0 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 12522 [0,0,0,0,0,0|1,0,0]=1 1 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 3974 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 21472 [0,0,0,0,0,0|1,0,0]=1 3 B11R1.19 CC(C)(C)C1=CC=C(S)C=C1 6846 [0,0,0,0,0,0|0,1,0]=1 4 B11R1.19 CC(C)(C)C1=NC=C(Br)C=N1 32424 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 16914 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.19 CC(C)(O)C1=CC=C(N)N=C1 30340 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 26273 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.19 CC(F)(F)C1=CC=C(Cl)C=C1 44754 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.19 CC1=CC=C(C(C)(C)C)C=C1 36092 [0,0,0,0,0,0|1,0,0]=1 10 B11R1.19 CC1=CC=C(C(F)(F)F)C=C1 1659 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 18694 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.19 CS(=O)(=O)C1=CC=C(Br)C=C1 10858 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 10874 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 10873 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 10832 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.19 C[Si](C)(C)c1ccc(F)cc1 28497 [0,0,0,0,0,0|1,1,0]=2 17 B11R1.19 ClC1=CC=C(C(Cl)(Cl)Cl)C=C1 22049 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.19 FC(F)(F)C1=CC=C(Br)C=C1 11717 [0,0,0,0,0,0|4,0,0]=4 19 B11R1.19 FC(F)(F)C1=CC=C(Br)C=C1 1635 [0,0,0,0,0,0|4,0,0]=4 20 B11R1.19 FC(F)(F)C1=CC=C(Cl)C=C1 5435 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.19 FC(F)(F)C1=CC=C(I)C=C1 3563 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.19 FC(F)(F)C1=CC=C(S)C=C1 6864 [0,0,0,0,0,0|3,1,0]=4 23 B11R1.19 FC1=CC=C(C(F)(F)F)C=C1 5437 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 2815 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 2816 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.19 NS(=O)(=O)C1=CC=C(O)C=C1 12595 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.19 OC1=CC=C(C(F)(F)F)C=C1 4011 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.19 OC1=CC=C(C(F)(F)F)N=C1 11257 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.19 OC1=CN=C(C(F)(F)F)C=C1 21818 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.19 OC1=NC=C(C(F)(F)F)C=C1 17576 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.19 OC1=NC=C(C(F)(F)F)C=C1 2402 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.13 C=C(C)C1=CC=C(O)C=C1 27834 [1,0,0,0,0,0|0,0,2]=3 33 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 3294 [1,0,0,0,0,0|2,0,1]=4 34 B10R1.13 CC(=O)C1=CC=C(C)C=C1 3326 [1,0,0,0,0,0|2,0,1]=4 35 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 3297 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.13 CC(=O)C1=CC=C(F)C=C1 10587 [1,0,0,0,0,0|2,0,1]=4 