,0,0,0|2,0,0]=4 1792 B12R1.1000 O=C(O)C1=C(Cl)C=C(Br)C=C1Cl 30531 [0,2,0,0,0,0|2,0,0]=4 1793 B12R1.1000 O=C(O)C1=C(Cl)C=C(Cl)C=C1Cl 18496 [0,2,0,0,0,0|2,0,0]=4 1794 B12R1.1000 O=C(O)C1=C(Cl)C=C(Cl)C=C1F 17575 [0,2,0,0,0,0|2,0,0]=4 1795 B12R1.1000 O=C(O)C1=C(Cl)C=C(F)C=C1F 28585 [0,2,0,0,0,0|2,0,0]=4 1796 B12R1.1000 O=C(O)C1=C(F)C=C(Br)C=C1Cl 30532 [0,2,0,0,0,0|2,0,0]=4 1797 B12R1.1000 O=C(O)C1=C(F)C=C(Br)C=C1F 2476 [0,2,0,0,0,0|2,0,0]=4 1798 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1F 1347 [0,2,0,0,0,0|2,0,0]=4 1799 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1O 11909 [0,2,0,0,0,0|1,0,0]=3 1800 B12R1.1000 O=C(O)C1=C(F)C=C(O)C=C1F 4938 [0,2,0,0,0,0|2,0,0]=4 1801 B12R1.1000 O=C(O)C1=C(O)C=C(O)C=C1O 20337 [0,2,0,0,0,0|1,0,0]=3 1802 B12R1.1000 O=[N+]([O-])C1=C(O)C=C(F)C=C1F 10663 [0,2,0,0,0,0|2,0,0]=4 1803 B12R1.1000 O=[N+]([O-])C1=C(O)C=C(F)C=C1O 18899 [0,2,0,0,0,0|2,0,0]=4 1804 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1C 28573 [0,2,0,0,0,0|2,0,0]=4 1805 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1Cl 12094 [0,2,0,0,0,0|2,0,0]=4 1806 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1F 28560 [0,2,0,0,0,0|2,0,0]=4 1807 B12R1.3441 COC(=O)C1=C(C)C=CC=C1C 30678 [0,2,0,0,0,0|2,0,0]=4 1808 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1C 30582 [0,2,0,0,0,0|2,0,0]=4 1809 B12R1.3441 COC(=O)C1=C(F)C=CC=C1C 28654 [0,2,0,0,0,0|2,0,0]=4 1810 B12R1.3441 COC(=O)C1=C(F)C=CC=C1O 4088 [0,2,0,0,0,0|1,0,0]=3 1811 B12R1.3441 COC(=O)C1=C(N)C=CC=C1Br 30734 [0,2,0,0,0,0|2,0,0]=4 1812 B12R1.3441 COC(=O)C1=C(N)C=CC=C1C 30579 [0,2,0,0,0,0|2,0,0]=4 1813 B12R1.3441 COC(=O)C1=C(N)C=CC=C1F 28525 [0,2,0,0,0,0|2,0,0]=4 1814 B12R1.3441 O=C(CBr)C1=C(Cl)C=CC=C1Cl 31181 [0,2,0,0,0,0|2,0,0]=4 1815 B12R1.3441 O=C(CBr)c1c(F)cccc1F 27506 [0,2,0,0,0,0|2,0,0]=4 1816 B12R1.24 CCC(=O)C1=C(Br)C(F)=CC=C1 34290 [0,2,0,0,0,0|2,0,0]=4 1817 B12R1.24 CNC(=O)C1=C(C)C(N)=CC=C1 33812 [0,2,0,0,0,0|1,0,0]=3 1818 B12R1.24 COC(=O)C1=C(Br)C(C)=CC=C1 3966 [0,2,0,0,0,0|2,0,0]=4 1819 B12R1.24 COC(=O)C1=C(Br)C(I)=CC=C1 30680 [0,2,0,0,0,0|2,0,0]=4 1820 B12R1.24 COC(=O)C1=C(Br)C(N)=CC=C1 30620 [0,2,0,0,0,0|2,0,0]=4 1821 B12R1.24 COC(=O)C1=C(C)C(Br)=CC=C1 20307 [0,2,0,0,0,0|2,0,0]=4 1822 B12R1.24 COC(=O)C1=C(C)C(C)=CC=C1 30575 [0,2,0,0,0,0|2,0,0]=4 1823 B12R1.24 COC(=O)C1=C(C)C(Cl)=CC=C1 30656 [0,2,0,0,0,0|2,0,0]=4 1824 B12R1.24 COC(=O)C1=C(C)C(N)=CC=C1 4978 [0,2,0,0,0,0|2,0,0]=4 1825 B12R1.24 COC(=O)C1=C(C)C(O)=CC=C1 30661 [0,2,0,0,0,0|2,0,0]=4 1826 B12R1.24 COC(=O)C1=C(Cl)C(C)=CC=C1 30754 [0,2,0,0,0,0|2,0,0]=4 1827 B12R1.24 COC(=O)C1=C(F)C(Br)=CC=C1 21940 [0,2,0,0,0,0|2,0,0]=4 1828 B12R1.24 COC(=O)C1=C(F)C(C)=CC=C1 25286 [0,2,0,0,0,0|2,0,0]=4 1829 B12R1.24 COC(=O)C1=C(F)C(F)=CC=C1 32214 [0,2,0,0,0,0|2,0,0]=4 1830 B12R1.24 COC(=O)C1=C(F)C(I)=CC=C1 30683 [0,2,0,0,0,0|2,0,0]=4 1831 B12R1.24 COC(=O)C1=C(F)C(N)=CC=C1 18729 [0,2,0,0,0,0|2,0,0]=4 1832 B12R1.24 COC(=O)C1=C(I)C(F)=CC=C1 30617 [0,2,0,0,0,0|2,0,0]=4 1833 B12R1.24 COC(=O)C1=C(N)C(Br)=CC=C1 28507 [0,2,0,0,0,0|2,0,0]=4 1834 B12R1.24 COC(=O)C1=C(N)C(C)=CC=C1 10929 [0,2,0,0,0,0|2,0,0]=4 1835 B12R1.24 COC(=O)C1=C(N)C(Cl)=CC=C1 13621 [0,2,0,0,0,0|2,0,0]=4 1836 B12R1.24 COC(=O)C1=C(N)C(F)=CC=C1 28523 [0,2,0,0,0,0|2,0,0]=4 1837 B12R1.24 COC(=O)C1=C(N)C(F)=CC=C1 30492 [0,2,0,0,0,0|2,0,0]=4 1838 B12R1.24 COC(=O)C1=C(N)C(N)=CC=C1 4608 [0,2,0,0,0,0|2,0,0]=4 1839 B12R1.24 COC(=O)C1=C(N)C(O)=CC=C1 22540 [0,2,0,0,0,0|2,0,0]=4 1840 B12R1.24 COC(=O)C1=C(O)C(Br)=CC=C1 28568 [0,2,0,0,0,0|1,0,0]=3 1841 B12R1.24 COC(=O)C1=C(O)C(Cl)=CC=C1 30510 [0,2,0,0,0,0|1,0,0]=3 1842 B12R1.24 COC(=O)C1=C(O)C(F)=CC=C1 4086 [0,2,0,0,0,0|1,0,0]=3 1843 B12R1.24 COC(=O)C1=CC=CC(C)=C1O 16431 [0,2,0,0,0,0|1,0,0]=3 1844 B12R1.24 N#CC(=O)C1=C(Cl)C(Cl)=CC=C1 14364 [0,2,0,0,0,0|1,0,1]=4 1845 B12R1.24 NC1=C(C(=O)C=O)C=CC=C1F 28931 [0,2,0,0,0,0|2,0,0]=4 1846 B12R1.24 O=C(CBr)C1=C(F)C(Cl)=CC=C1 31196 [0,2,0,0,0,0|2,0,0]=4 1847 B12R1.440 CC(=O)C1=CC=CC(C#N)=C1O 27782 [0,2,0,0,0,0|1,0,0]=3 1848 B12R1.440 CCC1=CC=CC(C(=O)O)=C1N 27701 [0,2,0,0,0,0|2,0,0]=4 1849 B12R1.440 COC1=C(O)C([N+](=O)[O-])=CC=C1 33267 [0,2,0,0,0,0|2,0,0]=4 1850 B12R1.440 COC1=CC=CC(C(=O)O)=C1Br 30461 [0,2,0,0,0,0|2,0,0]=4 1851 B12R1.440 COC1=CC=CC(C(=O)O)=C1C 4976 [0,2,0,0,0,0|2,0,0]=4 1852 B12R1.440 COC1=CC=CC(C(=O)O)=C1Cl 28592 [0,2,0,0,0,0|2,0,0]=4 1853 B12R1.440 COC1=CC=CC(C(=O)O)=C1F 4964 [0,2,0,0,0,0|2,0,0]=4 1854 B12R1.440 COC1=CC=CC(C(=O)O)=C1N 4701 [0,2,0,0,0,0|2,0,0]=4 1855 B12R1.440 COC1=CC=CC(C(C)=O)=C1N 29251 [0,2,0,0,0,0|2,0,0]=4 1856 B12R1.440 