0 B10R1.61 CC(=O)C1=C(F)N=CC=C1 CS-0044029 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 CC(=O)C1=CC=CC=C1Br CS-W007689 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.61 CC(=O)C1=CC=CNC1=O CS-W008721 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.61 CC1=C(C(=O)O)C=NN=C1 CS-0050427 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.61 CC1=NC=CN=C1C(=O)O CS-D1600 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.61 CN(C)C1=CC=CC=C1N CS-W008997 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 CS-B0638 [0,0,0,0,0,0|2,0,2]=4 7 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 CS-B0639 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.61 NC(=O)C1=C(Br)N=CC=N1 CS-0059681 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.61 NC1=C(C(F)F)C=CC=C1 CS-0036038 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.61 NC1=C([N+](=O)[O-])C=NC=C1 CS-W002462 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.61 O=C(O)C1=C(F)C=CN=C1 CS-0040491 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.61 O=C(O)C1=NC=CC=C1Br CS-W002771 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.61 O=C(O)C1=NC=CC=C1I CS-W021949 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.61 O=C(O)C1=NC=CN=C1Br CS-W020213 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.61 O=C(O)C1=NC=CN=C1I CS-W023217 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.61 O=[N+]([O-])C1=C(Br)C=CN=C1 CS-W006293 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.61 O=[N+]([O-])C1=C(Cl)C=NC=C1 CS-W005126 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.61 O=[N+]([O-])C1=C(O)C=CN=C1 CS-W002397 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Cl CS-W008191 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.61 OB(O)C1=CC=CC=C1Cl CS-D1476 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.6 CC(=O)C1=CN=CN=C1 CS-D0295 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.6 CC(=O)C1=NC=NC=C1 CS-0005388 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.6 CC(N)C1=CC=NC=C1 CS-0109447 [1,0,0,0,0,0|2,0,1]=4 24 B9R1.6 C[C@@H](N)C1=CC=CN=C1 CS-0029799 [1,0,0,0,0,0|2,0,1]=4 25 B9R1.6 C[C@H](N)C1=CC=NC=C1 CS-0098146 [1,0,0,0,0,0|2,0,1]=4 26 B9R1.6 C[C@H](N)C1=NC=CC=C1 CS-M3539 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.6 NC(=O)C1=NC=CC=C1 CS-0020700 [1,0,0,0,0,0|1,0,0]=2 28 B9R1.6 NC(=S)C1=NC=CC=N1 CS-0037234 [1,0,0,0,0,0|2,1,0]=4 29 B9R1.6 O=C(O)C1=CN=CN=C1 CS-B0029 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.6 O=C([O-])C1=CC=CC=C1 CS-0013645 [1,0,0,0,0,0|1,0,0]=2 31 B9R1.15 C#CC1=CC=CC=C1F CS-W011208 [1,0,0,0,0,0|2,0,1]=4 32 B9R1.15 C#CC1=CC=CC=C1N CS-W004892 [1,0,0,0,0,0|2,0,1]=4 33 B9R1.15 CC1=C(C=O)C=NC=C1 CS-0044125 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.15 CC1=CC=CC=C1CN CS-M1443 [1,0,0,0,0,0|1,0,1]=3 35 B9R1.15 CC1=NC=CC=C1CN CS-0047048 [1,0,0,0,0,0|2,0,1]=4 36 B9R1.15 CNC1=CC=CC=C1O CS-B1556 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.15 N#CC1=CC=CC=C1I CS-W010392 [1,0,0,0,0,0|1,0,2]=4 38 B9R1.15 NC1=C(C=O)C=CN=C1 CS-0019220 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.15 NC1=C(C=O)C=NC=C1 CS-0080149 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.15 NC1=CC=CC=C1C=O CS-W007486 [1,0,0,0,0,0|1,0,0]=2 41 B9R1.15 NCC1=C(Br)C=CN=C1 CS-0102145 [1,0,0,0,0,0|2,0,1]=4 42 B9R1.15 NCC1=C(Cl)C=CN=C1 CS-0038079 [1,0,0,0,0,0|2,0,1]=4 43 B9R1.15 NCC1=NC=CC=C1F CS-0047058 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.15 NCC1=NC=CC=C1F CS-0053366 [1,0,0,0,0,0|2,0,1]=4 45 B9R1.15 NNC1=C(Br)C=NC=C1 CS-0043603 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.15 O=CC1=C(Cl)C=CC=N1 CS-W005646 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.15 O=CC1=CC=NC=C1Cl CS-W011026 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.15 O=CC1=CC=NC=C1O CS-W005203 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.15 O=CC1=NC=CN=C1Cl CS-0051399 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.15 OCC1=NC=CC=C1O CS-0020046 [1,0,0,0,0,0|1,0,2]=4 51 B11R1.53 CC(=O)C1=CC=CC=C1C#N CS-W005120 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.53 COC1=CC=CC=C1[C@H](C)N CS-0000284 [0,1,0,0,0,0|1,0,1]=3 53 B11R1.87 CC(C)(O)C1=C(O)C=CC=C1 CS-0047114 [0,1,0,0,0,0|1,0,2]=4 54 B11R1.87 CC1=CC=CC=C1S(=O)(=O)O CS-W007285 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.87 NS(=O)(=O)C1=CC=CC=C1Br CS-0022414 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.87 O=S(=O)(O)C1=CC=CC=C1I