0 B9R1.6 CC(=O)C1=CC=CN=C1 1301 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.6 CC(=O)C1=CC=CN=N1 16091 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 CC(=O)C1=CC=NC=C1 7542 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 CC(=O)C1=CN=CN=C1 13185 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 CC(=O)C1=NC=CC=C1 13363 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.6 CC(=O)C1=NC=CC=N1 19777 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.6 CC(=O)C1=NC=CN=C1 8542 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 CC(=O)C1=NC=NC=C1 33412 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.6 CC(Cl)C1=CC=CC=C1 10204 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.6 CC(N)C1=CC=CC=C1 21079 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.6 CN(C)C1=CN=CN=C1 27648 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.6 CP(C)C1=CC=CC=C1 6420 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.6 C[C@@H](N)c1ccccc1 6026 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.6 C[C@@H](N)c1ccccc1 6060 [0,0,0,0,0,0|2,0,1]=3 14 B9R1.6 C[C@@H](N)c1ccccc1 9918 [0,0,0,0,0,0|2,0,1]=3 15 B9R1.6 C[C@@H](O)C1=CC=CN=C1 27201 [0,0,0,0,0,0|1,0,2]=3 16 B9R1.6 C[C@@H](O)c1ccccc1 6851 [0,0,0,0,0,0|2,0,2]=4 17 B9R1.6 C[C@H](N)c1ccccc1 6025 [0,0,0,0,0,0|2,0,1]=3 18 B9R1.6 C[C@H](N)c1ccccc1 6061 [0,0,0,0,0,0|2,0,1]=3 19 B9R1.6 C[C@H](O)c1ccccc1 6858 [0,0,0,0,0,0|2,0,2]=4 20 B9R1.6 ClP(Cl)C1=CC=CC=C1 6469 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.6 FC(Cl)C1=CC=CC=C1 15923 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.6 N=C(N)C1=CC=CN=C1 17590 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.6 N=C(N)C1=CC=C[NH+]=C1 16743 [0,0,0,0,0,0|1,0,1]=2 24 B9R1.6 N=C(N)C1=CC=NC=C1 17463 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.6 N=C(N)C1=NC=CC=C1 20227 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.6 N=C(N)C1=NC=CN=C1 8599 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.6 NC(=O)C1=CC=NC=C1 6888 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.6 NC(=S)C1=CC=CC=C1 13565 [0,0,0,0,0,0|1,1,0]=2 29 B9R1.6 NC(=S)C1=CC=CC=C1 18582 [0,0,0,0,0,0|1,1,0]=2 30 B9R1.6 O=C(Cl)C1=CC=CC=C1 22045 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.6 O=C(Cl)C1=CC=NC=C1 23974 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.6 O=C(Cl)C1=CN=CC=C1 15186 [0,0,0,0,0,0|1,0,0]=1 33 B9R1.6 O=C(Cl)C1=CN=CN=C1 25063 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.6 O=C(Cl)C1=NC=CC=C1 2059 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.6 O=C(Cl)C1=NC=NC=C1 15402 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.6 O=C(O)C1=CC=CN=N1 22109 [0,0,0,0,0,0|2,0,0]=2 37 B9R1.6 O=C(O)C1=CC=NC=C1 2595 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.6 O=C(O)C1=CN=CC=C1 2594 [0,0,0,0,0,0|1,0,0]=1 39 B9R1.6 O=C(O)C1=CN=CN=C1 2056 [0,0,0,0,0,0|2,0,0]=2 40 B9R1.6 O=C(O)C1=CN=NC=C1 9501 [0,0,0,0,0,0|2,0,0]=2 41 B9R1.6 O=C(O)C1=NC=CC=C1 9774 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.6 O=C(O)C1=NC=CC=N1 9603 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.6 O=C(O)C1=NC=CN=C1 8602 [0,0,0,0,0,0|2,0,0]=2 44 B9R1.6 O=C(O)C1=NC=NC=C1 5297 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.6 O=C([O-])C1=NC=CC=C1 20107 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 6646 [0,0,0,0,0,0|2,0,0]=2 47 B9R1.6 OB(O)C1=CC=CC=C1 1753 [0,0,0,0,0,0|3,0,1]=4 48 B9R1.6 OB(O)C1=CC=CN=C1 2183 [0,0,0,0,0,0|2,0,1]=3 49 B9R1.6 OB(O)C1=CN=CN=C1 5199 [0,0,0,0,0,0|3,0,1]=4 50 B9R1.6 OC(=S)C1=CC=CC=C1 36202 [0,0,0,0,0,0|2,0,1]=3 51 B8R1.2 BrCC1=CC=CC=C1 13143 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.2 BrCC1=CC=CN=C1 17664 [1,0,0,0,0,0|1,0,1]=3 53 B8R1.2 Br[Mg]C1=CN=CN=C1 2073 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.2 C#CC1=CC=CC=C1 15340 [1,0,0,0,0,0|2,0,1]=4 55 B8R1.2 C#CC1=CC=CN=C1 16106 [1,0,0,0,0,0|1,0,1]=3 56 B8R1.2 C=CC1=NC=CC=C1 23910 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.2 CNC1=CC=CN=C1 14983 [1,0,0,0,0,0|2,0,0]=3 58 B8R1.2 CNC1=CN=CN=C1 25066 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.2 COC1=CC=CC=C1 12830 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.2 COC1=CC=CC=C1 17272 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.2 COC1=CC=CN=C1 15370 [1,0,0,0,0,0|2,0,0]=3 62 B8R1.2 COC1=CN=CN=C1 25073 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.2 COC1=NC=CN=C1 8605 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.2 CSC1=CC=CC=C1 10578 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.2 CSC1=NC=CN=C1 8604 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.2 ClCC1=CC=CN=C1 9217 [1,0,0,0,0,0|1,0,1]=3 67 B8R1.2 ClCC1=NC=CN=C1 32160 [1,0,0,0,0,0|2,0,1]=4 68 B8R1.2 N#CC1=CC=CN=C1 11233 [1,0,0,0,0,0|0,0,2]=3 69 B8R1.2 N#CC1=CN=CN=C1 11102 [1,0,0,0,0,0|1,0,2]=4 70 B8R1.2 N#CC1=NC=CN=C1 8603 [1,0,0,0,0,0|1,0,2]=4 71 B8R1.2 N#Cc1ccccc1 25507 [1,0,0,0,0,0|1,0,2]=4 72 B8R1.2 NCC1=CC=CC=C1 25530 [1,0,0,0,0,0|1,0,1]=3 73 B8R1.2 NCC1=CC=CN=C1 11140 [1,0,0,0,0,0|0,0,1]=2 74 B8R1.2 NCC1=CC=NC=C1 12407 [1,0,0,0,0,0|2,0,1]=4 75 B8R1.2 NCC1=NC=CC=C1 11142 [1,0,0,0,0,0|2,0,1]=4 76 B8R1.2 NCC1=NC=CN=C1 17822 [1,0,0,0,0,0|1,0,1]=3 77 B8R1.2 NNC1=CC=CC=C1 22925 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.2 NNC1=CC=NC=C1 16313 [1,0,0,0,0,0|3,0,0]=4 79 B8R1.2 NNC1=NC=CC=C1 22630 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.2 NNC1=NC=CN=C1 18786 [1,0,0,0,0,0|2,0,0]=3 81 B8R1.2 O=CC1=CC=CN=C1 1124 [1,0,0,0,0,0|0,0,0]=1 82 B8R1.2 O=CC1=CC=CN=N1 23311 [1,0,0,0,0,0|1,0,0]=2 83 B8R1.2 O=CC1=CC=NC=C1 11745 [1,0,0,0,0,0|2,0,0]=3 84 B8R1.2 O=CC1=CN=CN=C1 5298 [1,0,0,0,0,0|1,0,0]=2 85 B8R1.2 O=CC1=NC=CC=C1 11741 [1,0,0,0,0,0|2,0,0]=3 86 B8R1.2 O=CC1=NC=CC=N1 23190 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.2 O=CC1=NC=CN=C1 32140 [1,0,0,0,0,0|1,0,0]=2 88 B8R1.2 OCC1=CC=CN=C1 11736 [1,0,0,0,0,0|0,0,2]=3 89 B8R1.2 OCC1=CN=CN=C1 9758 [1,0,0,0,0,0|1,0,2]=4 90 B8R1.2 OCC1=NC=CN=C1 32128 [1,0,0,0,0,0|1,0,2]=4 91 B8R1.2 SCC1=CC=CC=C1 6835 [1,0,0,0,0,0|1,1,1]=4 92 B8R1.2 SCC1=CC=CN=C1 25049 [1,0,0,0,0,0|0,1,1]=3 93 B8R1.2 SCC1=NC=CN=C1 32116 [1,0,0,0,0,0|1,1,1]=4 94 B10R1.13 C=C(C)C1=CC=C(O)C=C1 27834 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 3294 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.13 CC(=O)C1=CC=C(C)C=C1 3326 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 3297 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.13 CC(=O)C1=CC=C(Cl)N=N1 17693 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.13 CC(=O)C1=CC=C(F)C=C1 10587 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.13 CC(=O)C1=CC=C(I)C=C1 3323 [0,1,0,0,0,0|2,0,0]=3 101 B10R1.13 CC(=O)C1=CC=C(N)C=C1 3288 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.13 CC(=O)C1=CC=C(O)C=C1 3311 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 5959 [0,1,0,0,0,0|1,0,0]=2 104 B10R1.13 CC(=O)C1=CN=C(C)C=C1 14412 [0,1,0,0,0,0|1,0,0]=2 105 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 14411 [0,1,0,0,0,0|1,0,0]=2 106 B10R1.13 CC(=O)C1=CN=C(O)C=C1 29236 [0,1,0,0,0,0|1,0,0]=2 107 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 20326 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.13 CC(=O)C1=NC=C(C)C=C1 16371 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.13 CC(=O)C1=NC=C(N)C=C1 33797 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 27544 [0,1,0,0,0,0|2,0,1]=4 111 B10R1.13 CC(N)C1=CC=C(F)C=C1 3425 [0,1,0,0,0,0|2,0,1]=4 112 B10R1.13 CC1=CC=C(B(O)O)C=N1 17081 [0,1,0,0,0,0|2,0,1]=4 113 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 15455 [0,1,0,0,0,0|2,0,0]=3 114 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15433 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.13 CC1=CC=C(C(=O)O)N=N1 18650 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.13 CC1=CC=C(C(N)=O)C=C1 27569 [0,1,0,0,0,0|1,0,0]=2 117 B10R1.13 CC1=CC=C(C(O)=S)C=C1 10665 [0,1,0,0,0,0|2,0,1]=4 118 B10R1.13 CC1=CC=C(S(=O)O)C=C1 35986 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 35988 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.13 CC1=CN=C(C(=O)O)C=C1 22648 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.13 CC1=CN=C(C(=O)O)C=N1 8550 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.13 CC1=NC=C(C(=O)O)C=C1 1218 [0,1,0,0,0,0|1,0,0]=2 123 B10R1.13 CC1=NC=C(C(=O)O)C=N1 13290 [0,1,0,0,0,0|2,0,0]=3 124 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 6699 [0,1,0,0,0,0|2,0,0]=3 125 B10R1.13 CN(C)C1=CC=C(Br)N=C1 33778 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.13 CN(N)C1=CC=C(Cl)N=N1 9500 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 15222 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 15219 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 2454 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.13 C[C@@H](N)c1ccc(Br)cc1 14234 [0,1,0,0,0,0|2,0,1]=4 131 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 15221 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 15218 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.13 C[C@H](N)c1ccc(Br)cc1 5736 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.13 Cc1ccc([C@@H](C)N)cc1 8021 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.13 Cc1ccc([S@@](N)=O)cc1 9914 [0,1,0,0,0,0|2,0,0]=3 136 B10R1.13 Cc1ccc([S@](N)=O)cc1 9913 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 25824 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.13 N=C(N)C1=CC=C(N)C=C1 13445 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.13 N=C(N)C1=CC=C(O)C=C1 18174 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 3737 [0,1,0,0,0,0|1,0,0]=2 141 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 3619 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.13 NC(=O)C1=CC=C(Cl)N=N1 35945 [0,1,0,0,0,0|1,0,0]=2 143 B10R1.13 NC(=O)C1=CC=C(F)C=C1 3407 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.13 NC(=O)C1=CC=C(N)C=C1 35461 [0,1,0,0,0,0|1,0,0]=2 145 B10R1.13 NC(=O)C1=NC=C(Cl)N=C1 32127 [0,1,0,0,0,0|1,0,0]=2 146 B10R1.13 NC(=O)C1=NC=C(N)C=C1 17853 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.13 NC(=O)C1=NC=C(N)C=N1 25348 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.13 NC(=O)C1=NC=C(N)N=C1 32178 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 10912 [0,1,0,0,0,0|1,1,0]=3 150 B10R1.13 NC(=S)C1=CC=C(N)C=C1 13560 [0,1,0,0,0,0|1,1,0]=3 151 B10R1.13 NC(=S)C1=CC=C(O)C=C1 13555 [0,1,0,0,0,0|1,1,0]=3 152 B10R1.13 NC1=CC=C(B(O)O)C=N1 25619 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.13 NC1=CC=C(C(=O)O)C=C1 13422 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 2098 [0,1,0,0,0,0|3,0,0]=4 155 B10R1.13 NC1=CN=C(C(=O)O)C=C1 15896 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.13 NC1=CN=C(C(=O)O)C=C1 17661 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.13 NC1=CN=C(C(=O)O)C=N1 7866 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.13 NC1=NC=C(C(=O)O)C=C1 2417 [0,1,0,0,0,0|1,0,0]=2 159 B10R1.13 NC1=NC=C(C(=O)O)C=N1 18198 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.13 NC1=NC=C([N+](=O)[O-])C=C1 1157 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.13 NC1=NC=C([N+](=O)[O-])C=N1 6898 [0,1,0,0,0,0|3,0,0]=4 162 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 16513 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 14145 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 19744 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 27236 [0,1,0,0,0,0|2,0,0]=3 166 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 18665 [0,1,0,0,0,0|1,0,0]=2 167 B10R1.13 O=C(Cl)C1=CN=C(F)C=C1 5141 [0,1,0,0,0,0|1,0,0]=2 168 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 3741 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 8985 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 17692 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.13 O=C(O)C1=CC=C(F)C=C1 8221 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.13 O=C(O)C1=CC=C(I)C=C1 3928 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.13 O=C(O)C1=CC=C(O)C=C1 16819 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.13 O=C(O)C1=CC=C(O)N=N1 16854 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.13 O=C(O)C1=CC=C(S)C=C1 6842 [0,1,0,0,0,0|2,0,0]=3 176 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 1122 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 2600 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 29068 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.13 O=C(O)C1=CN=C(F)C=C1 1121 [0,1,0,0,0,0|1,0,0]=2 180 B10R1.13 O=C(O)C1=CN=C(O)C=C1 15641 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 9212 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 10379 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 24823 [0,1,0,0,0,0|2,0,0]=3 184 B10R1.13 O=C(O)C1=NC=C(F)C=C1 14387 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.13 O=C(O)C1=NC=C(I)C=C1 27836 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.13 O=C(O)C1=NC=C(O)C=C1 10094 [0,1,0,0,0,0|3,0,0]=4 187 B10R1.13 O=C(O)C1=NC=C(O)N=C1 24014 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 24616 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 2286 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 4436 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 19727 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 5422 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=C1 1183 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.13 O=[N+]([O-])C1=CN=C(Br)N=C1 13464 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)C=C1 1190 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)N=C1 12364 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.13 O=[N+]([O-])C1=CN=C(F)C=C1 1202 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.13 O=[N+]([O-])C1=CN=C(I)C=C1 6575 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.13 O=[N+]([O-])C1=CN=C(O)C=C1 1205 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.13 O=[N+]([O-])C1=CN=C(O)N=C1 23554 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.13 O=[N+]([O-])c1ccc(Br)cc1 27491 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.13 OB(O)C1=CN=C(Br)C=C1 5082 [0,1,0,0,0,0|2,0,1]=4 203 B10R1.13 OB(O)C1=CN=C(Cl)C=C1 7918 [0,1,0,0,0,0|2,0,1]=4 204 B10R1.13 OB(O)C1=CN=C(F)C=C1 7963 [0,1,0,0,0,0|2,0,1]=4 205 B10R1.15 C=CC(=O)C1=CC=CC=C1 19662 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.15 C=CS(=O)C1=CC=CC=C1 15339 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.15 CC(CN)C1=CC=CC=C1 16143 [0,1,0,0,0,0|2,0,1]=4 208 B10R1.15 CCC(=O)C1=CC=CN=C1 27239 [0,1,0,0,0,0|1,0,0]=2 209 B10R1.15 CCC(N)C1=CC=CC=C1 21078 [0,1,0,0,0,0|2,0,1]=4 210 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 5668 [0,1,0,0,0,0|2,0,1]=4 211 B10R1.15 CNC(=O)C1=CC=CC=C1 35135 [0,1,0,0,0,0|1,0,0]=2 212 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 18717 [0,1,0,0,0,0|2,0,1]=4 213 B10R1.15 COC(=O)C1=CC=NC=C1 11729 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.15 COC(=O)C1=CN=CC=C1 11724 [0,1,0,0,0,0|1,0,0]=2 215 B10R1.15 COC(=O)C1=CN=CN=C1 13273 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.15 COC(=O)C1=NC=CC=C1 15906 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.15 COC(=O)C1=NC=CN=C1 14789 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.15 C[C@H](CN)C1=CC=CC=C1 21084 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.15 N#CC(N)c1ccccc1 28208 [0,1,0,0,0,0|2,0,1]=4 220 B10R1.15 NCC(=O)C1=CC=CC=C1 10002 [0,1,0,0,0,0|1,0,0]=2 221 B10R1.15 NCC(=O)C1=CC=CC=C1 21792 [0,1,0,0,0,0|1,0,0]=2 222 B10R1.15 NCC(=O)C1=CC=CC=C1 3247 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.15 NCC(O)C1=CC=CC=C1 44911 [0,1,0,0,0,0|1,0,2]=4 224 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 13836 [0,1,0,0,0,0|1,0,2]=4 225 B10R1.15 NC[C@H](O)C1=CC=CC=C1 14747 [0,1,0,0,0,0|1,0,2]=4 226 B10R1.15 NNC(=O)C1=CN=CN=C1 25061 [0,1,0,0,0,0|1,0,0]=2 227 B10R1.15 NNC(=O)C1=NC=CC=C1 23651 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.15 NNC(=O)c1ccccc1 21535 [0,1,0,0,0,0|1,0,0]=2 229 B10R1.15 N[C@@H](CO)c1ccccc1 6081 [0,1,0,0,0,0|1,0,2]=4 230 B10R1.15 N[C@H](CO)c1ccccc1 6080 [0,1,0,0,0,0|1,0,2]=4 231 B10R1.15 N\C(=N/O)C1=CC=CC=C1 12481 [0,1,0,0,0,0|1,0,1]=3 232 B10R1.15 O=C(CBr)C1=CC=CC=C1 3257 [0,1,0,0,0,0|2,0,0]=3 233 B10R1.15 O=C(CBr)C1=NC=CC=C1 21374 