0 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 G-7564 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Q54381 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.61 CC(=O)C1=CC=CN=C1Br F-4747 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.61 CC(=O)C1=CC=CN=C1C Q52526 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.61 CC(=O)C1=CC=CN=C1F O30900 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.61 CC(=O)C1=CC=CN=C1N Q52860 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.61 CC(=O)C1=CN=CN=C1C Q58769 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.61 CC(=O)C1=NC=CC=C1Cl G-7206 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.61 CC(=O)C1=NC=CC=C1F O30529 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.61 CC(=O)C1=NC=CC=C1O P41694 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.61 CC(=O)C1=NC=CN=C1Cl G-7946 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.61 CC(Br)C1=CC=CC=C1F O31043 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.61 CC(Cl)C1=CC=CC=C1Cl P40025 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.61 CC(N)C1=CC=CC=C1Br O34378 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.61 CC(N)C1=CC=CC=C1Cl P38305 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.61 CC(N)C1=CC=CC=C1F P36297 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.61 CC(N)C1=CC=CC=C1N P38310 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.61 CC(O)C1=C(F)C=NC=C1 Q65366 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.61 CC(O)C1=CC=CN=C1Br O30716 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.61 CC(O)C1=CC=CN=C1Cl P41711 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.61 CC(O)C1=CC=CN=C1F N26796 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.61 CC1=C(B(O)O)C=CN=C1 I-9950 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.61 CC1=C(B(O)O)C=NC=C1 Q66522 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.61 CC1=C(C(=O)O)C=CN=C1 Q56301 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.61 CC1=C(C(=O)O)C=NN=C1 G-5521 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.61 CC1=C(C(=O)O)N=NC=C1 L13035 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 C-3702 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.61 CC1=CC=CC=C1C(C)N P38147 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] G-6919 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.61 CC1=CC=NC=C1C(=O)O G-5539 [0,0,0,0,0,0|2,0,0]=2 30 B10R1.61 CC1=CN=CN=C1C(=O)O O33331 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.61 CC1=NC=CC=C1B(O)O N24577 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.61 CC1=NC=CC=C1B(O)O P43526 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.61 CC1=NC=CC=C1C(=O)O E-3023 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] C-3336 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.61 CC1=NC=CN=C1C(=O)O G-5660 [0,0,0,0,0,0|3,0,0]=3 36 B10R1.61 CN(C)C1=CC=CC=C1O P38469 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 H-8943 [0,0,0,0,0,0|2,0,1]=3 38 B10R1.61 C[C@@H](O)C1=CC=CN=C1N Q62533 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.61 C[C@H](N)C1=CC=CC=C1Br P51405 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl P41701 [0,0,0,0,0,0|2,0,1]=3 41 B10R1.61 C[C@H](O)C1=CC=CN=C1N Q62532 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.61 N=C(N)C1=CC=CC=C1F P51589 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.61 N=C(N)C1=NC=CC=C1F O32719 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.61 N=C(N)C1=NC=CC=C1F O32720 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 N25046 [0,0,0,0,0,0|3,0,0]=3 46 B10R1.61 NC(=O)C1=C(N)C=CN=C1 C-3535 [0,0,0,0,0,0|3,0,0]=3 47 B10R1.61 NC(=O)C1=CC=CN=C1F N25255 [0,0,0,0,0,0|3,0,0]=3 48 B10R1.61 NC(=O)C1=CC=NC=C1N O34515 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.61 NC(=O)C1=CN=CN=C1O O34320 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.61 NC(=O)C1=NC=CC=C1N C-3697 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.61 NC1=C(B(O)O)C=NC=C1 S72547 [0,0,0,0,0,0|3,0,1]=4 52 B10R1.61 NC1=C(B(O)O)C=NC=C1 S72548 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.61 NC1=C(C(=O)O)C=CN=C1 G-6779 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.61 NC1=C(C(=O)O)C=NC=C1 G-5409 [0,0,0,0,0,0|2,0,0]=2 55 B10R1.61 NC1=C(C(=O)O)N=CN=C1 Q57220 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.61 NC1=CC=CN=C1C(=O)O C-3331 [0,0,0,0,0,0|2,0,0]=2 57 B10R1.61 NC1=CC=NC=C1N(=O)=O A-908 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.61 NC1=NC=CC=C1B(O)O Q68886 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.61 NC1=NC=CC=C1[N+](=O)[O-] C-3682 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.61 NC1=NN=CC=C1C(=O)O M15199 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.61 O=C(Cl)C1=CC=CN=C1Br N24418 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.61 O=C(Cl)C1=CC=CN=C1F N25171 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 E-3001 [0,0,0,0,0,0|2,0,0]=2 64 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 G-5495 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.61 O=C(O)C1=C(Br)N=CN=C1 H-8378 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 H-8359 [0,0,0,0,0,0|2,0,0]=2 67 B10R1.61 O=C(O)C1=C(Cl)N=CN=C1 H-8380 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.61 O=C(O)C1=C(F)C=NC=C1 G-7559 [0,0,0,0,0,0|2,0,0]=2 69 B10R1.61 O=C(O)C1=C(I)C=NC=C1 O31943 [0,0,0,0,0,0|2,0,0]=2 70 B10R1.61 O=C(O)C1=CN=CC=C1F O34100 [0,0,0,0,0,0|2,0,0]=2 71 B10R1.61 O=C(O)C1=CN=CNC1=O H-8379 [0,0,0,0,0,0|2,0,1]=3 72 B10R1.61 O=C(O)C1=NC=CC=C1F H-8045 [0,0,0,0,0,0|2,0,0]=2 73 B10R1.61 O=C(O)C1=NC=CC=C1O I-9324 [0,0,0,0,0,0|1,0,0]=1 74 B10R1.61 O=C(O)C1=NC=CN=C1Br S70901 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.61 O=C(O)C1=NC=CN=C1Cl G-5403 [0,0,0,0,0,0|3,0,0]=3 76 B10R1.61 O=C(O)C1=NC=CN=C1I O29988 [0,0,0,0,0,0|3,0,0]=3 77 B10R1.61 O=C(O)C1=NC=CN=C1O C-3727 [0,0,0,0,0,0|2,0,0]=2 78 B10R1.61 O=C(O)C1=NC=NC=C1Cl P51523 [0,0,0,0,0,0|3,0,0]=3 79 B10R1.61 O=C(O)C1=NC=NC=C1F O33158 [0,0,0,0,0,0|3,0,0]=3 80 B10R1.61 O=C1NC=CC=C1B(O)O G-7460 [0,0,0,0,0,0|2,0,2]=4 81 B10R1.61 O=[N+]([O-])C1=C(F)C=NC=C1 O30658 [0,0,0,0,0,0|3,0,1]=4 82 B10R1.61 O=[N+]([O-])C1=C(I)C=CN=C1 Q52538 [0,0,0,0,0,0|3,0,1]=4 83 B10R1.61 O=[N+]([O-])C1=C(O)C=NC=C1 10600 [0,0,0,0,0,0|2,0,1]=3 84 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Br C-3687 [0,0,0,0,0,0|3,0,1]=4 85 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O G-5324 [0,0,0,0,0,0|2,0,1]=3 86 B10R1.61 O=[N+]([O-])C1=NC=CC=C1O L13797 [0,0,0,0,0,0|2,0,1]=3 87 B10R1.61 OB(O)C1=C(Br)C=CN=C1 N25518 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.61 OB(O)C1=C(Br)C=CN=C1 N26550 [0,0,0,0,0,0|3,0,1]=4 89 B10R1.61 OB(O)C1=C(Br)C=CN=C1 O29115 [0,0,0,0,0,0|3,0,1]=4 90 B10R1.61 OB(O)C1=C(Br)C=NC=C1 Q66417 [0,0,0,0,0,0|3,0,1]=4 91 B10R1.61 OB(O)C1=C(Cl)C=CN=C1 M24062 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.61 OB(O)C1=C(Cl)C=NC=C1 N24124 [0,0,0,0,0,0|3,0,1]=4 93 B10R1.61 OB(O)C1=C(F)C=CN=C1 Q54495 [0,0,0,0,0,0|3,0,1]=4 94 B10R1.61 OB(O)C1=C(F)C=NC=C1 N24272 [0,0,0,0,0,0|3,0,1]=4 95 B10R1.61 OB(O)C1=CC=CC=C1I Q67114 [0,0,0,0,0,0|2,0,1]=3 96 B10R1.61 OB(O)C1=CC=CN=C1Br Q66269 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.61 OB(O)C1=NC=CC=C1F Q53806 [0,0,0,0,0,0|3,0,1]=4 98 B10R1.61 OB(O)C1=NC=CC=C1O Q62472 [0,0,0,0,0,0|2,0,1]=3 99 B9R1.6 CC(=O)C1=CC=CN=C1 P44672 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.6 CC(=O)C1=CC=NN=C1 G-6740 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.6 CC(=O)C1=CN=CN=C1 G-5167 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.6 CC(=O)C1=NC=CC=N1 G-6326 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.6 CC(=O)C1=NC=NC=C1 O34283 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.6 CC(=O)C1=NN=CC=C1 C-2755 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.6 CS(=O)C1=NC=CC=C1 O34232 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.6 N=C(N)C1=NC=CC=C1 O34083 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.6 NC(=O)C1=NC=NC=C1 P51213 [1,0,0,0,0,0|3,0,0]=4 108 B9R1.6 O=C(O)C1=CC=CN=N1 C-2266 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.6 O=C(O)C1=CC=NC=N1 C-2226 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.6 O=C(O)C1=CC=NN=C1 C-3207 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.6 O=C(O)C1=CN=CC=N1 C-3429 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.6 O=C(O)C1=CN=CN=C1 C-3274 [1,0,0,0,0,0|2,0,0]=3 113 B9R1.6 O=C(O)C1=NC=CC=N1 C-3378 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.6 O=S([O-])C1=CC=CN=C1 O32481 [1,0,0,0,0,0|2,0,1]=4 115 B9R1.6 O=S([O-])C1=CC=NC=C1 Q69553 [1,0,0,0,0,0|2,0,1]=4 116 B9R1.6 O=S([O-])C1=NC=CC=C1 O32707 [1,0,0,0,0,0|2,0,1]=4 117 B9R1.6 OB(O)C1=CC=NC=C1 C-3686 [1,0,0,0,0,0|2,0,1]=4 118 B9R1.15 