N#CC1=C(O)C([N+](=O)[O-])=CC=C1 33418 [0,2,0,0,0,0|2,0,0]=4 1857 B12R1.440 N#CC1=CC=CC(C(=O)O)=C1F 27654 [0,2,0,0,0,0|2,0,0]=4 1858 B12R1.440 N#CC1=CC=CC(C(=O)O)=C1N 27653 [0,2,0,0,0,0|2,0,0]=4 1859 B12R1.440 N#CC1=CC=CC(C(=O)O)=C1O 27383 [0,2,0,0,0,0|1,0,0]=3 1860 B12R1.440 O=C(O)C1=C(Cl)C(CF)=CC=C1 2557 [0,2,0,0,0,0|2,0,0]=4 1861 B12R1.440 O=C(O)C1=C(F)C(CO)=CC=C1 16482 [0,2,0,0,0,0|2,0,0]=4 1862 B12R1.440 O=CC1=CC=CC([N+](=O)[O-])=C1O 7773 [0,2,0,0,0,0|2,0,0]=4 1863 B12R1.511 CC(=O)C1=C(F)C(Cl)=CC(Cl)=C1 10163 [0,2,0,0,0,0|2,0,0]=4 1864 B12R1.511 CC(=O)C1=C(F)C(F)=CC(F)=C1 4283 [0,2,0,0,0,0|2,0,0]=4 1865 B12R1.511 CC(=O)C1=C(N)C(C)=CC(C)=C1 29250 [0,2,0,0,0,0|2,0,0]=4 1866 B12R1.511 CC(=O)C1=C(O)C(F)=CC(F)=C1 29145 [0,2,0,0,0,0|1,0,0]=3 1867 B12R1.511 CC1=C(C(=O)O)C=C(F)C=C1F 8242 [0,2,0,0,0,0|2,0,0]=4 1868 B12R1.511 CC1=C(C(=O)O)C=C(F)C=C1N 26665 [0,2,0,0,0,0|2,0,0]=4 1869 B12R1.511 CC1=CC(Br)=CC(C(=O)O)=C1F 30705 [0,2,0,0,0,0|2,0,0]=4 1870 B12R1.511 CC1=CC(Br)=CC(C(=O)O)=C1O 4713 [0,2,0,0,0,0|1,0,0]=3 1871 B12R1.511 CC1=CC(C(=O)O)=C(F)C(F)=C1 8224 [0,2,0,0,0,0|2,0,0]=4 1872 B12R1.511 CC1=CC(C(=O)O)=C(N)C(C)=C1 4685 [0,2,0,0,0,0|2,0,0]=4 1873 B12R1.511 CC1=CC(C)=C(O)C([N+](=O)[O-])=C1 28381 [0,2,0,0,0,0|2,0,0]=4 1874 B12R1.511 CC1=CC(F)=CC(C(=O)O)=C1F 8237 [0,2,0,0,0,0|2,0,0]=4 1875 B12R1.511 NC1=C(C(=O)O)C=C(Br)C=C1Br 3720 [0,2,0,0,0,0|2,0,0]=4 1876 B12R1.511 NC1=C(C(=O)O)C=C(F)C=C1F 30458 [0,2,0,0,0,0|2,0,0]=4 1877 B12R1.511 NC1=CC(C(=O)O)=C(O)C(N)=C1 25409 [0,2,0,0,0,0|1,0,0]=3 1878 B12R1.511 O=C(O)C1=C(Br)C(F)=CC(F)=C1 4993 [0,2,0,0,0,0|2,0,0]=4 1879 B12R1.511 O=C(O)C1=C(Cl)C(F)=CC(F)=C1 28584 [0,2,0,0,0,0|2,0,0]=4 1880 B12R1.511 O=C(O)C1=C(F)C(Cl)=CC(Cl)=C1 28616 [0,2,0,0,0,0|2,0,0]=4 1881 B12R1.511 O=C(O)C1=C(F)C(F)=CC(Br)=C1 23047 [0,2,0,0,0,0|2,0,0]=4 1882 B12R1.511 O=C(O)C1=C(F)C(F)=CC(F)=C1 1401 [0,2,0,0,0,0|2,0,0]=4 1883 B12R1.511 O=C(O)C1=C(I)C(I)=CC(I)=C1 3825 [0,2,0,0,0,0|2,0,0]=4 1884 B12R1.511 O=C(O)C1=C(O)C(Br)=CC(Br)=C1 3854 [0,2,0,0,0,0|1,0,0]=3 1885 B12R1.511 O=C(O)C1=C(O)C(Cl)=CC(F)=C1 19395 [0,2,0,0,0,0|1,0,0]=3 1886 B12R1.511 O=C(O)C1=CC(Cl)=CC(Cl)=C1O 28619 [0,2,0,0,0,0|1,0,0]=3 1887 B12R1.511 O=[N+]([O-])C1=CC(Br)=CC(F)=C1O 2842 [0,2,0,0,0,0|2,0,0]=4 1888 B12R1.511 O=[N+]([O-])C1=CC(Cl)=CC(Br)=C1O 35131 [0,2,0,0,0,0|2,0,0]=4 1889 B12R1.511 O=[N+]([O-])C1=CC(Cl)=CC(Cl)=C1O 22918 [0,2,0,0,0,0|2,0,0]=4 1890 B12R1.893 CC(=O)C1=C(F)C(F)=C(C)C=C1 29150 [0,2,0,0,0,0|2,0,0]=4 1891 B12R1.893 CC(=O)C1=C(F)C(F)=C(F)C=C1 8438 [0,2,0,0,0,0|2,0,0]=4 1892 B12R1.893 CC(=O)C1=C(F)C(O)=C(F)C=C1 29144 [0,2,0,0,0,0|2,0,0]=4 1893 B12R1.893 CC(=O)C1=C(O)C(O)=C(O)C=C1 3246 [0,2,0,0,0,0|1,0,0]=3 1894 B12R1.893 CC1=C(C(=O)O)C=CC(F)=C1F 8240 [0,2,0,0,0,0|2,0,0]=4 1895 B12R1.893 CC1=C(C)C(N)=C(C(=O)O)C=C1 4683 [0,2,0,0,0,0|2,0,0]=4 1896 B12R1.893 CC1=C(F)C=CC(C(=O)O)=C1F 4943 [0,2,0,0,0,0|2,0,0]=4 1897 B12R1.893 CC1=C(N)C=CC(C(=O)O)=C1C 28520 [0,2,0,0,0,0|2,0,0]=4 1898 B12R1.893 CC1=CC=C([N+](=O)[O-])C(O)=C1Br 33936 [0,2,0,0,0,0|2,0,0]=4 1899 B12R1.893 NC1=C(C(=O)O)C=CC(Br)=C1F 30699 [0,2,0,0,0,0|2,0,0]=4 1900 B12R1.893 NC1=C(C(=O)O)C=CC(Cl)=C1Cl 17205 [0,2,0,0,0,0|2,0,0]=4 1901 B12R1.893 NC1=C(C(=O)O)C=CC(F)=C1F 28515 [0,2,0,0,0,0|2,0,0]=4 1902 B12R1.893 NC1=C(F)C(F)=C(C(=O)O)C=C1 4674 [0,2,0,0,0,0|2,0,0]=4 1903 B12R1.893 O=C(Cl)C1=C(F)C(Cl)=C(F)C=C1 4743 [0,2,0,0,0,0|2,0,0]=4 1904 B12R1.893 O=C(Cl)C1=C(F)C(F)=C(F)C=C1 28695 [0,2,0,0,0,0|2,0,0]=4 1905 B12R1.893 O=C(O)C1=C(Br)C(F)=C(F)C=C1 4992 [0,2,0,0,0,0|2,0,0]=4 1906 B12R1.893 O=C(O)C1=C(Br)C(O)=C(Br)C=C1 33930 [0,2,0,0,0,0|2,0,0]=4 1907 B12R1.893 O=C(O)C1=C(Cl)C(Cl)=C(F)C=C1 4613 [0,2,0,0,0,0|2,0,0]=4 1908 B12R1.893 O=C(O)C1=C(Cl)C(F)=C(F)C=C1 30701 [0,2,0,0,0,0|2,0,0]=4 1909 B12R1.893 O=C(O)C1=C(Cl)C(O)=C(Br)C=C1 33931 [0,2,0,0,0,0|2,0,0]=4 1910 B12R1.893 O=C(O)C1=C(F)C(Cl)=C(F)C=C1 2217 [0,2,0,0,0,0|2,0,0]=4 1911 B12R1.893 O=C(O)C1=C(F)C(F)=C(Br)C=C1 4994 [0,2,0,0,0,0|2,0,0]=4 1912 B12R1.893 O=C(O)C1=C(F)C(F)=C(Cl)C=C1 4744 [0,2,0,0,0,0|2,0,0]=4 1913 B12R1.893 O=C(O)C1=C(F)C(F)=C(F)C=C1 1345 [0,2,0,0,0,0|2,0,0]=4 1914 B12R1.893 O=C(O)C1=C(F)C(F)=C(O)C=C1 2609 [0,2,0,0,0,0|2,0,0]=4 1915 B12R1.893 O=C(O)C1=C(F)C(O)=C(F)C=C1 4937 [0,2,0,0,0,0|2,0,0]=4 1916 B12R1.893 O=C(O)C1=C(O)C(F)=C(F)C=C1 28626 [0,2,0,0,0,0|1,0,0]=3 1917 B12R1.893 O=C(O)C1=C(O)C(O)=C(Br)C=C1 33932 [0,2,0,0,0,0|1,0,0]=3 1918 B12R1.893 O=C([O-])C1=C(F)C(F)=C(F)C=C1 28694 [0,2,0,0,0,0|2,0,0]=4 1919 B12R1.893 O=[N+]([O-])C1=CC=C(F)C(F)=C1O 2873 [0,2,0,0,0,0|2,0,0]=4 1920 B12R1.232 CC(=O)C1=C(Cl)C=C(Cl)C(F)=C1 