37 B10R1.13 CC(=O)C1=CC=C(I)C=C1 3323 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.13 CC(=O)C1=CC=C(N)C=C1 3288 [1,0,0,0,0,0|2,0,1]=4 39 B10R1.13 CC(=O)C1=CC=C(O)C=C1 3311 [1,0,0,0,0,0|1,0,1]=3 40 B10R1.13 CC(=O)C1=CN=C(O)C=C1 29236 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.13 CC(C)C1=CC=C(Br)C=C1 18676 [1,0,0,0,0,0|1,0,0]=2 42 B10R1.13 CC(C)C1=CC=C(I)C=C1 3975 [1,0,0,0,0,0|1,0,0]=2 43 B10R1.13 CC(C)C1=CC=C(N)C=N1 19458 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.13 CC(C)C1=CC=C(S)C=C1 6814 [1,0,0,0,0,0|0,1,0]=2 45 B10R1.13 CC(C)C1=NC=C(Br)C=N1 27971 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 27544 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.13 CC(N)C1=CC=C(F)C=C1 3425 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.13 CC(O)C1=CC=C(Br)C=C1 12552 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.13 CC1=CC=C(N(C)C)C=C1 21347 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 15589 [1,0,0,0,0,0|2,0,0]=3 51 B10R1.13 CN(C)C1=CC=C(Br)C=C1 2230 [1,0,0,0,0,0|2,0,0]=3 52 B10R1.13 CN(C)C1=CC=C(Br)N=C1 33778 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 5271 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.13 CN(C)C1=CC=C(F)C=C1 3365 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.13 CN(C)C1=CC=C(O)C=C1 27800 [1,0,0,0,0,0|1,0,0]=2 56 B10R1.13 CN(C)C1=NC=C(Br)C=C1 5051 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.13 CN(C)C1=NC=C(N)C=C1 15373 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.13 CN(C)c1ccc(N)cc1 21651 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 15222 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 15219 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 2454 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.13 C[C@@H](N)c1ccc(Br)cc1 14234 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 14252 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 14249 [1,0,0,0,0,0|2,0,0]=3 65 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 14245 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 15221 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 15218 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.13 C[C@H](N)c1ccc(Br)cc1 5736 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 14253 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 14251 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 14247 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.13 Cc1ccc(C(Cl)Cl)cc1 10212 [1,0,0,0,0,0|3,0,0]=4 73 B10R1.13 Cc1ccc([C@@H](C)N)cc1 8021 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.13 FC(F)C1=CC=C(Br)C=C1 23296 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.13 N=C(N)C1=CC=C(O)C=C1 18174 [1,0,0,0,0,0|2,0,1]=4 76 B10R1.13 NC(=S)C1=CC=C(O)C=C1 