C#CC1=CC=CC=C1Br O27884 [1,0,0,0,0,0|2,0,1]=4 119 B9R1.15 C#CC1=CC=CC=C1C O28000 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.15 C#CC1=CC=CC=C1N L13529 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.15 C#CC1=CC=CC=C1O O30353 [1,0,0,0,0,0|1,0,1]=3 122 B9R1.15 C(=O)C1=C(O)C=CN=C1 Q57085 [1,0,0,0,0,0|1,0,0]=2 123 B9R1.15 C(=O)C1=CC=CN=C1C C-2892 [1,0,0,0,0,0|2,0,0]=3 124 B9R1.15 C(=O)C1=CC=CN=C1N E-3082 [1,0,0,0,0,0|2,0,0]=3 125 B9R1.15 C(=O)C1=CN=CC=C1C C-2893 [1,0,0,0,0,0|2,0,0]=3 126 B9R1.15 C(=O)C1=CN=CN=C1N Q55481 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.15 C(=O)C1=NC=CN=C1Cl L18467 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.15 C(=O)C1=NC=CN=C1N C-3433 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.15 C(=O)C1=NC=NC=C1N Q55482 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.15 C=CC1=C(C)N=CC=C1 L14938 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.15 C=CC1=CC=CC=C1N O30540 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.15 C=CC1=CC=CN=C1Br O29963 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.15 CC1=C(C=O)N=CC=C1 G-5812 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.15 CC1=C(CO)C=NC=C1 G-7931 [1,0,0,0,0,0|2,0,1]=4 135 B9R1.15 CC1=C(CO)N=CC=C1 Q62329 [1,0,0,0,0,0|2,0,1]=4 136 B9R1.15 CC1=CN=CC=C1CO C-2894 [1,0,0,0,0,0|2,0,1]=4 137 B9R1.15 CC1=NC=CC=C1CO 10789 [1,0,0,0,0,0|2,0,1]=4 138 B9R1.15 CC1=NC=NC=C1C=O Q60398 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.15 COC1=C(O)C=NC=C1 O30206 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.15 COC1=NC=CC=C1O Q67611 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.15 NC1=C(C=O)C=CN=C1 I-9640 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.15 NC1=C(C=O)C=NC=C1 Q51902 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.15 NC1=C(CO)C=NC=C1 O34460 [1,0,0,0,0,0|2,0,1]=4 144 B9R1.15 NC1=CC=CC=C1CO G-7793 [1,0,0,0,0,0|1,0,1]=3 145 B9R1.15 NC1=NC=CC=C1CO O32321 [1,0,0,0,0,0|2,0,1]=4 146 B9R1.15 NCC1=C(O)C=CN=C1 Q62259 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.15 NCC1=CC=CC=C1Br P38336 [1,0,0,0,0,0|2,0,1]=4 148 B9R1.15 NCC1=CC=CC=C1I P38307 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.15 O=C1NC=CC=C1CO L18304 [1,0,0,0,0,0|1,0,2]=4 150 B9R1.15 O=CC1=C(Br)C=CN=C1 L14209 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.15 O=CC1=C(Br)C=CN=C1 L21843 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.15 O=CC1=C(Br)C=CN=C1 N24911 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.15 O=CC1=C(Br)C=NC=C1 Q66929 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.15 O=CC1=C(Br)C=NC=C1 Q67986 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.15 O=CC1=C(Cl)C=CN=C1 G-7008 [1,0,0,0,0,0|2,0,0]=3 156 B9R1.15 O=CC1=C(Cl)C=CN=C1 N24210 [1,0,0,0,0,0|2,0,0]=3 157 B9R1.15 O=CC1=C(Cl)C=NC=C1 N27329 [1,0,0,0,0,0|2,0,0]=3 158 B9R1.15 O=CC1=C(Cl)N=CN=C1 Q53710 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.15 O=CC1=C(F)C=CN=C1 Q56666 [1,0,0,0,0,0|2,0,0]=3 160 B9R1.15 O=CC1=C(I)C=CC=C1 G-5775 [1,0,0,0,0,0|1,0,0]=2 161 B9R1.15 O=CC1=NC=CC=C1Br O31907 [1,0,0,0,0,0|2,0,0]=3 162 B9R1.15 O=CC1=NC=CC=C1Cl O31967 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.15 O=CC1=NC=CC=C1F Q66589 [1,0,0,0,0,0|2,0,0]=3 164 B9R1.15 O=CC1=NC=CC=C1O L22205 [1,0,0,0,0,0|1,0,0]=2 165 B9R1.15 OCC1=C(Br)C=CN=C1 N25303 [1,0,0,0,0,0|2,0,1]=4 166 B9R1.15 OCC1=C(Br)C=CN=C1 N25521 [1,0,0,0,0,0|2,0,1]=4 167 B9R1.15 OCC1=C(Br)C=CN=C1 N25828 [1,0,0,0,0,0|2,0,1]=4 168 B9R1.15 OCC1=C(Br)C=NC=C1 P41171 [1,0,0,0,0,0|2,0,1]=4 169 B9R1.15 OCC1=C(Cl)C=CN=C1 O31919 [1,0,0,0,0,0|2,0,1]=4 170 B9R1.15 OCC1=C(Cl)C=NC=C1 P36007 [1,0,0,0,0,0|2,0,1]=4 171 B9R1.15 OCC1=C(F)C=CN=C1 L14446 [1,0,0,0,0,0|2,0,1]=4 172 B9R1.15 OCC1=C(F)C=CN=C1 Q55508 [1,0,0,0,0,0|2,0,1]=4 173 B9R1.15 OCC1=C(F)C=NC=C1 G-5482 [1,0,0,0,0,0|2,0,1]=4 174 B9R1.15 OCC1=CC=CN=C1Br P41707 [1,0,0,0,0,0|2,0,1]=4 175 B9R1.15 OCC1=CC=CN=C1Cl C-3458 [1,0,0,0,0,0|2,0,1]=4 176 B9R1.15 OCC1=CC=CN=C1F Q67775 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.15 OCC1=NC=CC=C1F C-2822 [1,0,0,0,0,0|2,0,1]=4 178 B9R1.15 OCC1=NC=CC=C1O P41369 [1,0,0,0,0,0|1,0,1]=3 179 B11R1.53 C#CC1=CC=CC=C1B(O)O Q65557 [0,1,0,0,0,0|2,0,1]=4 180 B11R1.53 C#CC1=CC=CC=C1C(=O)O O28760 [0,1,0,0,0,0|1,0,0]=2 181 B11R1.53 C#CC1=CC=CC=C1C(C)=O O29479 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.53 C#CC1=CC=CC=C1C(N)=O O29403 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.53 C#CC1=CC=CC=C1[N+](=O)[O-] O27867 [0,1,0,0,0,0|2,0,1]=4 184 B11R1.53 CCC1=CN=CC=C1C(=O)O Q60755 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.53 COC1=C(B(O)O)C=CN=C1 Q68889 [0,1,0,0,0,0|2,0,1]=4 186 B11R1.53 COC1=C(C(C)=O)C=NC=C1 O33511 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.53 COC1=C(C(C)=O)N=CC=C1 Q62300 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.53 COC1=C([N+](=O)[O-])C=CN=C1 10606 [0,1,0,0,0,0|2,0,1]=4 189 B11R1.53 COC1=CC=CC=C1C(C)N P38299 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.53 COC1=CC=CC=C1C(N)=O P39422 [0,1,0,0,0,0|1,0,0]=2 191 B11R1.53 COC1=CC=CN=C1C(=O)O O31773 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.53 COC1=CC=NC=C1B(O)O Q53748 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.53 COC1=NC=CC=C1C(C)=O P41710 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.53 COC1=NC=CC=C1C(C)O P42615 [0,1,0,0,0,0|2,0,1]=4 195 B11R1.53 N#CC1=C(C(=O)O)C=CC=N1 Q60785 [0,1,0,0,0,0|2,0,0]=3 196 B11R1.53 N#CC1=CC=CC=C1B(O)O Q66418 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.53 N#CC1=CC=CN=C1C(=O)O G-7848 [0,1,0,0,0,0|2,0,0]=3 198 B11R1.53 N#CC1=CC=NC=C1C(=O)O G-7849 [0,1,0,0,0,0|2,0,0]=3 199 B11R1.53 N#CC1=CN=CC=C1C(=O)O Q60903 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.53 NCC1=CC=CC=C1B(O)O O34146 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.53 NCC1=CC=CC=C1C(=O)O O28742 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.53 NCC1=CC=CC=C1[N+](=O)[O-] P39381 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.53 O=C(O)C1=CC=CC=C1CO O34075 [0,1,0,0,0,0|0,0,0]=1 204 B11R1.53 O=CC1=C(C(=O)O)C=NC=C1 P44466 [0,1,0,0,0,0|1,0,1]=3 205 B11R1.53 O=CC1=C(C(=O)O)N=CC=C1 Q60211 [0,1,0,0,0,0|1,0,1]=3 206 B11R1.53 O=CC1=CN=CC=C1C(=O)O Q60210 [0,1,0,0,0,0|1,0,1]=3 207 B11R1.53 O=CC1=NC=CC=C1C(=O)O Q60213 [0,1,0,0,0,0|1,0,1]=3 208 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 D-2711 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.87 CC(C)(O)C1=CC=CC=C1I Q69151 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.87 CS(=O)(=O)C1=CC=CC=C1Br P51334 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.156 CC(=O)C1=C(Cl)C=NC=C1Cl Q68333 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.156 CC(=O)C1=C(I)C=CN=C1F N27716 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.156 CC1=C(C(=O)O)C(Br)=CN=C1 Q64763 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=C1 I-9230 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=N1 Q60700 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.156 CC1=C(C(=O)O)C(Cl)=NC=C1 Q52933 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.156 CC1=C(C(=O)O)C(F)=CN=C1 Q60648 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.156 CC1=C(C(=O)O)C(F)=NC=C1 N26390 [0,1,0,0,0,0|2,0,0]=3 219 B11R1.156 CC1=CN=CC(C)=C1C(=O)O Q60782 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.156 CC1=CN=CC(N)=C1C(=O)O Q63314 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.156 CC1=NC=CC(C)=C1C(=O)O G-7850 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.156 NC(=O)C1=C(Cl)C=NC=C1Cl O29200 [0,1,0,0,0,0|3,0,0]=4 223 B11R1.156 NC(=O)C1=C(F)C=CN=C1Cl Q62283 [0,1,0,0,0,0|3,0,0]=4 224 B11R1.156 NC1=C(C(=O)O)C(Cl)=NC=C1 L14459 [0,1,0,0,0,0|2,0,0]=3 225 B11R1.156 NC1=C([N+](=O)[O-])C(F)=CC=C1 E-3042 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.156 NC1=CC=CC(Br)=C1[N+](=O)[O-] E-3034 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.156 NC1=CC=CC(I)=C1C(=O)O O32252 [0,1,0,0,0,0|1,0,0]=2 228 B11R1.156 O=C(Cl)C1=C(Cl)C=CC=C1Br Q67512 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.156 O=C(Cl)C1=C(Cl)C=NC=C1Cl O29012 [0,1,0,0,0,0|3,0,0]=4 230 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br Q67183 [0,1,0,0,0,0|1,0,0]=2 231 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F C-3485 [0,1,0,0,0,0|1,0,0]=2 232 B11R1.156 O=C(O)C1=C(Br)C=CN=C1F O30907 [0,1,0,0,0,0|2,0,0]=3 233 B11R1.156 O=C(O)C1=C(Br)C=NC=C1Br Q66331 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.156 O=C(O)C1=C(Br)C=NC=C1F N24768 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O Q66580 [0,1,0,0,0,0|0,0,0]=1 236 B11R1.156 O=C(O)C1=C(Cl)C=CN=C1O Q60761 [0,1,0,0,0,0|1,0,0]=2 237 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1Br N27720 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1Cl Q67313 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1F