3374 [0,2,0,0,0,0|2,0,0]=4 1921 B12R1.232 CC(=O)C1=C(Cl)C=C(F)C(F)=C1 23586 [0,2,0,0,0,0|2,0,0]=4 1922 B12R1.232 CC(=O)C1=C(F)C=C(C)C(Cl)=C1 31201 [0,2,0,0,0,0|2,0,0]=4 1923 B12R1.232 CC(=O)C1=C(F)C=C(F)C(Br)=C1 22074 [0,2,0,0,0,0|2,0,0]=4 1924 B12R1.232 CC(=O)C1=C(F)C=C(F)C(F)=C1 4288 [0,2,0,0,0,0|2,0,0]=4 1925 B12R1.232 CC(=O)C1=C(N)C=C(Br)C(F)=C1 29128 [0,2,0,0,0,0|2,0,0]=4 1926 B12R1.232 CC(=O)C1=C(N)C=C(Cl)C(Br)=C1 29247 [0,2,0,0,0,0|2,0,0]=4 1927 B12R1.232 CC(=O)C1=C(N)C=C(Cl)C(F)=C1 29129 [0,2,0,0,0,0|2,0,0]=4 1928 B12R1.232 CC(=O)C1=C(O)C=C(C)C(C)=C1 29281 [0,2,0,0,0,0|1,0,0]=3 1929 B12R1.232 CC(=O)C1=C(O)C=C(F)C(F)=C1 29146 [0,2,0,0,0,0|1,0,0]=3 1930 B12R1.232 CC(=O)c1cc(F)c(Br)cc1F 27507 [0,2,0,0,0,0|2,0,0]=4 1931 B12R1.232 CC1=C(C(=O)O)C=C(F)C(F)=C1 8243 [0,2,0,0,0,0|2,0,0]=4 1932 B12R1.232 CC1=CC(Br)=C(C(=O)O)C=C1F 1364 [0,2,0,0,0,0|2,0,0]=4 1933 B12R1.232 CC1=CC(C(=O)O)=C(Br)C=C1F 1362 [0,2,0,0,0,0|2,0,0]=4 1934 B12R1.232 CC1=CC(C(=O)O)=C(F)C=C1Br 1365 [0,2,0,0,0,0|2,0,0]=4 1935 B12R1.232 CC1=CC(C(=O)O)=C(F)C=C1F 8228 [0,2,0,0,0,0|2,0,0]=4 1936 B12R1.232 CC1=CC(C(=O)O)=C(N)C=C1Cl 15932 [0,2,0,0,0,0|2,0,0]=4 1937 B12R1.232 CC1=CC(C)=C(C(=O)O)C=C1Br 27675 [0,2,0,0,0,0|2,0,0]=4 1938 B12R1.232 CC1=CC(C)=C(C(=O)O)C=C1C 15442 [0,2,0,0,0,0|2,0,0]=4 1939 B12R1.232 CC1=CC(Cl)=C(C(=O)O)C=C1Cl 30698 [0,2,0,0,0,0|2,0,0]=4 1940 B12R1.232 CC1=CC(Cl)=C(C(=O)O)C=C1F 30543 [0,2,0,0,0,0|2,0,0]=4 1941 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1Br 35901 [0,2,0,0,0,0|2,0,0]=4 1942 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1Cl 23768 [0,2,0,0,0,0|2,0,0]=4 1943 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1F 4944 [0,2,0,0,0,0|2,0,0]=4 1944 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1O 28642 [0,2,0,0,0,0|2,0,0]=4 1945 B12R1.232 CC1=CC(N)=C(C(=O)O)C=C1C 28519 [0,2,0,0,0,0|2,0,0]=4 1946 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1I 28668 [0,2,0,0,0,0|1,0,0]=3 1947 B12R1.232 CC1=NC(N)=C(C(N)=O)C=C1Br 5714 [0,2,0,0,0,0|2,0,0]=4 1948 B12R1.232 NC(=O)C1=C(Cl)N=C(Cl)C(Cl)=C1 32287 [0,2,0,0,0,0|2,0,0]=4 1949 B12R1.232 NC1=C(C(=O)O)C=C(Br)C(Br)=C1 27557 [0,2,0,0,0,0|2,0,0]=4 1950 B12R1.232 NC1=C(C(=O)O)C=C(Cl)C(Br)=C1 19833 [0,2,0,0,0,0|2,0,0]=4 1951 B12R1.232 NC1=C(C(=O)O)C=C(Cl)C(Cl)=C1 4657 [0,2,0,0,0,0|2,0,0]=4 1952 B12R1.232 NC1=C(C(=O)O)C=C(F)C(Cl)=C1 30560 [0,2,0,0,0,0|2,0,0]=4 1953 B12R1.232 NC1=C(C(=O)O)C=C(F)C(F)=C1 4675 [0,2,0,0,0,0|2,0,0]=4 1954 B12R1.232 NC1=CC(C(=O)O)=C(Cl)C=C1Cl 28514 [0,2,0,0,0,0|2,0,0]=4 1955 B12R1.232 NC1=CC(F)=C(C(=O)O)C=C1F 8202 [0,2,0,0,0,0|2,0,0]=4 1956 B12R1.232 O=C(Cl)C1=C(Cl)C=C(Cl)C(F)=C1 28614 [0,2,0,0,0,0|2,0,0]=4 1957 B12R1.232 O=C(Cl)C1=C(F)C=C(Cl)C(F)=C1 28586 [0,2,0,0,0,0|2,0,0]=4 1958 B12R1.232 O=C(Cl)C1=C(F)C=C(F)C(F)=C1 9716 [0,2,0,0,0,0|2,0,0]=4 1959 B12R1.232 O=C(O)C1=C(Br)C=C(F)C(F)=C1 4991 [0,2,0,0,0,0|2,0,0]=4 1960 B12R1.232 O=C(O)C1=C(Br)C=C(O)C(Br)=C1 30597 [0,2,0,0,0,0|2,0,0]=4 1961 B12R1.232 O=C(O)C1=C(Cl)C=C(Br)C(Cl)=C1 30480 [0,2,0,0,0,0|2,0,0]=4 1962 B12R1.232 O=C(O)C1=C(Cl)C=C(Br)C(F)=C1 1361 [0,2,0,0,0,0|2,0,0]=4 1963 B12R1.232 O=C(O)C1=C(Cl)C=C(Cl)C(F)=C1 1338 [0,2,0,0,0,0|2,0,0]=4 1964 B12R1.232 O=C(O)C1=C(Cl)C=C(F)C(F)=C1 1339 [0,2,0,0,0,0|2,0,0]=4 1965 B12R1.232 O=C(O)C1=C(F)C=C(Br)C(F)=C1 28555 [0,2,0,0,0,0|2,0,0]=4 1966 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(Br)=C1 3556 [0,2,0,0,0,0|2,0,0]=4 1967 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(Cl)=C1 4615 [0,2,0,0,0,0|2,0,0]=4 1968 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(F)=C1 1367 [0,2,0,0,0,0|2,0,0]=4 1969 B12R1.232 O=C(O)C1=C(F)C=C(F)C(Cl)=C1 1343 [0,2,0,0,0,0|2,0,0]=4 1970 B12R1.232 O=C(O)C1=C(F)C=C(F)C(F)=C1 1346 [0,2,0,0,0,0|2,0,0]=4 1971 B12R1.232 O=C(O)C1=C(I)C=C(F)C(F)=C1 18500 [0,2,0,0,0,0|2,0,0]=4 1972 B12R1.232 O=C(O)C1=C(O)C=C(F)C(Cl)=C1 30645 [0,2,0,0,0,0|1,0,0]=3 1973 B12R1.232 O=C([O-])C1=C(F)C=C(F)C(F)=C1 28699 [0,2,0,0,0,0|2,0,0]=4 1974 B12R1.232 O=[N+]([O-])C1=C(O)C=C(Cl)C(Cl)=C1 31123 [0,2,0,0,0,0|2,0,0]=4 1975 B12R1.232 O=[N+]([O-])C1=C(O)C=C(Cl)C(F)=C1 31100 [0,2,0,0,0,0|2,0,0]=4 1976 B12R1.232 O=[N+]([O-])C1=C(O)C=C(F)C(F)=C1 10661 [0,2,0,0,0,0|2,0,0]=4 1977 B12R1.452 CC(=O)C1=C(O)C=C(C#N)C=C1 29274 [0,2,0,0,0,0|1,0,0]=3 1978 B12R1.452 CC1=C(C(=O)O)C=CC(C#N)=C1 30565 [0,2,0,0,0,0|2,0,0]=4 1979 B12R1.452 CNC1=CC(Cl)=C(C(=O)O)C=C1 24164 [0,2,0,0,0,0|2,0,0]=4 1980 B12R1.452 COC1=CC(Br)=C(C(=O)O)C=C1 17209 [0,2,0,0,0,0|2,0,0]=4 1981 B12R1.452 COC1=CC(C)=C(C(=O)O)C=C1 30466 [0,2,0,0,0,0|2,0,0]=4 1982 B12R1.452 COC1=CC(Cl)=C(C(=O)O)C=C1 