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.15 O=C(CBr)C1=NC=CN=C1 21375 [0,1,0,0,0,0|2,0,0]=3 235 B10R1.15 O=C(CCl)C1=CC=CC=C1 29268 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.15 O=C(CF)C1=CC=CC=C1 3472 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.15 O=C(CO)C1=CC=CC=C1 23011 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.28 CC(C)(N)C1=CC=CC=C1 19654 [0,1,0,0,0,0|2,0,1]=4 239 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 10862 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.28 FC(F)(F)C1=CC=CN=C1 8025 [0,1,0,0,0,0|2,0,1]=4 241 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 23308 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.28 O=P(Cl)(Cl)C1=CC=CC=C1 6464 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.28 O=P(O)(O)C1=CC=CC=C1 21303 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 10441 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.28 O=S(=O)(Cl)C1=CC=CN=C1 15795 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.28 O=S(=O)(Cl)C1=CC=CN=C1 15796 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.28 O=S(=O)(F)C1=CC=CC=C1 14507 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.28 O=S(=O)(O)C1=CC=CN=C1 9608 [0,1,0,0,0,0|2,0,0]=3 249 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 21767 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 3086 [0,1,0,0,0,0|2,0,0]=3 251 B10R1.61 CC(=O)C1=C(C)C=CC=C1 3090 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 3084 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.61 CC(=O)C1=C(F)C=CC=C1 22574 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.61 CC(=O)C1=C(F)C=NC=C1 33787 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.61 CC(=O)C1=C(I)C=CC=C1 3893 [0,1,0,0,0,0|2,0,0]=3 256 B10R1.61 CC(=O)C1=C(O)C=CC=C1 23010 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.61 CC(=O)C1=CC=CN=C1Cl 14410 [0,1,0,0,0,0|1,0,0]=2 258 B10R1.61 CC(=O)C1=CC=CN=C1F 5049 [0,1,0,0,0,0|1,0,0]=2 259 B10R1.61 CC(=O)C1=CC=CN=C1N 18534 [0,1,0,0,0,0|1,0,0]=2 260 B10R1.61 CC(=O)C1=CC=CNC1=O 23936 [0,1,0,0,0,0|1,0,1]=3 261 B10R1.61 CC(=O)C1=NC=CC=C1Cl 34385 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.61 CC(=O)C1=NC=CC=C1F 1300 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.61 CC(=O)C1=NC=CC=C1N 17729 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.61 CC(=O)C1=NC=CN=C1C 8616 [0,1,0,0,0,0|2,0,0]=3 265 B10R1.61 CC(=O)C1=NC=CN=C1N 33762 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.61 CC(C)C1=C(O)C=CN=C1 35264 [0,1,0,0,0,0|2,0,1]=4 267 B10R1.61 CC(C)C1=CC=CN=C1Cl 6145 [0,1,0,0,0,0|2,0,1]=4 268 B10R1.61 CC1=C(B(O)O)C=NC=C1 17083 [0,1,0,0,0,0|2,0,1]=4 269 B10R1.61 CC1=C(C(=O)O)C=CC=N1 2458 [0,1,0,0,0,0|1,0,0]=2 270 B10R1.61 CC1=C(C(=O)O)C=CN=C1 19851 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.61 CC1=C(C(=O)O)C=NC=C1 16270 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.61 CC1=C(C(O)=S)C=CC=C1 10795 [0,1,0,0,0,0|2,0,1]=4 273 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 6644 [0,1,0,0,0,0|2,0,0]=3 274 B10R1.61 CC1=CC=CC=C1C(=O)Cl 15451 [0,1,0,0,0,0|2,0,0]=3 275 B10R1.61 CC1=CC=CC=C1C(=O)O 15431 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.61 CC1=CC=CN=C1C(=O)O 14396 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.61 CC1=CC=CN=C1C(=O)O 17659 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.61 CC1=NC=CC=C1B(O)O 17080 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.61 CC1=NC=CC=C1C(N)=O 22966 [0,1,0,0,0,0|0,0,0]=1 280 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] 6643 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 24734 [0,1,0,0,0,0|2,0,1]=4 282 B10R1.61 C[C@@H](N)C1=C(O)C=CC=C1 23367 [0,1,0,0,0,0|2,0,1]=4 283 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 24731 [0,1,0,0,0,0|2,0,1]=4 284 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 15728 [0,1,0,0,0,0|2,0,1]=4 285 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 3733 [0,1,0,0,0,0|1,0,0]=2 286 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 22133 [0,1,0,0,0,0|2,0,0]=3 287 B10R1.61 NC(=O)C1=C(Cl)C=CC=C1 3617 [0,1,0,0,0,0|1,0,0]=2 288 B10R1.61 NC(=O)C1=C(F)C=CC=C1 3405 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.61 NC(=O)C1=C(F)C=NC=C1 15252 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.61 NC(=O)C1=C(I)C=CC=C1 3299 [0,1,0,0,0,0|1,0,0]=2 291 B10R1.61 NC(=O)C1=C(N)C=CN=C1 3187 [0,1,0,0,0,0|0,0,0]=1 292 B10R1.61 NC(=O)C1=CC=CC=C1N 13631 [0,1,0,0,0,0|1,0,0]=2 293 B10R1.61 NC(=O)C1=CC=CC=C1O 10992 [0,1,0,0,0,0|1,0,0]=2 294 B10R1.61 NC(=O)C1=CC=CN=C1N 14977 [0,1,0,0,0,0|0,0,0]=1 295 B10R1.61 NC(=O)C1=NC=CC=C1N 16893 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.61 NC(=O)C1=NC=CC=C1O 36150 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.61 NC(=O)C1=NC=CN=C1Cl 32162 [0,1,0,0,0,0|1,0,0]=2 298 B10R1.61 NC(=O)C1=NC=CN=C1Cl 32162 [0,1,0,0,0,0|1,0,0]=2 299 B10R1.61 NC(=O)C1=NC=CN=C1O 32110 [0,1,0,0,0,0|1,0,0]=2 300 B10R1.61 NC(=O)c1cccnc1Br 10860 [0,1,0,0,0,0|0,0,0]=1 301 B10R1.61 NC1=C(B(O)O)C=NC=C1 21017 [0,1,0,0,0,0|2,0,1]=4 302 B10R1.61 NC1=C(C(=O)O)C=CC=N1 1216 [0,1,0,0,0,0|1,0,0]=2 303 B10R1.61 NC1=C(C(=O)O)C=CN=C1 16665 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.61 NC1=C(C(=O)O)C=CN=C1 2420 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.61 NC1=C(C(=O)O)N=NC=C1 19684 [0,1,0,0,0,0|2,0,0]=3 306 B10R1.61 NC1=C([N+](=O)[O-])C=NC=C1 1277 [0,1,0,0,0,0|2,0,0]=3 307 B10R1.61 NC1=CC=CN=C1C(=O)O 2015 [0,1,0,0,0,0|3,0,0]=4 308 B10R1.61 NC1=CC=NC=C1C(=O)O 1214 [0,1,0,0,0,0|1,0,0]=2 309 B10R1.61 NC1=NC=CC=C1[N+](=O)[O-] 1276 [0,1,0,0,0,0|2,0,0]=3 310 B10R1.61 NC1=NC=CN=C1C(=O)O 8544 [0,1,0,0,0,0|2,0,0]=3 311 B10R1.61 NC1=NC=NC=C1C(=O)O 21834 [0,1,0,0,0,0|2,0,0]=3 312 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 12510 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 2599 [0,1,0,0,0,0|1,0,0]=2 314 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 15054 [0,1,0,0,0,0|2,0,0]=3 315 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 3739 [0,1,0,0,0,0|2,0,0]=3 316 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 18140 [0,1,0,0,0,0|1,0,0]=2 317 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 13576 [0,1,0,0,0,0|3,0,0]=4 318 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 5087 [0,1,0,0,0,0|3,0,0]=4 319 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 2596 [0,1,0,0,0,0|1,0,0]=2 320 B10R1.61 O=C(O)C1=C(F)C=CC=C1 9650 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.61 O=C(O)C1=C(F)C=CN=C1 10434 [0,1,0,0,0,0|1,0,0]=2 322 B10R1.61 O=C(O)C1=C(F)C=NC=C1 3549 [0,1,0,0,0,0|3,0,0]=4 323 B10R1.61 O=C(O)C1=C(F)N=CC=C1 1120 [0,1,0,0,0,0|1,0,0]=2 324 B10R1.61 O=C(O)C1=C(I)C=CC=C1 3924 [0,1,0,0,0,0|2,0,0]=3 325 B10R1.61 O=C(O)C1=C(I)N=CC=C1 34248 [0,1,0,0,0,0|1,0,0]=2 326 B10R1.61 O=C(O)C1=C(O)C=NC=C1 16741 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.61 O=C(O)C1=C(O)N=CC=C1 2597 [0,1,0,0,0,0|1,0,0]=2 328 B10R1.61 O=C(O)C1=C(S)N=CC=C1 21289 [0,1,0,0,0,0|1,0,0]=2 329 B10R1.61 O=C(O)C1=CC=CC=C1S 6841 [0,1,0,0,0,0|2,0,0]=3 330 B10R1.61 O=C(O)C1=CC=CN=C1Br 5071 [0,1,0,0,0,0|1,0,0]=2 331 B10R1.61 O=C(O)C1=CN=CC=C1Cl 12989 [0,1,0,0,0,0|1,0,0]=2 332 B10R1.61 O=C(O)C1=CN=CC=C1I 33396 [0,1,0,0,0,0|1,0,0]=2 333 B10R1.61 O=C(O)C1=NC=CC=C1Br 5070 [0,1,0,0,0,0|3,0,0]=4 334 B10R1.61 O=C(O)C1=NC=CC=C1Cl 12918 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.61 O=C(O)C1=NC=CC=C1F 5140 [0,1,0,0,0,0|3,0,0]=4 336 B10R1.61 O=C(O)C1=NC=CC=C1O 9286 [0,1,0,0,0,0|3,0,0]=4 337 B10R1.61 O=C(O)C1=NC=CN=C1Br 32152 [0,1,0,0,0,0|2,0,0]=3 338 B10R1.61 O=C(O)C1=NC=CN=C1Cl 19770 [0,1,0,0,0,0|2,0,0]=3 339 B10R1.61 O=C(O)C1=NC=CN=C1I 32124 [0,1,0,0,0,0|2,0,0]=3 340 B10R1.61 O=C(O)C1=NC=CN=C1O 8870 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 2270 [0,1,0,0,0,0|2,0,0]=3 342 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 3819 [0,1,0,0,0,0|3,0,0]=4 343 B10R1.61 O=[N+]([O-])C1=C(Br)C=CN=C1 6662 [0,1,0,0,0,0|2,0,0]=3 344 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CN=C1 9253 [0,1,0,0,0,0|2,0,0]=3 345 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 2063 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.61 O=[N+]([O-])C1=C(F)C=CN=C1 6676 [0,1,0,0,0,0|2,0,0]=3 347 B10R1.61 O=[N+]([O-])C1=C(I)C=CC=C1 3952 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.61 O=[N+]([O-])C1=C(I)C=CN=C1 6683 [0,1,0,0,0,0|2,0,0]=3 349 B10R1.61 O=[N+]([O-])C1=C(O)C=CN=C1 9279 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Br 5955 [0,1,0,0,0,0|2,0,0]=3 351 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Cl 1229 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.61 O=[N+]([O-])C1=CC=CN=C1F 1115 [0,1,0,0,0,0|2,0,0]=3 353 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O 6557 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.61 O=[N+]([O-])C1=CN=CN=C1O 7203 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.61 O=[N+]([O-])C1=NC=CN=C1Cl 32179 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.61 O=[N+]([O-])c1ccccc1Cl 18481 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.61 O=[N+]([O-])c1ccccc1F 28476 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.61 OB(O)C1=C(Cl)C=CN=C1 33770 [0,1,0,0,0,0|2,0,1]=4 359 B10R1.61 OB(O)C1=CC=CN=C1Br 5080 [0,1,0,0,0,0|2,0,1]=4 360 B10R1.61 OB(O)C1=CC=CN=C1Cl 5078 [0,1,0,0,0,0|2,0,1]=4 361 B10R1.61 OB(O)C1=CC=CN=C1F 5044 [0,1,0,0,0,0|2,0,1]=4 362 B10R1.61 OB(O)C1=CC=CN=C1O 33718 [0,1,0,0,0,0|2,0,1]=4 363 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 3087 [0,1,0,0,0,0|2,0,0]=3 364 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 15626 [0,1,0,0,0,0|1,0,0]=2 365 B10R1.113 CC(=O)C1=CC(C)=CC=C1 4279 [0,1,0,0,0,0|2,0,0]=3 366 B10R1.113 CC(=O)C1=CC(C)=CN=C1 26484 [0,1,0,0,0,0|1,0,0]=2 367 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 27309 [0,1,0,0,0,0|2,0,0]=3 368 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 3085 [0,1,0,0,0,0|2,0,0]=3 369 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 6177 [0,1,0,0,0,0|3,0,0]=4 370 B10R1.113 CC(=O)C1=CC(F)=CC=C1 4232 [0,1,0,0,0,0|2,0,0]=3 371 B10R1.113 CC(=O)C1=CC(F)=CN=C1 34208 [0,1,0,0,0,0|1,0,0]=2 372 B10R1.113 CC(=O)C1=CC(I)=CC=C1 3895 [0,1,0,0,0,0|2,0,0]=3 373 B10R1.113 CC(=O)C1=CC(N)=CC=C1 6391 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.113 CC(=O)C1=CC(O)=CC=C1 3284 [0,1,0,0,0,0|2,0,0]=3 375 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 13351 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.113 CC(=O)C1=NC(C)=CC=C1 9826 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.113 CC(=O)C1=NC=CC(C)=C1 4045 [0,1,0,0,0,0|3,0,0]=4 378 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 19518 [0,1,0,0,0,0|3,0,0]=4 379 B10R1.113 CC(N)C1=CC(F)=CC=C1 24339 [0,1,0,0,0,0|2,0,1]=4 380 B10R1.113 CC1=CC(C(=O)Cl)=CN=C1 14338 [0,1,0,0,0,0|1,0,0]=2 381 B10R1.113 CC1=CC(C(=O)O)=CC=C1 15435 [0,1,0,0,0,0|2,0,0]=3 382 B10R1.113 CC1=CC(C(=O)O)=CN=C1 11961 [0,1,0,0,0,0|1,0,0]=2 383 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 15456 [0,1,0,0,0,0|2,0,0]=3 384 B10R1.113 CC1=CC=CC(C(=O)O)=N1 12414 [0,1,0,0,0,0|3,0,0]=4 385 B10R1.113 CC1=CC=CC(C(=O)O)=N1 18834 [0,1,0,0,0,0|3,0,0]=4 386 B10R1.113 CC1=CC=CC(C(O)=S)=C1 28685 [0,1,0,0,0,0|2,0,1]=4 387 B10R1.113 CC1=CN=CC(B(O)O)=C1 17082 [0,1,0,0,0,0|2,0,1]=4 388 B10R1.113 CC1=CN=CC([N+](=O)[O-])=C1 6645 [0,1,0,0,0,0|2,0,0]=3 389 B10R1.113 CC1=NC(C(=O)O)=CN=C1 29069 [0,1,0,0,0,0|2,0,0]=3 390 B10R1.113 CC1=NC=CC(C(=O)O)=C1 13978 [0,1,0,0,0,0|3,0,0]=4 391 B10R1.113 CN(C)C1=CC(Br)=CN=C1 22076 [0,1,0,0,0,0|3,0,0]=4 392 B10R1.113 C[C@@H](N)C1=CC(Cl)=CC=C1 24741 [0,1,0,0,0,0|2,0,1]=4 393 B10R1.113 C[C@@H](N)C1=CC(F)=CC=C1 24730 [0,1,0,0,0,0|2,0,1]=4 394 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 14235 [0,1,0,0,0,0|2,0,1]=4 395 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 24746 [0,1,0,0,0,0|2,0,1]=4 396 B10R1.113 C[C@H](N)C1=CC(Cl)=CC=C1 24735 [0,1,0,0,0,0|2,0,1]=4 397 B10R1.113 C[C@H](N)C1=CC(F)=CC=C1 25216 [0,1,0,0,0,0|2,0,1]=4 398 B10R1.113 N=C(N)C1=CC(Br)=CC=C1 25825 [0,1,0,0,0,0|2,0,0]=3 399 B10R1.113 N=C(N)C1=CC(Br)=CC=C1 25933 [0,1,0,0,0,0|2,0,0]=3 400 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 3734 [0,1,0,0,0,0|1,0,0]=2 401 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 16641 [0,1,0,0,0,0|2,0,0]=3 402 B10R1.113 NC(=O)C1=CC(Cl)=CC=C1 3618 [0,1,0,0,0,0|1,0,0]=2 403 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 16074 [0,1,0,0,0,0|2,0,0]=3 404 B10R1.113 NC(=O)C1=CC(I)=CC=C1 3301 [0,1,0,0,0,0|1,0,0]=2 405 B10R1.113 NC(=O)C1=CC(N)=CC=C1 28767 [0,1,0,0,0,0|1,0,0]=2 406 B10R1.113 NC(=O)C1=CC(N)=NC=C1 16603 [0,1,0,0,0,0|2,0,0]=3 407 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 1212 [0,1,0,0,0,0|0,0,0]=1 408 B10R1.113 NC(=O)C1=NC(Cl)=CN=C1 32143 [0,1,0,0,0,0|1,0,0]=2 409 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 9223 [0,1,0,0,0,0|2,0,0]=3 410 B10R1.113 NC(=O)C1=NC=CC(F)=C1 14534 [0,1,0,0,0,0|2,0,0]=3 411 B10R1.113 NC(=S)C1=CC(Cl)=CC=C1 20134 [0,1,0,0,0,0|1,1,0]=3 412 B10R1.113 NC(=S)C1=CC(F)=CC=C1 35675 [0,1,0,0,0,0|1,1,0]=3 413 B10R1.113 NC1=CC(C(=O)O)=CN=C1 15914 [0,1,0,0,0,0|1,0,0]=2 414 B10R1.113 NC1=CC(C(=O)O)=NC=C1 22241 [0,1,0,0,0,0|3,0,0]=4 415 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 24745 [0,1,0,0,0,0|3,0,0]=4 416 B10R1.113 NC1=CC=CC(C(=O)O)=N1 7686 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.113 NC1=CN=CC(B(O)O)=C1 24820 [0,1,0,0,0,0|2,0,1]=4 418 B10R1.113 NC1=CN=CC(C(=O)O)=N1 32113 [0,1,0,0,0,0|2,0,0]=3 419 B10R1.113 NC1=NC=CC(C(=O)O)=C1 2426 [0,1,0,0,0,0|3,0,0]=4 420 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 13574 [0,1,0,0,0,0|2,0,0]=3 421 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 16064 [0,1,0,0,0,0|3,0,0]=4 422 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 19742 [0,1,0,0,0,0|2,0,0]=3 423 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 3740 [0,1,0,0,0,0|2,0,0]=3 424 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 9211 [0,1,0,0,0,0|3,0,0]=4 425 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 8991 [0,1,0,0,0,0|2,0,0]=3 426 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 2598 [0,1,0,0,0,0|3,0,0]=4 427 B10R1.113 O=C(O)C1=CC(F)=CC=C1 3480 [0,1,0,0,0,0|2,0,0]=3 428 B10R1.113 O=C(O)C1=CC(F)=NC=C1 3548 [0,1,0,0,0,0|3,0,0]=4 429 B10R1.113 O=C(O)C1=CC(I)=CC=C1 3925 [0,1,0,0,0,0|2,0,0]=3 430 B10R1.113 O=C(O)C1=CC(I)=NC=C1 16692 [0,1,0,0,0,0|3,0,0]=4 431 B10R1.113 O=C(O)C1=CC(O)=CC=C1 9161 [0,1,0,0,0,0|2,0,0]=3 432 B10R1.113 O=C(O)C1=CC(O)=NC=C1 16780 [0,1,0,0,0,0|3,0,0]=4 433 B10R1.113 O=C(O)C1=CC(S)=CC=C1 5566 [0,1,0,0,0,0|2,0,0]=3 434 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 29232 [0,1,0,0,0,0|3,0,0]=4 435 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 9222 [0,1,0,0,0,0|3,0,0]=4 436 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 1211 [0,1,0,0,0,0|1,0,0]=2 437 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 11089 [0,1,0,0,0,0|1,0,0]=2 438 B10R1.113 O=C(O)C1=CN=CC(F)=C1 10942 [0,1,0,0,0,0|1,0,0]=2 439 B10R1.113 O=C(O)C1=CN=CC(O)=C1 2415 [0,1,0,0,0,0|1,0,0]=2 440 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 2422 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.113 O=C(O)C1=NC(Br)=CN=C1 27951 [0,1,0,0,0,0|2,0,0]=3 442 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 16687 [0,1,0,0,0,0|2,0,0]=3 443 B10R1.113 O=C(O)C1=NC(F)=CC=C1 13570 [0,1,0,0,0,0|3,0,0]=4 444 B10R1.113 O=C(O)C1=NC(I)=CC=C1 9290 [0,1,0,0,0,0|3,0,0]=4 445 B10R1.113 O=C(O)C1=NC(O)=CC=C1 2421 [0,1,0,0,0,0|3,0,0]=4 446 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 4064 [0,1,0,0,0,0|3,0,0]=4 447 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 12731 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.113 O=C(O)C1=NC=CC(I)=C1 27885 [0,1,0,0,0,0|3,0,0]=4 449 B10R1.113 O=C(O)C1=NC=CC(O)=C1 17131 [0,1,0,0,0,0|3,0,0]=4 450 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 26798 [0,1,0,0,0,0|3,0,0]=4 451 B10R1.113 O=C1C=C(C(=O)O)C=NN1 22764 [0,1,0,0,0,0|2,0,0]=3 452 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 3820 [0,1,0,0,0,0|3,0,0]=4 453 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 10642 [0,1,0,0,0,0|3,0,0]=4 454 B10R1.113 O=[N+]([O-])C1=CC=CC(I)=C1 3954 [0,1,0,0,0,0|3,0,0]=4 455 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 17999 [0,1,0,0,0,0|3,0,0]=4 456 B10R1.113 O=[N+]([O-])C1=CN=CC(Cl)=C1 