Q57224 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1Br Q67320 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1F O30790 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1I P43249 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.156 O=C(O)C1=C(F)C=CN=C1Br O29983 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.156 O=C(O)C1=C(F)N=CC=C1I A-622 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.156 O=C(O)C1=C(I)C=NC=C1Br N26737 [0,1,0,0,0,0|2,0,0]=3 246 B11R1.156 O=[N+]([O-])C1=C(I)C=CC=C1F O30650 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.156 OB(O)C1=C(Br)C=CC=C1Br N24222 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Br Q66801 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.156 OB(O)C1=C(Cl)C=CC=C1O N25356 [0,1,0,0,0,0|1,0,1]=3 250 B11R1.156 OB(O)C1=C(I)C=CC=C1F Q66793 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.156 OB(O)C1=C(O)C=CC=C1F P51507 [0,1,0,0,0,0|1,0,1]=3 252 B11R1.156 OB(O)C1=C(O)C=CC=C1O O29455 [0,1,0,0,0,0|1,0,1]=3 253 B11R1.159 CC(=O)C1=C(F)C(Cl)=NC=C1 N26896 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 M23816 [0,1,0,0,0,0|1,0,0]=2 255 B11R1.159 CC(O)C1=CC=CC(Cl)=C1Cl P37496 [0,1,0,0,0,0|2,0,1]=4 256 B11R1.159 CC1=C(B(O)O)C=CC=C1F N24187 [0,1,0,0,0,0|2,0,1]=4 257 B11R1.159 CC1=C(B(O)O)C=CC=C1O N27745 [0,1,0,0,0,0|2,0,1]=4 258 B11R1.159 CC1=C(Br)C=CC=C1B(O)O Q67304 [0,1,0,0,0,0|2,0,1]=4 259 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O P49354 [0,1,0,0,0,0|2,0,0]=3 260 B11R1.159 CC1=C(C(=O)O)C=CN=C1F N26427 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.159 CC1=C(C(=O)O)C=NC=C1Br N25194 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.159 CC1=C(C(=O)O)C=NC=C1Cl Q60529 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.159 CC1=C(C(=O)O)C=NC=C1F Q60749 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.159 CC1=C(C(N)=O)C=CC=C1Br N24536 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.159 CC1=C(C(N)=O)C=NC=C1Br N25587 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.159 CC1=C(C)C(C(=O)O)=CC=N1 Q60787 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O Q66298 [0,1,0,0,0,0|2,0,1]=4 268 B11R1.159 CC1=C(F)C(B(O)O)=CC=C1 Q66499 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.159 CC1=C(F)C(C(=O)O)=CC=C1 Q67898 [0,1,0,0,0,0|1,0,0]=2 270 B11R1.159 CC1=C(N)C(C(N)=O)=CC=C1 O30695 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.159 CC1=C(O)C([N+](=O)[O-])=NC=C1 Q52552 [0,1,0,0,0,0|2,0,1]=4 272 B11R1.159 CC1=CC=CC(B(O)O)=C1O N24258 [0,1,0,0,0,0|1,0,1]=3 273 B11R1.159 CC1=NC=CC(C(=O)O)=C1N Q64766 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.159 CC1=NC=NC(C(=O)O)=C1C Q60491 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.159 CN1C=CC=C(C(=O)O)C1=O G-7544 [0,1,0,0,0,0|1,0,1]=3 276 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=NC=C1 N25264 [0,1,0,0,0,0|3,0,0]=4 277 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 O31275 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.159 NC(=O)C1=CC=CC(N)=C1N G-7463 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O L14675 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl O31474 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 P35150 [0,1,0,0,0,0|1,0,0]=2 282 B11R1.159 NC1=C(I)C=CC=C1C(=O)O O32276 [0,1,0,0,0,0|1,0,0]=2 283 B11R1.159 NC1=NC=CC(C(=O)O)=C1N Q58195 [0,1,0,0,0,0|2,0,0]=3 284 B11R1.159 O=C(O)C1=C(Br)C(Cl)=NC=C1 O29217 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CN=C1 N26393 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 Q66969 [0,1,0,0,0,0|2,0,0]=3 287 B11R1.159 O=C(O)C1=C(Cl)C(F)=CN=C1 N26255 [0,1,0,0,0,0|2,0,0]=3 288 B11R1.159 O=C(O)C1=C(Cl)C(F)=NC=C1 Q66538 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 E-3012 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 N24320 [0,1,0,0,0,0|1,0,0]=2 291 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O P51774 [0,1,0,0,0,0|0,0,0]=1 292 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O Q66616 [0,1,0,0,0,0|0,0,0]=1 293 B11R1.159 O=C(O)C1=CC=CC(I)=C1F Q67650 [0,1,0,0,0,0|1,0,0]=2 294 B11R1.159 O=C(O)C1=CC=NC(F)=C1F F-4045 [0,1,0,0,0,0|2,0,0]=3 295 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1Cl S72554 [0,1,0,0,0,0|2,0,0]=3 296 B11R1.159 O=C(O)C1=NC=NC(Cl)=C1F Q53531 [0,1,0,0,0,0|3,0,0]=4 297 B11R1.159 O=[N+]([O-])C1=C(Br)C(O)=CC=C1 O34477 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.159 O=[N+]([O-])C1=C(F)C(O)=CC=C1 H-8862 [0,1,0,0,0,0|2,0,1]=4 299 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1Br P40178 [0,1,0,0,0,0|2,0,1]=4 300 B11R1.159 O=[N+]([O-])C1=CC=NC(Cl)=C1O Q52336 [0,1,0,0,0,0|2,0,1]=4 301 B11R1.159 O=[N+]([O-])C1=CN=CC(Br)=C1O Q67697 [0,1,0,0,0,0|2,0,1]=4 302 B11R1.159 OB(O)C1=C(Br)C(F)=CC=C1 N26461 [0,1,0,0,0,0|2,0,1]=4 303 B11R1.159 OB(O)C1=C(F)C(O)=CC=C1 N25968 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.159 OB(O)C1=CC=CC(Br)=C1F Q66366 [0,1,0,0,0,0|2,0,1]=4 305 B11R1.159 OB(O)C1=CC=CC(Cl)=C1O Q66633 [0,1,0,0,0,0|1,0,1]=3 306 B11R1.159 OB(O)C1=CC=CC(F)=C1Cl G-7117 [0,1,0,0,0,0|2,0,1]=4 307 B11R1.159 OB(O)C1=CC=CC(F)=C1O Q66632 [0,1,0,0,0,0|1,0,1]=3 308 B11R1.159 OB(O)C1=CC=CC(I)=C1F Q66484 [0,1,0,0,0,0|2,0,1]=4 309 B11R1.166 CC(=O)C1=C(C)C=C(C)N=C1 O31353 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.166 CC(=O)C1=CC=C(C)C=C1Br P42929 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl O30258 [0,1,0,0,0,0|3,0,0]=4 312 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1N Q69764 [0,1,0,0,0,0|3,0,0]=4 313 B11R1.166 CC(=O)C1=CC=C(N)C=C1Cl O32522 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl Q62398 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C O31315 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.166 CC(=O)C1=NC=C(Br)C=C1Cl O31321 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1Br O30236 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1C O29675 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1F O30130 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.166 CC(=O)C1=NC=C(F)C=C1Br O31291 [0,1,0,0,0,0|3,0,0]=4 321 B11R1.166 CC(=O)C1=NC=C(F)C=C1Cl O29749 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.166 CC(=O)C1=NC=C(F)C=C1F O32686 [0,1,0,0,0,0|3,0,0]=4 323 B11R1.166 CC1=CC(=O)NC=C1C(=O)O Q57090 [0,1,0,0,0,0|2,0,0]=3 324 B11R1.166 CC1=CC(Br)=CC=C1B(O)O N25479 [0,1,0,0,0,0|2,0,1]=4 325 B11R1.166 CC1=CC(Br)=CN=C1C(=O)Cl N24228 [0,1,0,0,0,0|3,0,0]=4 326 B11R1.166 CC1=CC(Br)=CN=C1C(N)=O N25137 [0,1,0,0,0,0|3,0,0]=4 327 B11R1.166 CC1=CC(Br)=NC=C1C(=O)O N26124 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O N25656 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 C-3216 [0,1,0,0,0,0|2,0,1]=4 330 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 Q60789 [0,1,0,0,0,0|2,0,0]=3 331 B11R1.166 CC1=CC(F)=NC=C1C(=O)O Q67322 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.166 CC1=CC(O)=CC=C1B(O)O Q66536 [0,1,0,0,0,0|2,0,1]=4 333 B11R1.166 CC1=CC(O)=CN=C1C(=O)O Q60879 [0,1,0,0,0,0|2,0,0]=3 334 B11R1.166 CC1=CC=C(B(O)O)C(Br)=C1 N26773 [0,1,0,0,0,0|2,0,1]=4 335 B11R1.166 CC1=CC=C(B(O)O)C(O)=C1 G-5911 [0,1,0,0,0,0|1,0,1]=3 336 B11R1.166 CC1=CC=C(C(=O)O)C(N)=N1 L13612 [0,1,0,0,0,0|2,0,0]=3 337 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Br)=C1 Q67791 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.166 CC1=CN=C(C(=O)O)C(Br)=C1 O31836 [0,1,0,0,0,0|2,0,0]=3 339 B11R1.166 CC1=CN=C(C(=O)O)C(C)=C1 O31096 [0,1,0,0,0,0|2,0,0]=3 340 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 I-9719 [0,1,0,0,0,0|2,0,0]=3 341 B11R1.166 CC1=CN=C(C(=O)O)C(O)=N1 K12278 [0,1,0,0,0,0|2,0,0]=3 342 B11R1.166 CC1=CN=C(C(N)=O)C(N)=C1 O31639 [0,1,0,0,0,0|3,0,0]=4 343 B11R1.166 CC1=CN=C([N+](=O)[O-])C(O)=C1 M15040 [0,1,0,0,0,0|2,0,1]=4 344 B11R1.166 CC1=NC(Br)=C(C(=O)O)C=N1 H-8399 [0,1,0,0,0,0|3,0,0]=4 345 B11R1.166 CC1=NC(Br)=CC=C1C(=O)O N26103 [0,1,0,0,0,0|2,0,0]=3 346 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 P51309 [0,1,0,0,0,0|2,0,0]=3 347 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 Q60943 [0,1,0,0,0,0|2,0,0]=3 348 B11R1.166 CC1=NC(Cl)=CC=C1C(=O)O N25033 [0,1,0,0,0,0|2,0,0]=3 349 B11R1.166 CC1=NC(Cl)=NC=C1C(=O)O O30245 [0,1,0,0,0,0|3,0,0]=4 350 B11R1.166 CC1=NC(F)=C(C(=O)O)C=C1 N24616 [0,1,0,0,0,0|2,0,0]=3 351 B11R1.166 CC1=NC(F)=CC=C1C(=O)O Q67993 [0,1,0,0,0,0|2,0,0]=3 352 B11R1.166 CC1=NC(N)=NC=C1C(=O)O O30878 [0,1,0,0,0,0|3,0,0]=4 353 B11R1.166 CC1=NC(O)=C(B(O)O)C=C1 Q53802 [0,1,0,0,0,0|2,0,1]=4 354 B11R1.166 CC1=NC(O)=CC=C1C(=O)O Q52564 [0,1,0,0,0,0|2,0,0]=3 355 B11R1.166 CC1=NC=C(C(=O)O)C(C)=N1 O34423 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=C1 M15159 [0,1,0,0,0,0|2,0,0]=3 357 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 H-8401 [0,1,0,0,0,0|3,0,0]=4 358 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl O30415 [0,1,0,0,0,0|3,0,0]=4 