13555 [1,0,0,0,0,0|2,0,1]=4 77 B10R1.13 NC1=CC=C(C(F)F)C=C1 23828 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.13 O=C(O)C1=CC=C(O)C=C1 16819 [1,0,0,0,0,0|2,0,1]=4 79 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 19727 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.13 OB(O)C1=CC=C(O)C=C1 1729 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.13 OC1=CC=C(C(F)F)C=C1 19704 [1,0,0,0,0,0|2,0,0]=3 82 B10R1.28 CC(C)(C)C1=CC=CC=C1 36004 [1,0,0,0,0,0|0,0,0]=1 83 B10R1.28 CC(C)(N)C1=CC=CC=C1 19654 [1,0,0,0,0,0|1,0,0]=2 84 B10R1.28 CC(C)(O)C1=CC=NC=C1 16172 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.28 CC(C)(O)C1=NC=CC=C1 34335 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.28 CC(C)(S)C1=CC=CC=C1 6849 [1,0,0,0,0,0|1,0,0]=2 87 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 10862 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 10814 [1,0,0,0,0,0|1,1,0]=3 89 B10R1.28 ClC(Cl)(Cl)C1=CC=CC=C1 22016 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.28 FC(F)(F)C1=CC=CC=C1 18922 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.28 FC(F)(F)C1=CC=CC=C1 5423 [1,0,0,0,0,0|3,0,0]=4 92 B12R1.6 CC(C)(C)C1=CC=C(CBr)C=C1 4892 [0,1,0,0,0,0|1,0,0]=2 93 B12R1.6 CC(C)(C)C1=CC=C(CCl)C=C1 36097 [0,1,0,0,0,0|1,0,0]=2 94 B12R1.6 CC(C)(C)C1=CC=C(CN)C=C1 4711 [0,1,0,0,0,0|1,0,0]=2 95 B12R1.6 CC(C)(C)C1=CC=C(NN)C=C1 7625 [0,1,0,0,0,0|1,0,0]=2 96 B12R1.6 COC1=CC=C(C(C)(C)C)C=C1 35317 [0,1,0,0,0,0|0,0,0]=1 97 B12R1.6 COC1=CC=C(C(C)(C)O)C=C1 24425 [0,1,0,0,0,0|1,0,0]=2 98 B12R1.6 COC1=CC=C(C(F)(F)F)C=C1 10126 [0,1,0,0,0,0|3,0,0]=4 99 B12R1.6 COC1=CC=C(S(C)(=O)=O)C=C1 10828 [0,1,0,0,0,0|3,0,0]=4 100 B12R1.6 COC1=CCC(C(C)(C)O)=CC1 15657 [0,1,0,0,0,0|1,0,2]=4 101 B12R1.6 OCC1=CC=C(C(F)(F)F)C=C1 3573 [0,1,0,0,0,0|3,0,0]=4 102 B12R1.9 CC(C)(C#N)C1=CC=C(N)C=C1 19386 [0,1,0,0,0,0|1,0,1]=3 103 B12R1.23 CC(C)(C)C1=CC(Br)=C(Br)C=C1 4370 [0,1,0,0,0,0|1,0,0]=2 104 B12R1.23 CC(C)(C)C1=CC(Br)=C(N)C=C1 28269 [0,1,0,0,0,0|1,0,0]=2 105 B12R1.23 CC(C)(C)C1=CC(Br)=C(O)C=C1 15100 [0,1,0,0,0,0|0,0,0]=1 106 B12R1.23 CC(C)(C)C1=CC(Cl)=C(Cl)C=C1 27674 [0,1,0,0,0,0|1,0,0]=2 107 B12R1.23 CC(C)(C)C1=CC(Cl)=C(N)C=C1 33274 [0,1,0,0,0,0|1,0,0]=2 108 B12R1.23 CC(C)(C)C1=CC(F)=C(Br)C=C1 33255 [0,1,0,0,0,0|1,0,0]=2 109 B12R1.23 CC(C)(C)C1=CC(F)=C(O)C=C1 21344 [0,1,0,0,0,0|0,0,0]=1 110 B12R1.23 CC(C)(C)C1=CC(I)=C(N)C=C1 27662 [0,1,0,0,0,0|1,0,0]=2 111 B12R1.23 CC(C)(C)C1=CC(I)=C(O)C=C1 44743 [0,1,0,0,0,0|0,0,0]=1 112 B12R1.23 CC(C)(C)C1=CC(N)=C(N)C=C1 22919 [0,1,0,0,0,0|1,0,0]=2 113 B12R1.23 CC(C)(C)C1=CC(O)=C(Br)C=C1 27385 [0,1,0,0,0,0|1,0,0]=2 114 B12R1.23 CC(C)(C)C1=CC=C(O)C(O)=C1 14587 [0,1,0,0,0,0|0,0,0]=1 115 B12R1.23 CC1=C(N)C=C(C(C)(C)C)C=C1 27805 [0,1,0,0,0,0|1,0,0]=2 116 B12R1.23 CC1=CC(C(C)(C)C)=CC=C1O 