6621 [0,1,0,0,0,0|2,0,0]=3 457 B10R1.113 OB(O)C1=CC(Cl)=CN=C1 17397 [0,1,0,0,0,0|2,0,1]=4 458 B10R1.113 OB(O)C1=CC(F)=CN=C1 24822 [0,1,0,0,0,0|2,0,1]=4 459 B10R1.113 OB(O)C1=CN=CC(Br)=C1 5305 [0,1,0,0,0,0|2,0,1]=4 460 B8R1.7 CC(=O)C1=CC=CN1 20915 [0,0,0,0,1,0|1,0,1]=3 461 B8R1.7 CC(=O)C1=CC=CO1 6939 [0,0,0,0,1,0|2,0,0]=3 462 B8R1.7 CC(=O)C1=CC=CS1 5172 [0,0,0,0,1,0|2,0,0]=3 463 B8R1.7 CC(=O)C1=CNC=C1 22508 [0,0,0,0,1,0|1,0,1]=3 464 B8R1.7 CC(=O)C1=CNC=N1 12484 [0,0,0,0,1,0|2,0,0]=3 465 B8R1.7 CC(=O)C1=CNN=C1 30409 [0,0,0,0,1,0|2,0,0]=3 466 B8R1.7 CC(=O)C1=CSC=C1 5220 [0,0,0,0,1,0|2,0,0]=3 467 B8R1.7 CC(=O)C1=NC=CO1 23008 [0,0,0,0,1,0|2,0,0]=3 468 B8R1.7 CC(=O)C1=NC=CS1 9940 [0,0,0,0,1,0|2,0,0]=3 469 B8R1.7 CC(=O)N1C=CC=N1 13397 [0,0,0,0,1,0|2,0,0]=3 470 B8R1.7 CC(=O)N1C=CN=C1 25826 [0,0,0,0,1,0|2,0,0]=3 471 B8R1.7 CC(C)=C1C=CC=C1 35011 [0,0,0,0,1,0|2,0,0]=3 472 B8R1.7 N=C(N)N1C=NC=N1 26231 [0,0,0,0,1,0|3,0,0]=4 473 B8R1.7 N=C(N)n1cccn1 23612 [0,0,0,0,1,0|2,0,0]=3 474 B8R1.7 NC(=O)C1=NNC=C1 14330 [0,0,0,0,1,0|1,0,0]=2 475 B8R1.7 NC(=O)C1=NNC=N1 26028 [0,0,0,0,1,0|2,0,0]=3 476 B8R1.7 NC(=S)C1=CC=CS1 32072 [0,0,0,0,1,0|1,1,0]=3 477 B8R1.7 O=C(Cl)C1=CC=CO1 19997 [0,0,0,0,1,0|2,0,0]=3 478 B8R1.7 O=C(Cl)C1=CC=CS1 5166 [0,0,0,0,1,0|2,0,0]=3 479 B8R1.7 O=C(Cl)C1=CSC=C1 5597 [0,0,0,0,1,0|2,0,0]=3 480 B8R1.7 O=C(O)C1=CC=CN1 15698 [0,0,0,0,1,0|1,0,1]=3 481 B8R1.7 O=C(O)C1=CC=CO1 6946 [0,0,0,0,1,0|2,0,0]=3 482 B8R1.7 O=C(O)C1=CC=CS1 5157 [0,0,0,0,1,0|2,0,0]=3 483 B8R1.7 O=C(O)C1=CC=NN1 12935 [0,0,0,0,1,0|2,0,0]=3 484 B8R1.7 O=C(O)C1=CC=NN1 35926 [0,0,0,0,1,0|2,0,0]=3 485 B8R1.7 O=C(O)C1=CC=NO1 8643 [0,0,0,0,1,0|2,0,0]=3 486 B8R1.7 O=C(O)C1=CC=NS1 30427 [0,0,0,0,1,0|2,0,0]=3 487 B8R1.7 O=C(O)C1=CN=CN1 9003 [0,0,0,0,1,0|2,0,0]=3 488 B8R1.7 O=C(O)C1=CN=CS1 14533 [0,0,0,0,1,0|2,0,0]=3 489 B8R1.7 O=C(O)C1=CNC=C1 8345 [0,0,0,0,1,0|1,0,1]=3 490 B8R1.7 O=C(O)C1=CNN=C1 13293 [0,0,0,0,1,0|2,0,0]=3 491 B8R1.7 O=C(O)C1=CNN=N1 13727 [0,0,0,0,1,0|3,0,0]=4 492 B8R1.7 O=C(O)C1=COC=C1 6945 [0,0,0,0,1,0|2,0,0]=3 493 B8R1.7 O=C(O)C1=COC=N1 11025 [0,0,0,0,1,0|2,0,0]=3 494 B8R1.7 O=C(O)C1=CON=C1 8775 [0,0,0,0,1,0|2,0,0]=3 495 B8R1.7 O=C(O)C1=CSC=C1 7735 [0,0,0,0,1,0|2,0,0]=3 496 B8R1.7 O=C(O)C1=CSC=N1 35764 [0,0,0,0,1,0|2,0,0]=3 497 B8R1.7 O=C(O)C1=NC=CN1 25373 [0,0,0,0,1,0|2,0,0]=3 498 B8R1.7 O=C(O)C1=NC=CS1 16257 [0,0,0,0,1,0|2,0,0]=3 499 B8R1.7 O=C(O)C1=NN=CS1 18394 [0,0,0,0,1,0|3,0,0]=4 500 B8R1.7 O=C(O)C1=NOC=C1 12341 [0,0,0,0,1,0|2,0,0]=3 501 B8R1.7 O=C(O)C1=NSC=C1 22100 [0,0,0,0,1,0|2,0,0]=3 502 B8R1.7 O=C(O)[C-]1C=CC=C1 10724 [0,0,0,0,1,0|1,0,1]=3 503 B8R1.7 O=C([O-])C1=CC=CS1 32366 [0,0,0,0,1,0|2,0,0]=3 504 B8R1.7 O=[N+]([O-])C1=CC=CS1 5570 [0,0,0,0,1,0|3,0,0]=4 505 B8R1.7 O=[N+]([O-])C1=CC=NN1 8639 [0,0,0,0,1,0|3,0,0]=4 506 B8R1.7 O=[N+]([O-])C1=CNC=C1 22365 [0,0,0,0,1,0|2,0,1]=4 507 B8R1.7 O=[N+]([O-])C1=CNC=N1 7615 [0,0,0,0,1,0|3,0,0]=4 508 B8R1.7 O=[N+]([O-])C1=CNN=C1 14984 [0,0,0,0,1,0|3,0,0]=4 509 B8R1.7 O=[N+]([O-])C1=NC=CN1 7616 [0,0,0,0,1,0|3,0,0]=4 510 B8R1.7 S=C(S)C1=CNC=N1 9018 [0,0,0,0,1,0|2,1,0]=4 511 B10R1.18 CC(=O)CC1=CC=NC=C1 21323 [0,0,0,0,0,1|3,0,0]=4 512 B10R1.18 CC(=O)CC1=NC=CC=C1 32233 [0,0,0,0,0,1|3,0,0]=4 513 B10R1.18 CC(=O)NC1=CN=CN=C1 25070 [0,0,0,0,0,1|2,0,0]=3 514 B10R1.18 CC(=O)SC1=CC=CC=C1 15324 [0,0,0,0,0,1|2,0,0]=3 515 B10R1.18 NC(=S)NC1=CC=CC=C1 35672 [0,0,0,0,0,1|1,1,0]=3 516 B10R1.18 O=C(Cl)CC1=CC=CC=C1 35236 [0,0,0,0,0,1|2,0,0]=3 517 B10R1.18 O=C(O)CC1=CC=CN=C1 13998 [0,0,0,0,0,1|1,0,0]=2 518 B10R1.18 O=C(O)CC1=CC=NC=C1 14000 [0,0,0,0,0,1|3,0,0]=4 519 B10R1.18 O=C(O)CC1=CN=CN=C1 13279 [0,0,0,0,0,1|2,0,0]=3 520 B10R1.18 O=C(O)CC1=NC=CC=C1 14404 [0,0,0,0,0,1|3,0,0]=4 521 B10R1.18 O=C([O-])CC1=CC=CC=C1 20019 [0,0,0,0,0,1|2,0,0]=3 522 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 16807 [0,0,0,0,0,1|3,0,0]=4 523 B10R1.18 OC(=S)CC1=CC=CC=C1 10786 [0,0,0,0,0,1|2,0,1]=4 524 B7R0.4 C\C=C\C=C\C(=O)[O-] 26113 [1,0,1,0,0,0|1,0,1]=4 525 B7R1.3 BrC1=CC=CN=C1 2571 [2,0,0,0,0,0|1,0,0]=3 526 B7R1.3 BrC1=CN=CN=C1 6902 [2,0,0,0,0,0|2,0,0]=4 527 B7R1.3 BrC1=NC=CN=C1 18036 [2,0,0,0,0,0|2,0,0]=4 528 B7R1.3 CC1=CC=CN=N1 17696 [2,0,0,0,0,0|1,0,1]=4 529 B7R1.3 CC1=CN=CN=C1 7207 [2,0,0,0,0,0|1,0,1]=4 530 B7R1.3 CC1=NC=CN=C1 8601 [2,0,0,0,0,0|1,0,1]=4 531 B7R1.3 ClC1=CC=CN=C1 2576 [2,0,0,0,0,0|1,0,0]=3 532 B7R1.3 ClC1=CC=CN=N1 19779 [2,0,0,0,0,0|2,0,0]=4 533 B7R1.3 ClC1=CN=CN=C1 7041 [2,0,0,0,0,0|2,0,0]=4 534 B7R1.3 ClC1=NC=CN=C1 8546 [2,0,0,0,0,0|2,0,0]=4 535 B7R1.3 FC1=CC=CC=C1 29401 [2,0,0,0,0,0|2,0,0]=4 536 B7R1.3 FC1=CC=CN=C1 1095 [2,0,0,0,0,0|1,0,0]=3 537 B7R1.3 FC1=CN=CN=C1 7193 [2,0,0,0,0,0|2,0,0]=4 538 B7R1.3 FC1=NC=CN=C1 13961 [2,0,0,0,0,0|2,0,0]=4 539 B7R1.3 IC1=CC=CC=C1 2143 [2,0,0,0,0,0|2,0,0]=4 540 B7R1.3 IC1=CC=CC=C1 3921 [2,0,0,0,0,0|2,0,0]=4 541 B7R1.3 IC1=CC=CN=C1 6634 [2,0,0,0,0,0|1,0,0]=3 542 B7R1.3 IC1=CN=CN=C1 25074 [2,0,0,0,0,0|2,0,0]=4 543 B7R1.3 NC1=CC=CN=C1 2569 [2,0,0,0,0,0|0,0,0]=2 544 B7R1.3 NC1=CC=CN=N1 16747 [2,0,0,0,0,0|1,0,0]=3 545 B7R1.3 NC1=CC=CN=N1 9538 [2,0,0,0,0,0|1,0,0]=3 546 B7R1.3 NC1=CC=NC=C1 1281 [2,0,0,0,0,0|2,0,0]=4 547 B7R1.3 NC1=CN=CN=C1 25064 [2,0,0,0,0,0|1,0,0]=3 548 B7R1.3 NC1=NC=CC=C1 10484 [2,0,0,0,0,0|2,0,0]=4 549 B7R1.3 NC1=NC=CN=C1 8600 [2,0,0,0,0,0|1,0,0]=3 550 B7R1.3 O=C1C=CC=NN1 9528 [2,0,0,0,0,0|1,0,0]=3 551 B7R1.3 OC1=CC=CN=C1 2568 [2,0,0,0,0,0|0,0,1]=3 552 B7R1.3 OC1=CN=CN=C1 20799 [2,0,0,0,0,0|1,0,1]=4 553 B7R1.3 OC1=C[NH+]=CN=C1 23934 [2,0,0,0,0,0|1,0,1]=4 554 B7R1.3 OC1=NC=CN=C1 8869 [2,0,0,0,0,0|1,0,1]=4 555 B7R1.3 PC1=CC=CC=C1 25514 [2,0,0,0,0,0|1,1,0]=4 556 B7R1.3 SC1=CC=CC=C1 5421 [2,0,0,0,0,0|1,1,0]=4 557 B7R1.3 [Li]C1=CC=CC=C1 26659 [2,0,0,0,0,0|2,0,0]=4 558 B7R1.3 [O-][N+]1=CN=CC=C1 13269 [2,0,0,0,0,0|1,0,1]=4 559 B7R1.3 [S-]C1=CC=CC=C1 35336 [2,0,0,0,0,0|1,1,0]=4 560 B7R1.3 [SiH3]C1=CC=CC=C1 25896 [2,0,0,0,0,0|1,1,0]=4 561 B9R1.1 C=CC1=CC=C(Cl)C=C1 12659 [1,1,0,0,0,0|2,0,0]=4 562 B9R1.1 C=CC1=CC=C(N)C=C1 12625 [1,1,0,0,0,0|2,0,0]=4 563 B9R1.1 C=CC1=CN=C(Br)C=C1 27635 [1,1,0,0,0,0|1,0,0]=3 564 B9R1.1 C=CC1=CN=C(C)C=C1 15153 [1,1,0,0,0,0|1,0,0]=3 565 B9R1.1 CC1=CC=C(C=O)C=C1 15497 [1,1,0,0,0,0|1,0,0]=3 566 B9R1.1 CC1=CC=C(CN)C=C1 10199 [1,1,0,0,0,0|1,0,1]=4 567 B9R1.1 CC1=CC=C(CO)C=N1 27403 [1,1,0,0,0,0|0,0,2]=4 568 B9R1.1 CC1=CC=C(NN)C=C1 4500 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.1 CC1=CN=C(C=O)C=C1 17169 [1,1,0,0,0,0|2,0,0]=4 570 B9R1.1 CC1=CN=C(C=O)C=N1 32176 [1,1,0,0,0,0|1,0,0]=3 571 B9R1.1 CC1=CN=C(NN)C=N1 35476 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.1 CC1=NC=C(C#N)C=C1 6695 [1,1,0,0,0,0|0,0,2]=4 573 B9R1.1 CC1=NC=C(C=O)C=C1 19463 [1,1,0,0,0,0|0,0,0]=2 574 B9R1.1 CC1=NC=C(CN)C=N1 24665 [1,1,0,0,0,0|1,0,1]=4 575 B9R1.1 CC1=NC=C(NN)C=C1 19456 [1,1,0,0,0,0|1,0,0]=3 576 B9R1.1 CC1=NC=C(NN)C=C1 26049 [1,1,0,0,0,0|1,0,0]=3 577 B9R1.1 CCC1=CN=C(C)C=C1 10482 [1,1,0,0,0,0|1,0,1]=4 578 B9R1.1 CCC1=CN=C(C)C=C1 18256 [1,1,0,0,0,0|1,0,1]=4 579 B9R1.1 COC1=CC=C(C)N=C1 6640 [1,1,0,0,0,0|2,0,0]=4 580 B9R1.1 COC1=CN=C(Br)C=C1 15210 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.1 COC1=CN=C(Cl)C=C1 6222 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.1 COC1=CN=C(F)C=C1 33665 [1,1,0,0,0,0|2,0,0]=4 583 B9R1.1 COC1=CN=C(N)C=C1 23280 [1,1,0,0,0,0|2,0,0]=4 584 B9R1.1 ClCC1=CN=C(Cl)C=C1 9210 [1,1,0,0,0,0|1,0,1]=4 585 B9R1.1 N#CC1=CN=C(Br)C=C1 5963 [1,1,0,0,0,0|0,0,2]=4 586 B9R1.1 N#CC1=CN=C(Cl)C=C1 1224 [1,1,0,0,0,0|0,0,2]=4 587 B9R1.1 N#CC1=CN=C(F)C=C1 19505 [1,1,0,0,0,0|0,0,2]=4 588 B9R1.1 N#CC1=CN=C(N)C=C1 31629 [1,1,0,0,0,0|0,0,2]=4 589 B9R1.1 N#CC1=CN=C(N)C=C1 5752 [1,1,0,0,0,0|0,0,2]=4 590 B9R1.1 N#CC1=CN=C(O)C=C1 18529 [1,1,0,0,0,0|0,0,2]=4 591 B9R1.1 NC1=CC=C(C=O)C=C1 7795 [1,1,0,0,0,0|1,0,0]=3 592 B9R1.1 NC1=CC=C(CO)C=N1 18913 [1,1,0,0,0,0|0,0,2]=4 593 B9R1.1 NC1=NC=C(C=O)C=N1 27597 [1,1,0,0,0,0|1,0,0]=3 594 B9R1.1 NCC1=CC=C(Br)C=C1 23806 [1,1,0,0,0,0|1,0,1]=4 595 B9R1.1 NCC1=CC=C(Br)C=C1 3751 [1,1,0,0,0,0|1,0,1]=4 596 B9R1.1 NCC1=CC=C(Cl)C=C1 9028 [1,1,0,0,0,0|1,0,1]=4 597 B9R1.1 NCC1=CC=C(Cl)N=C1 24215 [1,1,0,0,0,0|0,0,1]=3 598 B9R1.1 NCC1=CC=C(F)C=C1 3408 [1,1,0,0,0,0|1,0,1]=4 599 B9R1.1 NCC1=CC=C(F)C=C1 4420 [1,1,0,0,0,0|1,0,1]=4 600 B9R1.1 NCC1=CC=C(I)C=C1 3304 [1,1,0,0,0,0|1,0,1]=4 601 B9R1.1 NCC1=CC=C(N)C=C1 5803 [1,1,0,0,0,0|1,0,1]=4 602 B9R1.1 NCC1=CC=C(O)C=C1 26036 [1,1,0,0,0,0|1,0,1]=4 603 B9R1.1 NCC1=CN=C(Cl)C=C1 1255 [1,1,0,0,0,0|0,0,1]=3 604 B9R1.1 NCC1=CN=C(Cl)C=C1 15212 [1,1,0,0,0,0|0,0,1]=3 605 B9R1.1 NCC1=CN=C(Cl)N=C1 22776 [1,1,0,0,0,0|1,0,1]=4 606 B9R1.1 NCC1=CNC(=O)C=C1 19427 [1,1,0,0,0,0|0,0,2]=4 607 B9R1.1 NNC1=CC=C(Br)C=C1 21916 [1,1,0,0,0,0|2,0,0]=4 608 B9R1.1 NNC1=CC=C(Br)C=C1 6409 [1,1,0,0,0,0|2,0,0]=4 609 B9R1.1 NNC1=CC=C(Cl)C=C1 23899 [1,1,0,0,0,0|2,0,0]=4 610 B9R1.1 NNC1=CC=C(Cl)C=C1 4483 [1,1,0,0,0,0|2,0,0]=4 611 B9R1.1 NNC1=CC=C(F)C=C1 15913 [1,1,0,0,0,0|2,0,0]=4 612 B9R1.1 NNC1=CC=C(F)C=C1 3330 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.1 NNC1=CC=C(I)C=C1 15797 [1,1,0,0,0,0|2,0,0]=4 614 B9R1.1 NNC1=CN=C(Cl)C=C1 16449 [1,1,0,0,0,0|1,0,0]=3 615 B9R1.1 NNC1=CN=C(Cl)C=C1 20865 [1,1,0,0,0,0|1,0,0]=3 616 B9R1.1 O=CC1=CC=C(Br)C=C1 8053 [1,1,0,0,0,0|1,0,0]=3 617 B9R1.1 O=CC1=CC=C(Cl)C=C1 8078 [1,1,0,0,0,0|1,0,0]=3 618 B9R1.1 O=CC1=CC=C(Cl)N=C1 23354 [1,1,0,0,0,0|0,0,0]=2 619 B9R1.1 O=CC1=CC=C(F)C=C1 3478 [1,1,0,0,0,0|1,0,0]=3 620 B9R1.1 O=CC1=CC=C(I)C=C1 5349 [1,1,0,0,0,0|1,0,0]=3 621 B9R1.1 O=CC1=CC=C(O)C=C1 10188 [1,1,0,0,0,0|1,0,0]=3 622 B9R1.1 O=CC1=CN=C(Br)C=C1 1181 [1,1,0,0,0,0|0,0,0]=2 623 B9R1.1 O=CC1=CN=C(Cl)C=C1 9221 [1,1,0,0,0,0|0,0,0]=2 624 B9R1.1 O=CC1=CN=C(Cl)N=C1 23896 [1,1,0,0,0,0|1,0,0]=3 625 B9R1.1 O=CC1=CN=C(F)C=C1 5150 [1,1,0,0,0,0|0,0,0]=2 626 B9R1.1 O=CC1=CN=C(O)C=C1 17127 [1,1,0,0,0,0|0,0,0]=2 627 B9R1.1 O=CC1=NC=C(Br)C=C1 5059 [1,1,0,0,0,0|2,0,0]=4 628 B9R1.1 O=CC1=NC=C(Cl)C=C1 17153 [1,1,0,0,0,0|2,0,0]=4 629 B9R1.1 O=CC1=NC=C(F)C=C1 5149 [1,1,0,0,0,0|2,0,0]=4 630 B9R1.1 O=CC1=NC=C(O)C=C1 33708 [1,1,0,0,0,0|2,0,0]=4 631 B9R1.1 OCC1=CC=C(F)N=C1 17062 [1,1,0,0,0,0|0,0,2]=4 632 B9R1.1 OCC1=CN=C(Cl)C=C1 12920 [1,1,0,0,0,0|0,0,2]=4 633 B9R1.2 C=CC1=CC(Br)=CC=C1 23859 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.2 CC1=CC(C=O)=CC=C1 15513 [1,1,0,0,0,0|1,0,0]=3 635 B9R1.2 CC1=CC(C=O)=NC=C1 17166 [1,1,0,0,0,0|2,0,0]=4 636 B9R1.2 CC1=CC=CC(C=O)=N1 15904 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.2 CC1=CC=CC(CN)=C1 10198 [1,1,0,0,0,0|1,0,1]=4 638 B9R1.2 CC1=CC=CC(NN)=C1 6397 [1,1,0,0,0,0|2,0,0]=4 639 B9R1.2 CC1=CN=CC(CO)=C1 22640 [1,1,0,0,0,0|0,0,2]=4 640 B9R1.2 CC1=CN=CC(NN)=N1 32180 [1,1,0,0,0,0|2,0,0]=4 641 B9R1.2 CNC1=CC(Br)=CN=C1 34590 [1,1,0,0,0,0|2,0,0]=4 642 B9R1.2 COC1=CN=CC(Br)=C1 5085 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.2 COC1=CN=CC(I)=C1 16704 [1,1,0,0,0,0|2,0,0]=4 644 B9R1.2 COC1=CN=CC(N)=C1 22353 [1,1,0,0,0,0|2,0,0]=4 645 B9R1.2 COC1=CN=CC(O)=C1 27157 [1,1,0,0,0,0|2,0,0]=4 646 B9R1.2 ClCC1=CC(I)=CN=C1 27044 [1,1,0,0,0,0|1,0,1]=4 647 B9R1.2 ClCC1=CN=CC(Br)=C1 26331 [1,1,0,0,0,0|1,0,1]=4 648 B9R1.2 N#CC1=CC(Cl)=CN=C1 14369 [1,1,0,0,0,0|0,0,2]=4 649 B9R1.2 N#CC1=CC(O)=CN=C1 17727 [1,1,0,0,0,0|0,0,2]=4 650 B9R1.2 N#CC1=CC(O)=CN=C1 18350 [1,1,0,0,0,0|0,0,2]=4 651 B9R1.2 N#CC1=CN=CC(Br)=C1 7702 [1,1,0,0,0,0|0,0,2]=4 652 B9R1.2 N#CC1=CN=CC(F)=C1 32489 [1,1,0,0,0,0|0,0,2]=4 653 B9R1.2 N#CC1=CN=CC(N)=C1 21874 [1,1,0,0,0,0|0,0,2]=4 654 B9R1.2 NCC1=CC(Br)=CC=C1 21109 [1,1,0,0,0,0|1,0,1]=4 655 B9R1.2 NCC1=CC(Br)=CC=C1 3750 [1,1,0,0,0,0|1,0,1]=4 656 B9R1.2 NCC1=CC(F)=CC=C1 4417 [1,1,0,0,0,0|1,0,1]=4 657 B9R1.2 NCC1=CC(I)=CC=C1 3302 [1,1,0,0,0,0|1,0,1]=4 658 B9R1.2 NCC1=CC(N)=CC=C1 5802 [1,1,0,0,0,0|1,0,1]=4 659 B9R1.2 NNC1=CC(Br)=CC=C1 23212 [1,1,0,0,0,0|2,0,0]=4 660 B9R1.2 NNC1=CC(Cl)=CC=C1 7529 [1,1,0,0,0,0|2,0,0]=4 661 B9R1.2 NNC1=CC(F)=CC=C1 3341 [1,1,0,0,0,0|2,0,0]=4 662 B9R1.2 O=CC1=CC(Br)=CC=C1 3728 [1,1,0,0,0,0|1,0,0]=3 663 B9R1.2 O=CC1=CC(Br)=CN=C1 7706 [1,1,0,0,0,0|0,0,0]=2 664 B9R1.2 O=CC1=CC(Br)=NC=C1 5075 [1,1,0,0,0,0|2,0,0]=4 665 B9R1.2 O=CC1=CC(Cl)=CC=C1 10800 [1,1,0,0,0,0|1,0,0]=3 666 B9R1.2 O=CC1=CC(Cl)=NC=C1 5099 [1,1,0,0,0,0|2,0,0]=4 667 B9R1.2 O=CC1=CC(F)=CC=C1 3477 [1,1,0,0,0,0|1,0,0]=3 668 B9R1.2 O=CC1=CC(F)=NC=C1 17094 [1,1,0,0,0,0|2,0,0]=4 669 B9R1.2 O=CC1=CC(I)=CC=C1 3917 [1,1,0,0,0,0|1,0,0]=3 670 B9R1.2 O=CC1=CC(O)=CC=C1 7767 [1,1,0,0,0,0|1,0,0]=3 671 B9R1.2 O=CC1=CC(O)=CN=C1 23673 [1,1,0,0,0,0|0,0,0]=2 672 B9R1.2 O=CC1=CC(O)=NC=C1 9345 [1,1,0,0,0,0|2,0,0]=4 673 B9R1.2 O=CC1=CC=CC(F)=N1 15245 [1,1,0,0,0,0|2,0,0]=4 674 B9R1.2 O=CC1=CN=CC(Br)=C1 16604 [1,1,0,0,0,0|0,0,0]=2 675 B9R1.2 O=CC1=CN=CC(Cl)=C1 16702 [1,1,0,0,0,0|0,0,0]=2 676 B9R1.2 O=CC1=CN=CC(F)=C1 5151 [1,1,0,0,0,0|0,0,0]=2 677 B9R1.2 O=CC1=CN=CC(I)=C1 16653 [1,1,0,0,0,0|0,0,0]=2 678 B9R1.2 O=CC1=NC(Br)=CC=C1 3196 [1,1,0,0,0,0|2,0,0]=4 679 B9R1.2 O=CC1=NC(Br)=CC=C1 9209 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.2 O=CC1=NC(Cl)=CC=C1 13323 [1,1,0,0,0,0|2,0,0]=4 681 B9R1.2 O=CC1=NC(Cl)=CN=C1 32134 [1,1,0,0,0,0|1,0,0]=3 682 B9R1.2 O=CC1=NC=CC(Cl)=C1 24779 [1,1,0,0,0,0|2,0,0]=4 683 B9R1.2 OCC1=CC(Br)=CN=C1 22108 [1,1,0,0,0,0|0,0,2]=4 684 B9R1.2 OCC1=CC(Cl)=CN=C1 12982 [1,1,0,0,0,0|0,0,2]=4 685 B9R1.2 OCC1=CC(I)=CN=C1 16706 [1,1,0,0,0,0|0,0,2]=4 686 B9R1.8 BrCCC1=CC=CN=C1 21399 [1,1,0,0,0,0|1,0,1]=4 687 B9R1.8 C=CCC1=CC=CC=C1 29358 [1,1,0,0,0,0|2,0,0]=4 688 B9R1.8 C=CSC1=CC=CC=C1 10778 [1,1,0,0,0,0|2,0,0]=4 689 B9R1.8 CNCC1=CC=CC=C1 19910 [1,1,0,0,0,0|1,0,1]=4 690 B9R1.8 CNCC1=CC=CC=C1 25218 [1,1,0,0,0,0|1,0,1]=4 691 B9R1.8 CNCC1=CC=CC=C1 5801 [1,1,0,0,0,0|1,0,1]=4 692 B9R1.8 ClCCC1=CC=CN=C1 23929 [1,1,0,0,0,0|1,0,1]=4 693 B9R1.8 NCCC1=CC=CN=C1 13196 [1,1,0,0,0,0|0,0,1]=3 694 B9R1.8 NCCC1=CC=CN=C1 14084 [1,1,0,0,0,0|0,0,1]=3 695 B9R1.8 NCCc1ccccc1 21077 [1,1,0,0,0,0|1,0,1]=4 696 B9R1.8 NNCC1=CC=CC=C1 29056 [1,1,0,0,0,0|1,0,1]=4 697 B9R1.8 NOCC1=CC=CC=C1 24804 [1,1,0,0,0,0|1,0,1]=4 698 B9R1.8 NOCC1=CC=CC=C1 7095 [1,1,0,0,0,0|1,0,1]=4 699 B9R1.8 O=C=NC1=CC=CN=C1 14441 [1,1,0,0,0,0|0,0,1]=3 700 B9R1.8 ONCC1=CC=CC=C1 25520 [1,1,0,0,0,0|1,0,1]=4 701 B9R1.8 SCCC1=CC=CN=C1 25052 [1,1,0,0,0,0|0,1,1]=4 702 B9R1.15 BrCC1=CC=CN=C1Br 22284 [1,1,0,0,0,0|1,0,1]=4 703 B9R1.15 C#CC1=CC=CN=C1N 34373 [1,1,0,0,0,0|1,0,1]=4 704 B9R1.15 C=CC1=C(Br)C=CC=C1 23975 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.15 CC1=C(C#N)C=NC=C1 31633 [1,1,0,0,0,0|0,0,2]=4 706 B9R1.15 CC1=C(C#N)C=NC=C1 6623 [1,1,0,0,0,0|0,0,2]=4 707 B9R1.15 CC1=C(C=O)C=CC=N1 24064 [1,1,0,0,0,0|0,0,0]=2 708 B9R1.15 CC1=C(CN)C=CC=C1 10197 [1,1,0,0,0,0|1,0,1]=4 709 B9R1.15 CC1=C(CO)C=NC=C1 34710 [1,1,0,0,0,0|0,0,2]=4 710 B9R1.15 CC1=C(NN)C=CC=C1 22584 [1,1,0,0,0,0|2,0,0]=4 711 B9R1.15 CC1=C(NN)C=CC=C1 6396 [1,1,0,0,0,0|2,0,0]=4 712 B9R1.15 CC1=CC=CC=C1C=O 15511 [1,1,0,0,0,0|1,0,0]=3 713 B9R1.15 CC1=CC=CN=C1C=O 17165 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.15 CC1=CC=NC=C1C#N 18426 [1,1,0,0,0,0|0,0,2]=4 715 B9R1.15 CC1=CC=NC=C1C=O 18427 [1,1,0,0,0,0|0,0,0]=2 716 B9R1.15 CC1=NC=CC=C1C#N 17460 [1,1,0,0,0,0|0,0,2]=4 717 B9R1.15 CC1=NC=CC=C1CCl 26692 [1,1,0,0,0,0|1,0,1]=4 718 B9R1.15 CC1=NC=CC=C1CO 26693 [1,1,0,0,0,0|0,0,2]=4 719 B9R1.15 CCC1=CC=CN=C1N 35166 [1,1,0,0,0,0|1,0,1]=4 720 B9R1.15 COC1=C(Br)C=CN=C1 20095 [1,1,0,0,0,0|2,0,0]=4 721 B9R1.15 COC1=C(Br)C=CN=C1 34713 [1,1,0,0,0,0|2,0,0]=4 722 B9R1.15 COC1=C(C)C=CN=C1 34674 [1,1,0,0,0,0|2,0,0]=4 723 B9R1.15 COC1=C(Cl)C=CN=C1 33677 [1,1,0,0,0,0|2,0,0]=4 724 B9R1.15 COC1=C(N)C=CN=C1 27755 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.15 COC1=C(O)C=CN=C1 34289 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.15 COC1=CC=CN=C1Br 5916 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.15 COC1=CC=CN=C1C 6637 [1,1,0,0,0,0|2,0,0]=4 728 B9R1.15 COC1=CC=CN=C1Cl 6146 [1,1,0,0,0,0|2,0,0]=4 729 B9R1.15 COC1=CC=CN=C1N 28123 [1,1,0,0,0,0|2,0,0]=4 730 B9R1.15 COC1=CC=CN=C1O 6543 [1,1,0,0,0,0|2,0,0]=4 731 B9R1.15 N#CC1=C(Br)C=CN=C1 17650 [1,1,0,0,0,0|0,0,2]=4 732 B9R1.15 N#CC1=C(Br)N=CC=C1 35805 [1,1,0,0,0,0|0,0,2]=4 733 B9R1.15 N#CC1=C(I)N=CC=C1 34249 [1,1,0,0,0,0|0,0,2]=4 734 B9R1.15 N#CC1=CC=CN=C1Cl 2573 [1,1,0,0,0,0|0,0,2]=4 735 B9R1.15 N#CC1=CC=CN=C1F 1108 [1,1,0,0,0,0|0,0,2]=4 736 B9R1.15 N#CC1=CC=CN=C1N 5584 [1,1,0,0,0,0|0,0,2]=4 737 B9R1.15 N#CC1=CC=CN=C1O 20421 [1,1,0,0,0,0|0,0,2]=4 738 B9R1.15 N#CC1=CC=CN=C1O 6539 [1,1,0,0,0,0|0,0,2]=4 739 B9R1.15 N#CC1=CN=CC=C1O 13974 [1,1,0,0,0,0|0,0,2]=4 740 B9R1.15 NC1=C(C=O)C=CC=C1 15692 [1,1,0,0,0,0|1,0,0]=3 741 B9R1.15 NC1=C(C=O)C=CN=C1 26765 [1,1,0,0,0,0|2,0,0]=4 742 B9R1.15 NC1=C(C=O)C=NC=C1 7681 [1,1,0,0,0,0|0,0,0]=2 743 B9R1.15 NC1=C(CO)C=NC=C1 26901 [1,1,0,0,0,0|0,0,2]=4 744 B9R1.15 NC1=CC=CN=C1C=O 7680 [1,1,0,0,0,0|2,0,0]=4 745 B9R1.15 NC1=NC=CC=C1C=O 1262 [1,1,0,0,0,0|0,0,0]=2 746 B9R1.15 NC1=NC=CC=C1CO 7688 [1,1,0,0,0,0|0,0,2]=4 747 B9R1.15 NCC1=C(Br)C=CC=C1 20398 [1,1,0,0,0,0|1,0,1]=4 748 B9R1.15 NCC1=C(Br)C=CC=C1 3749 [1,1,0,0,0,0|1,0,1]=4 749 B9R1.15 NCC1=C(Cl)C=CC=C1 5800 [1,1,0,0,0,0|1,0,1]=4 750 B9R1.15 NCC1=C(Cl)C=CC=C1 6155 [1,1,0,0,0,0|1,0,1]=4 751 B9R1.15 NCC1=C(F)C=CC=C1 4415 [1,1,0,0,0,0|1,0,1]=4 752 B9R1.15 NCC1=C(N)C=CC=C1 23363 [1,1,0,0,0,0|1,0,1]=4 753 B9R1.15 NCC1=C(O)C=CC=C1 7383 [1,1,0,0,0,0|1,0,1]=4 754 B9R1.15 NCC1=CC=CN=C1Cl 17749 [1,1,0,0,0,0|0,0,1]=3 755 B9R1.15 NCC1=NC=CN=C1Cl 32131 [1,1,0,0,0,0|1,0,1]=4 756 B9R1.15 NNC1=C(Br)C=CC=C1 4463 [1,1,0,0,0,0|2,0,0]=4 757 B9R1.15 NNC1=C(Cl)C=CC=C1 4482 [1,1,0,0,0,0|2,0,0]=4 758 B9R1.15 NNC1=C(F)C=CC=C1 3347 [1,1,0,0,0,0|2,0,0]=4 759 B9R1.15 NNC1=C(F)C=CC=C1 3350 [1,1,0,0,0,0|2,0,0]=4 760 B9R1.15 O=CC1=C(Br)C=CC=C1 3727 [1,1,0,0,0,0|1,0,0]=3 761 B9R1.15 O=CC1=C(Br)C=CN=C1 5061 [1,1,0,0,0,0|0,0,0]=2 762 B9R1.15 O=CC1=C(Br)C=NC=C1 5063 [1,1,0,0,0,0|2,0,0]=4 763 B9R1.15 O=CC1=C(Cl)C=CN=C1 7359 [1,1,0,0,0,0|0,0,0]=2 764 B9R1.15 O=CC1=C(Cl)C=NC=C1 25431 [1,1,0,0,0,0|2,0,0]=4 765 B9R1.15 O=CC1=C(F)C=CC=C1 3476 [1,1,0,0,0,0|1,0,0]=3 766 B9R1.15 O=CC1=C(F)C=NC=C1 5137 [1,1,0,0,0,0|2,0,0]=4 767 B9R1.15 O=CC1=C(I)C=CC=C1 3914 [1,1,0,0,0,0|1,0,0]=3 768 B9R1.15 O=CC1=C(O)C=NC=C1 33398 [1,1,0,0,0,0|2,0,0]=4 769 B9R1.15 O=CC1=C(O)N=CC=C1 17177 [1,1,0,0,0,0|0,0,0]=2 770 B9R1.15 O=CC1=CC=CN=C1Br 5057 [1,1,0,0,0,0|0,0,0]=2 771 B9R1.15 O=CC1=CC=CN=C1Cl 31630 [1,1,0,0,0,0|0,0,0]=2 772 B9R1.15 O=CC1=CC=CN=C1Cl 5097 [1,1,0,0,0,0|0,0,0]=2 773 B9R1.15 O=CC1=CC=CN=C1F 5131 [1,1,0,0,0,0|0,0,0]=2 774 B9R1.15 O=CC1=NC=CC=C1Br 15122 [1,1,0,0,0,0|2,0,0]=4 775 B9R1.15 O=CC1=NC=CC=C1Cl 17163 [1,1,0,0,0,0|2,0,0]=4 776 B9R1.15 O=CC1=NC=CC=C1F 5142 [1,1,0,0,0,0|2,0,0]=4 777 B9R1.15 O=CC1=NC=CC=C1O 12415 [1,1,0,0,0,0|2,0,0]=4 778 B9R1.15 O=CC1=NC=CN=C1Cl 32137 [1,1,0,0,0,0|1,0,0]=3 779 B9R1.15 OCC1=C(Cl)C=CN=C1 12981 [1,1,0,0,0,0|0,0,2]=4 780 B9R1.15 OCC1=CC=CN=C1Cl 12984 [1,1,0,0,0,0|0,0,2]=4 781 B9R1.15 OCC1=CC=CN=C1F 7351 [1,1,0,0,0,0|0,0,2]=4 782 B9R1.11 CCC(=O)C1=CC=CS1 12618 [0,1,0,0,1,0|2,0,0]=4 783 B9R1.11 COC(=O)C1=CC=CN1 9141 [0,1,0,0,1,0|1,0,1]=4 784 B9R1.11 COC(=O)C1=CC=CO1 7090 [0,1,0,0,1,0|2,0,0]=4 785 B9R1.11 COC(=O)C1=CC=CS1 19955 [0,1,0,0,1,0|2,0,0]=4 786 B9R1.11 COC(=O)C1=CN=CS1 17249 [0,1,0,0,1,0|2,0,0]=4 787 B9R1.11 COC(=O)C1=CNC=C1 22507 [0,1,0,0,1,0|1,0,1]=4 788 B9R1.11 COC(=O)C1=CNC=N1 16142 [0,1,0,0,1,0|2,0,0]=4 789 B9R1.11 COC(=O)C1=CSC=N1 15784 [0,1,0,0,1,0|2,0,0]=4 790 B9R1.11 COC(=O)C1=NC=CN1 23680 [0,1,0,0,1,0|2,0,0]=4 791 B9R1.11 COC(=O)C1=NNC=C1 14332 [0,1,0,0,1,0|2,0,0]=4 792 B9R1.11 NNC(=O)C1=CC=CO1 32208 [0,1,0,0,1,0|1,0,0]=3 793 B9R1.11 NNC(=O)C1=CC=CS1 5213 [0,1,0,0,1,0|1,0,0]=3 794 B9R1.11 O=C(CBr)C1=CC=CS1 10129 [0,1,0,0,1,0|2,0,0]=4 795 B9R1.19 NS(=O)(=O)C1=CC=CS1 12992 [0,1,0,0,1,0|2,0,0]=4 796 B9R1.35 CC(=O)C1=CC(C)=CS1 5214 [0,1,0,0,1,0|2,0,0]=4 797 B9R1.35 CC(=O)C1=CC(C)=NO1 24234 [0,1,0,0,1,0|2,0,0]=4 798 B9R1.35 CC(=O)C1=CC(Cl)=CS1 44706 [0,1,0,0,1,0|2,0,0]=4 799 B9R1.35 CC(=O)C1=CC=C(Br)S1 5219 [0,1,0,0,1,0|2,0,0]=4 800 B9R1.35 CC(=O)C1=CC=C(C)O1 6971 [0,1,0,0,1,0|2,0,0]=4 801 B9R1.35 CC(=O)C1=CC=C(C)S1 5212 [0,1,0,0,1,0|2,0,0]=4 802 B9R1.35 CC(=O)C1=CC=C(Cl)S1 2614 [0,1,0,0,1,0|2,0,0]=4 803 B9R1.35 CC(=O)C1=CSC(Cl)=C1 24099 [0,1,0,0,1,0|2,0,0]=4 804 B9R1.35 CC1=CC(C(=O)O)=NO1 15552 [0,1,0,0,1,0|2,0,0]=4 805 B9R1.35 CC1=CC=C(C(=O)O)S1 5206 [0,1,0,0,1,0|2,0,0]=4 806 B9R1.35 CC1=CN=C(C(=O)O)S1 23003 [0,1,0,0,1,0|2,0,0]=4 807 B9R1.35 CC1=CNC(C(=O)O)=C1 13375 [0,1,0,0,1,0|1,0,1]=4 808 B9R1.35 CC1=CSC(C(=O)O)=C1 9431 [0,1,0,0,1,0|2,0,0]=4 809 B9R1.35 CC1=NC=C(C(=O)O)S1 22287 [0,1,0,0,1,0|2,0,0]=4 810 B9R1.35 CC1=NNC(C(=O)O)=C1 7842 [0,1,0,0,1,0|2,0,0]=4 811 B9R1.35 CN1C=C(C(=O)O)C=N1 20860 [0,1,0,0,1,0|2,0,0]=4 812 B9R1.35 CN1C=CC(C(=O)O)=C1 25790 [0,1,0,0,1,0|1,0,1]=4 813 B9R1.35 CN1C=CC(C(N)=O)=N1 24146 [0,1,0,0,1,0|1,0,0]=3 814 B9R1.35 CN1C=NC(C(=O)O)=C1 9001 [0,1,0,0,1,0|2,0,0]=4 815 B9R1.35 NC(=O)C1=CC=C(Br)N1 24946 [0,1,0,0,1,0|0,0,1]=3 816 B9R1.35 NC(=O)C1=CN=C(Br)S1 34305 [0,1,0,0,1,0|1,0,0]=3 817 B9R1.35 NC1=NC(C(=O)O)=CO1 19787 [0,1,0,0,1,0|2,0,0]=4 818 B9R1.35 NC1=NC(C(=O)O)=CS1 8903 [0,1,0,0,1,0|2,0,0]=4 819 B9R1.35 NC1=NC(C(=O)O)=CS1 9934 [0,1,0,0,1,0|2,0,0]=4 820 B9R1.35 NC1=NC=C(C(=O)O)S1 21384 [0,1,0,0,1,0|2,0,0]=4 821 B9R1.35 O=C(Cl)C1=CC=C(Br)O1 10452 [0,1,0,0,1,0|2,0,0]=4 822 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 16132 [0,1,0,0,1,0|2,0,0]=4 823 B9R1.35 O=C(O)C1=CC(Br)=CS1 5189 [0,1,0,0,1,0|2,0,0]=4 824 B9R1.35 O=C(O)C1=CC(Br)=NO1 17690 [0,1,0,0,1,0|2,0,0]=4 825 B9R1.35 O=C(O)C1=CC(O)=NO1 24875 [0,1,0,0,1,0|2,0,0]=4 826 B9R1.35 O=C(O)C1=CC=C(Br)S1 7368 [0,1,0,0,1,0|2,0,0]=4 827 B9R1.35 O=C(O)C1=CC=C(Cl)O1 31597 [0,1,0,0,1,0|2,0,0]=4 828 B9R1.35 O=C(O)C1=CC=C(Cl)S1 7380 [0,1,0,0,1,0|2,0,0]=4 829 B9R1.35 O=C(O)C1=CN=C(Br)S1 15963 [0,1,0,0,1,0|2,0,0]=4 830 B9R1.35 O=C(O)C1=CN=C(Cl)S1 32212 [0,1,0,0,1,0|2,0,0]=4 831 B9R1.35 O=C(O)C1=CSC(Br)=N1 22900 [0,1,0,0,1,0|2,0,0]=4 832 B9R1.35 O=C(O)C1=NNC(Cl)=C1 23727 [0,1,0,0,1,0|2,0,0]=4 833 B9R1.41 CC(=O)C1=C(Br)C=CS1 7280 [0,1,0,0,1,0|2,0,0]=4 834 B9R1.41 CC(=O)C1=C(C)C=CS1 5186 [0,1,0,0,1,0|2,0,0]=4 835 B9R1.41 CC(=O)C1=C(C)N=CS1 33350 [0,1,0,0,1,0|2,0,0]=4 836 B9R1.41 CC(=O)C1=C(I)C=CS1 34469 [0,1,0,0,1,0|2,0,0]=4 837 B9R1.41 CC(=O)C1=C(N)C=CS1 20830 [0,1,0,0,1,0|2,0,0]=4 838 B9R1.41 CC(=O)C1=CC=CN1C 27052 [0,1,0,0,1,0|1,0,1]=4 839 B9R1.41 CC(=O)C1=CC=NN1C 22711 [0,1,0,0,1,0|2,0,0]=4 840 B9R1.41 CC(=O)C1=CNC=C1C 22818 [0,1,0,0,1,0|1,0,1]=4 841 B9R1.41 CC1=C(C(=O)Cl)SC=C1 5561 [0,1,0,0,1,0|2,0,0]=4 842 B9R1.41 CC1=C(C(=O)O)C=NO1 8652 [0,1,0,0,1,0|2,0,0]=4 843 B9R1.41 CC1=C(C(=O)O)SC=C1 5182 [0,1,0,0,1,0|2,0,0]=4 844 B9R1.41 CC1=C(C(=O)O)SC=N1 8416 [0,1,0,0,1,0|2,0,0]=4 845 B9R1.41 CC1=C(C(N)=O)SC=C1 16135 [0,1,0,0,1,0|1,0,0]=3 846 B9R1.41 CC1=CNN=C1C(=O)O 19201 [0,1,0,0,1,0|2,0,0]=4 847 B9R1.41 CC1=CSC=C1C(=O)O 24253 [0,1,0,0,1,0|2,0,0]=4 848 B9R1.41 CC1=NOC=C1C(=O)O 10465 [0,1,0,0,1,0|2,0,0]=4 849 B9R1.41 CC1=NSC=C1C(=O)O 24648 [0,1,0,0,1,0|2,0,0]=4 850 B9R1.41 CN1C=CC=C1C(=O)O 9181 [0,1,0,0,1,0|1,0,1]=4 851 B9R1.41 CN1C=CN=C1C(=O)O 8048 [0,1,0,0,1,0|2,0,0]=4 852 B9R1.41 CN1C=NC=C1C(=O)O 20954 [0,1,0,0,1,0|2,0,0]=4 853 B9R1.41 CN1N=CC=C1C(=O)O 16306 [0,1,0,0,1,0|2,0,0]=4 854 B9R1.41 NC(=O)C1=C(Br)C=CS1 16136 [0,1,0,0,1,0|1,0,0]=3 855 B9R1.41 NC(=O)C1=C(N)C=CS1 5242 [0,1,0,0,1,0|1,0,0]=3 856 B9R1.41 NC(=O)C1=C(N)N=CN1 26011 [0,1,0,0,1,0|1,0,0]=3 857 B9R1.41 NC(=O)C1=C(N)NC=N1 14475 [0,1,0,0,1,0|1,0,0]=3 858 B9R1.41 NC(=O)C1=C(N)NC=N1 9129 [0,1,0,0,1,0|1,0,0]=3 859 B9R1.41 NC(=O)C1=C(N)OC=N1 14695 [0,1,0,0,1,0|1,0,0]=3 860 B9R1.41 NC(=O)C1=C(N)SC=N1 25297 [0,1,0,0,1,0|1,0,0]=3 861 B9R1.41 NC(=O)C1=C(N)SN=C1 31704 [0,1,0,0,1,0|1,0,0]=3 862 B9R1.41 NC(=O)C1=C(O)NC=N1 13970 [0,1,0,0,1,0|1,0,0]=3 863 B9R1.41 NC(=O)C1=CC=CN1N 22288 [0,1,0,0,1,0|0,0,1]=3 864 B9R1.41 NC(=O)C1=CNN=C1N 14012 [0,1,0,0,1,0|1,0,0]=3 865 B9R1.41 NC(=O)C1=CNN=C1N 35101 [0,1,0,0,1,0|1,0,0]=3 866 B9R1.41 NC1=NNC=C1C(=O)O 11081 [0,1,0,0,1,0|2,0,0]=4 867 B9R1.41 O=C(Cl)C1=C(Cl)C=CS1 5480 [0,1,0,0,1,0|2,0,0]=4 868 B9R1.41 O=C(O)C1=C(Br)C=CS1 10096 [0,1,0,0,1,0|2,0,0]=4 869 B9R1.41 O=C(O)C1=C(Br)SC=C1 32434 [0,1,0,0,1,0|2,0,0]=4 870 B9R1.41 O=C(O)C1=C(Br)SC=N1 8916 [0,1,0,0,1,0|2,0,0]=4 871 B9R1.41 O=C(O)C1=C(Cl)C=CS1 5491 [0,1,0,0,1,0|2,0,0]=4 872 B9R1.41 O=C(O)C1=C(Cl)SC=C1 32436 [0,1,0,0,1,0|2,0,0]=4 873 B9R1.41 O=C(O)C1=CSC=C1Br 33364 [0,1,0,0,1,0|2,0,0]=4 874 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 31604 [0,1,0,0,0,1|2,0,0]=4 875 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 28145 [0,1,0,0,0,1|2,0,0]=4 876 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 28133 [0,1,0,0,0,1|2,0,0]=4 877 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 35682 [0,1,0,0,0,1|2,0,0]=4 878 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 3342 [0,1,0,0,0,1|2,0,0]=4 879 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 26262 [0,1,0,0,0,1|2,0,0]=4 880 B11R1.20 CC(=O)NC1=CC=C(Cl)N=N1 34198 [0,1,0,0,0,1|2,0,0]=4 881 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 3293 [0,1,0,0,0,1|2,0,0]=4 882 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 17726 [0,1,0,0,0,1|2,0,0]=4 883 B11R1.20 CC(=O)NC1=CC=C(S)C=C1 6832 [0,1,0,0,0,1|2,0,0]=4 884 B11R1.20 CC(=O)NC1=CN=C(Br)C=C1 9474 [0,1,0,0,0,1|1,0,0]=3 885 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 3061 [0,1,0,0,0,1|2,0,0]=4 886 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 17532 [0,1,0,0,0,1|1,0,0]=3 887 B11R1.20 NC(=S)NC1=CC=C(Br)C=C1 14266 [0,1,0,0,0,1|1,1,0]=4 888 B11R1.20 NC(=S)NC1=CC=C(F)C=C1 10059 [0,1,0,0,0,1|1,1,0]=4 889 B11R1.20 NC1=CC=C(CC(=O)O)C=N1 25031 [0,1,0,0,0,1|1,0,0]=3 890 B11R1.20 Nc1ccc(CC(=O)O)cc1 22147 [0,1,0,0,0,1|2,0,0]=4 891 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 44721 [0,1,0,0,0,1|2,0,0]=4 892 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 17517 [0,1,0,0,0,1|2,0,0]=4 893 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 4246 [0,1,0,0,0,1|2,0,0]=4 894 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 4250 [0,1,0,0,0,1|2,0,0]=4 895 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 13909 [0,1,0,0,0,1|1,0,0]=3 896 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 13432 [0,1,0,0,0,1|2,0,0]=4 897 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 19614 [0,1,0,0,0,1|2,0,0]=4 898 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 18835 [0,1,0,0,0,1|2,0,0]=4 899 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 22193 [0,1,0,0,0,1|2,0,0]=4 900 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 34915 [0,1,0,0,0,1|2,0,0]=4 901 B11R1.20 O=C([O-])[ClH]C1=CC=C(Br)C=C1 28974 [0,1,0,0,0,1|2,0,0]=4 902 B11R1.20 O=C([O-])[ClH]C1=CC=C(F)C=C1 28972 [0,1,0,0,0,1|2,0,0]=4 903 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 35902 [0,1,0,0,0,1|2,0,0]=4 904 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 21081 [0,1,0,0,0,1|2,0,0]=4 905 B11R1.36 C[C@@H](C(=O)O)c1ccccc1 6079 [0,1,0,0,0,1|2,0,0]=4 906 B11R1.36 C[C@H](C(=O)O)c1ccccc1 6862 [0,1,0,0,0,1|2,0,0]=4 907 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 16346 [0,1,0,0,0,1|1,0,0]=3 908 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 19408 [0,1,0,0,0,1|1,0,0]=3 909 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 16811 [0,1,0,0,0,1|2,0,0]=4 910 B11R1.36 N[C@@H](C(=O)O)c1ccccc1 11005 [0,1,0,0,0,1|2,0,0]=4 911 B11R1.36 N[C@H](C(=O)O)c1ccccc1 23858 [0,1,0,0,0,1|2,0,0]=4 912 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 6066 [0,1,0,0,0,1|2,0,0]=4 913 B11R1.36 O=C(O)[C@@H](O)c1ccccc1 6067 [0,1,0,0,0,1|2,0,0]=4 914 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 21083 [0,1,0,0,0,1|2,0,0]=4 915 B11R1.40 CCC(=O)NC1=CC=CC=C1 3338 [0,1,0,0,0,1|2,0,0]=4 916 B11R1.40 CNC(=O)OC1=CC=CC=C1 35857 [0,1,0,0,0,1|1,0,0]=3 917 B11R1.40 COC(=O)CC1=CC=CN=C1 13725 [0,1,0,0,0,1|1,0,0]=3 918 B11R1.40 COC(=O)CC1=NC=CN=C1 27419 [0,1,0,0,0,1|2,0,0]=4 919 B11R1.40 NNC(=S)NC1=CC=CC=C1 10747 [0,1,0,0,0,1|1,1,0]=4 920 B11R1.40 O=C(CF)NC1=CC=CC=C1 3369 [0,1,0,0,0,1|2,0,0]=4 921 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 23388 [0,1,0,0,0,1|2,0,0]=4 922 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 28140 [0,1,0,0,0,1|2,0,0]=4 923 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 28149 [0,1,0,0,0,1|2,0,0]=4 924 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 3830 [0,1,0,0,0,1|2,0,0]=4 925 B11R1.86 CC(=O)NC1=C(O)C=CN=C1 26792 [0,1,0,0,0,1|1,0,0]=3 926 B11R1.86 CC(=O)OC1=C(Br)C=CC=C1 3055 [0,1,0,0,0,1|2,0,0]=4 927 B11R1.86 CC(=O)OC1=C(F)C=CC=C1 3059 [0,1,0,0,0,1|2,0,0]=4 928 B11R1.86 CC(=O)OC1=C(I)C=CC=C1 3062 [0,1,0,0,0,1|2,0,0]=4 929 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 20124 [0,1,0,0,0,1|2,0,0]=4 930 B11R1.86 CC1=C(CC(N)=O)C=CC=C1 17571 [0,1,0,0,0,1|1,0,0]=3 931 B11R1.86 NC(=S)NC1=C(Br)C=CC=C1 14267 [0,1,0,0,0,1|1,1,0]=4 932 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 7214 [0,1,0,0,0,1|2,0,0]=4 933 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 16509 [0,1,0,0,0,1|2,0,0]=4 934 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 4164 [0,1,0,0,0,1|2,0,0]=4 935 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 2552 [0,1,0,0,0,1|2,0,0]=4 936 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 20030 [0,1,0,0,0,1|2,0,0]=4 937 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 25423 [0,1,0,0,0,1|2,0,0]=4 938 B11R1.157 CC(=O)CC1=CC(Cl)=CC=C1 19805 [0,1,0,0,0,1|2,0,0]=4 939 B11R1.157 CC(=O)CC1=CC(F)=CC=C1 35854 [0,1,0,0,0,1|2,0,0]=4 940 B11R1.157 CC(=O)NC1=CC(Br)=CN=C1 20022 [0,1,0,0,0,1|1,0,0]=3 941 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 3340 [0,1,0,0,0,1|2,0,0]=4 942 B11R1.157 CC(=O)NC1=CC(I)=CC=C1 3291 [0,1,0,0,0,1|2,0,0]=4 943 B11R1.157 CC(=O)NC1=CC=CC(O)=C1 3835 [0,1,0,0,0,1|2,0,0]=4 944 B11R1.157 CC(=O)OC1=CC(Cl)=CC=C1 3057 [0,1,0,0,0,1|2,0,0]=4 945 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 3060 [0,1,0,0,0,1|2,0,0]=4 946 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 28872 [0,1,0,0,0,1|2,0,0]=4 947 B11R1.157 NC(=S)NC1=CC(Br)=CC=C1 14268 [0,1,0,0,0,1|1,1,0]=4 948 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 1961 [0,1,0,0,0,1|2,0,0]=4 949 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 4244 [0,1,0,0,0,1|2,0,0]=4 950 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 16510 [0,1,0,0,0,1|2,0,0]=4 951 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 4167 [0,1,0,0,0,1|2,0,0]=4 952 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 4195 [0,1,0,0,0,1|2,0,0]=4 953 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 21773 [0,1,0,0,0,1|2,0,0]=4 954 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 10753 [0,1,0,0,0,1|2,0,0]=4 955 B11R1.509 NS(=O)(=O)CC1=CC=CN=C1 19057 [0,1,0,0,0,1|1,0,0]=3 956 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 30393 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 12624 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 3305 [0,2,0,0,0,0|2,0,0]=4 959 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 23568 [0,2,0,0,0,0|2,0,0]=4 960 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 31192 [0,2,0,0,0,0|2,0,0]=4 961 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 31334 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 9725 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 15495 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.3 CCC1=NC=C([N+](=O)[O-])C=C1 25854 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 4517 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 9808 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.3 COC1=CC=C(C(=O)O)C=C1 23856 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.3 COC1=CC=C(C(C)=O)C=C1 3324 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.3 COC1=CC=C(C(N)=S)C=C1 13558 [0,2,0,0,0,0|1,1,0]=4 970 B11R1.3 COC1=CN=C(C(=O)O)C=N1 32117 [0,2,0,0,0,0|2,0,0]=4 971 B11R1.3 COC1=NC=C(C(=O)O)C=C1 15177 [0,2,0,0,0,0|1,0,0]=3 972 B11R1.3 COC1=NC=C(C(C)=O)C=C1 16770 [0,2,0,0,0,0|1,0,0]=3 973 B11R1.3 COC1=NC=C([N+](=O)[O-])C=C1 1207 [0,2,0,0,0,0|2,0,0]=4 974 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 3333 [0,2,0,0,0,0|2,0,0]=4 975 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 19745 [0,2,0,0,0,0|2,0,0]=4 976 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 16844 [0,2,0,0,0,0|1,0,0]=3 977 B11R1.3 N#CC1=NC=C([N+](=O)[O-])C=C1 6230 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 34552 [0,2,0,0,0,0|1,0,0]=3 979 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 5815 [0,2,0,0,0,0|2,0,0]=4 980 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 7535 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 7572 [0,2,0,0,0,0|2,0,0]=4 982 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 6700 [0,2,0,0,0,0|1,0,0]=3 983 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 28146 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 