CS-0041161 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.87 O=S(=O)([O-])C1=CC=CC=C1I CS-0090215 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.156 CC(=O)C1=C(C)C=CC=C1C CS-W005839 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.156 CC(=O)C1=C(F)C=CC=C1Br CS-W018884 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.156 CC(=O)C1=C(F)C=CC=C1O CS-W005023 [0,1,0,0,0,0|1,0,0]=2 61 B11R1.156 CC(=O)C1=C(O)C=CC=C1Br CS-W019055 [0,1,0,0,0,0|1,0,0]=2 62 B11R1.156 CC1=C([N+](=O)[O-])C(F)=CC=C1 CS-W007827 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.156 CC1=C([N+](=O)[O-])C(O)=CC=C1 CS-W006081 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.156 CC1=CC=CC(Cl)=C1[N+](=O)[O-] CS-D1523 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.156 CC1=NC=CC(C)=C1C(=O)O CS-0052147 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.156 CC1=NC=CC(O)=C1[N+](=O)[O-] CS-0047170 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F CS-0040294 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.156 NC1=CC=CC(I)=C1C(=O)O CS-0041326 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br CS-W005569 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1Br CS-0041699 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1Cl CS-W007920 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1F CS-W003306 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.159 CC(=O)C1=CC=CC(F)=C1O CS-0044517 [0,1,0,0,0,0|1,0,0]=2 74 B11R1.159 CC(=O)C1=CC=CC(O)=C1N CS-0033833 [0,1,0,0,0,0|2,0,0]=3 75 B11R1.159 CC1=C(Br)C=NC=C1C(=O)O CS-0046901 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1Br CS-W002413 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.159 CN1C(=O)C=CC=C1C(=O)O CS-W019189 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 CS-0062146 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O CS-B0777 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.159 NC1=C(C(=O)O)C=NC=C1Br CS-W006865 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.159 NC1=C(I)C=CC=C1C(=O)O CS-0030571 [0,1,0,0,0,0|2,0,0]=3 82 B11R1.159 NC1=C(O)C=CC=C1[N+](=O)[O-] CS-W008642 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1Br CS-W006849 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1F CS-D0998 [0,1,0,0,0,0|3,0,0]=4 85 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 CS-W017481 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 CS-W007697 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 CS-W006030 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.159 O=C(O)C1=CC=CC(Br)=C1I CS-0098092 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I CS-0041180 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.159 O=[N+]([O-])C1=C(I)C(Br)=CC=C1 CS-0041001 [0,1,0,0,0,0|3,0,0]=4 91 B11R1.159 O=[N+]([O-])C1=C(O)C(Cl)=NC=C1 CS-W007099 [0,1,0,0,0,0|3,0,0]=4 92 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1O CS-W021626 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 CS-W004840 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 CS-W020416 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.166 CC(=O)C1=C(N)C=C(Br)C=C1 CS-W006736 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 CS-W007177 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.166 CC(=O)C1=CC=C(O)C=C1Br CS-0031408 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.166 CC(N)C1=CC=C(Br)C=C1F CS-0101631 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 CS-W006084 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 CS-W008011 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O CS-W007037 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.166 CC1=CC(I)=CC=C1[N+](=O)[O-] CS-0098648 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.166 CC1=CC(N)=CC=C1[N+](=O)[O-] CS-W010957 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.166 CC1=CC(N)=NC=C1C(=O)O CS-0005496 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.166 CC1=CC=C(C(=O)O)C(C)=N1 CS-0038247 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.166 CC1=NC(F)=CC=C1C(=O)O CS-W022498 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 CS-B0703 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=C1 CS-W005731 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.166 N=C(N)C1=CC=C(Br)C=C1F CS-M2562 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1N CS-B0236 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.166 NC(=O)C1=NC=C(Cl)N=C1Cl CS-W019159 