14030 [0,2,0,0,0,0|2,0,0]=4 1983 B12R1.452 COC1=CC(F)=C(C(=O)Cl)C=C1 28648 [0,2,0,0,0,0|2,0,0]=4 1984 B12R1.452 COC1=CC(F)=C(C(=O)O)C=C1 4965 [0,2,0,0,0,0|2,0,0]=4 1985 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 2548 [0,2,0,0,0,0|2,0,0]=4 1986 B12R1.452 COC1=CC(N)=C(C(=O)O)C=C1 11856 [0,2,0,0,0,0|2,0,0]=4 1987 B12R1.452 COC1=CC(N)=C(C(C)=O)C=C1 29252 [0,2,0,0,0,0|2,0,0]=4 1988 B12R1.452 COC1=CC(O)=C(C(=O)O)C=C1 18895 [0,2,0,0,0,0|1,0,0]=3 1989 B12R1.452 COC1=CC(O)=C(C(C)=O)C=C1 3271 [0,2,0,0,0,0|1,0,0]=3 1990 B12R1.452 COC1=CC(O)=C([N+](=O)[O-])C=C1 22230 [0,2,0,0,0,0|2,0,0]=4 1991 B12R1.452 N#CC1=CC(Br)=C(C(=O)O)C=C1 30631 [0,2,0,0,0,0|2,0,0]=4 1992 B12R1.452 N#CC1=CC(F)=C(C(=O)O)C=C1 4603 [0,2,0,0,0,0|2,0,0]=4 1993 B12R1.452 N#CC1=CC(N)=C(C(=O)O)C=C1 30630 [0,2,0,0,0,0|2,0,0]=4 1994 B12R1.1703 CC1=CC(C)=C(C(=O)CBr)C=C1 16796 [0,2,0,0,0,0|2,0,0]=4 1995 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Cl)C=C1 24408 [0,2,0,0,0,0|2,0,0]=4 1996 B12R1.1703 CCC(=O)C1=C(F)C=C(Br)C=C1 27629 [0,2,0,0,0,0|2,0,0]=4 1997 B12R1.1703 CNC(=O)C1=C(F)C=C(Br)C=C1 27568 [0,2,0,0,0,0|1,0,0]=3 1998 B12R1.1703 CNC(=O)C1=C(F)C=C(I)C=C1 28779 [0,2,0,0,0,0|1,0,0]=3 1999 B12R1.1703 CNC(=O)C1=C(F)C=C(N)C=C1 22934 [0,2,0,0,0,0|1,0,0]=3 2000 B12R1.1703 CNC(=O)c1ccc(N)cc1F 34919 [0,2,0,0,0,0|1,0,0]=3 2001 B12R1.1703 COC(=O)C1=C(Br)C=C(C)C=C1 14035 [0,2,0,0,0,0|2,0,0]=4 2002 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)C=C1 28546 [0,2,0,0,0,0|2,0,0]=4 2003 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=C1 28558 [0,2,0,0,0,0|2,0,0]=4 2004 B12R1.1703 COC(=O)C1=C(Br)C=C(N)C=C1 30570 [0,2,0,0,0,0|2,0,0]=4 2005 B12R1.1703 COC(=O)C1=C(C)C=C(Br)C=C1 21350 [0,2,0,0,0,0|2,0,0]=4 2006 B12R1.1703 COC(=O)C1=C(C)C=C(Cl)C=C1 30758 [0,2,0,0,0,0|2,0,0]=4 2007 B12R1.1703 COC(=O)C1=C(C)C=C(N)C=C1 13977 [0,2,0,0,0,0|2,0,0]=4 2008 B12R1.1703 COC(=O)C1=C(Cl)C=C(Br)C=C1 26459 [0,2,0,0,0,0|2,0,0]=4 2009 B12R1.1703 COC(=O)C1=C(Cl)C=C(Cl)C=C1 3713 [0,2,0,0,0,0|2,0,0]=4 2010 B12R1.1703 COC(=O)C1=C(Cl)C=C(F)C=C1 18760 [0,2,0,0,0,0|2,0,0]=4 2011 B12R1.1703 COC(=O)C1=C(Cl)C=C(N)C=C1 4647 [0,2,0,0,0,0|2,0,0]=4 2012 B12R1.1703 COC(=O)C1=C(F)C=C(Br)C=C1 18624 [0,2,0,0,0,0|2,0,0]=4 2013 B12R1.1703 COC(=O)C1=C(F)C=C(F)C=C1 15678 [0,2,0,0,0,0|2,0,0]=4 2014 B12R1.1703 COC(=O)C1=C(F)C=C(I)C=C1 28644 [0,2,0,0,0,0|2,0,0]=4 2015 B12R1.1703 COC(=O)C1=C(F)C=C(N)C=C1 28527 [0,2,0,0,0,0|2,0,0]=4 2016 B12R1.1703 COC(=O)C1=C(F)C=C(O)C=C1 28639 [0,2,0,0,0,0|2,0,0]=4 2017 B12R1.1703 COC(=O)C1=C(N)C=C(Br)C=C1 4635 [0,2,0,0,0,0|2,0,0]=4 2018 B12R1.1703 COC(=O)C1=C(N)C=C(C)C=C1 30496 [0,2,0,0,0,0|2,0,0]=4 2019 B12R1.1703 COC(=O)C1=C(N)C=C(Cl)C=C1 4643 [0,2,0,0,0,0|2,0,0]=4 2020 B12R1.1703 COC(=O)C1=C(N)C=C(F)C=C1 28524 [0,2,0,0,0,0|2,0,0]=4 2021 B12R1.1703 COC(=O)C1=C(O)C=C(Br)C=C1 30520 [0,2,0,0,0,0|1,0,0]=3 2022 B12R1.1703 COC(=O)C1=C(O)C=C(N)C=C1 32352 [0,2,0,0,0,0|1,0,0]=3 2023 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 35728 [0,2,0,0,0,0|1,0,0]=3 2024 B12R1.1703 COC(=O)C1=CC=C(F)C=C1O 4089 [0,2,0,0,0,0|1,0,0]=3 2025 B12R1.1703 COC(=O)C1=CN=C(O)C=C1O 25858 [0,2,0,0,0,0|2,0,0]=4 2026 B12R1.1703 COC(=O)c1ccc(Br)cc1Br 24437 [0,2,0,0,0,0|2,0,0]=4 2027 B12R1.1703 NCC(=O)C1=C(Cl)C=C(Cl)C=C1 18183 [0,2,0,0,0,0|1,0,0]=3 2028 B12R1.1703 NCC(=O)C1=C(F)C=C(F)C=C1 16751 [0,2,0,0,0,0|1,0,0]=3 2029 B12R1.1703 NCC(=O)C1=C(F)C=C(F)C=C1 22349 [0,2,0,0,0,0|1,0,0]=3 2030 B12R1.1703 NNC(=O)C1=C(F)C=C(F)C=C1 3460 [0,2,0,0,0,0|1,0,0]=3 2031 B12R1.1703 N\C(=N/O)C1=C(Cl)C=C(Cl)C=C1 31887 [0,2,0,0,0,0|1,0,1]=4 2032 B12R1.1703 O=C(CBr)C1=C(Cl)C=C(Cl)C=C1 13425 [0,2,0,0,0,0|2,0,0]=4 2033 B12R1.1703 O=C(CBr)C1=C(F)C=C(F)C=C1 29133 [0,2,0,0,0,0|2,0,0]=4 2034 B12R1.1703 O=C(CCl)C1=C(Cl)C=C(Cl)C=C1 7499 [0,2,0,0,0,0|2,0,0]=4 2035 B12R1.1703 O=C(CCl)C1=C(F)C=C(F)C=C1 3267 [0,2,0,0,0,0|2,0,0]=4 2036 B12R1.1703 O=CC(=O)C1=C(F)C=C(F)C=C1 12166 [0,2,0,0,0,0|2,0,0]=4 2037 B12R1.354 CCC(=O)C1=C(F)C=CC(Br)=C1 20350 [0,2,0,0,0,0|2,0,0]=4 2038 B12R1.354 CCC(=O)C1=C(N)C=CC(Br)=C1 34488 [0,2,0,0,0,0|2,0,0]=4 2039 B12R1.354 COC(=O)C1=C(Br)C=CC(Br)=C1 3972 [0,2,0,0,0,0|2,0,0]=4 2040 B12R1.354 COC(=O)C1=C(Br)C=CC(C)=C1 30710 [0,2,0,0,0,0|2,0,0]=4 2041 B12R1.354 COC(=O)C1=C(Br)C=CC(Cl)=C1 11238 [0,2,0,0,0,0|2,0,0]=4 2042 B12R1.354 COC(=O)C1=C(Br)C=CC(F)=C1 28559 [0,2,0,0,0,0|2,0,0]=4 2043 B12R1.354 COC(=O)C1=C(Br)C=CC(F)=C1 29426 [0,2,0,0,0,0|2,0,0]=4 2044 B12R1.354 COC(=O)C1=C(C)C=CC(Br)=C1 10936 [0,2,0,0,0,0|2,0,0]=4 2045 B12R1.354 COC(=O)C1=C(C)C=CC(Cl)=C1 30530 [0,2,0,0,0,0|2,0,0]=4 2046 