15446 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 12790 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 8075 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.19 CC1=CC=C(S(N)(=O)=O)C=C1 35241 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.19 CS(=O)(=O)C1=CN=C(Br)C=C1 18617 [0,2,0,0,0,0|2,0,0]=4 989 B11R1.19 NC1=NC=C(S(=O)(=O)O)C=C1 11086 [0,2,0,0,0,0|2,0,0]=4 990 B11R1.19 NS(=O)(=O)C1=CC=C(Br)C=C1 35861 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)N=C1 12420 [0,2,0,0,0,0|1,0,0]=3 992 B11R1.19 NS(=O)(=O)C1=CC=C(F)C=C1 2167 [0,2,0,0,0,0|2,0,0]=4 993 B11R1.19 NS(=O)(=O)C1=CC=C(O)C=C1 12595 [0,2,0,0,0,0|2,0,0]=4 994 B11R1.19 O=S(=O)(Cl)C1=CN=C(Cl)C=C1 18688 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.19 O=S(=O)(O)C1=CC=C(O)N=C1 11085 [0,2,0,0,0,0|2,0,0]=4 996 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 29264 [0,2,0,0,0,0|2,0,0]=4 997 B11R1.21 CC(=O)C1=CC(Br)=C(Cl)C=C1 29259 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 4100 [0,2,0,0,0,0|2,0,0]=4 999 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 29246 [0,2,0,0,0,0|2,0,0]=4 1000 B11R1.21 CC(=O)C1=CC(C)=C(Br)C=C1 29265 [0,2,0,0,0,0|2,0,0]=4 1001 B11R1.21 CC(=O)C1=CC(C)=C(Cl)C=C1 24740 [0,2,0,0,0,0|2,0,0]=4 1002 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 19762 [0,2,0,0,0,0|2,0,0]=4 1003 B11R1.21 CC(=O)C1=CC(C)=C(O)C=C1 15346 [0,2,0,0,0,0|2,0,0]=4 1004 B11R1.21 CC(=O)C1=CC(Cl)=C(Br)C=C1 31191 [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 3383 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 4202 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.21 CC(=O)C1=CC(Cl)=C(N)C=C1 19715 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.21 CC(=O)C1=CC(Cl)=C(O)C=C1 29271 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.21 CC(=O)C1=CC(F)=C(Br)C=C1 25810 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.21 CC(=O)C1=CC(F)=C(C)C=C1 29155 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.21 CC(=O)C1=CC(F)=C(Cl)C=C1 28237 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 3089 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.21 CC(=O)C1=CC(F)=C(N)C=C1 24416 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 3492 [0,2,0,0,0,0|2,0,0]=4 1015 B11R1.21 CC(=O)C1=CC(N)=C(F)C=C1 7322 [0,2,0,0,0,0|2,0,0]=4 1016 B11R1.21 CC(=O)C1=CC(O)=C(C)C=C1 31188 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 3384 [0,2,0,0,0,0|2,0,0]=4 1018 B11R1.21 CC(=O)c1ccc(Br)c(Br)c1 28245 [0,2,0,0,0,0|2,0,0]=4 1019 B11R1.21 CC(=O)c1ccc(C)c(O)c1 24105 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.21 CC(=O)c1ccc(Cl)c(N)c1 27504 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 3806 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 3807 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.21 CC1=C(Br)C=CC(C(N)=O)=C1 3804 [0,2,0,0,0,0|1,0,0]=3 1024 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 14893 [0,2,0,0,0,0|2,0,0]=4 1025 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 4569 [0,2,0,0,0,0|2,0,0]=4 1026 B11R1.21 CC1=C(Cl)C=CC(C(=O)Cl)=C1 28594 [0,2,0,0,0,0|2,0,0]=4 1027 B11R1.21 CC1=C(Cl)C=CC(C(=O)Cl)=C1 30641 [0,2,0,0,0,0|2,0,0]=4 1028 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 3666 [0,2,0,0,0,0|2,0,0]=4 1029 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 1330 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.21 CC1=C(F)C=CC(C(=O)Cl)=C1 25412 [0,2,0,0,0,0|2,0,0]=4 1031 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 1397 [0,2,0,0,0,0|2,0,0]=4 1032 B11R1.21 CC1=C(I)C=C(C(=O)Cl)C=C1 28676 [0,2,0,0,0,0|2,0,0]=4 1033 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 3947 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.21 CC1=C(I)C=CC(C(=O)O)=C1 3948 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 8194 [0,2,0,0,0,0|2,0,0]=4 1036 B11R1.21 CC1=C(N)C=C(C(N)=O)C=C1 35463 [0,2,0,0,0,0|1,0,0]=3 1037 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 2067 [0,2,0,0,0,0|2,0,0]=4 1038 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 3890 [0,2,0,0,0,0|2,0,0]=4 1039 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 20044 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.21 CC1=CC(C(=O)O)=CN=C1F 5143 [0,2,0,0,0,0|1,0,0]=3 1041 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1Br 10608 [0,2,0,0,0,0|2,0,0]=4 1042 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1C 30332 [0,2,0,0,0,0|2,0,0]=4 1043 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1Cl 10621 [0,2,0,0,0,0|2,0,0]=4 1044 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1F 29300 [0,2,0,0,0,0|2,0,0]=4 1045 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1F 6326 [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1N 1274 [0,2,0,0,0,0|2,0,0]=4 1047 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1O 1113 [0,2,0,0,0,0|2,0,0]=4 1048 B11R1.21 NC(=O)C1=CC(Br)=C(F)C=C1 25391 [0,2,0,0,0,0|1,0,0]=3 1049 B11R1.21 NC(=O)C1=CC(Cl)=C(Cl)C=C1 3462 [0,2,0,0,0,0|1,0,0]=3 1050 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 3459 [0,2,0,0,0,0|1,0,0]=3 1051 B11R1.21 NC(=O)C1=CC(N)=C(Cl)C=C1 35464 [0,2,0,0,0,0|1,0,0]=3 1052 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 3130 [0,2,0,0,0,0|2,0,0]=4 1053 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 8988 [0,2,0,0,0,0|2,0,0]=4 1054 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 3524 [0,2,0,0,0,0|2,0,0]=4 1055 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 4690 [0,2,0,0,0,0|2,0,0]=4 1056 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 14046 [0,2,0,0,0,0|2,0,0]=4 1057 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 29055 [0,2,0,0,0,0|2,0,0]=4 1058 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 14418 [0,2,0,0,0,0|2,0,0]=4 1059 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 20504 [0,2,0,0,0,0|2,0,0]=4 1060 B11R1.21 NC1=CC([N+](=O)[O-])=CN=C1O 6516 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.21 NC1=NC=C([N+](=O)[O-])C=C1Br 1148 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.21 Nc1ccc(C(=O)O)cc1Cl 4652 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.21 O=C(Cl)C1=CC(Br)=C(F)C=C1 25457 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Cl)C=C1 26090 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.21 O=C(Cl)C1=CC(F)=C(Cl)C=C1 28589 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.21 O=C(Cl)C1=CC(F)=C(F)C=C1 14796 [0,2,0,0,0,0|2,0,0]=4 1067 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 28612 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 3585 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 1320 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 25903 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.21 O=C(O)C1=CC(Br)=C(O)N=C1 9825 [0,2,0,0,0,0|1,0,0]=3 1072 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 24806 [0,2,0,0,0,0|2,0,0]=4 1073 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 3686 [0,2,0,0,0,0|2,0,0]=4 1074 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 1334 [0,2,0,0,0,0|2,0,0]=4 1075 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 13038 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 1316 [0,2,0,0,0,0|2,0,0]=4 1077 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 1333 [0,2,0,0,0,0|2,0,0]=4 1078 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 1337 [0,2,0,0,0,0|2,0,0]=4 1079 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 29708 [0,2,0,0,0,0|2,0,0]=4 1080 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 1388 [0,2,0,0,0,0|2,0,0]=4 1081 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 2271 [0,2,0,0,0,0|2,0,0]=4 1082 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 28092 [0,2,0,0,0,0|2,0,0]=4 1083 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 12500 [0,2,0,0,0,0|2,0,0]=4 1084 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 1390 [0,2,0,0,0,0|2,0,0]=4 1085 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 28093 [0,2,0,0,0,0|2,0,0]=4 1086 B11R1.21 O=C(O)C1=CC(I)=C(O)C=C1 32382 [0,2,0,0,0,0|2,0,0]=4 1087 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 17671 [0,2,0,0,0,0|2,0,0]=4 1088 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 14051 [0,2,0,0,0,0|2,0,0]=4 1089 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 3494 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 28669 [0,2,0,0,0,0|2,0,0]=4 1091 B11R1.21 O=C(O)C1=CC(O)=C(I)N=C1 18329 [0,2,0,0,0,0|1,0,0]=3 1092 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 9738 [0,2,0,0,0,0|2,0,0]=4 1093 B11R1.21 O=C(O)C1=CN=C(Br)C(Br)=C1 17514 [0,2,0,0,0,0|1,0,0]=3 1094 B11R1.21 O=C(O)C1=CN=C(Br)C(F)=C1 24637 [0,2,0,0,0,0|1,0,0]=3 1095 B11R1.21 O=C(O)C1=CN=C(Cl)C(Br)=C1 12922 [0,2,0,0,0,0|1,0,0]=3 1096 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=C1 12968 [0,2,0,0,0,0|1,0,0]=3 1097 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=C1 29238 [0,2,0,0,0,0|1,0,0]=3 1098 B11R1.21 O=C(O)C1=CN=C(Cl)C(F)=C1 24638 [0,2,0,0,0,0|1,0,0]=3 1099 B11R1.21 O=C(O)C1=CN=C(F)C(Br)=C1 21829 [0,2,0,0,0,0|1,0,0]=3 1100 B11R1.21 O=C(O)C1=CN=C(F)C(Cl)=C1 36069 [0,2,0,0,0,0|1,0,0]=3 1101 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 18429 [0,2,0,0,0,0|1,0,0]=3 1102 B11R1.21 O=C(O)C1=CN=C(O)C(Cl)=C1 10618 [0,2,0,0,0,0|1,0,0]=3 1103 B11R1.21 O=[N+]([O-])C1=CN=C(Br)C(Br)=C1 5398 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.21 O=[N+]([O-])C1=CN=C(Br)C(Cl)=C1 5773 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.21 O=[N+]([O-])C1=CN=C(Cl)C(Br)=C1 1165 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.21 O=[N+]([O-])C1=CN=C(Cl)C(Cl)=C1 5408 [0,2,0,0,0,0|2,0,0]=4 1107 B11R1.21 O=[N+]([O-])C1=CN=C(Cl)C(F)=C1 26680 [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.21 O=[N+]([O-])C1=CN=C(F)C(Br)=C1 6248 [0,2,0,0,0,0|2,0,0]=4 1109 B11R1.21 O=[N+]([O-])C1=CN=C(F)C(F)=C1 5413 [0,2,0,0,0,0|2,0,0]=4 1110 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(Br)=C1 6708 [0,2,0,0,0,0|2,0,0]=4 1111 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(Cl)=C1 6536 [0,2,0,0,0,0|2,0,0]=4 1112 B11R1.21 O=[N+]([O-])C1=CN=C(S)C(Cl)=C1 14554 [0,2,0,0,0,0|2,0,0]=4 1113 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 12114 [0,2,0,0,0,0|2,0,0]=4 1114 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 7423 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 22351 [0,2,0,0,0,0|1,0,0]=3 1116 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 23893 [0,2,0,0,0,0|1,0,0]=3 1117 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 12477 [0,2,0,0,0,0|2,0,0]=4 1118 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 20971 [0,2,0,0,0,0|2,0,0]=4 1119 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 36050 [0,2,0,0,0,0|2,0,0]=4 1120 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 12578 [0,2,0,0,0,0|2,0,0]=4 1121 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 35537 [0,2,0,0,0,0|2,0,0]=4 1122 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 3962 [0,2,0,0,0,0|2,0,0]=4 1123 B11R1.22 COC(=O)C1=CC=C(C)C=C1 15479 [0,2,0,0,0,0|2,0,0]=4 1124 B11R1.22 COC(=O)C1=CC=C(C)N=N1 18664 [0,2,0,0,0,0|2,0,0]=4 1125 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 3708 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 36193 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.22 COC(=O)C1=CC=C(F)C=C1 3566 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.22 COC(=O)C1=CC=C(I)C=C1 20378 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.22 COC(=O)C1=CC=C(N)C=C1 28506 [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.22 COC(=O)C1=CC=C(O)C=C1 27407 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.22 COC(=O)C1=CC=C(O)C=C1 35335 [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 14326 [0,2,0,0,0,0|1,0,0]=3 1133 B11R1.22 COC(=O)C1=CN=C(Br)N=C1 27820 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.22 COC(=O)C1=CN=C(C)C=C1 13718 [0,2,0,0,0,0|1,0,0]=3 1135 B11R1.22 COC(=O)C1=CN=C(C)N=C1 21597 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 13584 [0,2,0,0,0,0|1,0,0]=3 1137 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 9777 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.22 COC(=O)C1=CN=C(F)C=C1 10629 [0,2,0,0,0,0|1,0,0]=3 1139 B11R1.22 COC(=O)C1=CN=C(N)C=C1 2418 [0,2,0,0,0,0|1,0,0]=3 1140 B11R1.22 COC(=O)C1=CN=C(N)N=C1 27978 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.22 COC(=O)C1=CNC(=O)N=C1 34673 [0,2,0,0,0,0|2,0,0]=4 1142 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 21394 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.22 COC(=O)C1=NC=C(N)N=C1 32171 [0,2,0,0,0,0|2,0,0]=4 1144 B11R1.22 COC(=O)C1=NC=C(O)N=C1 9107 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 29245 [0,2,0,0,0,0|2,0,0]=4 1146 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 16820 [0,2,0,0,0,0|1,0,0]=3 1147 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 16752 [0,2,0,0,0,0|1,0,0]=3 1148 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 22326 [0,2,0,0,0,0|1,0,0]=3 1149 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 3743 [0,2,0,0,0,0|1,0,0]=3 1150 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 3622 [0,2,0,0,0,0|1,0,0]=3 1151 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 3483 [0,2,0,0,0,0|1,0,0]=3 1152 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 3885 [0,2,0,0,0,0|1,0,0]=3 1153 B11R1.22 NNC(=O)C1=CN=C(Cl)C=C1 18551 [0,2,0,0,0,0|0,0,0]=2 1154 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 28432 [0,2,0,0,0,0|1,0,1]=4 1155 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 16821 [0,2,0,0,0,0|2,0,0]=4 1156 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 3260 [0,2,0,0,0,0|2,0,0]=4 1157 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 13415 [0,2,0,0,0,0|2,0,0]=4 1158 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 22524 [0,2,0,0,0,0|2,0,0]=4 1159 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 3320 [0,2,0,0,0,0|2,0,0]=4 1160 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 7424 [0,2,0,0,0,0|2,0,0]=4 1161 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 3372 [0,2,0,0,0,0|2,0,0]=4 1162 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 3269 [0,2,0,0,0,0|2,0,0]=4 1163 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 29269 [0,2,0,0,0,0|2,0,0]=4 1164 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 12103 [0,2,0,0,0,0|2,0,0]=4 1165 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 27268 [0,2,0,0,0,0|2,0,0]=4 1166 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 12090 [0,2,0,0,0,0|2,0,0]=4 1167 B11R1.22 O=CC(=O)C1=CC=C(F)C=C1 12088 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 12125 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.166 CC(=O)C1=C(Br)C=C(Br)C=C1 29275 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 29258 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 8533 [0,2,0,0,0,0|2,0,0]=4 1172 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 28228 [0,2,0,0,0,0|2,0,0]=4 1173 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 29261 [0,2,0,0,0,0|2,0,0]=4 1174 B11R1.166 CC(=O)C1=C(C)C=C(Br)C=C1 31226 [0,2,0,0,0,0|2,0,0]=4 1175 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 3376 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 29273 [0,2,0,0,0,0|2,0,0]=4 1177 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 24792 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 3265 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 13619 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 4187 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 28238 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 29270 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 24789 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 4207 [0,2,0,0,0,0|2,0,0]=4 1185 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 4213 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 24419 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 36301 [0,2,0,0,0,0|2,0,0]=4 1188 B11R1.166 CC(=O)C1=C(N)C=C(F)C=C1 27374 [0,2,0,0,0,0|2,0,0]=4 1189 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 19929 [0,2,0,0,0,0|2,0,0]=4 1190 B11R1.166 CC(=O)C1=C(O)C=C(C)C=C1 16935 [0,2,0,0,0,0|2,0,0]=4 1191 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 29061 [0,2,0,0,0,0|2,0,0]=4 1192 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 13252 [0,2,0,0,0,0|2,0,0]=4 