359 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)N=C1 H-8999 [0,1,0,0,0,0|3,0,0]=4 360 B11R1.166 NC(=O)C1=C(F)C=C(Br)C=C1 N24181 [0,1,0,0,0,0|2,0,0]=3 361 B11R1.166 NC(=O)C1=C(N)C=C(Br)C=C1 F-4223 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.166 NC(=O)C1=C(N)N=C(Cl)C=C1 O32779 [0,1,0,0,0,0|3,0,0]=4 363 B11R1.166 NC(=O)C1=CC=C(Br)C=C1Cl Q68006 [0,1,0,0,0,0|2,0,0]=3 364 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1Br Q68008 [0,1,0,0,0,0|2,0,0]=3 365 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl Q67952 [0,1,0,0,0,0|3,0,0]=4 366 B11R1.166 NC(=O)C1=CC=C(O)C=C1F O30471 [0,1,0,0,0,0|2,0,0]=3 367 B11R1.166 NC(=O)C1=NC=C(Br)C=C1F O31169 [0,1,0,0,0,0|3,0,0]=4 368 B11R1.166 NC(=O)C1=NC=C(Br)C=C1N C-3698 [0,1,0,0,0,0|3,0,0]=4 369 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1F O30034 [0,1,0,0,0,0|3,0,0]=4 370 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O C-2276 [0,1,0,0,0,0|2,0,0]=3 371 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O G-6102 [0,1,0,0,0,0|2,0,0]=3 372 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O G-6103 [0,1,0,0,0,0|2,0,0]=3 373 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O I-9422 [0,1,0,0,0,0|2,0,0]=3 374 B11R1.166 NC1=CC(F)=C(C(=O)O)N=C1 Q55031 [0,1,0,0,0,0|2,0,0]=3 375 B11R1.166 NC1=CC(F)=CN=C1C(=O)O O33092 [0,1,0,0,0,0|2,0,0]=3 376 B11R1.166 NC1=CC(F)=NC=C1C(=O)O G-7587 [0,1,0,0,0,0|2,0,0]=3 377 B11R1.166 NC1=CC(I)=CC=C1C(=O)O O32287 [0,1,0,0,0,0|1,0,0]=2 378 B11R1.166 NC1=CC=C(C(=O)O)C(Br)=N1 Q64646 [0,1,0,0,0,0|2,0,0]=3 379 B11R1.166 NC1=NC(Cl)=CC=C1C(=O)O C-2357 [0,1,0,0,0,0|2,0,0]=3 380 B11R1.166 NC1=NC(O)=CC=C1C(=O)O L19692 [0,1,0,0,0,0|2,0,0]=3 381 B11R1.166 O=C(Cl)C1=CC=C(Cl)N=C1Cl Q67951 [0,1,0,0,0,0|3,0,0]=4 382 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 F-4417 [0,1,0,0,0,0|2,0,0]=3 383 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=N1 Q60904 [0,1,0,0,0,0|2,0,0]=3 384 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 G-6764 [0,1,0,0,0,0|2,0,0]=3 385 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=N1 Q60786 [0,1,0,0,0,0|1,0,0]=2 386 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Br P37092 [0,1,0,0,0,0|1,0,0]=2 387 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br Q51864 [0,1,0,0,0,0|2,0,0]=3 388 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Cl N26004 [0,1,0,0,0,0|2,0,0]=3 389 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1F O30248 [0,1,0,0,0,0|2,0,0]=3 390 B11R1.166 O=C(O)C1=CC=C(F)C=C1O M22934 [0,1,0,0,0,0|0,0,0]=1 391 B11R1.166 O=C(O)C1=CC=C(I)C=C1F P43484 [0,1,0,0,0,0|1,0,0]=2 392 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl Q66502 [0,1,0,0,0,0|1,0,0]=2 393 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl O32638 [0,1,0,0,0,0|2,0,0]=3 394 B11R1.166 O=C(O)C1=CN=C(Br)C=C1I Q52323 [0,1,0,0,0,0|2,0,0]=3 395 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1I N27822 [0,1,0,0,0,0|2,0,0]=3 396 B11R1.166 O=C(O)C1=CN=C(O)N=C1O G-7724 [0,1,0,0,0,0|2,0,0]=3 397 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl Q68112 [0,1,0,0,0,0|2,0,0]=3 398 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F G-7561 [0,1,0,0,0,0|2,0,0]=3 399 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br Q67790 [0,1,0,0,0,0|2,0,0]=3 400 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F O30677 [0,1,0,0,0,0|2,0,0]=3 401 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl I-9428 [0,1,0,0,0,0|3,0,0]=4 402 B11R1.166 O=C(O)C1=NC=C(F)C=C1Cl O31562 [0,1,0,0,0,0|2,0,0]=3 403 B11R1.166 O=C(O)C1=NC=C(O)C=C1F O29407 [0,1,0,0,0,0|2,0,0]=3 404 B11R1.166 O=[N+]([O-])C1=CC=C(O)C=C1Br P50972 [0,1,0,0,0,0|2,0,1]=4 405 B11R1.166 O=[N+]([O-])C1=CN=C(Cl)C=C1O O31048 [0,1,0,0,0,0|2,0,1]=4 406 B11R1.166 O=[N+]([O-])C1=NC=C(Br)C=C1O 10645 [0,1,0,0,0,0|2,0,1]=4 407 B11R1.166 OB(O)C1=C(Cl)C=C(Br)C=C1 N25136 [0,1,0,0,0,0|2,0,1]=4 408 B11R1.166 OB(O)C1=CC=C(Br)C=C1F N24200 [0,1,0,0,0,0|2,0,1]=4 409 B11R1.166 OB(O)C1=CC=C(Br)C=C1O N27788 [0,1,0,0,0,0|1,0,1]=3 410 B11R1.166 OB(O)C1=CC=C(Cl)C=C1Br N24488 [0,1,0,0,0,0|2,0,1]=4 411 B11R1.166 OB(O)C1=CC=C(Cl)C=C1O N25789 [0,1,0,0,0,0|1,0,1]=3 412 B11R1.166 OB(O)C1=CC=C(F)C=C1Br N25282 [0,1,0,0,0,0|2,0,1]=4 413 B11R1.166 OB(O)C1=CC=C(F)C=C1O N24631 [0,1,0,0,0,0|1,0,1]=3 414 B11R1.166 OB(O)C1=CC=C(O)C=C1Cl O30606 [0,1,0,0,0,0|2,0,1]=4 415 B11R1.166 OB(O)C1=CC=C(O)C=C1F N24632 [0,1,0,0,0,0|2,0,1]=4 416 B11R1.166 OC1=CC(F)=CC=C1C(F)F O32122 [0,1,0,0,0,0|2,0,1]=4 417 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=N1 Q54706 [0,1,0,0,0,0|3,0,0]=4 418 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F G-7719 [0,1,0,0,0,0|3,0,0]=4 419 B11R1.167 CC(=O)C1=CC(C)=CC=C1Br O29725 [0,1,0,0,0,0|2,0,0]=3 420 B11R1.167 CC(=O)C1=CC(C)=CN=C1F N26923 [0,1,0,0,0,0|3,0,0]=4 421 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1F P37541 [0,1,0,0,0,0|2,0,0]=3 422 B11R1.167 CC(=O)C1=CC(Cl)=NC=C1Br O31310 [0,1,0,0,0,0|3,0,0]=4 423 B11R1.167 CC(=O)C1=CC(O)=CC=C1C N26381 [0,1,0,0,0,0|2,0,0]=3 424 B11R1.167 CC(C)C1=CC(Br)=CC=C1O Q67880 [0,1,0,0,0,0|2,0,1]=4 425 B11R1.167 CC(O)C1=CC(Br)=CC=C1F Q66925 [0,1,0,0,0,0|2,0,1]=4 426 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 P43289 [0,1,0,0,0,0|2,0,0]=3 427 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 L18299 [0,1,0,0,0,0|2,0,0]=3 428 B11R1.167 CC1=C(C(=O)O)N=C(Cl)C=C1 P44204 [0,1,0,0,0,0|2,0,0]=3 429 B11R1.167 CC1=CC(C(=O)O)=C(C)C=N1 Q60931 [0,1,0,0,0,0|2,0,0]=3 430 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=N1 Q60684 [0,1,0,0,0,0|2,0,0]=3 431 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 Q60686 [0,1,0,0,0,0|2,0,0]=3 432 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 Q51924 [0,1,0,0,0,0|2,0,0]=3 433 B11R1.167 CC1=CC=C(Br)C(B(O)O)=C1 N26851 [0,1,0,0,0,0|2,0,1]=4 434 B11R1.167 CC1=CC=C(Br)C=C1B(O)O N25858 [0,1,0,0,0,0|2,0,1]=4 435 B11R1.167 CC1=CC=C(Cl)C(B(O)O)=C1 Q66271 [0,1,0,0,0,0|2,0,1]=4 436 B11R1.167 CC1=CC=C(F)C(C(=O)O)=N1 O30076 [0,1,0,0,0,0|2,0,0]=3 437 B11R1.167 CC1=CC=C(I)C=C1C(=O)O P43248 [0,1,0,0,0,0|1,0,0]=2 438 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 L22360 [0,1,0,0,0,0|2,0,0]=3 439 B11R1.167 CC1=CC=C(N)C=C1C(=O)O P43309 [0,1,0,0,0,0|1,0,0]=2 440 B11R1.167 CC1=CC=C(O)C(B(O)O)=C1 N24688 [0,1,0,0,0,0|1,0,1]=3 441 B11R1.167 CC1=CC=C(O)C=C1B(O)O N25272 [0,1,0,0,0,0|2,0,1]=4 442 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 N24563 [0,1,0,0,0,0|2,0,0]=3 443 B11R1.167 CC1=CN=C(Cl)N=C1C(=O)O Q53304 [0,1,0,0,0,0|3,0,0]=4 444 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 N25261 [0,1,0,0,0,0|2,0,0]=3 445 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 L18300 [0,1,0,0,0,0|2,0,0]=3 446 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 Q60885 [0,1,0,0,0,0|2,0,0]=3 447 B11R1.167 CC1=NC=C(Cl)C(C(=O)O)=N1 G-7847 [0,1,0,0,0,0|3,0,0]=4 448 B11R1.167 CC1=NC=C(N)C(C(=O)O)=C1 G-5635 [0,1,0,0,0,0|2,0,0]=3 449 B11R1.167 CC1=NC=C(N)C=C1C(=O)O Q58346 [0,1,0,0,0,0|2,0,0]=3 450 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 O30799 [0,1,0,0,0,0|3,0,0]=4 451 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 O30885 [0,1,0,0,0,0|2,0,1]=4 452 B11R1.167 NC(=O)C1=C(F)C=NC(Br)=C1 Q62405 [0,1,0,0,0,0|3,0,0]=4 453 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Br N26093 [0,1,0,0,0,0|3,0,0]=4 454 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl Q67299 [0,1,0,0,0,0|3,0,0]=4 455 B11R1.167 NC(=O)C1=CC(Br)=CN=C1F N24843 [0,1,0,0,0,0|3,0,0]=4 456 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1Cl N25426 [0,1,0,0,0,0|3,0,0]=4 457 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1N O31569 [0,1,0,0,0,0|3,0,0]=4 458 B11R1.167 NC(=O)C1=CC(F)=CC=C1Br P43107 [0,1,0,0,0,0|2,0,0]=3 459 B11R1.167 NC(=O)C1=NC(Br)=CC=C1F Q62404 [0,1,0,0,0,0|3,0,0]=4 460 B11R1.167 NC(=O)C1=NC(Br)=CN=C1O 10632 [0,1,0,0,0,0|3,0,0]=4 461 B11R1.167 NC(=O)C1=NC(F)=CN=C1O F-4501 [0,1,0,0,0,0|3,0,0]=4 462 B11R1.167 NC1=C(C(=O)O)C=C(Cl)N=C1 C-3440 [0,1,0,0,0,0|2,0,0]=3 463 B11R1.167 NC1=C(C(=O)O)C=C(F)N=C1 L22147 [0,1,0,0,0,0|2,0,0]=3 464 B11R1.167 NC1=CC(C(=O)O)=C(Cl)N=C1 G-6804 [0,1,0,0,0,0|2,0,0]=3 465 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O O34588 [0,1,0,0,0,0|2,0,0]=3 466 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O G-5404 [0,1,0,0,0,0|2,0,0]=3 467 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O O34386 [0,1,0,0,0,0|2,0,0]=3 468 B11R1.167 NC1=CC=C(F)C(B(O)O)=C1 N25572 [0,1,0,0,0,0|2,0,1]=4 469 B11R1.167 NC1=CN=C(Cl)N=C1C(=O)O P51239 [0,1,0,0,0,0|3,0,0]=4 470 B11R1.167 NC1=NC=C(Br)N=C1C(=O)O P37901 [0,1,0,0,0,0|3,0,0]=4 471 B11R1.167 NC1=NC=C(Cl)C(C(=O)O)=N1 M15563 [0,1,0,0,0,0|3,0,0]=4 472 B11R1.167 NC1=NC=C(F)C=C1C(=O)O L18306 [0,1,0,0,0,0|2,0,0]=3 473 B11R1.167 O=C(Cl)C1=CC(Br)=CC=C1F Q67078 [0,1,0,0,0,0|2,0,0]=3 474 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1Cl N25174 [0,1,0,0,0,0|3,0,0]=4 