B12R1.354 COC(=O)C1=C(C)C=CC(F)=C1 28656 [0,2,0,0,0,0|2,0,0]=4 2047 B12R1.354 COC(=O)C1=C(C)C=CC(I)=C1 28677 [0,2,0,0,0,0|2,0,0]=4 2048 B12R1.354 COC(=O)C1=C(C)C=CC(O)=C1 28670 [0,2,0,0,0,0|2,0,0]=4 2049 B12R1.354 COC(=O)C1=C(Cl)C=CC(Br)=C1 28547 [0,2,0,0,0,0|2,0,0]=4 2050 B12R1.354 COC(=O)C1=C(Cl)C=CC(C)=C1 30581 [0,2,0,0,0,0|2,0,0]=4 2051 B12R1.354 COC(=O)C1=C(Cl)C=CC(Cl)=C1 3714 [0,2,0,0,0,0|2,0,0]=4 2052 B12R1.354 COC(=O)C1=C(Cl)C=CC(O)=C1 30711 [0,2,0,0,0,0|2,0,0]=4 2053 B12R1.354 COC(=O)C1=C(F)C=CC(Br)=C1 28565 [0,2,0,0,0,0|2,0,0]=4 2054 B12R1.354 COC(=O)C1=C(F)C=CC(I)=C1 28645 [0,2,0,0,0,0|2,0,0]=4 2055 B12R1.354 COC(=O)C1=C(F)C=CC(O)=C1 28640 [0,2,0,0,0,0|2,0,0]=4 2056 B12R1.354 COC(=O)C1=C(I)C=CC(Br)=C1 26364 [0,2,0,0,0,0|2,0,0]=4 2057 B12R1.354 COC(=O)C1=C(N)C=CC(Br)=C1 3344 [0,2,0,0,0,0|2,0,0]=4 2058 B12R1.354 COC(=O)C1=C(N)C=CC(Cl)=C1 3346 [0,2,0,0,0,0|2,0,0]=4 2059 B12R1.354 COC(=O)C1=C(N)C=CC(F)=C1 3558 [0,2,0,0,0,0|2,0,0]=4 2060 B12R1.354 COC(=O)C1=C(N)C=CC(I)=C1 3354 [0,2,0,0,0,0|2,0,0]=4 2061 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 19740 [0,2,0,0,0,0|1,0,0]=3 2062 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 30490 [0,2,0,0,0,0|1,0,0]=3 2063 B12R1.354 COC(=O)C1=C(O)C=CC(F)=C1 4087 [0,2,0,0,0,0|1,0,0]=3 2064 B12R1.354 COC(=O)C1=C(O)C=CC(O)=C1 26394 [0,2,0,0,0,0|1,0,0]=3 2065 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1O 23616 [0,2,0,0,0,0|2,0,0]=4 2066 B12R1.354 O=C(CCl)C1=C(F)C=CC(F)=C1 3268 [0,2,0,0,0,0|2,0,0]=4 2067 B12R1.453 CC(=O)C1=C(F)C=CC(C#N)=C1 31227 [0,2,0,0,0,0|2,0,0]=4 2068 B12R1.453 CC1=C(C(=O)O)C=C(C=O)C=C1 30646 [0,2,0,0,0,0|2,0,0]=4 2069 B12R1.453 CCC1=CC(C(=O)O)=C(N)C=C1 33560 [0,2,0,0,0,0|2,0,0]=4 2070 B12R1.453 CCC1=CC([N+](=O)[O-])=C(O)C=C1 27788 [0,2,0,0,0,0|2,0,0]=4 2071 B12R1.453 COC1=CC(C(=O)O)=C(Br)C=C1 2674 [0,2,0,0,0,0|2,0,0]=4 2072 B12R1.453 COC1=CC(C(=O)O)=C(C)C=C1 28681 [0,2,0,0,0,0|2,0,0]=4 2073 B12R1.453 COC1=CC(C(=O)O)=C(Cl)C=C1 4563 [0,2,0,0,0,0|2,0,0]=4 2074 B12R1.453 COC1=CC(C(=O)O)=C(F)C=C1 4966 [0,2,0,0,0,0|2,0,0]=4 2075 B12R1.453 COC1=CC(C(=O)O)=C(N)C=C1 2544 [0,2,0,0,0,0|2,0,0]=4 2076 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 13248 [0,2,0,0,0,0|1,0,0]=3 2077 B12R1.453 COC1=CC([N+](=O)[O-])=C(O)C=C1 16829 [0,2,0,0,0,0|2,0,0]=4 2078 B12R1.453 CSC1=CC(C(=O)O)=C(Cl)C=C1 10797 [0,2,0,0,0,0|2,0,0]=4 2079 B12R1.453 N#CC1=CC(C(=O)O)=C(Br)C=C1 28548 [0,2,0,0,0,0|2,0,0]=4 2080 B12R1.453 N#CC1=CC(C(=O)O)=C(F)C=C1 4605 [0,2,0,0,0,0|2,0,0]=4 2081 B12R1.453 N#CC1=CC(C(=O)O)=C(I)C=C1 27772 [0,2,0,0,0,0|2,0,0]=4 2082 B12R1.453 N#CC1=CC(C(=O)O)=C(N)C=C1 30599 [0,2,0,0,0,0|2,0,0]=4 2083 B12R1.453 N#CC1=CC([N+](=O)[O-])=C(O)C=C1 19690 [0,2,0,0,0,0|2,0,0]=4 2084 B12R1.453 NC(=O)C1=C(O)C=CC(C=O)=C1 30314 [0,2,0,0,0,0|0,0,0]=2 2085 B12R1.453 O=CC1=CC([N+](=O)[O-])=C(O)C=C1 8135 [0,2,0,0,0,0|2,0,0]=4 2086 B12R1.453 O=CC1=CC=C(O)C(C(=O)O)=C1 10569 [0,2,0,0,0,0|1,0,0]=3 2087 B12R1.453 O=[N+]([O-])C1=C(O)C=CC(CO)=C1 22917 [0,2,0,0,0,0|2,0,0]=4 2088 B12R1.308 CC1=C(C(=O)CC#N)C=CC=C1 12074 [0,2,0,0,0,0|1,0,1]=4 2089 B12R1.308 CCCC(=O)C1=C(O)C=CC=C1 21426 [0,2,0,0,0,0|1,0,0]=3 2090 B12R1.308 CCOC(=O)C1=C(Br)C=CC=C1 3937 [0,2,0,0,0,0|2,0,0]=4 2091 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 15493 [0,2,0,0,0,0|2,0,0]=4 2092 B12R1.308 CCOC(=O)C1=C(Cl)C=CC=C1 3703 [0,2,0,0,0,0|2,0,0]=4 2093 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 3469 [0,2,0,0,0,0|2,0,0]=4 2094 B12R1.308 CCOC(=O)C1=C(I)C=CC=C1 3881 [0,2,0,0,0,0|2,0,0]=4 2095 B12R1.308 CCOC(=O)C1=C(O)C=NC=C1 24103 [0,2,0,0,0,0|2,0,0]=4 2096 B12R1.308 CCOC(=O)C1=CC=CC=C1N 13628 [0,2,0,0,0,0|2,0,0]=4 2097 B12R1.308 CCOC(=O)C1=CC=CC=C1S 6857 [0,2,0,0,0,0|1,1,0]=4 2098 B12R1.308 N#CCC(=O)C1=C(Br)C=CC=C1 12044 [0,2,0,0,0,0|1,0,1]=4 2099 B12R1.308 N#CCC(=O)C1=C(Cl)C=CC=C1 12047 [0,2,0,0,0,0|1,0,1]=4 2100 B12R1.308 N#CCC(=O)C1=C(F)C=CC=C1 12050 [0,2,0,0,0,0|1,0,1]=4 2101 B12R1.308 N#CCC(=O)C1=C(I)C=CC=C1 12041 [0,2,0,0,0,0|1,0,1]=4 2102 B10R1.66 O=C(O)\C=C\C1=CC=CO1 6950 [0,0,1,1,0,0|1,0,0]=3 2103 B10R1.66 O=C(O)\C=C\C1=CC=CS1 22898 [0,0,1,1,0,0|1,1,0]=4 2104 B10R2.7 B1OC2=C(C=CC=C2)O1 18191 [1,0,0,1,0,0|2,0,0]=4 2105 B10R2.7 C1=CC2=C(C=C1)OC=C2 7003 [1,0,0,1,0,0|1,0,0]=3 2106 B10R2.7 C1=CC2=C(C=C1)OC=N2 21884 [1,0,0,1,0,0|2,0,0]=4 2107 B10R2.7 C1=CC2=C(C=C1)OCC2 6931 [1,0,0,1,0,0|1,0,1]=4 2108 B10R2.7 C1=CC2=C(C=C1)OCO2 2537 [1,0,0,1,0,0|2,0,0]=4 2109 B10R2.7 C1=CC2=C(C=C1)SC=C2 13545 [1,0,0,1,0,0|1,1,0]=4 2110 B10R2.7 C1=CC2=NNC=C2C=N1 33786 [1,0,0,1,0,0|2,0,0]=4 2111 B10R2.7 C1=CC=C2CC=CC2=C1 