1193 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 28229 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 3375 [0,2,0,0,0,0|2,0,0]=4 1195 B11R1.166 CC(=O)C1=CC=C(F)N=C1F 18362 [0,2,0,0,0,0|1,0,0]=3 1196 B11R1.166 CC(=O)C1=CN=C(N)N=C1C 13333 [0,2,0,0,0,0|2,0,0]=4 1197 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 4029 [0,2,0,0,0,0|2,0,0]=4 1198 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 4570 [0,2,0,0,0,0|2,0,0]=4 1199 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 33689 [0,2,0,0,0,0|1,0,0]=3 1200 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 1327 [0,2,0,0,0,0|2,0,0]=4 1201 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 10626 [0,2,0,0,0,0|1,0,0]=3 1202 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 10924 [0,2,0,0,0,0|2,0,0]=4 1203 B11R1.166 CC1=C(C(=O)O)C=NC(Cl)=C1 35774 [0,2,0,0,0,0|1,0,0]=3 1204 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Br)=N1 2968 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Cl)=N1 6225 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.166 CC1=C([N+](=O)[O-])C=CC(F)=N1 29111 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.166 CC1=C([N+](=O)[O-])C=CC(F)=N1 6327 [0,2,0,0,0,0|2,0,0]=4 1208 B11R1.166 CC1=C([N+](=O)[O-])C=CC(N)=N1 1156 [0,2,0,0,0,0|2,0,0]=4 1209 B11R1.166 CC1=C([N+](=O)[O-])C=CC(O)=N1 10387 [0,2,0,0,0,0|2,0,0]=4 1210 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 4719 [0,2,0,0,0,0|2,0,0]=4 1211 B11R1.166 CC1=CC(Br)=NC=C1[N+](=O)[O-] 1182 [0,2,0,0,0,0|2,0,0]=4 1212 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 15441 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 4567 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.166 CC1=CC(Cl)=NC=C1[N+](=O)[O-] 6223 [0,2,0,0,0,0|2,0,0]=4 1215 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 1395 [0,2,0,0,0,0|2,0,0]=4 1216 B11R1.166 CC1=CC(F)=NC=C1[N+](=O)[O-] 1201 [0,2,0,0,0,0|2,0,0]=4 1217 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 30572 [0,2,0,0,0,0|2,0,0]=4 1218 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 4952 [0,2,0,0,0,0|2,0,0]=4 1219 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 4030 [0,2,0,0,0,0|1,0,0]=3 1220 B11R1.166 CC1=CC(N)=NC=C1C(=O)O 5702 [0,2,0,0,0,0|1,0,0]=3 1221 B11R1.166 CC1=CC(N)=NC=C1[N+](=O)[O-] 1134 [0,2,0,0,0,0|2,0,0]=4 1222 B11R1.166 CC1=CC(O)=NC=C1[N+](=O)[O-] 2029 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 18270 [0,2,0,0,0,0|2,0,0]=4 1224 B11R1.166 CC1=CC=C(C(=O)O)C(O)=N1 26524 [0,2,0,0,0,0|1,0,0]=3 1225 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Br)=N1 5954 [0,2,0,0,0,0|2,0,0]=4 1226 B11R1.166 CC1=CC=C([N+](=O)[O-])C(C)=N1 14242 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Cl)=N1 6175 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.166 CC1=CC=C([N+](=O)[O-])C(F)=N1 6309 [0,2,0,0,0,0|2,0,0]=4 1229 B11R1.166 CC1=CC=C([N+](=O)[O-])C(N)=N1 1275 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.166 CC1=CC=C([N+](=O)[O-])C(O)=N1 1112 [0,2,0,0,0,0|2,0,0]=4 1231 B11R1.166 CC1=NC(Cl)=C(C(=O)O)C=C1 11019 [0,2,0,0,0,0|1,0,0]=3 1232 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 34358 [0,2,0,0,0,0|2,0,0]=4 1233 B11R1.166 NC(=O)C1=C(Br)C=C(Br)C=C1 28771 [0,2,0,0,0,0|1,0,0]=3 1234 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 31609 [0,2,0,0,0,0|1,0,0]=3 1235 B11R1.166 NC(=O)C1=C(F)C=C(F)C=C1 3458 [0,2,0,0,0,0|1,0,0]=3 1236 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=C1 25784 [0,2,0,0,0,0|1,0,0]=3 1237 B11R1.166 NC(=O)C1=CN=C(Cl)N=C1Cl 35712 [0,2,0,0,0,0|1,0,0]=3 1238 B11R1.166 NC(=S)C1=C(Cl)C=C(Cl)C=C1 20132 [0,2,0,0,0,0|1,1,0]=4 1239 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 13462 [0,2,0,0,0,0|2,0,0]=4 1240 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=N1 26435 [0,2,0,0,0,0|1,0,0]=3 1241 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 11211 [0,2,0,0,0,0|2,0,0]=4 1242 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 1323 [0,2,0,0,0,0|2,0,0]=4 1243 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 22552 [0,2,0,0,0,0|2,0,0]=4 1244 B11R1.166 NC1=CC(Br)=NC=C1[N+](=O)[O-] 15368 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 3109 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.166 NC1=CC(Cl)=NC=C1[N+](=O)[O-] 9316 [0,2,0,0,0,0|2,0,0]=4 1247 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 4693 [0,2,0,0,0,0|2,0,0]=4 1248 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 23542 [0,2,0,0,0,0|2,0,0]=4 1249 B11R1.166 NC1=NC(Cl)=CC=C1[N+](=O)[O-] 14382 [0,2,0,0,0,0|2,0,0]=4 1250 B11R1.166 NC1=NC(Cl)=CC=C1[N+](=O)[O-] 26053 [0,2,0,0,0,0|2,0,0]=4 1251 B11R1.166 NC1=NC=C(C(=O)O)C(=O)N1 33343 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.166 NC1=NC=C([N+](=O)[O-])C(Cl)=C1 13537 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.166 O=C(Cl)C1=C(F)C=C(Br)C=C1 25458 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.166 O=C(Cl)C1=C(F)C=C(F)C=C1 35111 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.166 O=C(Cl)C1=CN=C(Cl)N=C1Cl 20115 [0,2,0,0,0,0|2,0,0]=4 1256 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 3856 [0,2,0,0,0,0|2,0,0]=4 1257 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 4028 [0,2,0,0,0,0|2,0,0]=4 1258 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 1314 [0,2,0,0,0,0|2,0,0]=4 1259 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 3586 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 21313 [0,2,0,0,0,0|2,0,0]=4 1261 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 18521 [0,2,0,0,0,0|1,0,0]=3 1262 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 1370 [0,2,0,0,0,0|2,0,0]=4 1263 B11R1.166 O=C(O)C1=C(Cl)C=C(I)C=C1 10153 [0,2,0,0,0,0|2,0,0]=4 1264 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 4561 [0,2,0,0,0,0|2,0,0]=4 1265 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 1225 [0,2,0,0,0,0|1,0,0]=3 1266 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 1313 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 1374 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 1336 [0,2,0,0,0,0|2,0,0]=4 1269 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 1384 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 2608 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.166 O=C(O)C1=C(I)C=C(Br)C=C1 13466 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 4018 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 1389 [0,2,0,0,0,0|2,0,0]=4 1274 B11R1.166 O=C(O)C1=C(I)C=C(O)C=C1 27646 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 4010 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 3845 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 3493 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.166 O=C(O)C1=C(O)C=C(I)C=C1 3888 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br 14391 [0,2,0,0,0,0|1,0,0]=3 1280 B11R1.166 O=C(O)C1=CC=C(F)N=C1F 14392 [0,2,0,0,0,0|1,0,0]=3 1281 B11R1.166 O=C(O)C1=CN=C(Cl)N=C1Cl 35960 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.166 O=C(O)C1=CN=C(O)N=C1O 9623 [0,2,0,0,0,0|2,0,0]=4 1283 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl 27639 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.166 O=C([O-])C1=C(F)C=C(F)C=C1 29707 [0,2,0,0,0,0|2,0,0]=4 1285 B11R1.166 O=[N+]([O-])C1=CC=C(Br)N=C1Br 20184 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)N=C1Cl 9234 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)N=C1O 6555 [0,2,0,0,0,0|2,0,0]=4 1288 B11R1.166 O=[N+]([O-])C1=CC=C(F)N=C1F 35735 [0,2,0,0,0,0|2,0,0]=4 1289 B11R1.166 O=[N+]([O-])C1=CN=C(Cl)C=C1Cl 11803 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.166 O=[N+]([O-])C1=CN=C(O)C=C1Cl 18668 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.12 C\C=C(\C=O)C1=CC=CC=C1 10989 [0,2,0,0,0,0|2,0,0]=4 1292 B11R1.16 CCCC(=O)C1=CC=CN=C1 34740 [0,2,0,0,0,0|1,0,0]=3 1293 B11R1.16 CCOC(=O)C1=CN=CC=C1 11727 [0,2,0,0,0,0|1,0,0]=3 1294 B11R1.16 CNCC(=O)C1=CC=CC=C1 19826 [0,2,0,0,0,0|1,0,0]=3 1295 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 14016 [0,2,0,0,0,0|2,0,0]=4 1296 B11R1.16 N#CCC(=O)C1=CC=CC=C1 14543 [0,2,0,0,0,0|1,0,1]=4 1297 B11R1.16 N#CCC(=O)C1=CC=CN=C1 12106 [0,2,0,0,0,0|0,0,1]=3 1298 B11R1.16 NCCC(=O)C1=CC=CC=C1 29292 [0,2,0,0,0,0|1,0,0]=3 1299 B11R1.16 O=C(CCCl)C1=CC=CC=C1 14089 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.16 O=C(CCF)C1=CC=CC=C1 26688 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.16 O=C(N=C=S)C1=CC=CC=C1 7571 [0,2,0,0,0,0|1,0,1]=4 1302 B11R1.16 O=C(NCO)C1=CC=CC=C1 12540 [0,2,0,0,0,0|1,0,0]=3 1303 B11R1.16 O=C=NC(=O)C1=CC=CC=C1 7575 [0,2,0,0,0,0|1,0,1]=4 1304 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 35120 [0,2,0,0,0,0|1,0,0]=3 1305 B11R1.23 CC1=CN=CC(C(=O)NN)=N1 32174 [0,2,0,0,0,0|1,0,0]=3 1306 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 19020 [0,2,0,0,0,0|2,0,0]=4 1307 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 3083 [0,2,0,0,0,0|2,0,0]=4 1308 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 28263 [0,2,0,0,0,0|2,0,0]=4 1309 B11R1.23 CCC(=O)C1=CC(O)=CC=C1 25952 [0,2,0,0,0,0|2,0,0]=4 1310 B11R1.23 CNC(=O)C1=CC(Br)=NC=C1 9637 [0,2,0,0,0,0|2,0,0]=4 1311 B11R1.23 CNC(=O)C1=CC(N)=CC=C1 14198 [0,2,0,0,0,0|1,0,0]=3 1312 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 14985 [0,2,0,0,0,0|2,0,0]=4 1313 B11R1.23 COC(=O)C1=CC(Br)=CC=C1 3961 [0,2,0,0,0,0|2,0,0]=4 1314 B11R1.23 COC(=O)C1=CC(Cl)=CC=C1 36244 [0,2,0,0,0,0|2,0,0]=4 1315 B11R1.23 COC(=O)C1=CC(F)=CC=C1 25450 [0,2,0,0,0,0|2,0,0]=4 1316 B11R1.23 COC(=O)C1=CC(I)=CC=C1 28675 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.23 COC(=O)C1=CC(N)=CC=C1 16709 [0,2,0,0,0,0|2,0,0]=4 1318 B11R1.23 COC(=O)C1=CC(O)=CC=C1 12550 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.23 COC(=O)C1=CC(S)=CC=C1 20230 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.23 COC(=O)C1=CC=CC(C)=C1 15491 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 22051 [0,2,0,0,0,0|1,0,0]=3 1322 B11R1.23 COC(=O)C1=CN=CC(C)=C1 27511 [0,2,0,0,0,0|1,0,0]=3 1323 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 27818 [0,2,0,0,0,0|2,0,0]=4 1324 B11R1.23 COC(=O)C1=NC(C)=CN=C1 32142 [0,2,0,0,0,0|2,0,0]=4 1325 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 16685 [0,2,0,0,0,0|2,0,0]=4 1326 B11R1.23 COC(=O)C1=NC(N)=CN=C1 19897 [0,2,0,0,0,0|2,0,0]=4 1327 B11R1.23 NCC(=O)c1cccc(Br)c1 31219 [0,2,0,0,0,0|1,0,0]=3 1328 B11R1.23 NNC(=O)C1=CC(Cl)=CC=C1 3621 [0,2,0,0,0,0|1,0,0]=3 1329 B11R1.23 NNC(=O)C1=CC(F)=CC=C1 3482 [0,2,0,0,0,0|1,0,0]=3 1330 B11R1.23 NNC(=O)C1=CC(N)=NC=C1 16606 [0,2,0,0,0,0|2,0,0]=4 1331 B11R1.23 NNC(=O)C1=NC(I)=CC=C1 16532 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.23 NNC(=O)C1=NC=CC(Cl)=C1 26936 [0,2,0,0,0,0|2,0,0]=4 1333 B11R1.23 N\C(=N/O)C1=CC(Cl)=CC=C1 23438 [0,2,0,0,0,0|1,0,1]=4 1334 B11R1.23 O=C(CBr)C1=CC(Br)=CC=C1 29255 [0,2,0,0,0,0|2,0,0]=4 1335 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 29257 [0,2,0,0,0,0|2,0,0]=4 1336 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 13417 [0,2,0,0,0,0|2,0,0]=4 1337 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 16446 [0,2,0,0,0,0|2,0,0]=4 1338 B11R1.23 O=C(CCl)C1=CC(Cl)=CC=C1 3370 [0,2,0,0,0,0|2,0,0]=4 1339 B11R1.23 O=C(CCl)C1=CC(O)=CC=C1 16445 [0,2,0,0,0,0|2,0,0]=4 1340 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 10937 [0,2,0,0,0,0|2,0,0]=4 1341 B11R1.23 O=CC(=O)C1=CC(Br)=CC=C1 12315 [0,2,0,0,0,0|2,0,0]=4 1342 B11R1.23 O=CC(=O)C1=CC(Cl)=CC=C1 12320 [0,2,0,0,0,0|2,0,0]=4 1343 B11R1.222 CCC(=O)C1=C(F)C=CC=C1 19917 [0,2,0,0,0,0|2,0,0]=4 1344 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 21422 [0,2,0,0,0,0|2,0,0]=4 1345 B11R1.222 CNC(=O)C1=C(N)N=CC=C1 15000 [0,2,0,0,0,0|0,0,0]=2 1346 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 3956 [0,2,0,0,0,0|2,0,0]=4 1347 B11R1.222 COC(=O)C1=C(C)N=CC=C1 2218 [0,2,0,0,0,0|1,0,0]=3 1348 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 3707 [0,2,0,0,0,0|2,0,0]=4 1349 B11R1.222 COC(=O)C1=C(Cl)N=CC=C1 15917 [0,2,0,0,0,0|1,0,0]=3 1350 B11R1.222 COC(=O)C1=C(F)C=CC=C1 3565 [0,2,0,0,0,0|2,0,0]=4 1351 B11R1.222 COC(=O)C1=C(F)N=CC=C1 10628 [0,2,0,0,0,0|1,0,0]=3 1352 B11R1.222 COC(=O)C1=C(I)C=CC=C1 10568 [0,2,0,0,0,0|2,0,0]=4 1353 B11R1.222 COC(=O)C1=C(N)N=CC=C1 16778 [0,2,0,0,0,0|1,0,0]=3 1354 B11R1.222 COC(=O)C1=CC=CC=C1C 15492 [0,2,0,0,0,0|2,0,0]=4 1355 B11R1.222 COC(=O)C1=CC=CC=C1N 13629 [0,2,0,0,0,0|2,0,0]=4 1356 B11R1.222 COC(=O)C1=CC=CC=C1S 10565 [0,2,0,0,0,0|2,0,0]=4 1357 B11R1.222 COC(=O)C1=CC=CN=C1Br 14383 [0,2,0,0,0,0|1,0,0]=3 1358 B11R1.222 COC(=O)C1=CC=CNC1=O 19579 [0,2,0,0,0,0|1,0,1]=4 1359 B11R1.222 COC(=O)C1=CN=CC=C1C 21351 [0,2,0,0,0,0|1,0,0]=3 1360 B11R1.222 COC(=O)C1=CN=CC=C1N 25347 [0,2,0,0,0,0|1,0,0]=3 1361 B11R1.222 COC(=O)C1=CN=CN=C1O 21479 [0,2,0,0,0,0|2,0,0]=4 1362 B11R1.222 COC(=O)C1=NC=CN=C1Br 32147 [0,2,0,0,0,0|2,0,0]=4 1363 B11R1.222 COC(=O)C1=NC=CN=C1Cl 32119 [0,2,0,0,0,0|2,0,0]=4 1364 B11R1.222 COC(=O)C1=NC=CN=C1I 32125 [0,2,0,0,0,0|2,0,0]=4 1365 B11R1.222 COC(=O)C1=NC=CN=C1N 8549 [0,2,0,0,0,0|2,0,0]=4 1366 B11R1.222 NC1=C(C(=O)CBr)C=CC=C1 29244 [0,2,0,0,0,0|2,0,0]=4 1367 B11R1.222 NCC(=O)C1=C(Cl)C=CC=C1 29248 [0,2,0,0,0,0|1,0,0]=3 1368 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 29130 [0,2,0,0,0,0|1,0,0]=3 1369 B11R1.222 NNC(=O)C1=C(Br)C=CC=C1 3742 [0,2,0,0,0,0|1,0,0]=3 1370 B11R1.222 NNC(=O)C1=C(F)C=CC=C1 3481 [0,2,0,0,0,0|1,0,0]=3 1371 B11R1.222 NNC(=O)C1=CC=CC=C1O 22912 [0,2,0,0,0,0|1,0,0]=3 1372 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 16835 [0,2,0,0,0,0|2,0,0]=4 1373 B11R1.222 O=C(CBr)c1ccccc1Cl 11080 [0,2,0,0,0,0|2,0,0]=4 1374 B11R1.222 O=CC(=O)C1=CC=CCC1=S 12133 [0,2,0,0,0,0|2,0,0]=4 1375 B11R1.87 CC1=C(S(N)(=O)=O)C=CC=C1 10087 [0,2,0,0,0,0|2,0,0]=4 1376 B11R1.87 NS(=O)(=O)C1=C(Br)C=CC=C1 13521 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.87 NS(=O)(=O)C1=C(Cl)C=CC=C1 15336 [0,2,0,0,0,0|2,0,0]=4 1378 B11R1.87 NS(=O)(=O)C1=C(F)C=CC=C1 11761 [0,2,0,0,0,0|2,0,0]=4 1379 B11R1.87 O=S(=O)(Cl)C1=CC=CN=C1Cl 14833 [0,2,0,0,0,0|2,0,0]=4 1380 B11R1.155 CC1=CN=CC(S(=O)(=O)O)=C1 16071 [0,2,0,0,0,0|2,0,0]=4 1381 B11R1.155 NS(=O)(=O)C1=CC(Br)=CC=C1 11759 [0,2,0,0,0,0|2,0,0]=4 1382 B11R1.155 NS(=O)(=O)C1=CC(F)=CC=C1 11762 [0,2,0,0,0,0|2,0,0]=4 1383 B11R1.155 O=S(=O)(O)C1=CC(Br)=CN=C1 16057 [0,2,0,0,0,0|2,0,0]=4 1384 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 19668 [0,2,0,0,0,0|2,0,0]=4 1385 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 19789 [0,2,0,0,0,0|2,0,0]=4 1386 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 9869 [0,2,0,0,0,0|2,0,0]=4 1387 B11R1.53 CCC1=NC=CN=C1C(C)=O 8615 [0,2,0,0,0,0|2,0,0]=4 1388 B11R1.53 CNC1=NC=CC=C1[N+](=O)[O-] 16597 [0,2,0,0,0,0|2,0,0]=4 1389 B11R1.53 COC1=C(C(=O)O)C=CC=C1 18488 [0,2,0,0,0,0|2,0,0]=4 1390 B11R1.53 COC1=C(C(=O)O)C=CC=N1 20354 [0,2,0,0,0,0|1,0,0]=3 1391 B11R1.53 COC1=C(C(C)=O)C=CC=C1 4278 [0,2,0,0,0,0|2,0,0]=4 1392 B11R1.53 COC1=C(C(C)=O)C=NC=C1 33637 [0,2,0,0,0,0|1,0,0]=3 1393 B11R1.53 COC1=C(C(N)=S)C=CC=C1 35098 [0,2,0,0,0,0|1,1,0]=4 1394 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 14990 [0,2,0,0,0,0|2,0,0]=4 1395 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 6689 [0,2,0,0,0,0|2,0,0]=4 1396 B11R1.53 COC1=CC=CC=C1C(=O)Cl 26362 [0,2,0,0,0,0|2,0,0]=4 1397 B11R1.53 COC1=CC=NC=C1C(=O)O 33397 [0,2,0,0,0,0|1,0,0]=3 1398 B11R1.53 COC1=NC=CC=C1C(C)=O 27866 [0,2,0,0,0,0|1,0,0]=3 1399 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] 6593 [0,2,0,0,0,0|2,0,0]=4 1400 B11R1.53 COC1=NC=CN=C1C(=O)O 27950 [0,2,0,0,0,0|2,0,0]=4 1401 B11R1.53 CSC1=C(C(=O)O)C=CC=C1 10324 [0,2,0,0,0,0|2,0,0]=4 1402 B11R1.53 N#CC1=C(C(=O)O)C=CC=C1 12513 [0,2,0,0,0,0|2,0,0]=4 1403 B11R1.53 N#CC1=C(C(=O)O)C=CC=N1 34217 [0,2,0,0,0,0|1,0,0]=3 1404 B11R1.53 N#CC1=NC=CC=C1[N+](=O)[O-] 6227 [0,2,0,0,0,0|2,0,0]=4 1405 B11R1.53 NNC1=C(C(=O)O)C=CC=C1 6411 [0,2,0,0,0,0|2,0,0]=4 1406 B11R1.53 O=C(O)c1ccccc1CBr 23937 [0,2,0,0,0,0|2,0,0]=4 1407 B11R1.53 O=CC1=C(C(=O)O)C=CC=C1 7365 [0,2,0,0,0,0|2,0,0]=4 1408 B11R1.53 O=CC1=C([N+](=O)[O-])C=NC=C1 9764 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.156 CC(=O)C1=C(Br)C=CC=C1Cl 31211 [0,2,0,0,0,0|2,0,0]=4 1410 B11R1.156 CC(=O)C1=C(Br)C=CC=C1F 31193 [0,2,0,0,0,0|2,0,0]=4 1411 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O 24613 [0,2,0,0,0,0|2,0,0]=4 1412 B11R1.156 CC(=O)C1=C(C)C=CC=C1C 31230 [0,2,0,0,0,0|2,0,0]=4 