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.166 NC(=S)C1=CC=C(Cl)C=C1F CS-0114061 [0,1,0,0,0,0|1,1,0]=3 113 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 CS-W007847 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 CS-W017585 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=N1 CS-W005596 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.166 O=C(O)C1=C(F)C=C(F)C=N1 CS-W007725 [0,1,0,0,0,0|3,0,0]=4 117 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 CS-W022476 [0,1,0,0,0,0|3,0,0]=4 118 B11R1.166 O=C(O)C1=CC=C(F)N=C1Cl CS-0030261 [0,1,0,0,0,0|3,0,0]=4 119 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br CS-0041697 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.166 O=C(O)C1=NC=C(F)C=C1Cl CS-0079379 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.166 O=C(O)C1=NN=C(O)C=C1O CS-0047274 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.166 O=[N+]([O-])C1=CC=C(Br)C=C1F CS-D0900 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)C=C1F CS-W002202 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)C=C1I CS-0041170 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.166 O=[N+]([O-])C1=CC=C(F)C=C1Cl CS-W003054 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.166 O=[N+]([O-])C1=CC=C(O)C=C1Br CS-W003684 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.166 OB(O)C1=C(O)C=C(F)C=C1 CS-W006548 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 CS-W004802 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 CS-W005834 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.167 CC(=O)C1=CC(Br)=CC=C1C CS-0042136 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.167 CC(=O)C1=CC(O)=CC=C1Br CS-0036962 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.167 CC(C)C1=C(O)C=CC(Br)=C1 CS-0008502 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.167 CC(N)C1=CC(Cl)=CC=C1Cl CS-0038836 [0,1,0,0,0,0|2,0,1]=4 134 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 CS-D1105 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.167 CC1=C([N+](=O)[O-])C=C(O)C=C1 CS-D1224 [0,1,0,0,0,0|3,0,0]=4 136 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 CS-0008584 [0,1,0,0,0,0|1,0,0]=2 137 B11R1.167 CC1=CC(N(=O)=O)=C(Br)C=C1 CS-W014874 [0,1,0,0,0,0|3,0,0]=4 138 B11R1.167 CC1=CC=C(Cl)N=C1C(=O)O CS-D0312 [0,1,0,0,0,0|3,0,0]=4 139 B11R1.167 CC1=CC=C(F)C(C(=O)O)=C1 CS-W019919 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.167 CC1=CC=C(I)C(C(=O)O)=C1 CS-W009152 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.167 CC1=CN=C(O)C([N+](=O)[O-])=C1 CS-W016275 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.167 NC(=O)C1=C(N)N=CC(Br)=C1 CS-D0350 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.167 NC(=O)C1=CC(Br)=CC=C1O CS-W022309 [0,1,0,0,0,0|0,0,0]=1 144 B11R1.167 NC(=O)C1=NC(Cl)=CN=C1N CS-0097625 [0,1,0,0,0,0|3,0,0]=4 145 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O CS-0006535 [0,1,0,0,0,0|3,0,0]=4 146 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O CS-W009220 [0,1,0,0,0,0|3,0,0]=4 147 B11R1.167 NC1=CN=C(F)C=C1C(=O)O CS-W006661 [0,1,0,0,0,0|3,0,0]=4 148 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 CS-D1207 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1F CS-D0438 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.167 O=C(O)C1=CC(I)=CC=C1Br CS-D1730 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.167 O=C(O)C1=NC(Br)=CN=C1O CS-0042066 [0,1,0,0,0,0|3,0,0]=4 152 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F CS-W018881 [0,1,0,0,0,0|3,0,0]=4 153 B11R1.167 O=C([O-])C1=C(O)C=CC(O)=C1 CS-W017420 [0,1,0,0,0,0|1,0,0]=2 154 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(Br)=C1 CS-W019135 [0,1,0,0,0,0|3,0,0]=4 155 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CC=C1F CS-W019164 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.167 O=[N+]([O-])C1=CC(I)=CC=C1Br CS-0105563 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.167 O=[N+]([O-])C1=CC(I)=CC=C1Cl CS-0041172 [0,1,0,0,0,0|3,0,0]=4 158 B11R1.167 O=[N+]([O-])C1=CC(I)=CC=C1F CS-W004953 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.167 O=[N+]([O-])C1=CC(O)=CC=C1I CS-0103378 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.167 O=[N+]([O-])C1=NC(Br)=CC=C1O CS-W006076 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.167 OB(O)C1=CC(F)=CC=C1O CS-W020608 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.222 CC1=CC=CC=C1C(=O)CBr CS-0029521 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.222 