475 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1F N27324 [0,1,0,0,0,0|3,0,0]=4 476 B11R1.167 O=C(Cl)C1=CC(Cl)=NC=C1Cl N27773 [0,1,0,0,0,0|3,0,0]=4 477 B11R1.167 O=C(O)C1=C(Br)N=CC(Br)=C1 Q66324 [0,1,0,0,0,0|2,0,0]=3 478 B11R1.167 O=C(O)C1=C(Br)N=CC(Cl)=C1 Q67587 [0,1,0,0,0,0|2,0,0]=3 479 B11R1.167 O=C(O)C1=C(Cl)N=NC(Cl)=C1 C-3726 [0,1,0,0,0,0|3,0,0]=4 480 B11R1.167 O=C(O)C1=C(F)C=NC(Cl)=C1 Q67957 [0,1,0,0,0,0|2,0,0]=3 481 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl C-3392 [0,1,0,0,0,0|2,0,0]=3 482 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O C-3696 [0,1,0,0,0,0|1,0,0]=2 483 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br Q67187 [0,1,0,0,0,0|2,0,0]=3 484 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl L22357 [0,1,0,0,0,0|2,0,0]=3 485 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F K12095 [0,1,0,0,0,0|2,0,0]=3 486 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F E-3037 [0,1,0,0,0,0|2,0,0]=3 487 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl E-3057 [0,1,0,0,0,0|2,0,0]=3 488 B11R1.167 O=C(O)C1=CC(F)=CN=C1Br O31572 [0,1,0,0,0,0|2,0,0]=3 489 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl C-3699 [0,1,0,0,0,0|2,0,0]=3 490 B11R1.167 O=C(O)C1=CC(F)=CN=C1F Q62473 [0,1,0,0,0,0|2,0,0]=3 491 B11R1.167 O=C(O)C1=CC(F)=NC=C1Br N26408 [0,1,0,0,0,0|2,0,0]=3 492 B11R1.167 O=C(O)C1=CC(F)=NC=C1F H-8387 [0,1,0,0,0,0|2,0,0]=3 493 B11R1.167 O=C(O)C1=NC(Br)=CN=C1Br Q52652 [0,1,0,0,0,0|3,0,0]=4 494 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br G-7754 [0,1,0,0,0,0|2,0,0]=3 495 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F P44595 [0,1,0,0,0,0|2,0,0]=3 496 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Br L21544 [0,1,0,0,0,0|3,0,0]=4 497 B11R1.167 O=C(O)C1=NC(O)=CC=C1Cl Q60687 [0,1,0,0,0,0|2,0,0]=3 498 B11R1.167 O=[N+]([O-])C1=C(O)C=CC(Cl)=N1 F-4775 [0,1,0,0,0,0|2,0,1]=4 499 B11R1.167 O=[N+]([O-])C1=C(S)C=CC(Br)=C1 H-8777 [0,1,0,0,0,0|1,1,1]=4 500 B11R1.167 O=[N+]([O-])C1=NC(Br)=CC=C1O 10614 [0,1,0,0,0,0|2,0,1]=4 501 B11R1.167 OB(O)C1=CC(Br)=CC=C1Br Q66796 [0,1,0,0,0,0|2,0,1]=4 502 B11R1.167 OB(O)C1=CC(Br)=CC=C1O N24388 [0,1,0,0,0,0|1,0,1]=3 503 B11R1.167 OB(O)C1=CC(Cl)=CC=C1Br N24945 [0,1,0,0,0,0|2,0,1]=4 504 B11R1.167 OB(O)C1=CC(Cl)=CC=C1O Q66631 [0,1,0,0,0,0|1,0,1]=3 505 B11R1.167 OB(O)C1=CC(F)=CC=C1Br Q66800 [0,1,0,0,0,0|2,0,1]=4 506 B11R1.167 OB(O)C1=CC(F)=CC=C1O Q66483 [0,1,0,0,0,0|1,0,1]=3 507 B11R1.167 OB(O)C1=CC(F)=NC=C1O N27253 [0,1,0,0,0,0|2,0,1]=4 508 B11R1.167 OB(O)C1=CC(I)=CC=C1Br N24772 [0,1,0,0,0,0|2,0,1]=4 509 B11R1.167 OB(O)C1=CC(O)=CC=C1Br Q67431 [0,1,0,0,0,0|2,0,1]=4 510 B11R1.167 OB(O)C1=CC(O)=CC=C1F N24783 [0,1,0,0,0,0|2,0,1]=4 511 B11R1.167 OC1=CC=C(F)C=C1C(F)F O29287 [0,1,0,0,0,0|2,0,1]=4 512 B11R1.222 C#CC(=O)C1=CC=CC=C1Cl M23022 [0,1,0,0,0,0|2,0,0]=3 513 B11R1.222 C#CC(O)C1=CC=CC=C1Cl P40184 [0,1,0,0,0,0|2,0,1]=4 514 B11R1.222 CC1=CC=CC=C1C(=O)CBr O28087 [0,1,0,0,0,0|2,0,0]=3 515 B11R1.222 CC1=CC=CC=C1C(N)CO P42682 [0,1,0,0,0,0|2,0,1]=4 516 B11R1.222 CC1=CC=CC=C1C(O)CN P41633 [0,1,0,0,0,0|2,0,1]=4 517 B11R1.222 CC1=CC=CN=C1C(=O)CCl O30165 [0,1,0,0,0,0|3,0,0]=4 518 B11R1.222 CNC(=O)C1=CC=CC=C1Br P37075 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.222 CNC(=O)C1=CC=CC=C1C O32523 [0,1,0,0,0,0|2,0,0]=3 520 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 N25636 [0,1,0,0,0,0|2,0,0]=3 521 B11R1.222 COC(=O)C1=C(Br)N=CN=C1 H-8377 [0,1,0,0,0,0|3,0,0]=4 522 B11R1.222 COC(=O)C1=C(C)C=NC=C1 G-7865 [0,1,0,0,0,0|2,0,0]=3 523 B11R1.222 COC(=O)C1=C(C)C=NN=C1 G-7306 [0,1,0,0,0,0|3,0,0]=4 524 B11R1.222 COC(=O)C1=C(C)N=CC=C1 I-9174 [0,1,0,0,0,0|2,0,0]=3 525 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 N25043 [0,1,0,0,0,0|2,0,0]=3 526 B11R1.222 COC(=O)C1=C(F)C=NC=C1 G-7746 [0,1,0,0,0,0|2,0,0]=3 527 B11R1.222 COC(=O)C1=C(F)N=CC=C1 Q66492 [0,1,0,0,0,0|2,0,0]=3 528 B11R1.222 COC(=O)C1=C(I)C=NC=C1 G-6795 [0,1,0,0,0,0|2,0,0]=3 529 B11R1.222 COC(=O)C1=C(N)C=NC=N1 Q65333 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.222 COC(=O)C1=C(O)C=NC=C1 O30771 [0,1,0,0,0,0|1,0,0]=2 531 B11R1.222 COC(=O)C1=CC=CN=C1Br Q67675 [0,1,0,0,0,0|2,0,0]=3 532 B11R1.222 COC(=O)C1=CC=CN=C1I O30553 [0,1,0,0,0,0|2,0,0]=3 533 B11R1.222 COC(=O)C1=CC=NC=C1N C-3596 [0,1,0,0,0,0|2,0,0]=3 534 B11R1.222 COC(=O)C1=CC=NNC1=O L14296 [0,1,0,0,0,0|2,0,1]=4 535 B11R1.222 COC(=O)C1=CN=CN=C1Cl H-8381 [0,1,0,0,0,0|3,0,0]=4 536 B11R1.222 COC(=O)C1=NC=CC=C1Cl Q68224 [0,1,0,0,0,0|2,0,0]=3 537 B11R1.222 COC(=O)C1=NC=CC=C1F Q68214 [0,1,0,0,0,0|2,0,0]=3 538 B11R1.222 COC(=O)C1=NC=CN=C1Br Q51827 [0,1,0,0,0,0|3,0,0]=4 539 B11R1.222 COC(=O)C1=NC=CN=C1Cl C-3373 [0,1,0,0,0,0|3,0,0]=4 540 B11R1.222 COC(=O)C1=NC=CN=C1F L18388 [0,1,0,0,0,0|3,0,0]=4 541 B11R1.222 NC(CO)C1=CC=CC=C1Br P42427 [0,1,0,0,0,0|2,0,1]=4 542 B11R1.222 NC(CO)C1=CC=CC=C1Cl P41841 [0,1,0,0,0,0|2,0,1]=4 543 B11R1.222 NC(CO)C1=CC=CC=C1F P40408 [0,1,0,0,0,0|2,0,1]=4 544 B11R1.222 NCC(=O)C1=CC=CC=C1Br P35565 [0,1,0,0,0,0|2,0,0]=3 545 B11R1.222 NCC(=O)C1=CC=CC=C1Cl P40753 [0,1,0,0,0,0|2,0,0]=3 546 B11R1.222 NCC(=O)C1=CC=CC=C1O P37785 [0,1,0,0,0,0|1,0,0]=2 547 B11R1.222 NCC(O)C1=CC=CC=C1Br P36482 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.222 NCC(O)C1=CC=CC=C1Cl P39491 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.222 NCC(O)C1=CC=CC=C1F P38828 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.222 NNC(=O)C1=CC=CN=C1N O30046 [0,1,0,0,0,0|3,0,0]=4 551 B11R1.222 N[C@@H](CO)C1=CC=CC=C1Cl P42273 [0,1,0,0,0,0|2,0,1]=4 552 B11R1.222 N[C@H](CO)C1=CC=CC=C1Cl P39761 [0,1,0,0,0,0|2,0,1]=4 553 B11R1.222 O=C(CBr)C1=CC=CC=C1Br P37875 [0,1,0,0,0,0|2,0,0]=3 554 B11R1.222 O=C(CCl)C1=NC=CC=C1F O32003 [0,1,0,0,0,0|3,0,0]=4 555 B11R1.222 O=C(CF)C1=CC=CC=C1F P51651 [0,1,0,0,0,0|2,0,0]=3 556 B11R2.1 BrC1=COC2=CC=CC=C12 O30635 [0,0,0,1,0,0|2,0,0]=3 557 B11R2.1 BrC1=NNC2=CC=CC=C21 C-2069 [0,0,0,1,0,0|3,0,0]=4 558 B11R2.1 CC1=CNC2=C1C=CC=C2 I-9262 [0,0,0,1,0,0|3,0,0]=4 559 B11R2.1 CC1=NNC2=C1C=CC=C2 C-2144 [0,0,0,1,0,0|3,0,0]=4 560 B11R2.1 CC1=NOC2=CC=CC=C21 O30125 [0,0,0,1,0,0|2,0,0]=3 561 B11R2.1 ClC1=CNC2=C1C=CC=C2 L14683 [0,0,0,1,0,0|3,0,0]=4 562 B11R2.1 IC1=NNC2=C1C=CC=C2 Q67919 [0,0,0,1,0,0|3,0,0]=4 563 B11R2.1 NC1=CNC2=C1C=CC=C2 O32345 [0,0,0,1,0,0|3,0,0]=4 564 B11R2.1 NC1=CNC2=C1C=CC=C2 O32346 [0,0,0,1,0,0|3,0,0]=4 565 B11R2.1 NC1=CSC2=CC=CC=C12 O29978 [0,0,0,1,0,0|2,1,0]=4 566 B11R2.1 NC1=NNC2=C1C=CC=C2 P35582 [0,0,0,1,0,0|3,0,0]=4 567 B11R2.1 NC1=NOC2=C1C=CN=C2 K10867 [0,0,0,1,0,0|3,0,0]=4 568 B11R2.1 NC1=NOC2=C1C=NC=C2 K10866 [0,0,0,1,0,0|3,0,0]=4 569 B11R2.1 NC1=NOC2=CC=CN=C21 K10865 [0,0,0,1,0,0|3,0,0]=4 570 B11R2.1 O=C1CCC2=C1C=CN=C2 L22316 [0,0,0,1,0,0|3,0,0]=4 571 B11R2.1 O=C1CCC2=NC=CC=C12 G-6870 [0,0,0,1,0,0|3,0,0]=4 572 B11R2.1 O=C1NCC2=C1C=CC=C2 I-9101 [0,0,0,1,0,0|2,0,0]=3 573 B11R2.1 O=C1NCC2=CC=NC=C12 C-2838 [0,0,0,1,0,0|3,0,0]=4 574 B11R2.1 O=C1SNC2=CC=CC=C12 L18705 [0,0,0,1,0,0|1,1,0]=3 575 B11R2.1 OC1=CNC2=CC=CC=C12 Q52523 [0,0,0,1,0,0|2,0,0]=3 576 B11R2.55 BrC1=CC=CC=C1C2CO2 P36453 [0,0,0,1,0,0|2,0,1]=4 577 B11R2.55 ClC1=CC=CC=C1C2CO2 P36976 [0,0,0,1,0,0|2,0,1]=4 578 B11R2.55 FC1=CC=CC=C1C2CO2 Q66192 [0,0,0,1,0,0|2,0,1]=4 579 B9R1.41 CC(=O)C1=C(Br)C=CS1 Q65588 [0,0,0,0,1,0|3,0,0]=4 580 B9R1.41 CC1=C(C(=O)O)N=CO1 O31842 [0,0,0,0,1,0|3,0,0]=4 581 B9R1.41 CC1=C(C(=O)O)N=CS1 10657 [0,0,0,0,1,0|3,0,0]=4 582 B9R1.41 CC1=C(C(=O)O)NC=N1 L20560 [0,0,0,0,1,0|3,0,0]=4 583 B9R1.41 CC1=CSC=C1C(=O)O L22411 [0,0,0,0,1,0|2,0,0]=3 584 B9R1.41 CN1C=NC=C1C(=O)O G-7569 [0,0,0,0,1,0|3,0,0]=4 585 B9R1.41 CN1N=CC=C1C(=O)O G-5544 [0,0,0,0,1,0|3,0,0]=4 586 B9R1.41 NC(=O)C1=CC=CN1N L13700 [0,0,0,0,1,0|3,0,0]=4 587 B9R1.41 NC1=C(C(=O)O)C=CS1 P44611 [0,0,0,0,1,0|2,0,0]=3 588 B9R1.41 NC1=C(C(=O)O)C=NN1 A-808 [0,0,0,0,1,0|3,0,0]=4 589 B9R1.41 O=C(O)C1=C(Br)C=CS1 G-6768 [0,0,0,0,1,0|2,0,0]=3 590 B9R1.41 O=C(O)C1=C(Br)N=CN1 H-8119 [0,0,0,0,1,0|3,0,0]=4 591 B9R1.41 O=C(O)C1=C(Br)N=CS1 Q68781 [0,0,0,0,1,0|3,0,0]=4 592 B9R1.41 O=C(O)C1=C(Br)SC=N1 O34437 [0,0,0,0,1,0|3,0,0]=4 593 B9R1.41 O=C(O)C1=C(Cl)C=CN1 H-8302 [0,0,0,0,1,0|2,0,0]=3 594 B9R1.41 O=C(O)C1=CNN=C1Br Q61498 [0,0,0,0,1,0|3,0,0]=4 595 B9R1.41 O=C(O)C1=CNNC1=O F-4837 [0,0,0,0,1,0|2,0,1]=4 596 B9R1.41 O=C(O)C1=CSC=C1Br G-7938 [0,0,0,0,1,0|2,0,0]=3 597 B9R1.41 O=C(O)C1=NNC=C1F Q64164 [0,0,0,0,1,0|3,0,0]=4 598 B11R1.86 CC(=O)CC1=NC=CC=C1Br Q58439 [0,0,0,0,0,1|3,0,0]=4 599 B11R1.86 CC(=O)CC1=NC=CC=C1Cl Q58438 [0,0,0,0,0,1|3,0,0]=4 600 B11R1.86 CC(=O)OC1=CC=CC=C1Br P40333 [0,0,0,0,0,1|2,0,0]=3 601 B11R1.86 CC(N)CC1=C(O)C=CC=C1 L19732 [0,0,0,0,0,1|2,0,1]=4 602 B11R1.86 CC1=C(CC(=O)O)C=CC=N1 H-8205 [0,0,0,0,0,1|2,0,0]=3 603 B11R1.86 CC1=CC=NC=C1CC(=O)O Q60617 [0,0,0,0,0,1|2,0,0]=3 604 B11R1.86 FC1=CC=CC=C1C=C(Br)Br P43279 [0,0,0,0,0,1|3,0,0]=4 605 B11R1.86 NC1=CC=CC=C1CC(=O)O P38750 [0,0,0,0,0,1|1,0,0]=2 606 B11R1.86 