1413 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl 12362 [0,2,0,0,0,0|2,0,0]=4 1414 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F 7110 [0,2,0,0,0,0|2,0,0]=4 1415 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1O 31212 [0,2,0,0,0,0|2,0,0]=4 1416 B11R1.156 CC(=O)C1=C(F)C=CC=C1C 31223 [0,2,0,0,0,0|2,0,0]=4 1417 B11R1.156 CC(=O)C1=C(F)C=CC=C1F 4218 [0,2,0,0,0,0|2,0,0]=4 1418 B11R1.156 CC(=O)C1=C(O)C=CC=C1C 31224 [0,2,0,0,0,0|2,0,0]=4 1419 B11R1.156 CC(=O)C1=C(O)C=CC=C1O 3378 [0,2,0,0,0,0|2,0,0]=4 1420 B11R1.156 CC(=O)c1c(O)cccc1F 28251 [0,2,0,0,0,0|2,0,0]=4 1421 B11R1.156 CC1=C(C(=O)O)C(Br)=NC=C1 23850 [0,2,0,0,0,0|1,0,0]=3 1422 B11R1.156 CC1=C(C(=O)O)C(N)=NC=C1 9317 [0,2,0,0,0,0|1,0,0]=3 1423 B11R1.156 CC1=C([N+](=O)[O-])C(Br)=NC=C1 5950 [0,2,0,0,0,0|2,0,0]=4 1424 B11R1.156 CC1=C([N+](=O)[O-])C(Cl)=NC=C1 6148 [0,2,0,0,0,0|2,0,0]=4 1425 B11R1.156 CC1=C([N+](=O)[O-])C(F)=NC=C1 6297 [0,2,0,0,0,0|2,0,0]=4 1426 B11R1.156 CC1=C([N+](=O)[O-])C(N)=NC=C1 1272 [0,2,0,0,0,0|2,0,0]=4 1427 B11R1.156 CC1=C([N+](=O)[O-])C(O)=NC=C1 6548 [0,2,0,0,0,0|2,0,0]=4 1428 B11R1.156 CC1=CC=CC(Br)=C1C(=O)O 4715 [0,2,0,0,0,0|2,0,0]=4 1429 B11R1.156 CC1=CC=CC(C)=C1C(=O)O 4951 [0,2,0,0,0,0|2,0,0]=4 1430 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)O 4568 [0,2,0,0,0,0|2,0,0]=4 1431 B11R1.156 CC1=CC=CC(F)=C1C(=O)Cl 28655 [0,2,0,0,0,0|2,0,0]=4 1432 B11R1.156 CC1=CC=CC(F)=C1C(=O)O 1331 [0,2,0,0,0,0|2,0,0]=4 1433 B11R1.156 CC1=CC=CC(F)=C1C(N)=O 31753 [0,2,0,0,0,0|1,0,0]=3 1434 B11R1.156 CC1=CC=CC(N)=C1C(=O)O 4957 [0,2,0,0,0,0|2,0,0]=4 1435 B11R1.156 CC1=CC=CC(O)=C1C(=O)O 19633 [0,2,0,0,0,0|2,0,0]=4 1436 B11R1.156 CC1=CC=NC(Cl)=C1C(N)=O 17640 [0,2,0,0,0,0|0,0,0]=2 1437 B11R1.156 CC1=NC=NC(C)=C1C(=O)O 17096 [0,2,0,0,0,0|2,0,0]=4 1438 B11R1.156 NC(=O)C1=C(Cl)C=CC=C1I 27570 [0,2,0,0,0,0|1,0,0]=3 1439 B11R1.156 NC(=O)C1=C(F)C=CC=C1F 10766 [0,2,0,0,0,0|1,0,0]=3 1440 B11R1.156 NC(=O)C1=C(N)C=CC=C1F 4574 [0,2,0,0,0,0|1,0,0]=3 1441 B11R1.156 NC1=C(C(=O)O)C(Br)=CC=C1 14048 [0,2,0,0,0,0|2,0,0]=4 1442 B11R1.156 NC1=C(C(=O)O)C(Cl)=CC=C1 9876 [0,2,0,0,0,0|2,0,0]=4 1443 B11R1.156 NC1=C(C(=O)O)C(F)=CC=C1 1324 [0,2,0,0,0,0|2,0,0]=4 1444 B11R1.156 NC1=C([N+](=O)[O-])C(Cl)=NC=C1 9314 [0,2,0,0,0,0|2,0,0]=4 1445 B11R1.156 NC1=C([N+](=O)[O-])C(O)=NC=C1 6544 [0,2,0,0,0,0|2,0,0]=4 1446 B11R1.156 NC1=NC=CC(Cl)=C1[N+](=O)[O-] 17739 [0,2,0,0,0,0|2,0,0]=4 1447 B11R1.156 O=C(Cl)C1=C(Cl)C=CC=C1Cl 18674 [0,2,0,0,0,0|2,0,0]=4 1448 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1F 28621 [0,2,0,0,0,0|2,0,0]=4 1449 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1I 4963 [0,2,0,0,0,0|2,0,0]=4 1450 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br 28611 [0,2,0,0,0,0|2,0,0]=4 1451 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Cl 4048 [0,2,0,0,0,0|2,0,0]=4 1452 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F 1317 [0,2,0,0,0,0|2,0,0]=4 1453 B11R1.156 O=C(O)C1=C(Br)C=CC=C1O 33425 [0,2,0,0,0,0|2,0,0]=4 1454 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl 20028 [0,2,0,0,0,0|2,0,0]=4 1455 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1F 1372 [0,2,0,0,0,0|2,0,0]=4 1456 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O 30488 [0,2,0,0,0,0|2,0,0]=4 1457 B11R1.156 O=C(O)C1=C(Cl)C=CN=C1Cl 17746 [0,2,0,0,0,0|1,0,0]=3 1458 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1I 26811 [0,2,0,0,0,0|1,0,0]=3 1459 B11R1.156 O=C(O)C1=C(F)C=CC=C1F 2274 [0,2,0,0,0,0|2,0,0]=4 1460 B11R1.156 O=C(O)C1=C(F)C=CC=C1I 1386 [0,2,0,0,0,0|2,0,0]=4 1461 B11R1.156 O=C(O)C1=C(F)C=CC=C1O 4958 [0,2,0,0,0,0|2,0,0]=4 1462 B11R1.156 O=C(O)C1=C(F)N=CC=C1I 17043 [0,2,0,0,0,0|1,0,0]=3 1463 B11R1.156 O=C(O)C1=C(O)C=CC=C1O 21431 [0,2,0,0,0,0|2,0,0]=4 1464 B11R1.156 O=[N+]([O-])C1=C(Br)C=CN=C1Br 5450 [0,2,0,0,0,0|2,0,0]=4 1465 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CN=C1Cl 5459 [0,2,0,0,0,0|2,0,0]=4 1466 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CN=C1O 6547 [0,2,0,0,0,0|2,0,0]=4 1467 B11R1.156 O=[N+]([O-])C1=C(O)C=CN=C1O 5469 [0,2,0,0,0,0|2,0,0]=4 1468 B11R1.159 CC(=O)C1=C(C)C(Br)=CC=C1 31204 [0,2,0,0,0,0|2,0,0]=4 1469 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 19771 [0,2,0,0,0,0|2,0,0]=4 1470 B11R1.159 CC(=O)C1=C(Cl)C(Br)=CC=C1 31198 [0,2,0,0,0,0|2,0,0]=4 1471 B11R1.159 CC(=O)C1=C(Cl)C(Cl)=CC=C1 3368 [0,2,0,0,0,0|2,0,0]=4 1472 B11R1.159 CC(=O)C1=C(Cl)C(F)=CC=C1 31183 [0,2,0,0,0,0|2,0,0]=4 1473 B11R1.159 CC(=O)C1=C(F)C(Br)=CC=C1 4095 [0,2,0,0,0,0|2,0,0]=4 1474 B11R1.159 CC(=O)C1=C(F)C(C)=CC=C1 31221 [0,2,0,0,0,0|2,0,0]=4 1475 B11R1.159 CC(=O)C1=C(F)C(Cl)=CC=C1 29140 [0,2,0,0,0,0|2,0,0]=4 1476 B11R1.159 CC(=O)C1=C(F)C(F)=CC=C1 4211 [0,2,0,0,0,0|2,0,0]=4 1477 B11R1.159 CC(=O)C1=C(F)C(O)=CC=C1 33429 [0,2,0,0,0,0|2,0,0]=4 1478 B11R1.159 CC(=O)C1=C(N)C(C)=CC=C1 29253 [0,2,0,0,0,0|2,0,0]=4 1479 B11R1.159 CC(=O)C1=C(N)C(Cl)=CC=C1 29249 [0,2,0,0,0,0|2,0,0]=4 1480 B11R1.159 CC(=O)C1=C(N)C(F)=CC=C1 34667 [0,2,0,0,0,0|2,0,0]=4 1481 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 35768 [0,2,0,0,0,0|2,0,0]=4 1482 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 29262 [0,2,0,0,0,0|2,0,0]=4 1483 B11R1.159 CC(=O)C1=C(O)C(Cl)=CC=C1 31195 [0,2,0,0,0,0|2,0,0]=4 1484 B11R1.159 CC(=O)C1=C(O)C(F)=CC=C1 19786 [0,2,0,0,0,0|2,0,0]=4 1485 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 3281 [0,2,0,0,0,0|2,0,0]=4 1486 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 33767 [0,2,0,0,0,0|2,0,0]=4 1487 B11R1.159 CC(=O)c1cccc(N)c1O 10346 [0,2,0,0,0,0|2,0,0]=4 1488 B11R1.159 CC1=C(Br)C=NC=C1[N+](=O)[O-] 23155 [0,2,0,0,0,0|2,0,0]=4 1489 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br 4717 [0,2,0,0,0,0|2,0,0]=4 1490 B11R1.159 CC1=C(C(=O)O)C=CC=C1Cl 8362 [0,2,0,0,0,0|2,0,0]=4 1491 B11R1.159 CC1=C(C(=O)O)C=CC=C1F 1329 [0,2,0,0,0,0|2,0,0]=4 1492 B11R1.159 CC1=C(C(=O)O)C=CC=C1I 22968 [0,2,0,0,0,0|2,0,0]=4 1493 B11R1.159 CC1=C(C(=O)O)C=CC=C1N 10921 [0,2,0,0,0,0|2,0,0]=4 1494 B11R1.159 CC1=C(C(=O)O)C=CC=C1O 15694 [0,2,0,0,0,0|2,0,0]=4 1495 B11R1.159 CC1=C(Cl)C([N+](=O)[O-])=CN=C1 27700 [0,2,0,0,0,0|2,0,0]=4 1496 B11R1.159 CC1=C(N)C([N+](=O)[O-])=CN=C1 27686 [0,2,0,0,0,0|2,0,0]=4 1497 B11R1.159 CC1=CC=CC(C(=O)Cl)=C1C 28637 [0,2,0,0,0,0|2,0,0]=4 1498 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br 3805 [0,2,0,0,0,0|2,0,0]=4 1499 B11R1.159 CC1=CC=CC(C(=O)O)=C1C 2549 [0,2,0,0,0,0|2,0,0]=4 1500 B11R1.159 CC1=CC=CC(C(=O)O)=C1Cl 4566 [0,2,0,0,0,0|2,0,0]=4 1501 B11R1.159 CC1=CC=CC(C(=O)O)=C1F 1328 [0,2,0,0,0,0|2,0,0]=4 1502 B11R1.159 CC1=CC=CC(C(=O)O)=C1I 12741 [0,2,0,0,0,0|2,0,0]=4 1503 B11R1.159 CC1=CC=CC(C(=O)O)=C1N 4950 [0,2,0,0,0,0|2,0,0]=4 1504 B11R1.159 CC1=CC=CC(C(N)=O)=C1F 4573 [0,2,0,0,0,0|1,0,0]=3 1505 B11R1.159 CC1=CC=CC(C(N)=O)=C1N 26013 [0,2,0,0,0,0|1,0,0]=3 1506 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=C1 22279 [0,2,0,0,0,0|1,0,0]=3 1507 B11R1.159 NC(=O)C1=C(F)C(F)=CC=C1 25400 [0,2,0,0,0,0|1,0,0]=3 1508 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 9761 [0,2,0,0,0,0|2,0,0]=4 1509 B11R1.159 NC(=O)C1=C(N)C(F)=CC=C1 28768 [0,2,0,0,0,0|1,0,0]=3 1510 B11R1.159 NC(=O)C1=C(N)C(N)=CC=C1 19664 [0,2,0,0,0,0|1,0,0]=3 1511 B11R1.159 NC(=S)C1=C(Cl)C(Cl)=CC=C1 22984 [0,2,0,0,0,0|1,1,0]=4 1512 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O 6655 [0,2,0,0,0,0|1,0,0]=3 1513 B11R1.159 NC1=C(Br)C=NC=C1[N+](=O)[O-] 6651 [0,2,0,0,0,0|2,0,0]=4 1514 B11R1.159 NC1=C(C(=O)O)C=CC=C1Br 9022 [0,2,0,0,0,0|2,0,0]=4 1515 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl 4639 [0,2,0,0,0,0|2,0,0]=4 1516 B11R1.159 NC1=C(C(=O)O)C=CC=C1F 1356 [0,2,0,0,0,0|2,0,0]=4 1517 B11R1.159 NC1=C(C(=O)O)C=CC=C1F 30459 [0,2,0,0,0,0|2,0,0]=4 1518 B11R1.159 NC1=C(C(=O)O)C=CC=C1I 22551 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.159 NC1=C(Cl)C=NC=C1C(=O)O 6656 [0,2,0,0,0,0|1,0,0]=3 1520 B11R1.159 NC1=C(N)C([N+](=O)[O-])=CN=C1 6610 [0,2,0,0,0,0|2,0,0]=4 1521 B11R1.159 NC1=C(O)C=CC=C1C(=O)O 22539 [0,2,0,0,0,0|2,0,0]=4 1522 B11R1.159 NC1=CC=CC(C(=O)O)=C1Cl 10348 [0,2,0,0,0,0|2,0,0]=4 1523 B11R1.159 NC1=CC=CC(C(=O)O)=C1F 2533 [0,2,0,0,0,0|2,0,0]=4 1524 B11R1.159 NC1=CC=CC(C(=O)O)=C1N 3145 [0,2,0,0,0,0|2,0,0]=4 1525 B11R1.159 NC1=CC=CC(C(=O)O)=C1O 14474 [0,2,0,0,0,0|2,0,0]=4 1526 B11R1.159 O=C(Cl)C1=C(Cl)C(Cl)=CC=C1 35261 [0,2,0,0,0,0|2,0,0]=4 1527 B11R1.159 O=C(Cl)C1=C(F)C(Br)=CC=C1 28561 [0,2,0,0,0,0|2,0,0]=4 1528 B11R1.159 O=C(Cl)C1=C(F)C(Cl)=CC=C1 28588 [0,2,0,0,0,0|2,0,0]=4 1529 B11R1.159 O=C(Cl)C1=C(F)C(F)=CC=C1 16225 [0,2,0,0,0,0|2,0,0]=4 1530 B11R1.159 O=C(O)C1=C(Br)C(Br)=CC=C1 28610 [0,2,0,0,0,0|2,0,0]=4 1531 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 27754 [0,2,0,0,0,0|2,0,0]=4 1532 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 33724 [0,2,0,0,0,0|2,0,0]=4 1533 B11R1.159 O=C(O)C1=C(Br)C(F)=CC=C1 1319 [0,2,0,0,0,0|2,0,0]=4 1534 B11R1.159 O=C(O)C1=C(Br)C(I)=CC=C1 30460 [0,2,0,0,0,0|2,0,0]=4 1535 B11R1.159 O=C(O)C1=C(Br)C(O)=CC=C1 27698 [0,2,0,0,0,0|2,0,0]=4 1536 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CC=C1 26335 [0,2,0,0,0,0|2,0,0]=4 1537 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=CC=C1 8198 [0,2,0,0,0,0|2,0,0]=4 1538 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 1369 [0,2,0,0,0,0|2,0,0]=4 1539 B11R1.159 O=C(O)C1=C(Cl)C(I)=CC=C1 30702 [0,2,0,0,0,0|2,0,0]=4 1540 B11R1.159 O=C(O)C1=C(Cl)C(O)=CC=C1 30633 [0,2,0,0,0,0|2,0,0]=4 1541 B11R1.159 O=C(O)C1=C(F)C(Br)=CC=C1 1318 [0,2,0,0,0,0|2,0,0]=4 1542 B11R1.159 O=C(O)C1=C(F)C(Cl)=CC=C1 1332 [0,2,0,0,0,0|2,0,0]=4 1543 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 1379 [0,2,0,0,0,0|2,0,0]=4 1544 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 1383 [0,2,0,0,0,0|2,0,0]=4 1545 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 4959 [0,2,0,0,0,0|2,0,0]=4 1546 B11R1.159 O=C(O)C1=C(I)C(F)=CC=C1 1387 [0,2,0,0,0,0|2,0,0]=4 1547 B11R1.159 O=C(O)C1=C(I)C(O)=CC=C1 28114 [0,2,0,0,0,0|2,0,0]=4 1548 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 28569 [0,2,0,0,0,0|2,0,0]=4 1549 B11R1.159 O=C(O)C1=C(O)C(F)=CC=C1 4960 [0,2,0,0,0,0|2,0,0]=4 1550 B11R1.159 O=C(O)C1=C(O)C(O)=CC=C1 3119 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O 18184 [0,2,0,0,0,0|2,0,0]=4 1552 B11R1.159 O=[N+]([O-])C1=CN=CC(Br)=C1Cl 23156 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.159 O=[N+]([O-])C1=CN=CC(Br)=C1O 27164 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 23873 [0,2,0,0,0,0|2,0,0]=4 1555 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 3214 [0,2,0,0,0,0|2,0,0]=4 1556 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 29260 [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.167 CC(=O)C1=C(Cl)C=CC(Cl)=C1 10586 [0,2,0,0,0,0|2,0,0]=4 1558 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 4193 [0,2,0,0,0,0|2,0,0]=4 1559 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=C1 16430 [0,2,0,0,0,0|2,0,0]=4 1560 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 4237 [0,2,0,0,0,0|2,0,0]=4 1561 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 8394 [0,2,0,0,0,0|2,0,0]=4 1562 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 29131 [0,2,0,0,0,0|2,0,0]=4 1563 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 29152 [0,2,0,0,0,0|2,0,0]=4 1564 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 15742 [0,2,0,0,0,0|2,0,0]=4 1565 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 15829 [0,2,0,0,0,0|2,0,0]=4 1566 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 26324 [0,2,0,0,0,0|2,0,0]=4 1567 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 33711 [0,2,0,0,0,0|2,0,0]=4 1568 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 3913 [0,2,0,0,0,0|2,0,0]=4 1569 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 16936 [0,2,0,0,0,0|2,0,0]=4 1570 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 3353 [0,2,0,0,0,0|2,0,0]=4 1571 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 3356 [0,2,0,0,0,0|2,0,0]=4 1572 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 17597 [0,2,0,0,0,0|2,0,0]=4 1573 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 3377 [0,2,0,0,0,0|2,0,0]=4 1574 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F 30415 [0,2,0,0,0,0|1,0,0]=3 1575 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl 27246 [0,2,0,0,0,0|1,0,0]=3 1576 B11R1.167 CC1=C(C(=O)Cl)C=C(F)C=C1 31959 [0,2,0,0,0,0|2,0,0]=4 1577 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 4728 [0,2,0,0,0,0|2,0,0]=4 1578 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 4578 [0,2,0,0,0,0|2,0,0]=4 1579 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 1326 [0,2,0,0,0,0|2,0,0]=4 1580 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 4520 [0,2,0,0,0,0|2,0,0]=4 1581 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 4980 [0,2,0,0,0,0|2,0,0]=4 1582 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 25813 [0,2,0,0,0,0|2,0,0]=4 1583 B11R1.167 CC1=C(C(N)=O)C=C(F)C=C1 26344 [0,2,0,0,0,0|1,0,0]=3 1584 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 2166 [0,2,0,0,0,0|2,0,0]=4 1585 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 28638 [0,2,0,0,0,0|2,0,0]=4 1586 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 12501 [0,2,0,0,0,0|2,0,0]=4 1587 B11R1.167 CC1=CC(C(=O)O)=C(Cl)N=C1 33728 [0,2,0,0,0,0|1,0,0]=3 1588 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 4750 [0,2,0,0,0,0|2,0,0]=4 1589 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 4975 [0,2,0,0,0,0|2,0,0]=4 1590 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 4954 [0,2,0,0,0,0|2,0,0]=4 1591 B11R1.167 CC1=CC(C(=O)[O-])=C(I)C=C1 29722 [0,2,0,0,0,0|2,0,0]=4 1592 B11R1.167 CC1=CC(C(N)=O)=C(N)C=C1 13743 [0,2,0,0,0,0|1,0,0]=3 1593 B11R1.167 CC1=CN=C(Br)C([N+](=O)[O-])=C1 5952 [0,2,0,0,0,0|2,0,0]=4 1594 B11R1.167 CC1=CN=C(Cl)C([N+](=O)[O-])=C1 6171 [0,2,0,0,0,0|2,0,0]=4 1595 B11R1.167 CC1=CN=C(F)C([N+](=O)[O-])=C1 26681 [0,2,0,0,0,0|2,0,0]=4 1596 B11R1.167 CC1=CN=C(N)C([N+](=O)[O-])=C1 1273 [0,2,0,0,0,0|2,0,0]=4 1597 B11R1.167 CC1=CN=C(O)C([N+](=O)[O-])=C1 1204 [0,2,0,0,0,0|2,0,0]=4 1598 B11R1.167 CC1=NC=C(Br)C=C1[N+](=O)[O-] 13809 [0,2,0,0,0,0|2,0,0]=4 1599 B11R1.167 NC(=O)C1=C(Cl)C=CC(F)=C1 9137 [0,2,0,0,0,0|1,0,0]=3 1600 B11R1.167 NC(=O)C1=C(F)C=CC(Cl)=C1 9136 [0,2,0,0,0,0|1,0,0]=3 1601 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 13624 [0,2,0,0,0,0|1,0,0]=3 1602 B11R1.167 NC(=O)C1=C(N)C=CC(F)=C1 25959 [0,2,0,0,0,0|1,0,0]=3 1603 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl 29043 [0,2,0,0,0,0|0,0,0]=2 1604 B11R1.167 NC(=O)C1=CC(Cl)=CC=C1O 25792 [0,2,0,0,0,0|1,0,0]=3 1605 B11R1.167 NC(=O)C1=NC(Cl)=CC=C1N 19596 [0,2,0,0,0,0|2,0,0]=4 1606 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 3719 [0,2,0,0,0,0|2,0,0]=4 1607 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=N1 5708 [0,2,0,0,0,0|1,0,0]=3 1608 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 3575 [0,2,0,0,0,0|2,0,0]=4 1609 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=N1 5716 [0,2,0,0,0,0|1,0,0]=3 1610 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 1322 [0,2,0,0,0,0|2,0,0]=4 1611 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 2543 [0,2,0,0,0,0|2,0,0]=4 1612 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 15307 [0,2,0,0,0,0|2,0,0]=4 1613 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=C1 4637 [0,2,0,0,0,0|2,0,0]=4 1614 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 4654 [0,2,0,0,0,0|2,0,0]=4 1615 B11R1.167 NC1=CC(C(=O)O)=C(Cl)N=C1 34240 [0,2,0,0,0,0|1,0,0]=3 1616 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 1325 [0,2,0,0,0,0|2,0,0]=4 1617 B11R1.167 NC1=NC=C(Br)C=C1[N+](=O)[O-] 1105 [0,2,0,0,0,0|2,0,0]=4 1618 B11R1.167 NC1=NC=C(Br)N=C1C(=O)O 22388 [0,2,0,0,0,0|2,0,0]=4 1619 B11R1.167 NC1=NC=C(Cl)C=C1[N+](=O)[O-] 1151 [0,2,0,0,0,0|2,0,0]=4 1620 B11R1.167 NC1=NC=C(F)C=C1[N+](=O)[O-] 1271 [0,2,0,0,0,0|2,0,0]=4 1621 B11R1.167 Nc1ccc(O)c(C(=O)O)c1 17623 [0,2,0,0,0,0|2,0,0]=4 1622 B11R1.167 O=C(Cl)C1=C(F)C=CC(Cl)=C1 28590 [0,2,0,0,0,0|2,0,0]=4 1623 B11R1.167 O=C(Cl)C1=C(F)C=CC(I)=C1 2131 [0,2,0,0,0,0|2,0,0]=4 1624 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 3859 [0,2,0,0,0,0|2,0,0]=4 1625 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 3584 [0,2,0,0,0,0|2,0,0]=4 1626 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 1315 [0,2,0,0,0,0|2,0,0]=4 1627 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 3787 [0,2,0,0,0,0|2,0,0]=4 1628 B11R1.167 O=C(O)C1=C(Br)C=CC(O)=C1 30462 [0,2,0,0,0,0|2,0,0]=4 1629 B11R1.167 O=C(O)C1=C(Br)N=CC(Br)=C1 20950 [0,2,0,0,0,0|1,0,0]=3 1630 B11R1.167 O=C(O)C1=C(Br)N=CC(F)=C1 19483 [0,2,0,0,0,0|1,0,0]=3 1631 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 3587 [0,2,0,0,0,0|2,0,0]=4 1632 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 3685 [0,2,0,0,0,0|2,0,0]=4 1633 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 1371 [0,2,0,0,0,0|2,0,0]=4 1634 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 3649 [0,2,0,0,0,0|2,0,0]=4 1635 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=C1 16487 [0,2,0,0,0,0|2,0,0]=4 1636 B11R1.167 O=C(O)C1=C(Cl)N=CC(Br)=C1 12967 [0,2,0,0,0,0|1,0,0]=3 1637 B11R1.167 O=C(O)C1=C(Cl)N=CC(Cl)=C1 2601 [0,2,0,0,0,0|1,0,0]=3 1638 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 9827 [0,2,0,0,0,0|1,0,0]=3 1639 B11R1.167 O=C(O)C1=C(Cl)N=CC(O)=C1 32399 [0,2,0,0,0,0|1,0,0]=3 1640 B11R1.167 O=C(O)C1=C(Cl)N=NC(Cl)=C1 9529 [0,2,0,0,0,0|2,0,0]=4 1641 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 1312 [0,2,0,0,0,0|2,0,0]=4 1642 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 1375 [0,2,0,0,0,0|2,0,0]=4 1643 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 4935 [0,2,0,0,0,0|2,0,0]=4 1644 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 1385 [0,2,0,0,0,0|2,0,0]=4 1645 B11R1.167 O=C(O)C1=C(F)C=CC(O)=C1 2260 [0,2,0,0,0,0|2,0,0]=4 1646 B11R1.167 O=C(O)C1=C(F)N=CC(Br)=C1 17103 [0,2,0,0,0,0|1,0,0]=3 1647 B11R1.167 O=C(O)C1=C(F)N=CC(Cl)=C1 14328 [0,2,0,0,0,0|1,0,0]=3 1648 B11R1.167 O=C(O)C1=C(F)N=CC(F)=C1 22311 [0,2,0,0,0,0|1,0,0]=3 1649 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 3789 [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 3818 [0,2,0,0,0,0|2,0,0]=4 1651 B11R1.167 O=C(O)C1=C(I)C=CC(F)=C1 1391 [0,2,0,0,0,0|2,0,0]=4 1652 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 3838 [0,2,0,0,0,0|2,0,0]=4 1653 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 1382 [0,2,0,0,0,0|2,0,0]=4 1654 B11R1.167 O=C(O)C1=C(O)C=CC(I)=C1 3889 [0,2,0,0,0,0|2,0,0]=4 1655 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 14414 [0,2,0,0,0,0|2,0,0]=4 1656 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=C1 2602 [0,2,0,0,0,0|1,0,0]=3 1657 B11R1.167 O=C(O)C1=C(O)N=CC(Cl)=C1 12990 [0,2,0,0,0,0|1,0,0]=3 1658 B11R1.167 O=C(O)C1=C(O)N=CC(F)=C1 10622 [0,2,0,0,0,0|1,0,0]=3 1659 B11R1.167 O=C(O)C1=C(S)C=CC(F)=C1 24688 [0,2,0,0,0,0|2,0,0]=4 1660 B11R1.167 O=C(O)C1=NC(Br)=CN=C1Br 32416 [0,2,0,0,0,0|2,0,0]=4 1661 B11R1.167 O=C([O-])C1=C(F)C=CC(F)=C1 28620 [0,2,0,0,0,0|2,0,0]=4 1662 B11R1.167 O=C([O-])C1=C(O)C=CC(Br)=C1 25682 [0,2,0,0,0,0|2,0,0]=4 1663 B11R1.167 O=C([O-])C1=C(O)C=CC(Br)=C1 26261 [0,2,0,0,0,0|2,0,0]=4 1664 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1Br 5505 [0,2,0,0,0,0|2,0,0]=4 1665 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1Cl 1166 [0,2,0,0,0,0|2,0,0]=4 1666 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1F 6299 [0,2,0,0,0,0|2,0,0]=4 1667 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1O 1176 [0,2,0,0,0,0|2,0,0]=4 1668 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1Br 5951 [0,2,0,0,0,0|2,0,0]=4 1669 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1Cl 2267 [0,2,0,0,0,0|2,0,0]=4 1670 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1F 6302 [0,2,0,0,0,0|2,0,0]=4 1671 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1O 6553 [0,2,0,0,0,0|2,0,0]=4 1672 B11R1.167 O=[N+]([O-])C1=CC(F)=CN=C1Br 14284 [0,2,0,0,0,0|2,0,0]=4 1673 B11R1.167 O=[N+]([O-])C1=CC(F)=CN=C1Cl 2967 [0,2,0,0,0,0|2,0,0]=4 1674 B11R1.167 O=[N+]([O-])C1=CC(F)=CN=C1F 10475 [0,2,0,0,0,0|2,0,0]=4 1675 B11R1.167 O=[N+]([O-])C1=CC(F)=CN=C1O 2975 [0,2,0,0,0,0|2,0,0]=4 1676 B11R1.167 O=[N+]([O-])C1=CC(I)=CN=C1Br 27224 [0,2,0,0,0,0|2,0,0]=4 1677 B11R1.167 O=[N+]([O-])C1=CC(I)=CN=C1O 27151 [0,2,0,0,0,0|2,0,0]=4 1678 B11R1.167 O=[N+]([O-])C1=CC(O)=CN=C1O 5520 [0,2,0,0,0,0|2,0,0]=4 1679 B11R1.74 CC(=O)C1=CC(Br)=CC(Br)=C1 3388 [0,2,0,0,0,0|2,0,0]=4 1680 B11R1.74 CC(=O)C1=CC(Br)=CC(C)=C1 31218 [0,2,0,0,0,0|2,0,0]=4 1681 B11R1.74 CC(=O)C1=CC(Br)=CC(F)=C1 22227 [0,2,0,0,0,0|2,0,0]=4 1682 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 24402 [0,2,0,0,0,0|2,0,0]=4 1683 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 3389 [0,2,0,0,0,0|2,0,0]=4 1684 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 2179 [0,2,0,0,0,0|2,0,0]=4 1685 B11R1.74 CC(=O)C1=CC(I)=CC(Br)=C1 7457 [0,2,0,0,0,0|2,0,0]=4 1686 B11R1.74 CC(=O)C1=CC(N)=CC(N)=C1 7489 [0,2,0,0,0,0|2,0,0]=4 1687 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 3390 [0,2,0,0,0,0|2,0,0]=4 1688 B11R1.74 CC(=O)c1cc(Cl)cc(Br)c1 23803 [0,2,0,0,0,0|2,0,0]=4 1689 B11R1.74 CC(=O)c1cc(F)cc(Cl)c1 28236 [0,2,0,0,0,0|2,0,0]=4 1690 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=C1 30472 [0,2,0,0,0,0|2,0,0]=4 1691 B11R1.74 CC1=CC(C(=O)O)=CC(F)=C1 1396 [0,2,0,0,0,0|2,0,0]=4 1692 B11R1.74 CC1=CC(C(=O)O)=CC(O)=C1 18175 [0,2,0,0,0,0|2,0,0]=4 1693 B11R1.74 CC1=CC(C)=CC(C(=O)Cl)=C1 15465 [0,2,0,0,0,0|2,0,0]=4 1694 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 15440 [0,2,0,0,0,0|2,0,0]=4 1695 B11R1.74 CC1=CC(N)=CC(C(=O)O)=C1 4979 [0,2,0,0,0,0|2,0,0]=4 1696 B11R1.74 NC(=O)C1=CC(N)=CC(F)=C1 31592 [0,2,0,0,0,0|1,0,0]=3 1697 B11R1.74 NC(=O)C1=CC(O)=CC(O)=C1 13928 [0,2,0,0,0,0|1,0,0]=3 1698 B11R1.74 NC1=CC(Br)=CC(C(=O)O)=C1 30637 [0,2,0,0,0,0|2,0,0]=4 1699 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 32194 [0,2,0,0,0,0|2,0,0]=4 1700 B11R1.74 NC1=CC(Cl)=CC(C(=O)O)=C1 10455 [0,2,0,0,0,0|2,0,0]=4 1701 B11R1.74 NC1=CC(F)=CC(C(=O)O)=C1 28526 [0,2,0,0,0,0|2,0,0]=4 1702 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 21025 [0,2,0,0,0,0|2,0,0]=4 1703 B11R1.74 NC1=CC(O)=CC(C(=O)O)=C1 17213 [0,2,0,0,0,0|2,0,0]=4 1704 B11R1.74 O=C(Cl)C1=CC(Cl)=CC(Cl)=C1 10805 [0,2,0,0,0,0|2,0,0]=4 1705 B11R1.74 O=C(Cl)C1=CC(F)=CC(F)=C1 20777 [0,2,0,0,0,0|2,0,0]=4 1706 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 3861 [0,2,0,0,0,0|2,0,0]=4 1707 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 13461 [0,2,0,0,0,0|2,0,0]=4 1708 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 2154 [0,2,0,0,0,0|2,0,0]=4 1709 B11R1.74 O=C(O)C1=CC(Br)=CC(I)=C1 3788 [0,2,0,0,0,0|2,0,0]=4 1710 B11R1.74 O=C(O)C1=CC(Br)=CC(O)=C1 27678 [0,2,0,0,0,0|2,0,0]=4 1711 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 28613 [0,2,0,0,0,0|2,0,0]=4 1712 B11R1.74 O=C(O)C1=CC(Cl)=CC(F)=C1 1373 [0,2,0,0,0,0|2,0,0]=4 1713 B11R1.74 O=C(O)C1=CC(Cl)=CC(I)=C1 3650 [0,2,0,0,0,0|2,0,0]=4 1714 B11R1.74 O=C(O)C1=CC(Cl)=CC(O)=C1 30474 [0,2,0,0,0,0|2,0,0]=4 1715 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 2173 [0,2,0,0,0,0|2,0,0]=4 1716 B11R1.74 O=C(O)C1=CC(F)=CC(I)=C1 28646 [0,2,0,0,0,0|2,0,0]=4 1717 B11R1.74 O=C(O)C1=CC(F)=CC(O)=C1 30475 [0,2,0,0,0,0|2,0,0]=4 1718 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 3839 [0,2,0,0,0,0|2,0,0]=4 1719 B11R1.74 O=C(O)C1=CC(O)=CC(I)=C1 17219 [0,2,0,0,0,0|2,0,0]=4 1720 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 9162 [0,2,0,0,0,0|2,0,0]=4 1721 B11R1.74 O=C([O-])C1=CC(F)=CC(F)=C1 28622 [0,2,0,0,0,0|2,0,0]=4 1722 B11R1.266 C=CC1=CC=CC(C(=O)O)=C1 36178 [0,2,0,0,0,0|2,0,0]=4 1723 B11R1.266 CC(=O)C1=CC(C=O)=CC=C1 31237 [0,2,0,0,0,0|2,0,0]=4 1724 B11R1.266 CC(=O)C1=CC(CCl)=CC=C1 23456 [0,2,0,0,0,0|2,0,0]=4 1725 B11R1.266 CC(=O)C1=CC=CC(C#N)=C1 12649 [0,2,0,0,0,0|2,0,0]=4 1726 B11R1.266 CCC1=CC=CC(C(C)=O)=C1 3092 [0,2,0,0,0,0|2,0,0]=4 1727 B11R1.266 COC1=CC(C(=O)O)=CN=C1 27158 [0,2,0,0,0,0|1,0,0]=3 1728 B11R1.266 COC1=CC(C(N)=O)=NC=C1 9294 [0,2,0,0,0,0|2,0,0]=4 1729 B11R1.266 COC1=CC=CC(C(=O)Cl)=C1 35489 [0,2,0,0,0,0|2,0,0]=4 1730 B11R1.266 COC1=CC=CC(C(=O)O)=C1 9012 [0,2,0,0,0,0|2,0,0]=4 1731 B11R1.266 COC1=CC=CC(C(C)=O)=C1 9201 [0,2,0,0,0,0|2,0,0]=4 1732 B11R1.266 COC1=CC=CC(C(N)=O)=N1 16543 [0,2,0,0,0,0|2,0,0]=4 1733 B11R1.266 COC1=CN=CC(C(=O)O)=N1 27952 [0,2,0,0,0,0|2,0,0]=4 1734 B11R1.266 CSC1=CC=CC(C(=O)O)=C1 10679 [0,2,0,0,0,0|2,0,0]=4 1735 B11R1.266 CSC1=CC=CC(C(=O)O)=C1 20970 [0,2,0,0,0,0|2,0,0]=4 1736 B11R1.266 N#CC1=CC=CC(C(=O)Cl)=C1 10466 [0,2,0,0,0,0|2,0,0]=4 1737 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 25947 [0,2,0,0,0,0|2,0,0]=4 1738 B11R1.266 NC(=O)C1=NC(CO)=CC=C1 28922 [0,2,0,0,0,0|2,0,0]=4 1739 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 14415 [0,2,0,0,0,0|2,0,0]=4 1740 B11R1.266 O=C(Cl)C1=CC(CCl)=CC=C1 16448 [0,2,0,0,0,0|2,0,0]=4 1741 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 9744 [0,2,0,0,0,0|2,0,0]=4 1742 B11R1.266 O=C(O)C1=CC(CCl)=CC=C1 7446 [0,2,0,0,0,0|2,0,0]=4 1743 B11R1.266 O=CC1=CC=CC(C(=O)O)=C1 30672 [0,2,0,0,0,0|2,0,0]=4 1744 B9R1.69 CC1=CN=C(N)NC1=O 34226 [0,0,1,1,0,0|1,0,1]=4 1745 B9R1.69 O=C1NC(Cl)=CC=C1Br 34301 [0,0,1,1,0,0|2,0,0]=4 1746 B9R1.69 O=C1NC(Cl)=NC=C1Br 34886 [0,0,1,1,0,0|2,0,0]=4 1747 B11R2.10 BrC1=NC2=C(C=CC=C2)N1 16113 [0,0,0,1,0,1|2,0,0]=4 1748 B11R2.10 CC1=CC2=CC=CC=C2N1 7504 [0,0,0,1,0,1|2,0,0]=4 1749 B11R2.10 CC1=NC2=C(C=CC=C2)N1 7540 [0,0,0,1,0,1|2,0,0]=4 1750 B11R2.10 CC1=NC2=CC=CN=C2S1 31818 [0,0,0,1,0,1|1,1,0]=4 1751 B11R2.10 ClC1=CC2=C(N=CN=C2)N1 14943 [0,0,0,1,0,1|2,0,0]=4 1752 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 7598 [0,0,0,1,0,1|2,0,0]=4 1753 B11R2.10 ClC1=NC2=CC=CN=C2O1 33490 [0,0,0,1,0,1|1,0,1]=4 1754 B11R2.10 ClC1=NC2=NC=CC=C2N1 15408 [0,0,0,1,0,1|1,0,1]=4 1755 B11R2.10 ClC1=NC2=NC=CC=C2S1 35667 [0,0,0,1,0,1|1,0,1]=4 1756 B11R2.10 FC1=NC2=C(C=CC=C2)N1 13608 [0,0,0,1,0,1|2,0,0]=4 1757 B11R2.10 NC1=NC2=C(C=CC=C2)N1 9020 [0,0,0,1,0,1|2,0,0]=4 1758 B11R2.10 NC1=NC2=C(C=CC=C2)O1 17695 [0,0,0,1,0,1|1,0,1]=4 1759 B11R2.10 NC1=NC2=C(C=CC=C2)S1 13382 [0,0,0,1,0,1|1,1,0]=4 1760 B11R2.10 NC1=NC2=C(C=CN=C2)O1 33487 [0,0,0,1,0,1|0,0,1]=3 1761 B11R2.10 NC1=NC2=C(C=CN=C2)S1 27921 [0,0,0,1,0,1|0,1,0]=3 1762 B11R2.10 NC1=NC2=C(C=NC=C2)O1 34279 [0,0,0,1,0,1|1,0,0]=3 1763 B11R2.10 NC1=NC2=CC=CN=C2O1 33489 [0,0,0,1,0,1|0,0,1]=3 1764 B11R2.10 NC1=NC2=NC=CC=C2N1 33492 [0,0,0,1,0,1|1,0,0]=3 1765 B11R2.10 O=C1CC2=C(C=CC=C2)O1 22170 [0,0,0,1,0,1|2,0,0]=4 1766 B11R2.10 O=C1CC2=CC=CC=C2C1 9653 [0,0,0,1,0,1|2,0,0]=4 1767 B11R2.10 O=C1CC2=CC=CC=C2N1 7177 [0,0,0,1,0,1|1,0,0]=3 1768 B11R2.10 O=C1CC2=CC=CN=C2N1 35309 [0,0,0,1,0,1|0,0,0]=2 1769 B11R2.10 O=C1CC2=CC=NC=C2N1 17713 [0,0,0,1,0,1|1,0,0]=3 1770 B11R2.10 O=C1NC2=C(C=CC=C2)O1 8633 [0,0,0,1,0,1|1,0,0]=3 1771 B11R2.10 O=C1NC2=C(C=CC=C2)S1 21831 [0,0,0,1,0,1|1,0,0]=3 1772 B11R2.10 O=C1NC2=CC=CN=C2N1 18669 [0,0,0,1,0,1|0,0,0]=2 1773 B11R2.10 O=C1NC2=NC=CC=C2O1 11061 [0,0,0,1,0,1|0,0,0]=2 1774 B11R2.10 OC1=NC2=C(C=CC=C2)N1 7606 [0,0,0,1,0,1|1,0,1]=4 1775 B11R2.10 SC1=NC2=C(C=CC=C2)N1 13567 [0,0,0,1,0,1|1,1,0]=4 1776 B11R2.10 SC1=NC2=NC=CC=C2O1 23120 [0,0,0,1,0,1|0,1,1]=4 1777 B11R2.1 BrC1=CNC2=C1C=NC=N2 14723 [0,1,0,1,0,0|2,0,0]=4 1778 B11R2.1 BrC1=CNC2=CC=CC=C12 11087 [0,1,0,1,0,0|2,0,0]=4 1779 B11R2.1 BrC1=CNC2=NC=CC=C12 14707 [0,1,0,1,0,0|1,0,0]=3 1780 B11R2.1 BrC1=NNC2=C1C=NC=C2 14717 [0,1,0,1,0,0|1,0,0]=3 1781 B11R2.1 BrC1=NNC2=CC=CC=C21 11861 [0,1,0,1,0,0|2,0,0]=4 1782 B11R2.1 BrC1=NNC2=NC=CC=C12 32566 [0,1,0,1,0,0|1,0,0]=3 1783 B11R2.1 BrC1=NNC2=NC=CN=C12 33011 [0,1,0,1,0,0|2,0,0]=4 1784 B11R2.1 CC1=CNC2=C1C=NC=C2 34831 [0,1,0,1,0,0|1,0,0]=3 1785 B11R2.1 CC1=CNC2=CC=CC=C12 7505 [0,1,0,1,0,0|2,0,0]=4 1786 B11R2.1 CC1=CNC2=NC=CC=C12 19349 [0,1,0,1,0,0|1,0,0]=3 1787 B11R2.1 CC1=NNC2=C1C=NC=C2 32587 [0,1,0,1,0,0|1,0,0]=3 1788 B11R2.1 CC1=NNC2=CC=CC=C21 7820 [0,1,0,1,0,0|2,0,0]=4 1789 B11R2.1 CC1=NNC2=NC=CC=C12 32568 [0,1,0,1,0,0|1,0,0]=3 1790 B11R2.1 CC1=NNC2=NC=CN=C12 33392 [0,1,0,1,0,0|2,0,0]=4 1791 B11R2.1 ClC1=CNC2=CC=CC=C12 25672 [0,1,0,1,0,0|2,0,0]=4 1792 B11R2.1 ClC1=CNC2=NC=CC=C12 14740 [0,1,0,1,0,0|1,0,0]=3 1793 B11R2.1 IC1=CNC2=C1C=NC=N2 27185 [0,1,0,1,0,0|2,0,0]=4 1794 B11R2.1 IC1=CNC2=NC=CC=C12 16589 [0,1,0,1,0,0|1,0,0]=3 1795 B11R2.1 IC1=NNC2=CC=CC=C21 11868 [0,1,0,1,0,0|2,0,0]=4 1796 B11R2.1 IC1=NNC2=NC=CC=C12 32567 [0,1,0,1,0,0|1,0,0]=3 1797 B11R2.1 NC1=NCc2ccccc21 31698 [0,1,0,1,0,0|2,0,0]=4 1798 B11R2.1 NC1=NNC2=C1C=NC=C2 32586 [0,1,0,1,0,0|1,0,0]=3 1799 B11R2.1 NC1=NNC2=CC=CC=C21 11848 [0,1,0,1,0,0|2,0,0]=4 1800 B11R2.1 NC1=NNC2=NC=CC=C12 18838 [0,1,0,1,0,0|1,0,0]=3 1801 B11R2.1 NC1=NNC2=NC=CN=C12 33391 [0,1,0,1,0,0|2,0,0]=4 1802 B11R2.1 NC1=NOC2=C1C=CC=C2 14511 [0,1,0,1,0,0|1,0,1]=4 1803 B11R2.1 NC1COC2=NC=CC=C21 34572 [0,1,0,1,0,0|0,0,2]=4 1804 B11R2.1 O=C1CCC2=CC=CC=C12 5339 [0,1,0,1,0,0|2,0,0]=4 1805 B11R2.1 O=C1CCc2ncccc21 26187 [0,1,0,1,0,0|1,0,0]=3 1806 B11R2.1 O=C1COC2=C1C=CC=C2 7023 [0,1,0,1,0,0|2,0,0]=4 1807 B11R2.1 O=C1COC2=C1C=NC=C2 24176 [0,1,0,1,0,0|1,0,0]=3 1808 B11R2.1 O=C1COC2=NC=CC=C12 24153 [0,1,0,1,0,0|1,0,0]=3 1809 B11R2.1 O=C1CSC2=C1C=CC=C2 23797 [0,1,0,1,0,0|2,0,0]=4 1810 B11R2.1 O=C1NCC2=CC=CC=C12 25108 [0,1,0,1,0,0|1,0,0]=3 1811 B11R2.1 O=C1NN=C2C=CC=CN12 9282 [0,1,0,1,0,0|2,0,0]=4 1812 B11R2.1 O=C1NNC2=CC=CC=C12 28083 [0,1,0,1,0,0|1,0,0]=3 1813 B11R2.1 O=C1NSC2=C1C=CC=C2 15685 [0,1,0,1,0,0|1,0,0]=3 1814 B11R2.1 O=C1OCC2=CC=CC=C12 22169 [0,1,0,1,0,0|2,0,0]=4 1815 B11R2.1 O=C1SSC2=C1C=CC=C2 32197 [0,1,0,1,0,0|2,0,0]=4 1816 B11R2.1 OC1=CNC2=CC=CC=C12 7264 [0,1,0,1,0,0|1,0,1]=4 1817 B7R1.1 C=CN1C=CN=C1 9440 [1,0,0,0,1,0|2,0,0]=4 1818 B7R1.1 NCC1=CC=CO1 6967 [1,0,0,0,1,0|1,0,1]=4 1819 B7R1.1 NCC1=CC=CS1 22278 [1,0,0,0,1,0|1,0,1]=4 1820 B7R1.1 NCC1=CC=CS1 5606 [1,0,0,0,1,0|1,0,1]=4 1821 B7R1.1 NCC1=CC=NN1 14846 [1,0,0,0,1,0|1,0,1]=4 1822 B7R1.1 NCC1=COC=N1 24611 [1,0,0,0,1,0|1,0,1]=4 1823 B7R1.1 NCC1=CSC=C1 12348 [1,0,0,0,1,0|1,0,1]=4 1824 B7R1.1 NCC1=NC=CN1 15933 [1,0,0,0,1,0|1,0,1]=4 1825 B7R1.1 NCC1=NC=CN1 16027 [1,0,0,0,1,0|1,0,1]=4 1826 B7R1.1 NCC1=NC=CN1 16028 [1,0,0,0,1,0|1,0,1]=4 1827 B7R1.1 NCC1=NC=CO1 15935 [1,0,0,0,1,0|1,0,1]=4 1828 B7R1.1 NCC1=NOC=C1 15836 [1,0,0,0,1,0|1,0,1]=4 1829 B7R1.1 NCc1nccs1 15843 [1,0,0,0,1,0|1,0,1]=4 1830 B7R1.1 NNC1=NC=CN1 35367 [1,0,0,0,1,0|2,0,0]=4 1831 B7R1.1 O=CC1=CC=CN1 28928 [1,0,0,0,1,0|0,0,1]=3 1832 B7R1.1 O=CC1=CC=CN1 9140 [1,0,0,0,1,0|0,0,1]=3 1833 B7R1.1 O=CC1=CC=CO1 24739 [1,0,0,0,1,0|1,0,0]=3 1834 B7R1.1 O=CC1=CC=CS1 5153 [1,0,0,0,1,0|1,0,0]=3 1835 B7R1.1 O=CC1=CN=CS1 14219 [1,0,0,0,1,0|1,0,0]=3 1836 B7R1.1 O=CC1=CNC=C1 18051 [1,0,0,0,1,0|0,0,1]=3 1837 B7R1.1 O=CC1=CNC=N1 8980 [1,0,0,0,1,0|1,0,0]=3 1838 B7R1.1 O=CC1=CNN=C1 23658 [1,0,0,0,1,0|1,0,0]=3 1839 B7R1.1 O=CC1=CNN=C1 36037 [1,0,0,0,1,0|1,0,0]=3 1840 B7R1.1 O=CC1=CNN=C1 36038 [1,0,0,0,1,0|1,0,0]=3 1841 B7R1.1 O=CC1=COC=C1 6948 [1,0,0,0,1,0|1,0,0]=3 1842 B7R1.1 O=CC1=CSC=C1 5176 [1,0,0,0,1,0|1,0,0]=3 1843 B7R1.1 O=CC1=CSC=N1 13812 [1,0,0,0,1,0|1,0,0]=3 1844 B7R1.1 O=CC1=NC=CN1 8045 [1,0,0,0,1,0|1,0,0]=3 1845 B7R1.1 O=CC1=NC=CO1 17600 [1,0,0,0,1,0|1,0,0]=3 1846 B7R1.1 O=CC1=NC=CS1 9929 [1,0,0,0,1,0|1,0,0]=3 1847 B7R1.1 O=CC1=NNC=C1 14337 [1,0,0,0,1,0|1,0,0]=3 1848 B7R1.1 O=CC1=NOC=C1 14352 [1,0,0,0,1,0|1,0,0]=3 1849 B7R1.1 O=C[C-]1C=CC=C1 18830 [1,0,0,0,1,0|0,0,1]=3 1850 B11R1.91 CC(=O)COC1=CC=CC=C1 20265 [0,0,0,0,0,2|2,0,0]=4 1851 B11R1.91 CC(=O)NCC1=CC=CC=C1 19722 [0,0,0,0,0,2|2,0,0]=4 1852 B11R1.91 CC(=O)NCC1=CC=CN=C1 13219 [0,0,0,0,0,2|1,0,0]=3 1853 B11R1.91 CC(=O)NNC1=CC=CC=C1 7620 [0,0,0,0,0,2|2,0,0]=4 1854 B11R1.91 NC(=O)COC1=CC=CC=C1 12494 [0,0,0,0,0,2|1,0,0]=3 1855 B11R1.91 NC(=O)OCC1=CC=CC=C1 12421 [0,0,0,0,0,2|1,0,0]=3 1856 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 11078 [0,0,0,0,0,2|1,0,0]=3 1857 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 9173 [0,0,0,0,0,2|2,0,0]=4 1858 B11R1.91 O=C(Cl)COC1=CC=CC=C1 30326 [0,0,0,0,0,2|2,0,0]=4 1859 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 12079 [0,0,0,0,0,2|2,0,0]=4 1860 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 25891 [0,0,0,0,0,2|2,0,0]=4 1861 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 36191 [0,0,0,0,0,2|2,0,0]=4 1862 B11R1.91 O=C(O)C#CC1=CC=CC=C1 13737 [0,0,0,0,0,2|2,0,0]=4 1863 B11R1.91 O=C(O)CCC1=CC=CC=C1 8185 [0,0,0,0,0,2|2,0,0]=4 1864 B11R1.91 O=C(O)CCC1=CC=CN=C1 8701 [0,0,0,0,0,2|1,0,0]=3 1865 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 13612 [0,0,0,0,0,2|2,0,0]=4 1866 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 16731 [0,0,0,0,0,2|1,0,0]=3 1867 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 3816 [0,0,0,0,0,2|1,0,0]=3 1868 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 8142 [0,0,0,0,0,2|2,0,0]=4