CNC(=O)C1=CC=CC=C1N CS-W004940 [0,1,0,0,0,0|1,0,0]=2 164 B11R1.222 COC(=O)C1=C(C)C=CC=N1 CS-W008502 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.222 COC(=O)C1=C(O)N=CC=C1 CS-W007840 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.222 COC(=O)C1=CC=CN=C1N CS-M1170 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.222 COC(=O)C1=NC=CC=C1O CS-W022831 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.222 NCC(=O)C1=CC=CC=C1F CS-W021538 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.222 NNC(=O)C1=CC=CC=C1Cl CS-B1329 [0,1,0,0,0,0|1,0,0]=2 170 B11R1.222 O=C(CBr)C1=CC=CC=C1Cl CS-0008415 [0,1,0,0,0,0|2,0,0]=3 171 B11R2.1 BrC1=NNC2=CC=CC=C21 CS-W007434 [0,0,0,1,0,0|2,0,1]=4 172 B11R2.1 CC1=C2C=CC=NC2=NN1 CS-W013393 [0,0,0,1,0,0|3,0,0]=4 173 B11R2.1 CC1=NOC2=CC=CC=C21 CS-W008538 [0,0,0,1,0,0|1,0,1]=3 174 B11R2.1 N=C1NNC2=C1N=CC=C2 CS-0044056 [0,0,0,1,0,0|3,0,0]=4 175 B11R2.1 NC1=NCC2=CC=CC=C21 CS-B1325 [0,0,0,1,0,0|2,0,0]=3 176 B11R2.1 NC1=NOC2=C1C=CC=C2 CS-W009278 [0,0,0,1,0,0|1,0,0]=2 177 B11R2.1 NC1COC2=CC=CC=C21 CS-0070832 [0,0,0,1,0,0|1,0,1]=3 178 B11R2.1 NC1COC2=NC=CC=C21 CS-B1356 [0,0,0,1,0,0|2,0,1]=4 179 B11R2.1 O=C1NNC2=C1C=CN=C2 CS-W021333 [0,0,0,1,0,0|2,0,0]=3 180 B9R1.41 CC1=C(C(=O)O)C=CS1 CS-W005121 [0,0,0,0,1,0|3,0,0]=4 181 B9R1.41 CC1=C(C(=O)O)SC=C1 CS-W004782 [0,0,0,0,1,0|3,0,0]=4 182 B9R1.41 CC1=CSC=C1C(=O)O CS-W019951 [0,0,0,0,1,0|3,0,0]=4 183 B9R1.41 CN1C=CC=C1C(=O)O CS-W013520 [0,0,0,0,1,0|3,0,0]=4 184 B9R1.41 NC(=O)C1=C(N)NC=N1 CS-M3651 [0,0,0,0,1,0|3,0,0]=4 185 B9R1.41 O=C(O)C1=C(Br)C=CO1 CS-W021884 [0,0,0,0,1,0|3,0,0]=4 186 B9R1.41 O=C(O)C1=C(Br)OC=C1 CS-0029968 [0,0,0,0,1,0|3,0,0]=4 187 B9R1.41 O=C(O)C1=C(Br)SC=C1 CS-D0553 [0,0,0,0,1,0|3,0,0]=4 188 B9R1.41 O=C(O)C1=C(I)OC=C1 CS-0047021 [0,0,0,0,1,0|3,0,0]=4 189 B11R1.86 CC(=O)NC1=C(I)C=NC=C1 CS-0100540 [0,0,0,0,0,1|3,0,0]=4 190 B11R1.86 O=C(O)CC1=NC=CC=C1Cl CS-W021389 [0,0,0,0,0,1|3,0,0]=4 191 B11R1.86 O=C(O)CN1C=CC=CC1=O CS-0038742 [0,0,0,0,0,1|2,0,1]=4 192 B8R1.2 NCC1=CC=NC=C1 CS-W005997 [2,0,0,0,0,0|1,0,1]=4 193 B8R1.2 NNC1=CC=CC=N1 CS-W007453 [2,0,0,0,0,0|2,0,0]=4 194 B8R1.2 NNC1=CC=CN=C1 CS-W021932 [2,0,0,0,0,0|2,0,0]=4 195 B8R1.2 O=CC1=NC=CC=N1 CS-0048725 [2,0,0,0,0,0|2,0,0]=4 196 B8R1.2 O=CC1=NC=CN=C1 CS-W009118 [2,0,0,0,0,0|2,0,0]=4 197 B8R1.5 CC1=C(O)C=NC=C1 CS-W018986 [2,0,0,0,0,0|1,0,1]=4 198 B8R1.5 CC1=CC=CNC1=O CS-W013671 [2,0,0,0,0,0|2,0,0]=4 199 B8R1.5 CC1=NC=CC=C1N CS-W020092 [2,0,0,0,0,0|2,0,0]=4 200 B8R1.5 NC1=C(O)C=NC=C1 CS-W008188 [2,0,0,0,0,0|1,0,0]=3 201 B8R1.5 NC1=CC=CC=C1I CS-W007318 [2,0,0,0,0,0|1,0,0]=3 202 B8R1.5 NC1=CC=CN=C1Br CS-D0804 [2,0,0,0,0,0|2,0,0]=4 203 B8R1.5 NC1=CC=CN=C1F CS-W008831 [2,0,0,0,0,0|2,0,0]=4 204 B8R1.5 O=C1OC=CC=C1O CS-W021933 [2,0,0,0,0,0|1,0,0]=3 205 B8R1.5 OC1=C(I)C=NC=C1 CS-W014750 [2,0,0,0,0,0|2,0,0]=4 206 B8R1.5 OC1=CC=CN=C1Br CS-D0714 [2,0,0,0,0,0|2,0,0]=4 207 B8R1.5 OC1=CN=CC=C1Cl CS-W013443 [2,0,0,0,0,0|2,0,0]=4 208 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 CS-W019730 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.13 CC(=O)C1=CC=C(C)N=C1 CS-B0461 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 CS-0040244 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.13 CC(=O)C1=NC=C(O)C=C1 CS-W021245 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 CS-0000299 [1,1,0,0,0,0|1,0,1]=4 213 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 CS-M1249 [1,1,0,0,0,0|2,0,0]=4 214 B10R1.13 CC1=NC=C(C(=O)O)C=C1 CS-W008333 [1,1,0,0,0,0|2,0,0]=4 215 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 CS-D0020 [1,1,0,0,0,0|1,0,1]=4 216 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 CS-W022338 [1,1,0,0,0,0|1,0,0]=3 217 B10R1.13 NC(=O)C1=NC=C(N)N=C1 CS-W019230 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.13 O=C(O)C1=CC=C(F)N=C1 CS-W019722 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 CS-D0613 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 CS-0028334 [1,1,0,0,0,0|1,0,1]=4 221 B10R1.28 CS(=N)(=O)C1=CC=CC=C1 CS-0047091 [1,1,0,0,0,0|1,0,1]=4 222 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 CS-W022941 [1,1,0,0,0,0|2,0,0]=4 223 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 CS-W015631 [1,1,0,0,0,0|2,0,0]=4 224 B10R1.113 CC(=O)C1=CC(C)=CN=C1 CS-0101623 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.113 CC(=O)C1=CC(C)=NC=C1 CS-W008996 [1,1,0,0,0,0|2,0,0]=4 226 B10R1.113 CC(=O)C1=CC(Cl)=CC=N1 CS-0037389 [1,1,0,0,0,0|2,0,0]=4 227 