21766 [0,1,0,0,0,0|0,0,0]=1 117 B12R1.23 CS(=O)(=O)C1=CC(N)=C(O)C=C1 10754 [0,1,0,0,0,0|3,0,0]=4 118 B12R1.23 NC1=C(O)C=CC(C(F)(F)F)=C1 28350 [0,1,0,0,0,0|3,0,0]=4 119 B12R1.23 OC1=C(Br)C=C(C(F)(F)F)C=C1 18455 [0,1,0,0,0,0|3,0,0]=4 120 B12R1.23 OC1=C(Cl)C=C(C(F)(F)F)C=C1 4105 [0,1,0,0,0,0|3,0,0]=4 121 B12R1.23 OC1=C(I)C=C(C(F)(F)F)C=C1 20185 [0,1,0,0,0,0|3,0,0]=4 122 B12R1.23 OC1=CC=C(C(F)(F)F)C=C1O 33433 [0,1,0,0,0,0|3,0,0]=4 123 B12R1.126 CC(C)(C)C1=C(Br)C=C(N)C=C1 31844 [0,1,0,0,0,0|1,0,0]=2 124 B12R1.126 CC1=CC(O)=C(C(C)(C)C)C=C1 24316 [0,1,0,0,0,0|1,0,0]=2 125 B12R1.126 OC1=CC(Br)=C(C(F)(F)F)C=C1 27395 [0,1,0,0,0,0|3,0,0]=4 126 B12R1.126 OC1=CC(Cl)=C(C(F)(F)F)C=C1 28367 [0,1,0,0,0,0|3,0,0]=4 127 B12R2.290 NC1(C2=CC=C(Cl)C=C2)CC1 19083 [0,0,0,1,0,0|2,0,0]=3 128 B10R1.55 CC(C)(C)C1=CC(N)=NO1 8656 [0,0,0,0,1,0|3,0,0]=4 129 B10R1.55 CC(C)(C)C1=CSC(N)=N1 35452 [0,0,0,0,1,0|3,0,0]=4 130 B10R1.55 CC(C)(C)C1=NNC(N)=C1 13393 [0,0,0,0,1,0|3,0,0]=4 131 B10R1.55 CC(C)(C)C1=NOC(N)=C1 15483 [0,0,0,0,1,0|3,0,0]=4 132 B10R1.55 C[Si](C)(C)C1=CC=C(Br)S1 34429 [0,0,0,0,1,0|2,1,0]=4 133 B12R1.106 CC(C)(C)OC1=CC=C(Br)C=C1 26114 [0,0,0,0,0,1|1,0,0]=2 134 B12R1.106 OC1=CC=C(OC(F)(F)F)C=C1 1506 [0,0,0,0,0,1|3,0,0]=4 135 B12R1.106 OC1=CC=C(SC(F)(F)F)C=C1 10845 [0,0,0,0,0,1|3,0,0]=4 136 B9R1.1 BrCC1=CC=C(Br)C=C1 7460 [2,0,0,0,0,0|2,0,0]=4 137 B9R1.1 BrCC1=CC=C(I)C=C1 3557 [2,0,0,0,0,0|2,0,0]=4 138 B9R1.1 CC1=CC=C(CN)C=C1 10199 [2,0,0,0,0,0|2,0,0]=4 139 B9R1.1 CCC1=CC=C(Br)C=C1 3772 [2,0,0,0,0,0|1,0,0]=3 140 B9R1.1 CCC1=CC=C(C)C=C1 21843 [2,0,0,0,0,0|1,0,0]=3 141 B9R1.1 CCC1=CC=C(I)C=C1 3877 [2,0,0,0,0,0|1,0,0]=3 142 B9R1.1 CCC1=CC=C(N)C=C1 26342 [2,0,0,0,0,0|1,0,0]=3 143 B9R1.1 CCC1=CC=C(O)C=C1 3874 [2,0,0,0,0,0|0,0,0]=2 144 B9R1.1 CCC1=CC=C(S)C=C1 6813 [2,0,0,0,0,0|0,1,0]=3 145 B9R1.1 CCC1=CN=C(C)C=C1 10482 [2,0,0,0,0,0|2,0,0]=4 146 B9R1.1 CCC1=CN=C(C)C=C1 18256 [2,0,0,0,0,0|2,0,0]=4 147 B9R1.1 CCC1=NC=C(Br)C=C1 16886 [2,0,0,0,0,0|2,0,0]=4 148 B9R1.1 CCC1=NC=C(N)C=C1 25855 [2,0,0,0,0,0|2,0,0]=4 149 B9R1.1 CCc1ccc(F)cc1 22752 [2,0,0,0,0,0|1,0,0]=3 150 B9R1.1 CNC1=CC=C(Cl)C=C1 23344 [2,0,0,0,0,0|2,0,0]=4 151 B9R1.1 CNC1=CC=C(I)C=C1 28328 [2,0,0,0,0,0|2,0,0]=4 152 B9R1.1 COC1=CC=C(Br)C=C1 3726 [2,0,0,0,0,0|2,0,0]=4 153 B9R1.1 COC1=CC=C(Cl)C=C1 3616 [2,0,0,0,0,0|2,0,0]=4 154 B9R1.1 COC1=CC=C(F)C=C1 3475 [2,0,0,0,0,0|2,0,0]=4 155 B9R1.1 COC1=CC=C(I)C=C1 3911 [2,0,0,0,0,0|2,0,0]=4 156 B9R1.1 COC1=CC=C(N)C=C1 21392 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.1 COC1=CC=C(N)C=C1 36098 [2,0,0,0,0,0|2,0,0]=4 158 B9R1.1 COC1=CC=C(O)C=C1 14584 [2,0,0,0,0,0|1,0,0]=3 159 B9R1.1 COC1=CC=C(O)C=C1 2276 [2,0,0,0,0,0|1,0,0]=3 160 B9R1.1 COC1=CC=C(S)C=C1 6822 [2,0,0,0,0,0|1,1,0]=4 161 B9R1.1 COC1=NC=C(O)C=C1 16171 [2,0,0,0,0,0|2,0,0]=4 162 B9R1.1 CSC1=CC=C(Br)C=C1 10650 [2,0,0,0,0,0|2,0,0]=4 163 B9R1.1 CSC1=CC=C(C)C=C1 10672 [2,0,0,0,0,0|2,0,0]=4 164 B9R1.1 CSC1=CC=C(Cl)C=C1 10645 [2,0,0,0,0,0|2,0,0]=4 165 B9R1.1 CSC1=CC=C(F)C=C1 10641 [2,0,0,0,0,0|2,0,0]=4 166 B9R1.1 CSC1=CC=C(I)C=C1 10670 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.1 CSC1=CC=C(N)C=C1 10636 [2,0,0,0,0,0|2,0,0]=4 168 B9R1.1 CSC1=CC=C(O)C=C1 15277 [2,0,0,0,0,0|1,0,0]=3 169 B9R1.1 CSC1=CC=C(S)C=C1 6825 [2,0,0,0,0,0|1,1,0]=4 170 B9R1.1 ClC1=CC=C(CBr)C=C1 36109 [2,0,0,0,0,0|2,0,0]=4 171 B9R1.1 ClCC1=CC=C(Br)C=C1 2478 [2,0,0,0,0,0|2,0,0]=4 172 B9R1.1 ClCC1=CC=C(Cl)C=C1 5797 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.1 FC1=CC=C(CBr)C=C1 7354 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.1 FC1=CC=C(CCl)C=C1 8864 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.1 FC1=CC=C(CS)C=C1 6855 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.1 NC1=CC=C(CBr)C=C1 26393 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.1 NC1=CC=C(CO)C=C1 7480 [2,0,0,0,0,0|2,0,0]=4 178 B9R1.1 NCC1=CC=C(Br)C=C1 23806 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.1 NCC1=CC=C(Br)C=C1 3751 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.1 NCC1=CC=C(Cl)C=C1 9028 [2,0,0,0,0,0|2,0,0]=4 181 B9R1.1 NCC1=CC=C(F)C=C1 3408 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.1 NCC1=CC=C(F)C=C1 4420 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.1 NCC1=CC=C(I)C=C1 3304 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.1 NCC1=CC=C(N)C=C1 5803 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.1 NCC1=CC=C(O)C=C1 26036 [2,0,0,0,0,0|1,0,0]=3 186 B9R1.1 O=CC1=CC=C(O)C=C1 10188 [2,0,0,0,0,0|1,0,1]=4 187 B9R1.1 OCC1=CC=C(Br)C=C1 3748 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.1 OCC1=CC=C(Cl)C=C1 3627 [2,0,0,0,0,0|2,0,0]=4 189 B9R1.1 OCC1=CC=C(F)C=C1 3487 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.1 OCC1=CC=C(I)C=C1 4081 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.1 OCC1=CC=C(O)C=C1 29320 [2,0,0,0,0,0|1,0,0]=3 192 B9R1.1 OCC1=CC=C(S)C=C1 6879 [2,0,0,0,0,0|1,1,0]=4 193 B9R1.1 SCC1=CC=C(Br)C=C1 6868 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.1 SCC1=CC=C(Cl)C=C1 6838 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.6 CC(Cl)C1=CC=CC=C1 10204 [2,0,0,0,0,0|1,0,0]=3 196 B9R1.6 CC(N)C1=CC=CC=C1 21079 [2,0,0,0,0,0|1,0,0]=3 197 B9R1.6 CN(C)C1=CC=NC=C1 2377 [2,0,0,0,0,0|2,0,0]=4 198 B9R1.6 CN(C)C1=NC=CC=C1 14996 [2,0,0,0,0,0|2,0,0]=4 199 B9R1.6 CP(C)C1=CC=CC=C1 6420 [2,0,0,0,0,0|1,0,0]=3 200 B9R1.6 C[C@@H](N)c1ccccc1 6026 [2,0,0,0,0,0|1,0,0]=3 201 B9R1.6 C[C@@H](N)c1ccccc1 6060 [2,0,0,0,0,0|1,0,0]=3 202 B9R1.6 C[C@@H](N)c1ccccc1 9918 [2,0,0,0,0,0|1,0,0]=3 203 B9R1.6 C[C@@H](O)C1=CC=CN=C1 27201 [2,0,0,0,0,0|2,0,0]=4 204 B9R1.6 C[C@@H](O)C1=NC=CC=C1 5699 [2,0,0,0,0,0|2,0,0]=4 205 B9R1.6 C[C@@H](O)c1ccccc1 6851 [2,0,0,0,0,0|1,0,0]=3 206 B9R1.6 C[C@H](N)c1ccccc1 6025 [2,0,0,0,0,0|1,0,0]=3 207 B9R1.6 C[C@H](N)c1ccccc1 6061 [2,0,0,0,0,0|1,0,0]=3 208 B9R1.6 C[C@H](O)C1=NC=CC=C1 5701 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.6 C[C@H](O)c1ccccc1 6858 [2,0,0,0,0,0|1,0,0]=3 210 B9R1.6 FC(Cl)C1=CC=CC=C1 15923 [2,0,0,0,0,0|2,0,0]=4 211 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 20531 [1,1,0,0,0,0|0,0,2]=4 212 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 31334 [1,1,0,0,0,0|1,0,1]=4 213 B11R1.3 CC(C)C1=CC=C(NN)C=C1 7533 [1,1,0,0,0,0|1,0,0]=3 214 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 8085 [1,1,0,0,0,0|1,0,1]=4 215 B11R1.3 CN(C)C1=CC=C(CO)C=C1 36061 [1,1,0,0,0,0|1,0,0]=3 216 B11R1.3 COC1=CC=C(C(C)=O)C=C1 3324 [1,1,0,0,0,0|1,0,1]=4 217 B11R1.3 COC1=CC=C(N(C)C)C=C1 16956 [1,1,0,0,0,0|1,0,0]=3 218 B11R1.3 COc1ccc([C@@H](C)N)cc1 9920 [1,1,0,0,0,0|1,0,0]=3 219 B11R1.3 COc1ccc([C@H](C)N)cc1 9919 [1,1,0,0,0,0|1,0,0]=3 220 B11R1.3 [C-]#[N+]C1=CC=C([C@@H](C)O)C=C1 14238 [1,1,0,0,0,0|2,0,0]=4 221 B11R1.3 [C-]#[N+]C1=CC=C([C@H](C)O)C=C1 14243 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.21 CC(=O)C1=CC(C)=C(O)C=C1 15346 [1,1,0,0,0,0|1,0,1]=4 223 B11R1.21 CC(=O)C1=CC(Cl)=C(O)C=C1 29271 [1,1,0,0,0,0|1,0,1]=4 224 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 3492 [1,1,0,0,0,0|1,0,1]=4 225 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 3384 [1,1,0,0,0,0|1,0,1]=4 226 B11R1.21 CC(C)C1=CC(Br)=C(N)C=C1 17446 [1,1,0,0,0,0|1,0,0]=3 227 B11R1.21 CC(C)C1=CC(O)=C(I)C=C1 34596 [1,1,0,0,0,0|1,0,0]=3 228 B11R1.21 CC(C)C1=CC=C(O)C(O)=C1 26367 [1,1,0,0,0,0|0,0,0]=2 229 B11R1.21 CC1=C(Br)C=CC(N(C)C)=C1 5345 [1,1,0,0,0,0|2,0,0]=4 230 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 25919 [1,1,0,0,0,0|1,0,0]=3 231 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 28331 [1,1,0,0,0,0|1,0,0]=3 232 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 10329 [1,1,0,0,0,0|1,0,0]=3 233 B11R1.21 CN(C)C1=CC(F)=C(F)C=C1 5241 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.21 CN(C)C1=CC(F)=C(I)C=C1 28131 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.22 CC1=CC=C([C@H](O)CN)C=C1 19376 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.22 CC[C@@H](O)C1=CC=C(Br)C=C1 15566 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.22 CC[C@@H](O)C1=CC=C(Cl)C=C1 15579 [1,1,0,0,0,0|2,0,0]=4 238 B11R1.22 CC[C@@H](O)C1=CC=C(F)C=C1 15586 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.22 COC(=O)C1=CC=C(O)C=C1 27407 [1,1,0,0,0,0|1,0,1]=4 240 B11R1.22 COC(=O)C1=CC=C(O)C=C1 35335 [1,1,0,0,0,0|1,0,1]=4 241 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 19370 