O=C(O)CC1=C(Cl)C=CC=N1 Q60647 [0,0,0,0,0,1|2,0,0]=3 607 B11R1.86 O=C(O)CC1=CC=CN=C1Cl G-5570 [0,0,0,0,0,1|2,0,0]=3 608 B11R1.86 O=C(O)CC1=CC=NC=C1Cl Q60592 [0,0,0,0,0,1|2,0,0]=3 609 B11R1.86 O=C(O)CC1=NC=CC=C1Br I-9578 [0,0,0,0,0,1|2,0,0]=3 610 B11R1.86 O=C(O)CC1=NC=CC=C1O F-4648 [0,0,0,0,0,1|1,0,0]=2 611 B11R1.86 OB(O)CC1=C(Cl)C=CC=C1 L20522 [0,0,0,0,0,1|2,0,1]=4 612 B11R1.86 OC1=CC=CC=C1OC(F)F M15813 [0,0,0,0,0,1|2,0,1]=4 613 B8R1.2 C(=O)C1=CC=NN=C1 C-2212 [2,0,0,0,0,0|2,0,0]=4 614 B8R1.2 C(=O)C1=CN=CC=N1 C-2218 [2,0,0,0,0,0|2,0,0]=4 615 B8R1.2 C(=O)C1=CN=CN=C1 A-903 [2,0,0,0,0,0|2,0,0]=4 616 B8R1.2 C(=O)C1=NC=CC=N1 C-2221 [2,0,0,0,0,0|2,0,0]=4 617 B8R1.2 C(=O)C1=NN=CC=C1 C-2223 [2,0,0,0,0,0|2,0,0]=4 618 B8R1.2 C=CC1=CC=CN=C1 O30687 [2,0,0,0,0,0|2,0,0]=4 619 B8R1.2 ICC1=CC=CC=C1 P37031 [2,0,0,0,0,0|1,0,1]=4 620 B8R1.5 CC1=C(O)C=CN=C1 E-3032 [2,0,0,0,0,0|1,0,1]=4 621 B8R1.5 CC1=CC=NC=C1O E-3031 [2,0,0,0,0,0|1,0,1]=4 622 B8R1.5 CC1=NC=CC=C1O G-6807 [2,0,0,0,0,0|1,0,1]=4 623 B8R1.5 NC1=C(O)C=NC=C1 O30556 [2,0,0,0,0,0|2,0,0]=4 624 B8R1.5 NC1=C(O)C=NC=C1 O31762 [2,0,0,0,0,0|2,0,0]=4 625 B8R1.5 NC1=CC=CN=C1O C-3656 [2,0,0,0,0,0|2,0,0]=4 626 B8R1.5 O=C1C=COC=C1O L14061 [2,0,0,0,0,0|1,0,0]=3 627 B8R1.5 O=C1OC=CC=C1O M15566 [2,0,0,0,0,0|1,0,0]=3 628 B8R1.5 OC1=C(Br)C=CN=C1 N24655 [2,0,0,0,0,0|2,0,0]=4 629 B8R1.5 OC1=C(Cl)C=CN=C1 N24314 [2,0,0,0,0,0|2,0,0]=4 630 B8R1.5 OC1=C(Cl)C=NC=C1 Q67665 [2,0,0,0,0,0|2,0,0]=4 631 B8R1.5 OC1=C(F)C=NC=C1 N24410 [2,0,0,0,0,0|2,0,0]=4 632 B8R1.5 OC1=C(I)C=CN=C1 N27325 [2,0,0,0,0,0|2,0,0]=4 633 B8R1.5 OC1=C(I)C=CN=C1 Q70033 [2,0,0,0,0,0|2,0,0]=4 634 B8R1.5 OC1=CC=CN=C1Br Q70032 [2,0,0,0,0,0|2,0,0]=4 635 B8R1.5 OC1=CC=CN=C1Cl I-9157 [2,0,0,0,0,0|2,0,0]=4 636 B8R1.5 OC1=CC=NC=C1I H-8691 [2,0,0,0,0,0|2,0,0]=4 637 B8R1.5 OC1=CC=NC=C1O 10601 [2,0,0,0,0,0|1,0,0]=3 638 B8R1.5 OC1=CN=CC=C1Br H-8866 [2,0,0,0,0,0|2,0,0]=4 639 B8R1.5 ON1C=CC=CC1=S Q62443 [2,0,0,0,0,0|1,1,0]=4 640 B10R1.13 CC(=O)C1=CC=C(F)N=C1 P35858 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 Q67245 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.13 CC(=O)C1=CN=C(N)C=C1 Q55451 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 O30755 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 P34872 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.13 CC(=O)C1=NC=C(F)C=C1 O30491 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.13 CC(O)C1=CC=C(N)C=C1 P41199 [1,1,0,0,0,0|1,0,1]=4 649 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [1,1,0,0,0,0|1,0,1]=4 650 B10R1.13 CC1=CN=C(C(=O)O)C=N1 G-7280 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.13 CC1=CN=C(C(=O)O)N=C1 G-6321 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.13 CC1=NC=C(C(=O)O)C=N1 P44549 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.13 NC(=O)C1=CC=C(Br)N=C1 P35365 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.13 NC(=O)C1=CC=C(F)N=C1 Q58490 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 O30890 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 N24759 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.13 NC(=O)C1=NC=C(N)C=C1 O30308 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.13 NC(=O)C1=NC=C(O)C=C1 P44353 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.13 NC1=CC=C(B(O)O)C=C1 Q66344 [1,1,0,0,0,0|1,0,1]=4 660 B10R1.13 NC1=CN=C(C(=O)O)C=C1 E-3036 [1,1,0,0,0,0|1,0,0]=3 661 B10R1.13 NC1=CN=C(C(=O)O)C=N1 10608 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.13 NC1=CN=C(C(=O)O)N=C1 O33536 [1,1,0,0,0,0|2,0,0]=4 663 B10R1.13 NC1=NC=C(C(=O)O)C=C1 C-3709 [1,1,0,0,0,0|1,0,0]=3 664 B10R1.13 NC1=NN=C(C(=O)O)C=C1 G-5218 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.13 O=C(Cl)C1=NC=C(Cl)C=C1 N25108 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.13 O=C(O)C1=CC=C(F)N=C1 E-3040 [1,1,0,0,0,0|1,0,0]=3 667 B10R1.13 O=C(O)C1=CC=C(O)N=N1 C-2295 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.13 O=C(O)C1=CN=C(Br)N=C1 Q64836 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 G-5309 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.13 O=C(O)C1=CN=C(O)N=C1 O31007 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 G-6770 [1,1,0,0,0,0|1,0,0]=3 672 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 Q52548 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 G-7253 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 B-1219 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.13 O=C(O)C1=NC=C(F)C=C1 P42746 [1,1,0,0,0,0|1,0,0]=3 676 B10R1.13 O=C(O)C1=NC=C(F)C=N1 H-8066 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.13 O=C(O)C1=NC=C(O)C=C1 G-6588 [1,1,0,0,0,0|1,0,0]=3 678 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 L14250 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 B-1753 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.13 OB(O)C1=CC=C(S)C=C1 P39473 [1,1,0,0,0,0|1,0,1]=4 681 B10R1.15 C#CC(=O)C1=CC=CC=C1 P38531 [1,1,0,0,0,0|1,0,0]=3 682 B10R1.15 C=CC(=O)C1=CC=CC=N1 Q52779 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.15 C=CC(=O)C1=CC=CN=C1 Q52778 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.15 C=CC(=O)C1=CC=NC=C1 Q52777 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.15 CCC(=O)C1=CC=CN=C1 P40926 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.15 CCC(=O)C1=CC=NC=C1 P40626 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.15 CCC(=O)C1=NC=CC=C1 P38825 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 P40939 [1,1,0,0,0,0|1,0,1]=4 689 B10R1.15 COC(=O)C1=CC=CN=N1 C-2267 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.15 COC(=O)C1=CC=NC=N1 C-2227 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.15 COC(=O)C1=CN=CN=C1 G-7535 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.15 COC(=O)C1=NC=CC=N1 C-3283 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.15 N=C(NN)C1=CC=CC=C1 O30004 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 P43243 [1,1,0,0,0,0|1,0,1]=4 695 B10R1.15 NC[C@H](O)C1=CC=CC=C1 P43317 [1,1,0,0,0,0|1,0,1]=4 696 B10R1.15 O=C(CBr)C1=CC=CC=N1 Q58258 [1,1,0,0,0,0|2,0,0]=4 697 B10R1.15 O=C(CBr)C1=CC=CN=C1 Q55443 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.15 O=C(CCl)C1=CC=CN=C1 O29841 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.28 NP(N)(=O)C1=CC=CC=C1 L19832 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 M15399 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.113 C=C(C)C1=CC(C)=CC=C1 P42602 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Q62345 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 O32374 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C-3316 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.113 CC(=O)C1=CC(F)=CN=C1 P43295 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.113 CC(=O)C1=NC=CC(C)=C1 P37184 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 P37163 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.113 CC1=CC(C(=O)O)=CN=N1 P49779 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.113 CC1=CC(C(=O)O)=NN=C1 L14505 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.113 CC1=CN=CC(C(=O)O)=C1 I-9162 [1,1,0,0,0,0|1,0,0]=3 711 B10R1.113 CC1=CN=CC(C(=O)O)=N1 G-6898 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.113 CC1=NC(C(=O)O)=NC=C1 L14301 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.113 CC1=NC=NC(C(=O)O)=C1 I-9646 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 P51219 [1,1,0,0,0,0|1,0,0]=3 715 B10R1.113 NC(=O)C1=CC(Cl)=CN=C1 O29660 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.113 NC(=O)C1=CC(F)=CN=C1 P36523 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 P37042 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 O30750 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 G-7501 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.113 NC1=NC=CC(C(=O)O)=C1 G-6760 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.113 NC1=NC=CC(C(=O)O)=N1 O31660 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 Q66304 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 O30825 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 Q68020 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 G-6966 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 G-7305 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.113 O=C(O)C1=CC(F)=CN=C1 C-3613 [1,1,0,0,0,0|1,0,0]=3 728 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 L13496 [1,1,0,0,0,0|1,0,0]=3 729 B10R1.113 O=C(O)C1=CC=CC(S)=N1 Q58206 [1,1,0,0,0,0|1,0,0]=3 730 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 G-6839 [1,1,0,0,0,0|1,0,0]=3 731 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 C-2323 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.113 O=C(O)C1=CN=CC(O)=C1 G-7172 [1,1,0,0,0,0|1,0,0]=3 733 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 O30875 [1,1,0,0,0,0|2,0,0]=4 734 