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 CS-M0495 [1,1,0,0,0,0|2,0,0]=4 228 B10R1.113 CC(=O)C1=NC(Cl)=CC=C1 CS-0043942 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.113 CC(N)C1=CC=CC(F)=C1 CS-0040943 [1,1,0,0,0,0|1,0,1]=4 230 B10R1.113 CC1=CC(C(=N)N)=NC=C1 CS-0038257 [1,1,0,0,0,0|2,0,0]=4 231 B10R1.113 CC1=CC(C(=O)O)=NC=C1 CS-W005037 [1,1,0,0,0,0|2,0,0]=4 232 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 CS-W020506 [1,1,0,0,0,0|1,0,1]=4 233 B10R1.113 CC1=NC(C(=N)N)=CC=C1 CS-0037151 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.113 CC1=NC=CC(C(=O)O)=C1 CS-W008764 [1,1,0,0,0,0|2,0,0]=4 235 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 CS-0008494 [1,1,0,0,0,0|1,0,1]=4 236 B10R1.113 N=C(N)C1=CC(Cl)=CC=C1 CS-W020729 [1,1,0,0,0,0|1,0,0]=3 237 B10R1.113 NC(=O)C1=CC(=O)NC=N1 CS-0107166 [1,1,0,0,0,0|2,0,0]=4 238 B10R1.113 NC(=S)C1=CC(F)=CN=C1 CS-0039422 [1,1,0,0,0,0|1,1,0]=4 239 B10R1.113 NC1=CC=NC(C(=O)O)=C1 CS-W022082 [1,1,0,0,0,0|2,0,0]=4 240 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 CS-B1791 [1,1,0,0,0,0|1,0,0]=3 241 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 CS-W009049 [1,1,0,0,0,0|2,0,0]=4 242 B10R1.2 CC1=C(Br)C=CC=C1C=O CS-0035195 [1,1,0,0,0,0|1,0,0]=3 243 B10R1.2 CC1=C(O)C(C#N)=CC=C1 CS-0103462 [1,1,0,0,0,0|0,0,2]=4 244 B10R1.2 CC1=C(O)C=CC=C1C=O CS-D1651 [1,1,0,0,0,0|1,0,0]=3 245 B10R1.2 N#CC1=CC=CC(O)=C1O CS-W018729 [1,1,0,0,0,0|0,0,2]=4 246 B10R1.2 NC1=C(C=O)C=NC=C1Br CS-0063825 [1,1,0,0,0,0|2,0,0]=4 247 B10R1.2 NNC1=CC=CC(F)=C1F CS-0042640 [1,1,0,0,0,0|2,0,0]=4 248 B10R1.2 O=CC1=C(O)C(Cl)=CC=C1 CS-W007724 [1,1,0,0,0,0|0,0,0]=2 249 B10R1.2 O=CC1=CC=CC(Br)=C1F CS-M0189 [1,1,0,0,0,0|1,0,0]=3 250 B10R1.2 O=CC1=CC=CC(I)=C1F CS-0109989 [1,1,0,0,0,0|1,0,0]=3 251 B10R1.2 O=CC1=CC=CC(O)=C1F CS-0029525 [1,1,0,0,0,0|1,0,0]=3 252 B10R1.4 CC1=CC=CC=C1CON CS-B1209 [1,1,0,0,0,0|1,0,1]=4 253 B10R1.20 C#CC1=CC=CC=C1C=O CS-W005336 [1,1,0,0,0,0|1,0,0]=3 254 B10R1.20 C#CC1=CC=CC=C1OC CS-W005515 [1,1,0,0,0,0|1,0,1]=4 255 B10R1.20 CCC1=CC=CC=C1C=O CS-W007787 [1,1,0,0,0,0|1,0,0]=3 256 B10R1.20 N#CC1=CC=CC=C1CO CS-W005877 [1,1,0,0,0,0|0,0,2]=4 257 B10R1.20 NCC1=CC=CC=C1CO CS-W003577 [1,1,0,0,0,0|0,0,1]=3 258 B10R1.25 CC1=CC(Cl)=NC=C1C=O CS-W019461 [1,1,0,0,0,0|2,0,0]=4 259 B10R1.25 CC1=CC(F)=C(C=O)C=C1 CS-W016507 [1,1,0,0,0,0|1,0,0]=3 260 B10R1.25 CC1=CC(F)=CC=C1NN CS-0105433 [1,1,0,0,0,0|2,0,0]=4 261 B10R1.25 COC1=CC=C(O)C=C1O CS-0031177 [1,1,0,0,0,0|2,0,0]=4 262 B10R1.25 N#CC1=CC=C(Cl)C=C1O CS-W022140 [1,1,0,0,0,0|0,0,2]=4 263 B10R1.25 NC1=C(C=O)C=CC(F)=C1 CS-0035711 [1,1,0,0,0,0|1,0,0]=3 264 B10R1.25 NC1=CC(Br)=CC=C1C=O CS-D1620 [1,1,0,0,0,0|1,0,0]=3 265 B10R1.25 NC1=CC(Cl)=NC=C1C=O CS-0038140 [1,1,0,0,0,0|2,0,0]=4 266 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 CS-0031349 [1,1,0,0,0,0|1,0,1]=4 267 B10R1.25 NNC1=CC=C(Cl)C=C1F CS-0030583 [1,1,0,0,0,0|2,0,0]=4 268 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 CS-W006819 [1,1,0,0,0,0|1,0,0]=3 269 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 CS-W007990 [1,1,0,0,0,0|1,0,0]=3 270 B10R1.25 O=CC1=C(F)C=C(Br)C=N1 CS-0047117 [1,1,0,0,0,0|2,0,0]=4 271 B10R1.25 O=CC1=C(O)C=C(F)C=C1 CS-W008001 [1,1,0,0,0,0|0,0,0]=2 272 B10R1.25 O=CC1=CC=C(Cl)N=C1F CS-0036103 [1,1,0,0,0,0|2,0,0]=4 273 B10R1.25 O=CC1=CC=C(I)C=C1F CS-0028258 [1,1,0,0,0,0|1,0,0]=3 274 B10R1.25 O=CC1=NC=C(Br)C=C1Br CS-0046921 [1,1,0,0,0,0|2,0,0]=4 275 B10R1.25 OCC1=CC=C(Br)C=C1O CS-0097805 [1,1,0,0,0,0|0,0,2]=4 276 B10R1.30 CC1=CC(C=O)=C(Br)C=C1 CS-W004919 [1,1,0,0,0,0|1,0,0]=3 277 B10R1.30 CC1=CC=C(Br)C(C=O)=N1 CS-0102723 [1,1,0,0,0,0|2,0,0]=4 278 B10R1.30 CC1=CNC(=O)C(C=O)=C1 CS-0064123 [1,1,0,0,0,0|1,0,1]=4 279 B10R1.30 CC1=NC=C(Br)C(C=O)=C1 CS-0102724 [1,1,0,0,0,0|2,0,0]=4 280 B10R1.30 COC1=CC(Br)=CC=C1O CS-W007865 [1,1,0,0,0,0|2,0,0]=4 281 B10R1.30 N#CC1=CC(Cl)=CC=C1O CS-0043964 [1,1,0,0,0,0|0,0,2]=4 282 B10R1.30 N#CC1=CC(F)=CC=C1O CS-W005093 [1,1,0,0,0,0|0,0,2]=4 283 B10R1.30 NNC1=CC(F)=CC=C1Cl CS-0030575 [1,1,0,0,0,0|2,0,0]=4 284 B10R1.30 O=CC1=CC(Br)=CC=C1I CS-W019684 [1,1,0,0,0,0|1,0,0]=3 285 B10R1.30 O=CC1=CC(Br)=CN=C1F CS-W019631 [1,1,0,0,0,0|2,0,0]=4 286 B10R1.30 O=CC1=CC(Cl)=NC=C1Br CS-0039821 [1,1,0,0,0,0|2,0,0]=4 287 B10R1.30 O=CC1=CC(Cl)=NC=C1Cl CS-0043722 [1,1,0,0,0,0|2,0,0]=4 288 B10R1.30 O=CC1=CC(F)=CC=C1O CS-W007331 [1,1,0,0,0,0|0,0,0]=2 289 B10R1.30 O=CC1=CC(O)=CC=C1Br CS-W007430 [1,1,0,0,0,0|1,0,0]=3 290 B10R1.30 O=CC1=CC(O)=CC=C1F CS-W004997 [1,1,0,0,0,0|1,0,0]=3 291 B10R1.245 CC1=C(C=O)C(Br)=CC=C1 CS-0061197 [1,1,0,0,0,0|1,0,0]=3 292 B10R1.245 CC1=C(C=O)C(F)=CC=C1 CS-W016505 [1,1,0,0,0,0|1,0,0]=3 293 B10R1.245 CC1=C(C=O)C(O)=CC=C1 CS-W006529 [1,1,0,0,0,0|0,0,0]=2 294 B10R1.245 COC1=C(Br)C=CC=C1O CS-0038237 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.245 NC1=C(C=O)C(Cl)=NC=C1 CS-0063843 [1,1,0,0,0,0|2,0,0]=4 296 B10R1.245 NCC1=C(Cl)C=CC=C1Cl CS-W004956 [1,1,0,0,0,0|1,0,1]=4 297 B10R1.245 NNC1=C(F)C=CC=C1F CS-W021529 [1,1,0,0,0,0|2,0,0]=4 298 B10R1.245 O=CC1=C(Br)C=CC=C1F CS-D1749 [1,1,0,0,0,0|1,0,0]=3 299 B10R1.245 O=CC1=C(Br)N=CC=C1Cl CS-0052003 [1,1,0,0,0,0|2,0,0]=4 300 B10R1.245 O=CC1=C(I)C=CN=C1Cl CS-D0962 [1,1,0,0,0,0|2,0,0]=4 301 B10R1.149 COC(=O)C1=C(O)C=CN1 CS-0044020 [0,1,0,0,1,0|2,0,0]=4 302 B12R1.75 COC1=CC=CC=C1CC(N)=O CS-M2045 [0,1,0,0,0,1|0,0,0]=2 303 B12R1.75 O=CC1=CC=CC=C1CC(=O)O CS-M2515 [0,1,0,0,0,1|1,0,1]=4 304 B12R1.127 O=C(O)CC1=C(Br)C=CC(Br)=C1 CS-M3358 [0,1,0,0,0,1|2,0,0]=4 305 B12R1.127 O=C(O)CC1=CC(Br)=CC=C1I CS-M3563 [0,1,0,0,0,1|2,0,0]=4 306 B12R1.127 O=C(O)CC1=CC(Cl)=CC=C1Cl CS-0042646 [0,1,0,0,0,1|2,0,0]=4 307 B12R1.151 NS(=O)(=O)CC1=C(Cl)C=CC=C1 CS-0036230 [0,1,0,0,0,1|2,0,0]=4 308 B12R1.151 NS(=O)(=O)CC1=CC=CC=C1Br CS-0037304 [0,1,0,0,0,1|2,0,0]=4 309 B12R1.224 O=C(O)CC1=C(F)C(Br)=CC=C1 CS-0041781 [0,1,0,0,0,1|2,0,0]=4 310 B12R1.233 CC(=O)NC1=CC=C(Br)C=C1I CS-0038148 [0,1,0,0,0,1|2,0,0]=4 311 B12R1.233 N=C(N)NC1=CC=C(F)C=C1Cl CS-M2115 [0,1,0,0,0,1|2,0,0]=4 312 B12R1.371 COC(=O)CC1=CC=CC=C1Br CS-W004685 [0,1,0,0,0,1|2,0,0]=4 313 B12R1.371 COC(=O)CC1=CC=CC=C1N CS-0042528 [0,1,0,0,0,1|2,0,0]=4 314 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1Cl CS-W015390 [0,1,0,0,0,1|2,0,0]=4 315 B12R1.46 C=CC1=CC=C(Cl)C=C1C(=O)O CS-W020423 [0,2,0,0,0,0|2,0,0]=4 316 B12R1.46 COC1=CC=C(N)C=C1[N+](=O)[O-] CS-W002411 [0,2,0,0,0,0|2,0,0]=4 317 B12R1.57 CC1=CC=C([N+](=O)[O-])C(CO)=C1 CS-0098720 [0,2,0,0,0,0|2,0,0]=4 318 B12R1.57 COC1=C([N+](=O)[O-])C=CC(N)=C1 CS-M0192 [0,2,0,0,0,0|2,0,0]=4 319 B12R1.57 COC1=CC(Cl)=CC=C1C(=O)O CS-W019517 [0,2,0,0,0,0|1,0,0]=3 320 B12R1.57 COC1=CC(Cl)=CC=C1C(N)=S CS-0115637 [0,2,0,0,0,0|0,1,0]=3 321 B12R1.57 COC1=CC(F)=CC=C1[N+](=O)[O-] CS-B0932 [0,2,0,0,0,0|2,0,0]=4 322 B12R1.57 O=C(O)C1=CC=C(Br)C=C1CO CS-0096396 [0,2,0,0,0,0|1,0,0]=3 323 B12R1.77 N#CC1=CC=CC=C1C(=O)CBr CS-W004404 [0,2,0,0,0,0|2,0,0]=4 324 B12R1.87 CNC1=C(F)C=CC=C1C(=O)O CS-0095465 [0,2,0,0,0,0|2,0,0]=4 325 B12R1.87 COC1=C(C(C)=O)C=CC=C1Br CS-0041874 [0,2,0,0,0,0|1,0,0]=3 326 B12R1.261 CC(O)C1=CC=CC=C1[N+](=O)[O-] CS-0097781 [0,2,0,0,0,0|2,0,0]=4 327 B12R1.261 NC(=O)C1=C(C(=O)O)C=CC=N1 CS-0038686 [0,2,0,0,0,0|1,0,0]=3 328 B12R1.283 O=[N+]([O-])C1=CC=CC=C1CCO CS-W008358 [0,2,0,0,0,0|2,0,0]=4 329 B12R1.437 COC1=C(C(=O)O)C(Br)=CC=C1 CS-W007547 [0,2,0,0,0,0|1,0,0]=3 330 B12R1.437 COC1=C(C(=O)O)C(Cl)=NC=C1 CS-0096904 [0,2,0,0,0,0|2,0,0]=4 331 B12R1.437 COC1=C(C(C)=O)C(Cl)=CC=C1 CS-0042564 [0,2,0,0,0,0|1,0,0]=3 332 B12R1.437 COC1=NC=CC(I)=C1C(=O)O CS-0059853 [0,2,0,0,0,0|2,0,0]=4 333 B12R1.437 N#CC1=CC=CC(O)=C1[N+](=O)[O-] CS-0097684 [0,2,0,0,0,0|2,0,0]=4 334 B12R1.437 O=CC1=CC=CC(O)=C1[N+](=O)[O-] CS-0102239 [0,2,0,0,0,0|2,0,0]=4 335 B12R1.894 CC1=C(Br)C(C(=O)O)=C(F)C=C1 CS-0098075 [0,2,0,0,0,0|2,0,0]=4 336 B12R1.894 CC1=C(Br)C=CC(F)=C1C(=O)O CS-0047306 [0,2,0,0,0,0|2,0,0]=4 337 B12R1.894 CC1=C([N+](=O)[O-])C(O)=CC=C1Br CS-0050984 [0,2,0,0,0,0|2,0,0]=4 338 B12R1.894 NC1=C(C(=O)O)C(Br)=C(F)C=C1 CS-0102129 [0,2,0,0,0,0|2,0,0]=4 339 B12R1.894 NC1=C(I)C=CC(F)=C1C(=O)O CS-W020529 [0,2,0,0,0,0|2,0,0]=4 340 B12R1.894 NC1=CC=C(F)C(C(=O)O)=C1F CS-W021830 [0,2,0,0,0,0|2,0,0]=4 341 B12R1.1000 CC1=C(C(=O)O)C(F)=CC(Cl)=C1 CS-0102013 [0,2,0,0,0,0|2,0,0]=4 342 B12R1.1000 CC1=CC(F)=C(C(=O)O)C(F)=C1 CS-W021528 [0,2,0,0,0,0|2,0,0]=4 343 B12R1.1000 CC1=CC(F)=CC(Br)=C1C(=O)O CS-0041779 [0,2,0,0,0,0|2,0,0]=4 344 B12R1.1000 NC1=CC(Br)=CC(F)=C1C(=O)O CS-0102001 [0,2,0,0,0,0|2,0,0]=4 345 B12R1.1000 O=C(O)C1=C(Cl)C=C(Br)C=C1Cl CS-W006731 [0,2,0,0,0,0|2,0,0]=4 346 B12R1.1000 O=C(O)C1=C(Cl)C=C(Cl)C=C1F CS-0036141 [0,2,0,0,0,0|2,0,0]=4 347 B12R1.1000 O=C(O)C1=C(F)C=C(Br)C=C1F CS-W009173 [0,2,0,0,0,0|2,0,0]=4 348 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1Cl CS-0097779 [0,2,0,0,0,0|2,0,0]=4 349 B12R1.3441 COC(=O)C1=C(C)C=CC=C1Br CS-W004694 [0,2,0,0,0,0|2,0,0]=4 350 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1Br CS-0094451 [0,2,0,0,0,0|2,0,0]=4 351 B12R1.3441 COC(=O)C1=C(F)C=CC=C1N