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.22 NCC(O)C1=CC=C(O)C=C1 18242 [1,1,0,0,0,0|1,0,0]=3 243 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 3320 [1,1,0,0,0,0|1,0,1]=4 244 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 29269 [1,1,0,0,0,0|1,0,1]=4 245 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 27665 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 29261 [1,1,0,0,0,0|1,0,1]=4 247 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 24792 [1,1,0,0,0,0|1,0,1]=4 248 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 28238 [1,1,0,0,0,0|1,0,1]=4 249 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 29270 [1,1,0,0,0,0|1,0,1]=4 250 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 24419 [1,1,0,0,0,0|1,0,1]=4 251 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 3375 [1,1,0,0,0,0|1,0,1]=4 252 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 35906 [1,1,0,0,0,0|0,0,0]=2 253 B11R1.166 CC1=C(N(C)C)C=CC(Br)=C1 5343 [1,1,0,0,0,0|2,0,0]=4 254 B11R1.166 CC1=CC(Br)=C(N(C)C)C=C1 5342 [1,1,0,0,0,0|2,0,0]=4 255 B11R1.166 CN(C)C1=C(Br)C=C(F)C=C1 5227 [1,1,0,0,0,0|2,0,0]=4 256 B11R1.166 CN(C)C1=C(Cl)C=C(Br)C=C1 5366 [1,1,0,0,0,0|2,0,0]=4 257 B11R1.166 CN(C)C1=C(Cl)C=C(F)C=C1 5235 [1,1,0,0,0,0|2,0,0]=4 258 B11R1.166 CN(C)C1=C(F)C=C(Br)C=C1 5229 [1,1,0,0,0,0|2,0,0]=4 259 B11R1.166 CN(C)C1=C(F)C=C(Cl)C=C1 5236 [1,1,0,0,0,0|2,0,0]=4 260 B11R1.166 CN(C)C1=C(F)C=C(F)C=C1 5240 [1,1,0,0,0,0|2,0,0]=4 261 B11R1.166 C[C@H](O)C1=C(Cl)C=C(F)C=C1 15575 [1,1,0,0,0,0|2,0,0]=4 262 B11R1.7 C#CC(C)(O)C1=CC=CC=C1 21780 [1,1,0,0,0,0|1,0,1]=4 263 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 10047 [1,1,0,0,0,0|2,0,0]=4 264 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 20188 [1,1,0,0,0,0|0,0,0]=2 265 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 18555 [1,1,0,0,0,0|1,0,0]=3 266 B11R1.87 CC(C)(O)C1=CC=CN=C1F 21047 [1,1,0,0,0,0|2,0,0]=4 267 B11R1.87 CC1=C(C(C)(C)C)C=CC=C1 27429 [1,1,0,0,0,0|0,0,0]=2 268 B11R1.87 C[Si](C)(C)C1=NC=CC=C1F 5144 [1,1,0,0,0,0|1,1,0]=4 269 B11R1.155 CC(C)(C)C1=CC(Cl)=NC=C1 36542 [1,1,0,0,0,0|1,0,0]=3 270 B11R1.155 CC(C)(C)C1=CC=CC(Br)=C1 4314 [1,1,0,0,0,0|0,0,0]=2 271 B11R1.155 CC(C)(C)C1=CC=CC(N)=C1 4364 [1,1,0,0,0,0|0,0,0]=2 272 B11R1.155 CC(C)(O)C1=CC(Br)=CC=C1 25421 [1,1,0,0,0,0|1,0,0]=3 273 B11R1.45 CC(C)(C)C1=CC=C(C#N)S1 5440 [0,1,0,0,1,0|2,0,0]=4 274 B11R1.45 CC(C)(C)c1ccc(C#N)s1 5329 [0,1,0,0,1,0|2,0,0]=4 275 B13R1.4 CC(C)(C)OC1=CC=C(C=O)C=C1 36214 [0,1,0,0,0,1|0,0,1]=3 276 B13R1.4 CC(C)(C)OC1=CC=C(CO)C=C1 31295 [0,1,0,0,0,1|0,0,0]=2 277 B13R1.38 CC(C)(C)C1=CC(O)=C(C#N)C=C1 27386 [0,2,0,0,0,0|1,0,0]=3 278 B13R1.38 CC(C)(C)C1=CC=C(C=O)C(O)=C1 8071 [0,2,0,0,0,0|0,0,1]=3 279 B13R1.140 CC(C)(C)C1=CC=C(CC#N)C=C1 13713 [0,2,0,0,0,0|1,0,0]=3 