B10R1.113 O=C(O)C1=NC(O)=NC=C1 O30222 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B-1209 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.113 O=C(O)C1=NC=CC(F)=C1 O30336 [1,1,0,0,0,0|1,0,0]=3 737 B10R1.113 O=C(O)C1=NC=CC(I)=C1 G-6705 [1,1,0,0,0,0|1,0,0]=3 738 B10R1.113 O=C1C=C(C(=O)O)NC=N1 Q57219 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.113 OB(O)C1=CC=CC(I)=C1 Q66503 [1,1,0,0,0,0|1,0,1]=4 740 B10R1.2 CC1=C(Br)C=CC=C1C=O N24620 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.2 CC1=C(Br)C=CC=C1CO P35887 [1,1,0,0,0,0|1,0,1]=4 742 B10R1.2 CC1=C(Br)C=NC=C1C=O N25722 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.2 CC1=C(C)C(C=O)=CN=C1 Q60295 [1,1,0,0,0,0|2,0,0]=4 744 B10R1.2 CC1=C(C=O)C=CC=C1O N24855 [1,1,0,0,0,0|1,0,0]=3 745 B10R1.2 CC1=C(C=O)C=CN=C1F N27705 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.2 CC1=C(CO)C=CC=C1Cl N24882 [1,1,0,0,0,0|1,0,1]=4 747 B10R1.2 CC1=C(Cl)C(C=O)=CC=N1 Q60345 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.2 CC1=C(Cl)C=CC=C1C=O Q67349 [1,1,0,0,0,0|1,0,0]=3 749 B10R1.2 CC1=C(F)C(CO)=CC=C1 Q67892 [1,1,0,0,0,0|1,0,1]=4 750 B10R1.2 CC1=C(I)C=CC=C1C=O N27701 [1,1,0,0,0,0|1,0,0]=3 751 B10R1.2 CC1=C(O)C(CO)=CC=C1 P39563 [1,1,0,0,0,0|0,0,1]=3 752 B10R1.2 CC1=NC=CC(C=O)=C1C O29443 [1,1,0,0,0,0|2,0,0]=4 753 B10R1.2 CN1C(=O)C=CC=C1C=O Q60456 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.2 COC1=C(O)C(Br)=CC=C1 G-5963 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.2 COC1=C(O)C(F)=CC=C1 Q66672 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.2 COC1=C(O)C(F)=CC=C1 Q67743 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.2 CSC1=CC=CC(F)=C1O N27023 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.2 N#CC1=CC=CC(Br)=C1O G-5739 [1,1,0,0,0,0|1,0,1]=4 759 B10R1.2 NC1=C(Br)C=CC=C1C=O M15514 [1,1,0,0,0,0|1,0,0]=3 760 B10R1.2 NC1=C(Br)C=CC=C1CO O32343 [1,1,0,0,0,0|1,0,1]=4 761 B10R1.2 NCC1=C(O)C(O)=CC=C1 P36464 [1,1,0,0,0,0|1,0,1]=4 762 B10R1.2 O=CC1=C(Br)C(Br)=CC=C1 N25236 [1,1,0,0,0,0|1,0,0]=3 763 B10R1.2 O=CC1=C(Br)C(Cl)=NC=C1 Q67645 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.2 O=CC1=C(Cl)C(Br)=NC=C1 Q67220 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.2 O=CC1=C(Cl)C(Cl)=CN=C1 L14672 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.2 O=CC1=C(Cl)C(Cl)=NC=C1 N24622 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.2 O=CC1=C(Cl)C(F)=NC=C1 Q67582 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.2 O=CC1=C(F)C(Br)=NC=C1 O31823 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.2 O=CC1=C(F)C(Cl)=NC=C1 Q67221 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.2 O=CC1=CC=CC(Cl)=C1O Q67707 [1,1,0,0,0,0|0,0,0]=2 771 B10R1.2 O=CC1=CC=CC(I)=C1F Q67649 [1,1,0,0,0,0|1,0,0]=3 772 B10R1.2 O=CC1=CC=CC(I)=C1O O30480 [1,1,0,0,0,0|0,0,0]=2 773 B10R1.2 O=CC1=CC=CC(O)=C1Br Q66620 [1,1,0,0,0,0|1,0,0]=3 774 B10R1.2 O=CC1=CC=CC(O)=C1F Q66733 [1,1,0,0,0,0|1,0,0]=3 775 B10R1.2 O=CC1=CN=CC(Br)=C1Cl N25909 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.2 O=CC1=CN=CC(Br)=C1Cl N26075 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.2 O=CC1=CN=CC(F)=C1Cl N25846 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.2 O=CC1=CN=CC(F)=C1Cl N27377 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.2 OCC1=C(Br)C(F)=CC=C1 N25113 [1,1,0,0,0,0|1,0,1]=4 780 B10R1.2 OCC1=CC=CC(Cl)=C1Br P42134 [1,1,0,0,0,0|1,0,1]=4 781 B10R1.2 OCC1=CC=CC(Cl)=C1Cl Q68410 [1,1,0,0,0,0|1,0,1]=4 782 B10R1.2 OCC1=CC=CC(Cl)=C1F Q68242 [1,1,0,0,0,0|1,0,1]=4 783 B10R1.2 OCC1=CC=CC(Cl)=C1O N27736 [1,1,0,0,0,0|0,0,1]=3 784 B10R1.2 OCC1=CC=CC(F)=C1I O31062 [1,1,0,0,0,0|1,0,1]=4 785 B10R1.2 OCC1=CC=CC(I)=C1F N26895 [1,1,0,0,0,0|1,0,1]=4 786 B10R1.4 COCC1=CC=CC=C1Br Q67462 [1,1,0,0,0,0|1,0,1]=4 787 B10R1.4 NCCC1=CC=CC=C1O M22991 [1,1,0,0,0,0|1,0,1]=4 788 B10R1.4 OC1=CC=CC=C1CCBr P37343 [1,1,0,0,0,0|1,0,1]=4 789 B10R1.4 OCCC1=CC=CC=C1O P36102 [1,1,0,0,0,0|0,0,1]=3 790 B10R1.4 O\N=C\C1=CC=CN=C1F N26790 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.20 C#CC1=CC=CC=C1C=O P38374 [1,1,0,0,0,0|1,0,0]=3 792 B10R1.20 C#CC1=CC=CC=C1CO O27866 [1,1,0,0,0,0|1,0,1]=4 793 B10R1.20 CCC1=CC=CC=C1C=O O31187 [1,1,0,0,0,0|1,0,0]=3 794 B10R1.20 CCC1=CC=CC=C1CO Q67965 [1,1,0,0,0,0|1,0,1]=4 795 B10R1.20 CNC1=CC=CC=C1CO P39027 [1,1,0,0,0,0|1,0,1]=4 796 B10R1.20 COC1=C(C=O)C=CN=C1 O33532 [1,1,0,0,0,0|1,0,0]=3 797 B10R1.20 COC1=C(C=O)C=NC=C1 N24850 [1,1,0,0,0,0|1,0,0]=3 798 B10R1.20 COC1=C(CO)C=CN=C1 Q55507 [1,1,0,0,0,0|1,0,1]=4 799 B10R1.20 COC1=C(CO)C=NC=C1 O31025 [1,1,0,0,0,0|1,0,1]=4 800 B10R1.20 COC1=CC=CC=C1CBr O30598 [1,1,0,0,0,0|1,0,1]=4 801 B10R1.20 COC1=NC=CC=C1C=O C-3519 [1,1,0,0,0,0|1,0,0]=3 802 B10R1.20 COC1=NC=CC=C1CO I-9302 [1,1,0,0,0,0|1,0,1]=4 803 B10R1.20 N#CC1=C(C=O)C=NC=C1 Q56668 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.20 N#CC1=CC=CN=C1C=O Q54467 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.20 N#CC1=CN=CC=C1C=O Q60382 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.20 NCC1=CC=CC=C1CO O34255 [1,1,0,0,0,0|1,0,1]=4 807 B10R1.20 OCC1=C(CO)C=NC=C1 G-7502 [1,1,0,0,0,0|1,0,1]=4 808 B10R1.20 OCC1=C(CO)C=NC=C1 L13996 [1,1,0,0,0,0|1,0,1]=4 809 B10R1.20 OCC1=CC=CN=C1CO Q56688 [1,1,0,0,0,0|1,0,1]=4 810 B10R1.25 C(=O)C1=CC=C(C)N=C1Br Q64554 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.25 C(=O)C1=CC=C(Cl)N=C1Cl C-2303 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.25 C(=O)C1=CC=C(N)N=C1Br Q64645 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.25 CC1=C(C=O)C=NC(Cl)=C1 N24678 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.25 CC1=CC(Br)=CC=C1CO P40596 [1,1,0,0,0,0|1,0,1]=4 815 B10R1.25 CC1=CC(Br)=CN=C1C=O N24312 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.25 CC1=CC(Br)=NC=C1C=O N26193 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.25 CC1=CC(Cl)=CC=C1C=O Q67549 [1,1,0,0,0,0|1,0,0]=3 818 B10R1.25 CC1=CC(Cl)=CC=C1CO P41778 [1,1,0,0,0,0|1,0,1]=4 819 B10R1.25 CC1=CC(F)=CC=C1CO Q67889 [1,1,0,0,0,0|1,0,1]=4 820 B10R1.25 CC1=CC(F)=CN=C1C=O Q60461 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.25 CC1=CC(F)=NC=C1C=O Q67340 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.25 CC1=CC(O)=CC=C1C=O Q68156 [1,1,0,0,0,0|1,0,0]=3 823 B10R1.25 CC1=CC(O)=CC=C1CO Q68377 [1,1,0,0,0,0|1,0,1]=4 824 B10R1.25 CC1=CC(O)=NC=C1C=O Q60311 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.25 CC1=CC=C(C=O)C(C)=N1 O30287 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.25 CC1=CC=C(C=O)C(F)=C1 Q67651 [1,1,0,0,0,0|1,0,0]=3 827 B10R1.25 CC1=CC=C(C=O)C(N)=N1 O30127 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.25 CC1=CC=C(CO)C(Br)=C1 N24923 [1,1,0,0,0,0|1,0,1]=4 829 B10R1.25 CC1=CC=C(CO)C(C)=C1 P40779 [1,1,0,0,0,0|1,0,1]=4 830 B10R1.25 CC1=CC=C(CO)C(Cl)=C1 N25728 [1,1,0,0,0,0|1,0,1]=4 831 B10R1.25 CC1=CC=C(CO)C(F)=C1 Q67939 [1,1,0,0,0,0|1,0,1]=4 832 B10R1.25 CC1=CC=C(CO)C(O)=C1 N25355 [1,1,0,0,0,0|0,0,1]=3 833 B10R1.25 CC1=CC=C(NO)C(Cl)=C1 O29263 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.25 CC1=CN=C(C=O)C(Br)=C1 N26488 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.25 CC1=CN=C(C=O)C(C)=C1 N25612 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.25 CC1=NC(Br)=CC=C1C=O N25138 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.25 CC1=NC(Cl)=CC=C1C=O Q67296 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.25 CC1=NC(F)=CC=C1C=O N26169 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.25 CC1=NC(O)=C(C=O)C=C1 Q60326 [1,1,0,0,0,0|1,0,0]=3 840 B10R1.25 CSC1=CC=C(F)C=C1O N25555 [1,1,0,0,0,0|2,0,0]=4 841 B10R1.25 NC1=C(C=O)C=CC(Cl)=N1 Q69586 [1,1,0,0,0,0|2,0,0]=4 842 B10R1.25 NC1=CC(Br)=CC=C1C=O O32309 [1,1,0,0,0,0|1,0,0]=3 843 B10R1.25 NC1=CC(Br)=CN=C1C=O L21957 [1,1,0,0,0,0|2,0,0]=4 844 B10R1.25 NC1=CC(Cl)=NC=C1C=O A-703 [1,1,0,0,0,0|2,0,0]=4 845 B10R1.25 NC1=CC=C(CO)C(Cl)=C1 O27967 [1,1,0,0,0,0|1,0,1]=4 846 B10R1.25 O=CC1=C(O)C=C(Br)N=C1 Q52264 [1,1,0,0,0,0|1,0,0]=3 847 B10R1.25 O=CC1=CC=C(Br)C=C1O P39549 [1,1,0,0,0,0|0,0,0]=2 848 B10R1.25 O=CC1=CC=C(Br)N=C1Br G-5429 [1,1,0,0,0,0|2,0,0]=4 849 B10R1.25 O=CC1=CC=C(Br)N=C1Cl N26033 [1,1,0,0,0,0|2,0,0]=4 850 B10R1.25 O=CC1=CC=C(Cl)C=C1O Q68512 [1,1,0,0,0,0|0,0,0]=2 851 B10R1.25 O=CC1=CC=C(F)C=C1O L13983 [1,1,0,0,0,0|0,0,0]=2 852 B10R1.25 O=CC1=CC=C(F)N=C1F Q66661 [1,1,0,0,0,0|2,0,0]=4 853 B10R1.25 O=CC1=CC=C(I)C=C1F B-1785 [1,1,0,0,0,0|1,0,0]=3 854 B10R1.25 O=CC1=CC=C(O)C=C1Cl P37350 [1,1,0,0,0,0|1,0,0]=3 855 B10R1.25 O=CC1=CN=C(Br)C=C1Br O32520 [1,1,0,0,0,0|2,0,0]=4 856 B10R1.25 O=CC1=CN=C(Br)C=C1Cl O32647 [1,1,0,0,0,0|2,0,0]=4 857 B10R1.25 O=CC1=CN=C(Cl)C=C1Cl O32554 [1,1,0,0,0,0|2,0,0]=4 858 B10R1.25 O=CC1=NC=C(Br)C=C1Br N24303 [1,1,0,0,0,0|2,0,0]=4 859 B10R1.25 O=CC1=NC=C(Br)C=C1F H-8322 [1,1,0,0,0,0|2,0,0]=4 860 B10R1.25 O=CC1=NC=C(Cl)C=C1Br N25492 [1,1,0,0,0,0|2,0,0]=4 861 B10R1.25 