CS-0045066 [0,2,0,0,0,0|2,0,0]=4 352 B12R1.3441 COC(=O)C1=C(F)C=CC=C1O CS-W006359 [0,2,0,0,0,0|1,0,0]=3 353 B12R1.3441 COC(=O)C1=C(I)C=CC=C1C CS-0035698 [0,2,0,0,0,0|2,0,0]=4 354 B12R1.3441 COC(=O)C1=C(I)C=CC=C1Cl CS-0105522 [0,2,0,0,0,0|2,0,0]=4 355 B12R1.24 COC(=O)C1=C(C)C(Br)=CC=C1 CS-W005509 [0,2,0,0,0,0|2,0,0]=4 356 B12R1.24 COC(=O)C1=C(N)C(Br)=CC=C1 CS-W018624 [0,2,0,0,0,0|2,0,0]=4 357 B12R1.24 COC(=O)C1=C(N)C(N)=CC=C1 CS-W005147 [0,2,0,0,0,0|2,0,0]=4 358 B12R1.24 COC(=O)C1=CC=CC(F)=C1N CS-W018997 [0,2,0,0,0,0|2,0,0]=4 359 B12R1.24 COC(=O)C1=CC=CC(O)=C1F CS-0085282 [0,2,0,0,0,0|2,0,0]=4 360 B12R1.24 COC(=O)C1=CC=CC(O)=C1N CS-W022796 [0,2,0,0,0,0|2,0,0]=4 361 B12R1.440 COC1=CC=CC(C(=O)O)=C1Br CS-W005119 [0,2,0,0,0,0|2,0,0]=4 362 B12R1.440 N#CC1=C(F)C(C(=O)O)=CC=C1 CS-W006903 [0,2,0,0,0,0|2,0,0]=4 363 B12R1.440 O=CC1=C(F)C(C(=O)O)=CC=C1 CS-0095020 [0,2,0,0,0,0|2,0,0]=4 364 B12R1.440 O=CC1=C(O)C(C(=O)O)=CC=C1 CS-B1702 [0,2,0,0,0,0|1,0,0]=3 365 B12R1.511 CC1=C(O)C(C(=O)O)=CC(Br)=C1 CS-0102034 [0,2,0,0,0,0|1,0,0]=3 366 B12R1.511 CC1=CC(Br)=CC([N+](=O)[O-])=C1O CS-0098686 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.511 NC1=C(F)C=C(Cl)C=C1C(=O)O CS-0047219 [0,2,0,0,0,0|2,0,0]=4 368 B12R1.511 O=C(O)C1=CC(Cl)=CC(Br)=C1F CS-0010961 [0,2,0,0,0,0|2,0,0]=4 369 B12R1.511 O=C(O)C1=CC(I)=CC(Cl)=C1F CS-0098760 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.511 O=[N+]([O-])C1=C(O)C(O)=CC(Br)=C1 CS-0080118 [0,2,0,0,0,0|2,0,0]=4 371 B12R1.511 O=[N+]([O-])C1=CC(F)=CC(Br)=C1O CS-0036370 [0,2,0,0,0,0|2,0,0]=4 372 B12R1.893 CC(=O)C1=CC=C(F)C(Br)=C1F CS-0028721 [0,2,0,0,0,0|2,0,0]=4 373 B12R1.893 CC(=O)C1=CC=C(F)C(F)=C1F CS-0104908 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.893 CC(=O)C1=CC=C(O)C(C)=C1N CS-M0970 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1N CS-0098654 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.893 CC1=CC=C(C(=O)O)C(F)=C1I CS-0046931 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.893 NC1=C(F)C(Br)=CC=C1C(=O)O CS-B1281 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.893 NC1=CC=C(C(=O)O)C(Cl)=C1Cl CS-0098672 [0,2,0,0,0,0|2,0,0]=4 379 B12R1.893 NC1=CC=C(C(=O)O)C(F)=C1F CS-0028802 [0,2,0,0,0,0|2,0,0]=4 380 B12R1.893 O=C(O)C1=CC=C(Br)C(Cl)=C1F CS-0098670 [0,2,0,0,0,0|2,0,0]=4 381 B12R1.893 O=[N+]([O-])C1=C(O)C(Br)=C(F)C=C1 CS-0041716 [0,2,0,0,0,0|2,0,0]=4 382 B12R1.232 CC1=C(Br)C=C([N+](=O)[O-])C(O)=C1 CS-W018718 [0,2,0,0,0,0|2,0,0]=4 383 B12R1.232 CC1=C(C(=O)O)C=C(N)C(Br)=C1 CS-0038569 [0,2,0,0,0,0|2,0,0]=4 384 B12R1.232 CC1=C(F)C=C(C(=O)O)C(Br)=C1 CS-0034104 [0,2,0,0,0,0|2,0,0]=4 385 B12R1.232 CC1=C(N)C=C(C(=O)O)C(Br)=C1 CS-0098738 [0,2,0,0,0,0|2,0,0]=4 386 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1N CS-0061169 [0,2,0,0,0,0|2,0,0]=4 387 B12R1.232 CC1=CC(C(=O)O)=C(N)C=C1Cl CS-M1328 [0,2,0,0,0,0|2,0,0]=4 388 B12R1.232 NC1=C(C(=O)O)C=C(F)C(Cl)=C1 CS-W005711 [0,2,0,0,0,0|2,0,0]=4 389 B12R1.232 NC1=CC(Br)=C(F)C=C1C(=O)O CS-0036807 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1Cl CS-W004398 [0,2,0,0,0,0|2,0,0]=4 391 B12R1.232 O=C(O)C1=CC(Br)=C(O)C=C1F CS-0047249 [0,2,0,0,0,0|2,0,0]=4 392 B12R1.232 O=C(O)C1=CC(Cl)=C(Br)C=C1F CS-W019357 [0,2,0,0,0,0|2,0,0]=4 393 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1Br CS-W012865 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.232 O=[N+]([O-])C1=C(O)C=C(Cl)C(Cl)=C1 CS-0060123 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.232 O=[N+]([O-])C1=CC(F)=C(Br)C=C1O CS-0102234 [0,2,0,0,0,0|2,0,0]=4 396 B12R1.452 COC1=CC(I)=C(C(=O)O)C=C1 CS-W005751 [0,2,0,0,0,0|2,0,0]=4 397 B12R1.452 COC1=CC=C(C(=O)O)C(C)=C1 CS-W007937 [0,2,0,0,0,0|2,0,0]=4 398 B12R1.452 COC1=CC=C(C(C)=O)C(N)=C1 CS-0040295 [0,2,0,0,0,0|2,0,0]=4 399 B12R1.452 N#CC1=CC=C(C(=O)O)C(Br)=C1 CS-0040133 [0,2,0,0,0,0|2,0,0]=4 400 B12R1.452 O=C(O)C1=CC=C(CO)C=C1F CS-0097075 [0,2,0,0,0,0|2,0,0]=4 401 B12R1.452 O=[N+]([O-])C1=C(O)C=C(CO)C=C1 CS-M0515 [0,2,0,0,0,0|2,0,0]=4 402 B12R1.1703 CNC(=O)C1=C(F)C=C(N)C=C1 CS-M1520 [0,2,0,0,0,0|1,0,0]=3 403 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=C1 CS-0041783 [0,2,0,0,0,0|2,0,0]=4 404 B12R1.1703 COC(=O)C1=C(F)C=C(N)C=C1 CS-W004728 [0,2,0,0,0,0|2,0,0]=4 405 B12R1.1703 COC(=O)C1=C(N)C=C(Br)C=C1 CS-W004770 [0,2,0,0,0,0|2,0,0]=4 406 B12R1.1703 COC(=O)C1=C(O)C=C(Br)C=C1 CS-W004803 [0,2,0,0,0,0|1,0,0]=3 407 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1I CS-0101592 [0,2,0,0,0,0|2,0,0]=4 408 B12R1.1703 COC(=O)C1=CC=C(C)C=C1N