20728 [1,0,0,1,0,0|2,0,0]=4 2112 B10R2.7 C1=CC=C2CNCC2=C1 16248 [1,0,0,1,0,0|1,0,1]=4 2113 B10R2.7 C1=CC=C2CNCC2=C1 16512 [1,0,0,1,0,0|1,0,1]=4 2114 B10R2.7 C1=CC=C2CNCC2=C1 33470 [1,0,0,1,0,0|1,0,1]=4 2115 B10R2.7 C1=CC=C2NN=CC2=C1 15665 [1,0,0,1,0,0|1,0,1]=4 2116 B12R2.24 NC1=CC2=CC=CC=C2C=C1 23236 [0,0,0,1,0,1|2,0,0]=4 2117 B12R2.24 NC1=CC2=CC=CC=C2C=N1 6217 [0,0,0,1,0,1|2,0,0]=4 2118 B12R2.24 NC1=CC2=CC=CC=C2N=C1 12769 [0,0,0,1,0,1|2,0,0]=4 2119 B12R2.24 NC1=NC2=CC=CC=C2C=C1 5818 [0,0,0,1,0,1|2,0,0]=4 2120 B12R2.24 NC1=NC2=CC=CC=C2N=C1 15443 [0,0,0,1,0,1|2,0,0]=4 2121 B12R2.24 O=C1C=CC2=CC=CC=C2O1 21620 [0,0,0,1,0,1|2,0,0]=4 2122 B12R2.24 O=C1CC2=CC=CC=C2CO1 22155 [0,0,0,1,0,1|2,0,0]=4 2123 B12R2.24 O=C1CCC2=CC=CC=C2C1 17934 [0,0,0,1,0,1|2,0,0]=4 2124 B12R2.24 O=C1COC2=C(C=CC=C2)N1 18791 [0,0,0,1,0,1|1,0,0]=3 2125 B12R2.24 O=C1COC2=CC=CC=C2C1 9704 [0,0,0,1,0,1|1,0,0]=3 2126 B12R2.202 CC1=C2NC(=O)NC2=NC=C1 18670 [0,0,0,1,0,1|2,0,0]=4 2127 B12R2.202 CC1=CC2=C(O)C=CC=C2N1 9379 [0,0,0,1,0,1|1,0,0]=3 2128 B12R2.202 CC1=CC=CC2=C1N=C(N)S2 8423 [0,0,0,1,0,1|1,1,0]=4 2129 B12R2.202 CC1=CC=CC2=C1NC(=O)S2 21873 [0,0,0,1,0,1|2,0,0]=4 2130 B12R2.202 NC1=CC=CC2=C1SC(N)=N2 24299 [0,0,0,1,0,1|2,0,0]=4 2131 B12R2.202 NC1=NC2=C(C=CC=C2Br)S1 21846 [0,0,0,1,0,1|1,1,0]=4 2132 B12R2.202 NC1=NC2=C(C=CC=C2Cl)S1 21701 [0,0,0,1,0,1|1,1,0]=4 2133 B12R2.202 NC1=NC2=C(C=CC=C2F)S1 21849 [0,0,0,1,0,1|1,1,0]=4 2134 B12R2.202 NC1=NC2=C(C=CC=C2O)S1 13340 [0,0,0,1,0,1|0,1,0]=3 2135 B12R2.202 NC1=NC2=C(S1)C(F)=CC=C2 28930 [0,0,0,1,0,1|2,0,0]=4 2136 B12R2.202 O=C1CC2=C(Br)C=CC=C2N1 7952 [0,0,0,1,0,1|1,0,0]=3 2137 B12R2.202 O=C1CC2=C(Cl)C=CN=C2N1 15482 [0,0,0,1,0,1|2,0,0]=4 2138 B12R2.202 O=C1CC2=CC=CC(Br)=C2C1 18017 [0,0,0,1,0,1|2,0,0]=4 2139 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 8934 [0,0,0,1,0,1|2,0,0]=4 2140 B12R2.202 O=C1CC2=CC=CC(Cl)=C2C1 18014 [0,0,0,1,0,1|2,0,0]=4 2141 B12R2.202 O=C1CC2=CC=CC(Cl)=C2N1 8305 [0,0,0,1,0,1|2,0,0]=4 2142 B12R2.202 O=C1CC2=CC=CC(F)=C2C1 18006 [0,0,0,1,0,1|2,0,0]=4 2143 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 8552 [0,0,0,1,0,1|2,0,0]=4 2144 B12R2.202 O=C1NC2=C(C=CC=C2Cl)S1 21835 [0,0,0,1,0,1|2,0,0]=4 2145 B12R2.202 O=C1NC2=C(C=CC=C2F)S1 21838 [0,0,0,1,0,1|2,0,0]=4 2146 B12R2.202 OC1=CC=CC2=C1NC(=S)O2 19276 [0,0,0,1,0,1|1,0,1]=4 2147 B12R2.1081 NC1=CC=CC2=CC=CC=C12 23886 [0,1,0,1,0,0|2,0,0]=4 2148 B12R2.1081 NC1=CC=NC2=CC=CC=C12 12777 [0,1,0,1,0,0|2,0,0]=4 2149 B12R2.1081 NC1=CN=CC2=CC=CC=C12 12825 [0,1,0,1,0,0|2,0,0]=4 2150 B12R2.1081 NC1=NC=CC2=CC=CC=C21 18941 [0,1,0,1,0,0|2,0,0]=4 2151 B12R2.1081 NC1CCOC2=CC=CC=C21 27739 [0,1,0,1,0,0|1,0,1]=4 2152 B12R2.1081 NC1COCC2=CC=CC=C21 14613 [0,1,0,1,0,0|1,0,1]=4 2153 B12R2.1081 O=C1CCCC2=CC=CC=C12 13786 [0,1,0,1,0,0|2,0,0]=4 2154 B12R2.1081 O=C1CCNC2=CC=CC=C12 21010 [0,1,0,1,0,0|2,0,0]=4 2155 B12R2.1081 O=C1CCOC2=CC=CC=C12 9708 [0,1,0,1,0,0|1,0,0]=3 2156 B12R2.1081 O=C1CCOC2=CC=CN=C12 19245 [0,1,0,1,0,0|2,0,0]=4 2157 B12R2.1081 O=C1N=NNC2=C1C=CC=C2 14541 [0,1,0,1,0,0|1,0,1]=4 2158 B12R2.1081 O=C1NC=CC2=C1C=CC=N2 33501 [0,1,0,1,0,0|2,0,0]=4 2159 B12R2.1081 O=C1NC=CC2=C1N=CC=C2 33410 [0,1,0,1,0,0|2,0,0]=4 2160 B12R2.1081 O=C1NC=CC2=CC=NC=C12 33498 [0,1,0,1,0,0|2,0,0]=4 2161 B12R2.1081 O=C1NC=CC2=CN=CC=C12 17879 [0,1,0,1,0,0|2,0,0]=4 2162 B12R2.1081 O=C1NC=NC2=C1C=CC=N2 23161 [0,1,0,1,0,0|2,0,0]=4 2163 B12R2.1081 O=C1NC=NC2=C1C=CN=C2 35566 [0,1,0,1,0,0|2,0,0]=4 2164 B12R2.1081 O=C1NC=NC2=C1C=NC=C2 33510 [0,1,0,1,0,0|2,0,0]=4 2165 B12R2.1081 O=C1NN=CC2=CC=CC=C12 14642 [0,1,0,1,0,0|1,0,0]=3 2166 B12R2.1081 O=C1NN=CC2=CC=CC=C12 33495 [0,1,0,1,0,0|1,0,0]=3 2167 B12R2.1081 O=C1OCCC2=CC=CC=C12 25692 [0,1,0,1,0,0|2,0,0]=4 2168 B12R2.2028 CC1CC(=O)C2=CC=CC=C21 8833 [0,1,0,1,0,0|2,0,0]=4 2169 B12R2.2028 O=C1NC(=O)C2=C1C=CN=C2 24840 [0,1,0,1,0,0|1,0,1]=4 2170 B12R2.2028 O=C1NC(=O)C2=CC=CC=C12 15713 [0,1,0,1,0,0|0,0,1]=3 2171 B12R2.2028 O=C1NC(=O)C2=CC=CC=C12 35955 [0,1,0,1,0,0|0,0,1]=3 2172 B12R2.2028 O=C1NC(=O)c2ncccc21 8817 [0,1,0,1,0,0|1,0,1]=4 2173 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 17494 [0,1,0,1,0,0|1,0,1]=4 2174 B12R2.2028 O=C1OC(Br)C2=CC=CC=C12 12493 [0,1,0,1,0,0|2,0,0]=4 2175 B12R2.2028 O=C1OC(Cl)C2=CC=CC=C12 12453 [0,1,0,1,0,0|2,0,0]=4 2176 B12R2.2028 O=C1O[IH2](O)C2=C1C=CC=C2 13972 [0,1,0,1,0,0|1,0,0]=3 2177 B12R2.203 BrC1=C2C(=CC=C1)NN=C2I 33043 [0,1,0,1,0,0|2,0,0]=4 2178 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 19846 [0,1,0,1,0,0|2,0,0]=4 2179 B12R2.203 CC1=NNC2=C1C(N)=CC=C2 28072 [0,1,0,1,0,0|2,0,0]=4 2180 B12R2.203 