280 B13R1.338 CC(=O)C1=CC=C(C(C)(C)C)C=C1 13707 [0,2,0,0,0,0|0,0,1]=3 281 B13R1.338 CC(C)(C)C1=CC=C(B(O)O)C=C1 1770 [0,2,0,0,0,0|0,0,0]=2 282 B13R1.338 CC(C)(C)C1=CC=C(C(=O)O)C=C1 19991 [0,2,0,0,0,0|0,0,0]=2 283 B13R1.338 C[Si](C)(C)C1=CC=C(B(O)O)C=C1 29546 [0,2,0,0,0,0|0,1,0]=3 284 B13R1.522 CC(C)(C(=O)O)C1=CC=C(Br)C=C1 14768 [0,2,0,0,0,0|1,0,1]=4 285 B13R1.522 CC(O)(C(=O)O)C1=CC=C(O)C=C1 20595 [0,2,0,0,0,0|1,0,1]=4 286 B13R1.50 CC(C)(C)C1=CC(C=O)=C(O)C=C1 19674 [0,2,0,0,0,0|0,0,0]=2 287 B11R2.34 BrC1=CC=C(C2CC2)N=C1 22082 [1,0,0,1,0,0|2,0,0]=4 288 B11R2.34 BrC1=CC=C([C@@H]2CO2)C=C1 5705 [1,0,0,1,0,0|2,0,0]=4 289 B11R2.34 BrC1=CC=C([C@H]2CO2)C=C1 5704 [1,0,0,1,0,0|2,0,0]=4 290 B11R2.34 BrC1=NC=C(C2CC2)C=C1 27621 [1,0,0,1,0,0|2,0,0]=4 291 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 18166 [1,0,0,1,0,0|2,0,0]=4 292 B11R2.34 FC1=CC=C([C@H]2CO2)C=C1 18172 [1,0,0,1,0,0|2,0,0]=4 293 B11R2.34 NC1=CC=C(C2CC2)C=C1 19700 [1,0,0,1,0,0|1,0,0]=3 294 B11R2.34 OC1=CC=C(C2CC2)C=C1 17543 [1,0,0,1,0,0|0,0,0]=2 295 B11R2.40 NC1(C2=CC=CC=C2)CC1 13912 [1,0,0,1,0,0|1,0,0]=3 296 B11R2.40 NC1(C2=CC=CC=C2)CC1 22892 [1,0,0,1,0,0|1,0,0]=3 297 B13R2.3051 CC1(C)OC2=C(C=C(N)C=C2)O1 34264 [0,0,0,1,0,1|2,0,0]=4 298 B13R2.102 N#CC1(C2=CC=C(F)C=C2)CC1 19951 [0,1,0,1,0,0|1,0,1]=4 299 B13R2.102 OCC1(C2=CC=C(Cl)C=C2)CC1 22424 [0,1,0,1,0,0|1,0,0]=3 300 B13R2.102 OCC1(C2=CC=C(F)C=C2)CC1 26555 [0,1,0,1,0,0|1,0,0]=3 301 B13R2.2986 NC1(C2=CC=C(Br)C=C2)CCC1 22245 [0,1,0,1,0,0|2,0,0]=4 302 B9R1.19 CC(C)(C)C1=CC=CC1 35005 [1,0,0,0,1,0|0,0,1]=3 303 B9R1.19 CC(C)(C)C1=CC=CS1 9596 [1,0,0,0,1,0|1,0,0]=3 304 B9R1.19 CC(C)(C)C1=CNN=C1 21801 [1,0,0,0,1,0|2,0,0]=4 305 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 35682 [1,0,0,0,0,1|1,0,1]=4 306 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 17726 [1,0,0,0,0,1|1,0,1]=4 307 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 27490 [1,0,0,0,0,1|1,0,0]=3 308 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 34794 [1,0,0,0,0,1|1,0,0]=3 309 B11R1.20 CC(C)OC1=CC=C(N)C=C1 28330 [1,0,0,0,0,1|1,0,0]=3 310 B11R1.20 CC(C)OC1=CC=C(O)C=C1 34515 [1,0,0,0,0,1|0,0,0]=2 311 B11R1.20 CC(C)OC1=CN=C(Br)C=C1 34828 [1,0,0,0,0,1|2,0,0]=4 312 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 22060 [1,0,0,0,0,1|2,0,0]=4 313 B11R1.20 CC(N)CC1=CC=C(F)C=C1 19961 [1,0,0,0,0,1|2,0,0]=4 314 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 21920 [1,0,0,0,0,1|1,0,0]=3 315 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 26241 [1,0,0,0,0,1|1,0,0]=3 316 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 7798 [1,0,0,0,0,1|1,0,0]=3 317 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 7799 [1,0,0,0,0,1|1,0,0]=3 318 B13R1.512 C[Si](C)(C)C#CC1=CC=C(Br)C=C1 33535 [0,0,0,0,0,2|1,1,0]=4