CS-0028743 [0,2,0,0,0,0|2,0,0]=4 409 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1F CS-0065296 [0,2,0,0,0,0|2,0,0]=4 410 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1I CS-0041112 [0,2,0,0,0,0|2,0,0]=4 411 B12R1.1703 COC(=O)C1=CC=C(I)C=C1Cl CS-0094435 [0,2,0,0,0,0|2,0,0]=4 412 B12R1.1703 O=C(CBr)C1=C(Cl)C=C(Cl)C=C1 CS-M0784 [0,2,0,0,0,0|2,0,0]=4 413 B12R1.354 CC1=C(C(=O)NN)C=C(Br)C=C1 CS-0038934 [0,2,0,0,0,0|1,0,0]=3 414 B12R1.354 COC(=O)C1=C(Br)C=CC(Cl)=C1 CS-W007971 [0,2,0,0,0,0|2,0,0]=4 415 B12R1.354 COC(=O)C1=C(C)C=CC(Br)=C1 CS-W007619 [0,2,0,0,0,0|2,0,0]=4 416 B12R1.354 COC(=O)C1=C(I)C=CC(Br)=C1 CS-W018330 [0,2,0,0,0,0|2,0,0]=4 417 B12R1.354 COC(=O)C1=CC(Cl)=CC=C1I CS-0030377 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.354 COC(=O)C1=CC(O)=CC=C1C CS-0036519 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.354 CSC(=O)C1=C(F)C=CC(F)=C1 CS-M1646 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.354 NNC(=S)C1=CC(F)=CC=C1F CS-M1654 [0,2,0,0,0,0|1,1,0]=4 421 B12R1.453 COC1=CC(C(=O)O)=C(F)C=C1 CS-W008479 [0,2,0,0,0,0|2,0,0]=4 422 B12R1.453 COC1=CC=C(O)C(C(C)=O)=C1 CS-D1489 [0,2,0,0,0,0|1,0,0]=3 423 B12R1.453 N#CC1=CC(C(=O)O)=C(Br)C=C1 CS-W019084 [0,2,0,0,0,0|2,0,0]=4 424 B12R1.453 N#CC1=CC(C(=O)O)=C(I)C=C1 CS-0039115 [0,2,0,0,0,0|2,0,0]=4 425 B12R1.453 N#CC1=CC(C(=O)O)=C(N)C=C1 CS-W005229 [0,2,0,0,0,0|2,0,0]=4 426 B12R1.453 N#CC1=CC=C(O)C([N+](=O)[O-])=C1 CS-W008477 [0,2,0,0,0,0|2,0,0]=4 427 B12R1.453 NC(=O)C1=C(F)C=CC(C=O)=C1 CS-0018388 [0,2,0,0,0,0|1,0,0]=3 428 B12R1.308 N#CCC(=O)C1=CC=CC=C1Cl CS-W016011 [0,2,0,0,0,0|1,0,1]=4 429 B12R1.308 O=C(CCCl)C1=CC=CC=C1F CS-0045341 [0,2,0,0,0,0|2,0,0]=4 430 B10R1.23 O=C(O)C(=O)C1=CC=CO1 CS-W016471 [0,0,1,1,0,0|2,0,0]=4 431 B10R2.320 O=C1CC2=C1C=CC=C2 CS-W022591 [1,0,0,1,0,0|1,0,0]=3 432 B10R2.7 C1=CC2=C(C=CO2)N=C1 CS-0049346 [1,0,0,1,0,0|2,0,0]=4 433 B12R2.24 O=C1C=CC2=CC=CC=C2N1 CS-W005598 [0,0,0,1,0,1|2,0,0]=4 434 B12R2.24 O=C1COC2=NC=CC=C2N1 CS-0030376 [0,0,0,1,0,1|2,0,0]=4 435 B12R2.202 CC1=CC2=C(C=CC=C2O)N1 CS-W008342 [0,0,0,1,0,1|1,0,0]=3 436 B12R2.202 NC1=NC2=C(Br)C=CC=C2S1 CS-W019966 [0,0,0,1,0,1|1,1,0]=4 437 B12R2.202 NC1=NC2=C(F)C=CC=C2S1 CS-W022180 [0,0,0,1,0,1|1,1,0]=4 438 B12R2.202 O=C1CC2=C(Cl)C=CN=C2N1 CS-0004789 [0,0,0,1,0,1|2,0,0]=4 439 B12R2.202 O=C1CC2=C(F)C=CC=C2N1 CS-0032315 [0,0,0,1,0,1|1,0,0]=3 440 B12R2.202 O=C1CC2=CC=CC(Br)=C2C1 CS-0051004 [0,0,0,1,0,1|2,0,0]=4 441 B12R2.202 O=C1NC2=CC=CC(Cl)=C2S1 CS-0043170 [0,0,0,1,0,1|1,0,0]=3 442 B12R2.202 S=C1NC2=CC=CC(Cl)=C2O1 CS-0064118 [0,0,0,1,0,1|1,1,0]=4 443 B12R2.1081 NC1=C2C=CC=CC2=NN=C1 CS-B0655 [0,1,0,1,0,0|2,0,0]=4 444 B12R2.1081 O=C1CCOC2=CC=CC=C12 CS-W007464 [0,1,0,1,0,0|1,0,0]=3 445 B12R2.1081 O=C1CCOC2=CC=CN=C12 CS-B0013 [0,1,0,1,0,0|2,0,0]=4 446 B12R2.1081 O=C1NC=NC2=C1C=CN=C2 CS-0046977 [0,1,0,1,0,0|2,0,0]=4 447 B12R2.1081 O=C1NC=NC2=C1C=NC=C2 CS-0051349 [0,1,0,1,0,0|2,0,0]=4 448 B12R2.1081 O=C1NCCC2=C1C=CC=C2 CS-W008863 [0,1,0,1,0,0|1,0,0]=3 449 B12R2.203 CC1=CNC2=CC=CC(O)=C12 CS-0038575 [0,1,0,1,0,0|1,0,0]=3 450 B12R2.203 O=C1CCC2=CC=CC(F)=C12 CS-D0686 [0,1,0,1,0,0|2,0,0]=4 451 B12R2.203 O=C1COC2=CC=CC(F)=C12 CS-0095519 [0,1,0,1,0,0|1,0,0]=3 452 B12R2.196 NC1=C2CNC(=O)C2=CC=C1 CS-0051053 [0,1,0,1,0,0|1,0,0]=3 453 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 CS-W008929 [0,1,0,1,0,0|2,0,0]=4 454 B12R2.196 O=C1NCC2=C1C=CC=C2O CS-W022188 [0,1,0,1,0,0|1,0,0]=3 455 B12R2.612 ClC1=CC2=C(C=C1)C(Cl)=NO2 CS-W021823 [0,1,0,1,0,0|1,0,1]=4 456 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 CS-W008687 [0,1,0,1,0,0|2,0,0]=4 457 B12R2.612 O=C1N=CC2=CC(O)=CC=C12 CS-W006098 [0,1,0,1,0,0|1,0,1]=4 458 B12R2.612 O=C1NOC2=C1C=CC(Br)=C2 CS-0085269 [0,1,0,1,0,0|0,0,0]=2 459 B12R2.612 O=C1NOC2=C1C=CC(Cl)=C2 CS-0063922 [0,1,0,1,0,0|0,0,0]=2 460 B12R2.612 O=C1OCC2=C1C=CC(O)=C2 CS-0028396 [0,1,0,1,0,0|2,0,0]=4 461 B12R2.132 ClC1=NOC2=C1C=C(Br)C=C2 CS-0059212 [0,1,0,1,0,0|1,0,1]=4 462 B12R2.132 NC1=CC2=C(C=C1)CCC2=O CS-W020513 [0,1,0,1,0,0|2,0,0]=4 463 B12R2.132 O=C1CCC2=CC=C(Cl)C=C12 CS-B1314 [0,1,0,1,0,0|2,0,0]=4 464 B12R2.132 O=C1NNC2=C1C=C(Br)C=C2 CS-D0107 [0,1,0,1,0,0|1,0,0]=3 465 B12R2.1 O=CC1=COC2=CC=CC=C12 CS-W004801 [0,1,0,1,0,0|1,0,0]=3 466 B12R2.18 CN1N=C2C=CC=CC2=C1I CS-0035760 [0,1,0,1,0,0|2,0,0]=4 467 B8R1.11 CC1=C(C=O)NC=C1 CS-0094722 [1,0,0,0,1,0|2,0,0]=4 468 B8R1.11 O=CC1=C(Br)SC=C1 CS-W006466 [1,0,0,0,1,0|2,0,0]=4 469 B8R1.11 O=CC1=C(Cl)SC=C1 CS-0089614 [1,0,0,0,1,0|2,0,0]=4