CC1=NNC2=C1C(O)=CC=C2 32534 [0,1,0,1,0,0|1,0,0]=3 2181 B12R2.203 CC1=NNC2=CC=CC(Br)=C21 28048 [0,1,0,1,0,0|2,0,0]=4 2182 B12R2.203 CC1=NNC2=CC=CC(Cl)=C21 32535 [0,1,0,1,0,0|2,0,0]=4 2183 B12R2.203 CC1=NNC2=CC=CC(F)=C21 28053 [0,1,0,1,0,0|2,0,0]=4 2184 B12R2.203 ClC1=C2C(=CC=C1)NN=C2Br 33044 [0,1,0,1,0,0|2,0,0]=4 2185 B12R2.203 ClC1=C2C(=CC=C1)NN=C2I 33045 [0,1,0,1,0,0|2,0,0]=4 2186 B12R2.203 ClC1=NNC2=CC=CC(Br)=C21 20680 [0,1,0,1,0,0|2,0,0]=4 2187 B12R2.203 FC1=C2C(=CC=C1)NN=C2Br 33038 [0,1,0,1,0,0|2,0,0]=4 2188 B12R2.203 FC1=C2C(=CC=C1)NN=C2I 33039 [0,1,0,1,0,0|2,0,0]=4 2189 B12R2.203 NC1=NNC2=CC=CC(Br)=C21 20681 [0,1,0,1,0,0|2,0,0]=4 2190 B12R2.203 NC1=NNC2=CC=CC(Cl)=C21 32562 [0,1,0,1,0,0|2,0,0]=4 2191 B12R2.203 NC1=NNC2=CC=CC(F)=C21 32559 [0,1,0,1,0,0|2,0,0]=4 2192 B12R2.203 NC1=NNC2=CC=CC(I)=C21 32565 [0,1,0,1,0,0|2,0,0]=4 2193 B12R2.203 O=C1CCC2=CC=CC(Br)=C12 13776 [0,1,0,1,0,0|2,0,0]=4 2194 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 13780 [0,1,0,1,0,0|2,0,0]=4 2195 B12R2.203 O=C1CCC2=CC=CC(O)=C12 23254 [0,1,0,1,0,0|1,0,0]=3 2196 B12R2.203 O=C1COC2=C1C(Cl)=CC=C2 17974 [0,1,0,1,0,0|1,0,0]=3 2197 B12R2.203 O=C1COC2=C1C(F)=CC=C2 17972 [0,1,0,1,0,0|1,0,0]=3 2198 B12R2.203 O=C1COC2=C1C(I)=CC=C2 17978 [0,1,0,1,0,0|1,0,0]=3 2199 B12R2.203 O=C1NOC2=C1C(Cl)=CC=C2 17389 [0,1,0,1,0,0|0,0,0]=2 2200 B12R2.203 O=C1OCC2=CC=CC(Cl)=C12 19473 [0,1,0,1,0,0|2,0,0]=4 2201 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 8834 [0,1,0,1,0,0|2,0,0]=4 2202 B12R2.196 CC1=COC2=C1C=CC=C2Br 32467 [0,1,0,1,0,0|2,0,0]=4 2203 B12R2.196 NC1=C2CNC(=O)C2=CC=C1 25126 [0,1,0,1,0,0|1,0,0]=3 2204 B12R2.196 NC1=C2COC(=O)C2=CC=C1 22580 [0,1,0,1,0,0|2,0,0]=4 2205 B12R2.196 NC1=NNC2=C(Br)C=CC=C12 32561 [0,1,0,1,0,0|2,0,0]=4 2206 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 13784 [0,1,0,1,0,0|2,0,0]=4 2207 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 5340 [0,1,0,1,0,0|2,0,0]=4 2208 B12R2.196 O=C1CCC2=C(F)C=CC=C12 13785 [0,1,0,1,0,0|2,0,0]=4 2209 B12R2.196 O=C1CCC2=C(O)C=CC=C12 9659 [0,1,0,1,0,0|2,0,0]=4 2210 B12R2.196 O=C1COC2=C1C=CC=C2Cl 17867 [0,1,0,1,0,0|1,0,0]=3 2211 B12R2.196 O=C1COC2=C1C=CC=C2I 17884 [0,1,0,1,0,0|1,0,0]=3 2212 B12R2.196 O=C1NCC2=C(Br)C=CC=C12 22006 [0,1,0,1,0,0|1,0,0]=3 2213 B12R2.196 O=C1NCC2=C(Cl)C=CC=C12 25129 [0,1,0,1,0,0|1,0,0]=3 2214 B12R2.196 O=C1NCC2=C(F)C=CC=C12 25128 [0,1,0,1,0,0|1,0,0]=3 2215 B12R2.196 O=C1NCC2=C(O)C=CC=C12 25124 [0,1,0,1,0,0|1,0,0]=3 2216 B12R2.196 O=C1OCC2=C(Cl)C=CC=C12 19470 [0,1,0,1,0,0|2,0,0]=4 2217 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 8850 [0,1,0,1,0,0|2,0,0]=4 2218 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 32472 [0,1,0,1,0,0|2,0,0]=4 2219 B12R2.612 CC1=NOC2=C1C=CC(Br)=C2 24259 [0,1,0,1,0,0|1,0,1]=4 2220 B12R2.612 CC1=NOC2=C1C=CC(Cl)=C2 26079 [0,1,0,1,0,0|1,0,1]=4 2221 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 27620 [0,1,0,1,0,0|1,0,1]=4 2222 B12R2.612 NC1=CC=C2C(=O)CCC2=C1 14476 [0,1,0,1,0,0|2,0,0]=4 2223 B12R2.612 NC1=CC=C2C(=O)NCC2=C1 25145 [0,1,0,1,0,0|1,0,0]=3 2224 B12R2.612 NC1=CC=C2C(=O)OCC2=C1 25214 [0,1,0,1,0,0|2,0,0]=4 2225 B12R2.612 NC1=NNC2=CC(Br)=CC=C21 17937 [0,1,0,1,0,0|2,0,0]=4 2226 B12R2.612 NC1=NNC2=CC(Cl)=CC=C21 32564 [0,1,0,1,0,0|2,0,0]=4 2227 B12R2.612 NC1COC2=C1C=CC(Br)=C2 17825 [0,1,0,1,0,0|1,0,1]=4 2228 B12R2.612 NC1COC2=C1C=CC(Br)=C2 23149 [0,1,0,1,0,0|1,0,1]=4 2229 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 8853 [0,1,0,1,0,0|2,0,0]=4 2230 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 2250 [0,1,0,1,0,0|2,0,0]=4 2231 B12R2.612 O=C1CCC2=CC(F)=CC=C12 2388 [0,1,0,1,0,0|2,0,0]=4 2232 B12R2.612 O=C1CCC2=CC(I)=CC=C12 17862 [0,1,0,1,0,0|2,0,0]=4 2233 B12R2.612 O=C1CCC2=CC(O)=CC=C12 8857 [0,1,0,1,0,0|2,0,0]=4 2234 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 17998 [0,1,0,1,0,0|1,0,0]=3 2235 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 17996 [0,1,0,1,0,0|1,0,0]=3 2236 B12R2.612 O=C1COC2=C1C=CC(I)=C2 22336 [0,1,0,1,0,0|1,0,0]=3 2237 B12R2.612 O=C1COC2=C1C=CC(O)=C2 28015 [0,1,0,1,0,0|1,0,0]=3 2238 B12R2.612 O=C1NCC2=CC(Br)=CC=C12 35478 [0,1,0,1,0,0|1,0,0]=3 2239 B12R2.612 O=C1NCC2=CC(F)=CC=C12 31701 [0,1,0,1,0,0|1,0,0]=3 2240 B12R2.612 O=C1NCc2cc(O)ccc21 31625 [0,1,0,1,0,0|1,0,0]=3 2241 B12R2.612 O=C1OCC2=CC(Br)=CC=C12 20699 [0,1,0,1,0,0|2,0,0]=4 2242 B12R2.612 OC1=NOC2=C1C=CC(Cl)=C2 11268 [0,1,0,1,0,0|0,0,2]=4 2243 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 8851 [0,1,0,1,0,0|2,0,0]=4 2244 B12R2.132 CC1=COC2=C1C=C(Br)C=C2 32473 [0,1,0,1,0,0|2,0,0]=4 2245 B12R2.132 NC1=CC=C2COC(=O)C2=C1 6988 [0,1,0,1,0,0|2,0,0]=4 2246 B12R2.132 NC1=CNC2=CC=C(Br)C=C12 9446 [0,1,0,1,0,0|2,0,0]=4 2247 B12R2.132 NC1=NNC2=CC=C(Br)C=C21 18573 [0,1,0,1,0,0|2,0,0]=4 2248 B12R2.132 NC1=NNC2=CC=C(Cl)C=C21 32563 [0,1,0,1,0,0|2,0,0]=4 2249 B12R2.132 NC1=NNC2=CC=C(F)C=C21 32560 [0,1,0,1,0,0|2,0,0]=4 2250 B12R2.132 NC1=NOC2=C1C=C(Br)C=C2 35091 [0,1,0,1,0,0|1,0,0]=3 2251 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 13783 [0,1,0,1,0,0|2,0,0]=4 2252 B12R2.132 O=C1CCC2=CC=C(Cl)C=C12 13778 [0,1,0,1,0,0|2,0,0]=4 2253 B12R2.132 O=C1CCC2=CC=C(F)C=C12 8856 [0,1,0,1,0,0|2,0,0]=4 2254 B12R2.132 O=C1CCC2=CC=C(I)C=C12 17865 [0,1,0,1,0,0|2,0,0]=4 2255 B12R2.132 O=C1CCC2=CC=C(O)C=C12 9660 [0,1,0,1,0,0|2,0,0]=4 2256 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 17377 [0,1,0,1,0,0|1,0,0]=3 2257 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 18004 [0,1,0,1,0,0|1,0,0]=3 2258 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 18005 [0,1,0,1,0,0|1,0,0]=3 2259 B12R2.132 O=C1COC2=C1C=C(Cl)C=C2 18003 [0,1,0,1,0,0|1,0,0]=3 2260 B12R2.132 O=C1NCC2=CC=C(Br)C=C12 27906 [0,1,0,1,0,0|1,0,0]=3 2261 B12R2.132 O=C1NCC2=CC=C(Cl)C=C12 16925 [0,1,0,1,0,0|1,0,0]=3 2262 B12R2.132 O=C1NOC2=C1C=C(Cl)C=C2 24257 [0,1,0,1,0,0|0,0,0]=2 2263 B12R2.132 O=C1OCC2=CC=C(Br)C=C12 22582 [0,1,0,1,0,0|2,0,0]=4 2264 B12R2.132 O=C1OCC2=CC=C(Cl)C=C12 22575 [0,1,0,1,0,0|2,0,0]=4 2265 B12R2.132 O=C1OCC2=CC=C(F)C=C12 22583 [0,1,0,1,0,0|2,0,0]=4 2266 B12R2.132 O=C1OCC2=CC=C(O)C=C12 22513 [0,1,0,1,0,0|2,0,0]=4 2267 B12R2.1 BrCC1=NOC2=C1C=CC=C2 26214 [0,1,0,1,0,0|1,0,1]=4 2268 B12R2.1 O=CC1=CNC2=CC=CC=C12 7247 [0,1,0,1,0,0|2,0,0]=4 2269 B12R2.1 O=CC1=CSC2=C1C=CC=C2 13543 [0,1,0,1,0,0|1,1,0]=4 2270 B12R2.1 O=CC1=NNC2=CC=CC=C21 11853 [0,1,0,1,0,0|1,0,1]=4 2271 B12R2.18 CC1CC2=CC=CC=C2C1=O 2387 [0,1,0,1,0,0|2,0,0]=4 2272 B12R2.18 CN1NC2=CC=CC=C2C1=O 27652 [0,1,0,1,0,0|1,0,0]=3 2273 B12R2.18 CN1SC2=C(C=CC=C2)C1=O 29423 [0,1,0,1,0,0|0,1,0]=3 2274 B12R2.18 Cn1c(=O)oc2ccccc21 8685 [0,1,0,1,0,0|2,0,0]=4 2275 B12R2.18 O=C1C2=CC=CC=C2CC1Br 8852 [0,1,0,1,0,0|2,0,0]=4 2276 B12R2.18 O=C1NC2=CC=CC=C2C1=O 13609 [0,1,0,1,0,0|2,0,0]=4 2277 B8R1.7 CC(=O)C1=CC=CN1 20915 [1,0,0,0,1,0|2,0,0]=4 2278 B8R1.7 CC(=O)C1=CC=CO1 6939 [1,0,0,0,1,0|2,0,0]=4 2279 B8R1.7 CC(=O)C1=CC=CS1 5172 [1,0,0,0,1,0|2,0,0]=4 2280 B8R1.7 CC(=O)C1=CNC=C1 22508 [1,0,0,0,1,0|2,0,0]=4 2281 B8R1.7 CC(=O)C1=CSC=C1 5220 [1,0,0,0,1,0|2,0,0]=4 2282 B8R1.7 CC(C)=C1C=CC=C1 35011 [1,0,0,0,1,0|2,0,0]=4 2283 B8R1.7 NC(=O)C1=NNC=C1 14330 [1,0,0,0,1,0|2,0,0]=4 2284 B8R1.7 NC(=S)C1=CC=CS1 32072 [1,0,0,0,1,0|1,1,0]=4 2285 B8R1.7 O=C(Cl)C1=CC=CO1 19997 [1,0,0,0,1,0|2,0,0]=4 2286 B8R1.7 O=C(Cl)C1=CC=CS1 5166 [1,0,0,0,1,0|2,0,0]=4 2287 B8R1.7 O=C(Cl)C1=CSC=C1 5597 [1,0,0,0,1,0|2,0,0]=4 2288 B8R1.7 O=C(O)C1=CC=CN1 15698 [1,0,0,0,1,0|2,0,0]=4 2289 B8R1.7 O=C(O)C1=CC=CO1 6946 [1,0,0,0,1,0|2,0,0]=4 2290 B8R1.7 O=C(O)C1=CC=CS1 5157 [1,0,0,0,1,0|2,0,0]=4 2291 B8R1.7 O=C(O)C1=CNC=C1 8345 [1,0,0,0,1,0|2,0,0]=4 2292 B8R1.7 O=C(O)C1=COC=C1 6945 [1,0,0,0,1,0|2,0,0]=4 2293 B8R1.7 O=C(O)C1=CSC=C1 7735 [1,0,0,0,1,0|2,0,0]=4 2294 B8R1.7 O=C(O)[C-]1C=CC=C1 10724 [1,0,0,0,1,0|1,0,1]=4 2295 B8R1.7 O=C([O-])C1=CC=CS1 32366 [1,0,0,0,1,0|2,0,0]=4 2296 B8R1.11 CC1=C(C=O)SC=C1 5183 [1,0,0,0,1,0|2,0,0]=4 2297 B8R1.11 CC1=C(C=O)SC=C1 9495 [1,0,0,0,1,0|2,0,0]=4 2298 B8R1.11 CN1C=CC=C1C=O 9617 [1,0,0,0,1,0|2,0,0]=4 2299 B8R1.11 O=CC1=C(Br)C=CO1 7803 [1,0,0,0,1,0|2,0,0]=4 2300 B8R1.11 O=CC1=C(Br)C=CS1 5327 [1,0,0,0,1,0|2,0,0]=4 2301 B8R1.11 O=CC1=C(Br)SC=C1 27355 [1,0,0,0,1,0|2,0,0]=4 2302 B8R1.11 O=CC1=C(Cl)C=CS1 21836 [1,0,0,0,1,0|2,0,0]=4 2303 B8R1.11 O=CC1=C(Cl)SC=C1 33642 [1,0,0,0,1,0|2,0,0]=4 2304 B8R1.11 O=CC1=C(I)SC=C1 34866 [1,0,0,0,1,0|2,0,0]=4 2305 B8R1.11 O=CC1=CSC=C1Br 32438 [1,0,0,0,1,0|2,0,0]=4 2306 B12R1.125 CC1=C(CCC(=O)O)C=CC=C1 31589 [0,0,0,0,0,2|2,0,0]=4 2307 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 8211 [0,0,0,0,0,2|2,0,0]=4 2308 B12R1.125 O=C(O)CCC1=C(Br)C=CC=C1 15787 [0,0,0,0,0,2|2,0,0]=4 2309 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 19768 [0,0,0,0,0,2|2,0,0]=4 2310 B12R1.125 O=C(O)CNC1=C(F)C=CC=C1 13945 [0,0,0,0,0,2|2,0,0]=4 2311 B12R1.125 O=C(O)COC1=C(F)C=CC=C1 19212 [0,0,0,0,0,2|2,0,0]=4 2312 B12R1.125 O=C(O)\C=C\C1=C(Br)C=CC=C1 3756 [0,0,0,0,0,2|2,0,0]=4 2313 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 3628 [0,0,0,0,0,2|2,0,0]=4 2314 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 3488 [0,0,0,0,0,2|2,0,0]=4 2315 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 8214 [0,0,0,0,0,2|1,0,0]=3