O=CC1=NC=C(Cl)C=C1Cl P43267 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.25 O=CC1=NC=C(Cl)C=C1F O30025 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.25 O=CC1=NC=C(F)C=C1Br O29536 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.25 O=CC1=NC=C(F)C=C1Cl O29764 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.25 OCC1=CC=C(Br)C=C1Cl P40293 [1,1,0,0,0,0|1,0,1]=4 866 B10R1.25 OCC1=CC=C(Cl)C=C1Br N24970 [1,1,0,0,0,0|1,0,1]=4 867 B10R1.25 OCC1=CC=C(O)C=C1F O30496 [1,1,0,0,0,0|1,0,1]=4 868 B10R1.30 CC1=C(C=O)C=C(I)C=C1 N24708 [1,1,0,0,0,0|1,0,0]=3 869 B10R1.30 CC1=CC(C=O)=C(Cl)C=N1 Q60367 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.30 CC1=CC=C(Br)C(C=O)=C1 Q66721 [1,1,0,0,0,0|1,0,0]=3 871 B10R1.30 CC1=CC=C(Br)C(CO)=C1 N24927 [1,1,0,0,0,0|1,0,1]=4 872 B10R1.30 CC1=CC=C(Br)C=C1C=O Q66367 [1,1,0,0,0,0|1,0,0]=3 873 B10R1.30 CC1=CC=C(Br)C=C1CO O34085 [1,1,0,0,0,0|1,0,1]=4 874 B10R1.30 CC1=CC=C(C)C(CO)=C1 P37558 [1,1,0,0,0,0|1,0,1]=4 875 B10R1.30 CC1=CC=C(Cl)C(C=O)=C1 Q67759 [1,1,0,0,0,0|1,0,0]=3 876 B10R1.30 CC1=CC=C(Cl)C=C1C=O N24758 [1,1,0,0,0,0|1,0,0]=3 877 B10R1.30 CC1=CC=C(Cl)C=C1CO P37211 [1,1,0,0,0,0|1,0,1]=4 878 B10R1.30 CC1=CC=C(F)C(CO)=C1 Q68220 [1,1,0,0,0,0|1,0,1]=4 879 B10R1.30 CC1=CC=C(F)C=C1CO Q67532 [1,1,0,0,0,0|1,0,1]=4 880 B10R1.30 CC1=CC=C(O)C(CO)=C1 N26156 [1,1,0,0,0,0|0,0,1]=3 881 B10R1.30 CC1=CC=C(O)C=C1C=O Q67573 [1,1,0,0,0,0|1,0,0]=3 882 B10R1.30 CC1=CC=C(O)C=C1CO N24525 [1,1,0,0,0,0|1,0,1]=4 883 B10R1.30 CC1=CN=C(Cl)C(C=O)=C1 N25126 [1,1,0,0,0,0|2,0,0]=4 884 B10R1.30 CC1=CN=C(F)C(C=O)=C1 N25335 [1,1,0,0,0,0|2,0,0]=4 885 B10R1.30 CC1=NC(C=O)=C(F)C=C1 L22459 [1,1,0,0,0,0|2,0,0]=4 886 B10R1.30 CC1=NC=C(Cl)C=C1C=O Q60371 [1,1,0,0,0,0|2,0,0]=4 887 B10R1.30 CCC1=C(O)C=CC(Br)=C1 N24526 [1,1,0,0,0,0|1,0,1]=4 888 B10R1.30 NC1=CC=C(Br)C=C1C=O G-7659 [1,1,0,0,0,0|1,0,0]=3 889 B10R1.30 NC1=CC=C(Br)C=C1CO G-7692 [1,1,0,0,0,0|1,0,1]=4 890 B10R1.30 O=C1C=CC(=O)C(CO)=C1 P43227 [1,1,0,0,0,0|0,0,2]=4 891 B10R1.30 O=CC1=C(Br)N=CC(Br)=C1 Q66657 [1,1,0,0,0,0|2,0,0]=4 892 B10R1.30 O=CC1=C(F)N=CC(Cl)=C1 P43188 [1,1,0,0,0,0|2,0,0]=4 893 B10R1.30 O=CC1=CC(Br)=CC=C1Br Q67129 [1,1,0,0,0,0|1,0,0]=3 894 B10R1.30 O=CC1=CC(Br)=CN=C1Cl L13548 [1,1,0,0,0,0|2,0,0]=4 895 B10R1.30 O=CC1=CC(Br)=CN=C1F C-2352 [1,1,0,0,0,0|2,0,0]=4 896 B10R1.30 O=CC1=CC(Br)=NC=C1Br Q67225 [1,1,0,0,0,0|2,0,0]=4 897 B10R1.30 O=CC1=CC(Br)=NC=C1Cl N25049 [1,1,0,0,0,0|2,0,0]=4 898 B10R1.30 O=CC1=CC(Br)=NC=C1F L21793 [1,1,0,0,0,0|2,0,0]=4 899 B10R1.30 O=CC1=CC(Cl)=CN=C1Br N26185 [1,1,0,0,0,0|2,0,0]=4 900 B10R1.30 O=CC1=CC(Cl)=CN=C1Cl Q67459 [1,1,0,0,0,0|2,0,0]=4 901 B10R1.30 O=CC1=CC(Cl)=NC=C1Br Q67223 [1,1,0,0,0,0|2,0,0]=4 902 B10R1.30 O=CC1=CC(Cl)=NC=C1Cl N24266 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.30 O=CC1=CC(Cl)=NC=C1F N24660 [1,1,0,0,0,0|2,0,0]=4 904 B10R1.30 O=CC1=CC(Cl)=NC=C1O Q57091 [1,1,0,0,0,0|1,0,0]=3 905 B10R1.30 O=CC1=CC(F)=CN=C1Cl I-9133 [1,1,0,0,0,0|2,0,0]=4 906 B10R1.30 O=CC1=CC(F)=NC=C1Br N27816 [1,1,0,0,0,0|2,0,0]=4 907 B10R1.30 O=CC1=CC(F)=NC=C1Cl O30148 [1,1,0,0,0,0|2,0,0]=4 908 B10R1.30 O=CC1=CC(F)=NC=C1F H-8386 [1,1,0,0,0,0|2,0,0]=4 909 B10R1.30 O=CC1=CC(I)=CC=C1Br N24623 [1,1,0,0,0,0|1,0,0]=3 910 B10R1.30 O=CC1=CC(O)=CC=C1F Q66734 [1,1,0,0,0,0|1,0,0]=3 911 B10R1.30 O=CC1=NC(Br)=CC=C1F I-9355 [1,1,0,0,0,0|2,0,0]=4 912 B10R1.30 O=CC1=NC(Cl)=CC=C1Br O31369 [1,1,0,0,0,0|2,0,0]=4 913 B10R1.30 OCC1=C(F)C=CC(I)=C1 N27718 [1,1,0,0,0,0|1,0,1]=4 914 B10R1.30 OCC1=CC(Cl)=CC=C1F P40230 [1,1,0,0,0,0|1,0,1]=4 915 B10R1.245 C(=O)C1=C(I)C=CN=C1Cl E-3004 [1,1,0,0,0,0|2,0,0]=4 916 B10R1.245 C(=O)C1=C(I)C=CN=C1F E-3005 [1,1,0,0,0,0|2,0,0]=4 917 B10R1.245 C=CC1=C(Br)C=CN=C1O L21757 [1,1,0,0,0,0|2,0,0]=4 918 B10R1.245 C=CC1=C(C)C=CC=C1C O29873 [1,1,0,0,0,0|2,0,0]=4 919 B10R1.245 C=CC1=C(Cl)C=CN=C1O L21786 [1,1,0,0,0,0|2,0,0]=4 920 B10R1.245 C=CC1=C(F)C=CN=C1O L21776 [1,1,0,0,0,0|2,0,0]=4 921 B10R1.245 C=CC1=C(O)N=CC=C1I L21779 [1,1,0,0,0,0|2,0,0]=4 922 B10R1.245 CC1=C(C=O)C(F)=NC=C1 Q66659 [1,1,0,0,0,0|2,0,0]=4 923 B10R1.245 CC1=CC=CC(C)=C1CO Q67997 [1,1,0,0,0,0|1,0,1]=4 924 B10R1.245 CC1=CC=NC(O)=C1C=O Q60291 [1,1,0,0,0,0|1,0,0]=3 925 B10R1.245 CC1=CN=CC(Br)=C1C=O N25771 [1,1,0,0,0,0|2,0,0]=4 926 B10R1.245 CC1=CN=CC(C)=C1C=O Q62371 [1,1,0,0,0,0|2,0,0]=4 927 B10R1.245 COC1=C(F)C=CC=C1O N24698 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.245 COC1=C(O)C=CC=C1Br N25096 [1,1,0,0,0,0|2,0,0]=4 929 B10R1.245 CSC1=C(Cl)C=CC=C1O N27031 [1,1,0,0,0,0|2,0,0]=4 930 B10R1.245 N#CC1=C(Cl)C=CC=C1O C-2883 [1,1,0,0,0,0|1,0,1]=4 931 B10R1.245 NC1=C(C=O)C(Br)=CC=N1 Q53400 [1,1,0,0,0,0|2,0,0]=4 932 B10R1.245 NC1=CC=CC(Br)=C1C=O L14081 [1,1,0,0,0,0|1,0,0]=3 933 B10R1.245 NC1=NC=CC(Cl)=C1C=O Q51905 [1,1,0,0,0,0|2,0,0]=4 934 B10R1.245 O=CC1=C(Br)C=CC=C1Br Q66757 [1,1,0,0,0,0|1,0,0]=3 935 B10R1.245 O=CC1=C(Br)C=CN=C1Cl N27604 [1,1,0,0,0,0|2,0,0]=4 936 B10R1.245 O=CC1=C(Br)C=CN=C1Cl Q67030 [1,1,0,0,0,0|2,0,0]=4 937 B10R1.245 O=CC1=C(Br)C=CNC1=O Q53636 [1,1,0,0,0,0|1,0,1]=4 938 B10R1.245 O=CC1=C(Br)C=NC=C1Br P43222 [1,1,0,0,0,0|2,0,0]=4 939 B10R1.245 O=CC1=C(Br)C=NC=C1Cl Q67260 [1,1,0,0,0,0|2,0,0]=4 940 B10R1.245 O=CC1=C(Br)N=CC=C1Cl L21958 [1,1,0,0,0,0|2,0,0]=4 941 B10R1.245 O=CC1=C(Cl)C=CC=C1Br Q66759 [1,1,0,0,0,0|1,0,0]=3 942 B10R1.245 O=CC1=C(Cl)C=CC=C1I N24994 [1,1,0,0,0,0|1,0,0]=3 943 B10R1.245 O=CC1=C(Cl)C=CC=C1O Q67768 [1,1,0,0,0,0|0,0,0]=2 944 B10R1.245 O=CC1=C(Cl)C=CN=C1Cl N24129 [1,1,0,0,0,0|2,0,0]=4 945 B10R1.245 O=CC1=C(Cl)C=NC=C1F Q60470 [1,1,0,0,0,0|2,0,0]=4 946 B10R1.245 O=CC1=C(F)C=CC=C1I Q67539 [1,1,0,0,0,0|1,0,0]=3 947 B10R1.245 O=CC1=C(F)C=CN=C1Cl N25394 [1,1,0,0,0,0|2,0,0]=4 948 B10R1.245 O=CC1=C(F)C=NC=C1Br N25135 [1,1,0,0,0,0|2,0,0]=4 949 B10R1.245 O=CC1=C(F)C=NC=C1F K10827 [1,1,0,0,0,0|2,0,0]=4 950 B10R1.245 O=CC1=C(O)C=CC=C1F Q66732 [1,1,0,0,0,0|0,0,0]=2 951 B10R1.245 O=CC1=C(O)C=CC=C1O M15620 [1,1,0,0,0,0|0,0,0]=2 952 B10R1.245 OCC1=C(Cl)C=CC=C1Br N24289 [1,1,0,0,0,0|1,0,1]=4 953 B10R1.245 OCC1=C(Cl)C=CC=C1O N24912 [1,1,0,0,0,0|0,0,1]=3 954 B10R1.245 OCC1=C(F)C=CC=C1Br Q67998 [1,1,0,0,0,0|1,0,1]=4 955 B10R1.245 OCC1=C(F)C=CC=C1I N25105 [1,1,0,0,0,0|1,0,1]=4 956 B10R1.39 CSC1=C(C(=O)O)C=CS1 N25635 [0,1,0,0,1,0|1,1,0]=4 957 B10R1.59 O=C(O)C1=C(Br)C=C(Br)S1 Q67324 [0,1,0,0,1,0|2,0,0]=4 958 B10R1.149 COC(=O)C1=C(Br)C=CN1 G-6702 [0,1,0,0,1,0|2,0,0]=4 959 B10R1.149 COC(=O)C1=C(C)C=CN1 G-7400 [0,1,0,0,1,0|2,0,0]=4 960 B10R1.149 COC(=O)C1=C(Cl)C=CN1 G-6436 [0,1,0,0,1,0|2,0,0]=4 961 B10R1.149 COC(=O)C1=C(N)C=CO1 I-9332 [0,1,0,0,1,0|2,0,0]=4 962 B10R1.149 COC(=O)C1=C(N)C=CO1 L14050 [0,1,0,0,1,0|2,0,0]=4 963 B10R1.149 COC(=O)C1=CNC=C1C L22330 [0,1,0,0,1,0|2,0,0]=4 964 B10R1.149 COC(=O)C1=CSC=C1Br O34448 [0,1,0,0,1,0|2,0,0]=4 965 B10R1.149 COC(=O)C1=CSC=C1C N26170 [0,1,0,0,1,0|2,0,0]=4 966 B10R1.149 COC(=O)C1=CSC=C1N Q52828 [0,1,0,0,1,0|2,0,0]=4 967 B10R1.192 CC1=CSC(C)=C1C(=O)O Q68492 [0,1,0,0,1,0|2,0,0]=4 968 B10R1.194 CC1=C(C(=O)O)SC=C1Br Q65603 [0,1,0,0,1,0|2,0,0]=4 969 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 O30456 [0,1,0,0,1,0|2,0,0]=4 970 B10R1.194 CC1=CNC(C(=O)O)=C1C C-3353 [0,1,0,0,1,0|2,0,0]=4 971 B10R1.194 CN1C(Br)=CC=C1C(=O)O O30276 [0,1,0,0,1,0|2,0,0]=4 972 B10R1.194 CN1N=CC(C(=O)O)=C1O Q60572 [0,1,0,0,1,0|2,0,0]=4 973 B10R1.194 O=C(O)C1=C(F)C(F)=CN1 Q70074 [0,1,0,0,1,0|2,0,0]=4 974 B12R1.75 COC1=C(CC(=O)O)C=CC=N1 Q60487 [0,1,0,0,0,1|1,0,0]=3 975 B12R1.75 COC1=CC=CN=C1CC(=O)O Q52077 [0,1,0,0,0,1|1,0,0]=3 976 B12R1.75 COC1=CC=CN=C1CC(=O)[O-] L14567 [0,1,0,0,0,1|1,0,1]=4 977 B12R1.75 CSC1=C(NC(C)=O)C=CC=C1 O33939 [0,1,0,0,0,1|1,1,0]=4 978 B12R1.124 CC1=CC=CC=C1C(=O)C(=O)O P41054 [0,1,0,0,0,1|1,0,0]=3 979 B12R1.124 CC1=CC=CC=C1C(N)C(=O)O P41783 [0,1,0,0,0,1|1,0,0]=3 980 B12R1.124 NC(C(=O)O)C1=CC=CC=C1Br O28104 [0,1,0,0,0,1|1,0,0]=3 981 B12R1.124 NC(C(=O)O)C1=CC=CC=C1F P35865 [0,1,0,0,0,1|1,0,0]=3 982 B12R1.124 NC(C(=O)O)C1=CC=CC=C1O M15540 [0,1,0,0,0,1|0,0,0]=2 983 B12R1.124 NC1=CC=CC=C1C(=O)C(=O)O M22832 [0,1,0,0,0,1|1,0,0]=3 984 B12R1.124 N[C@@H](C(=O)O)C1=CC=CC=C1O O28562 [0,1,0,0,0,1|0,0,0]=2 985 B12R1.124 N[C@H](C(=O)O)C1=CC=CC=C1O O28563 [0,1,0,0,0,1|0,0,0]=2 986 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1Br P39207 [0,1,0,0,0,1|1,0,0]=3 987 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1Cl P39275 [0,1,0,0,0,1|1,0,0]=3 988 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1F P36020 [0,1,0,0,0,1|1,0,0]=3 989 B12R1.124 O=C(O)C(O)C1=CC=CC=C1Br M22703 [0,1,0,0,0,1|1,0,0]=3 990 B12R1.127 CC(=O)NC1=CC(C)=CC=C1C P43337 [0,1,0,0,0,1|2,0,0]=4 991 B12R1.127 CC1=CC=C(Br)C=C1CC(=O)O P35765 [0,1,0,0,0,1|1,0,0]=3 992 B12R1.127 O=C(O)CC1=CC(Br)=CC=C1Br Q52414 [0,1,0,0,0,1|1,0,0]=3 993 B12R1.127 O=C(O)CC1=CC(Cl)=CC=C1Cl P37555 [0,1,0,0,0,1|1,0,0]=3 994 B12R1.127 O=C(O)CC1=CC(F)=CN=C1Cl Q64325 [0,1,0,0,0,1|2,0,0]=4 995 B12R1.224 CC(=O)NC1=C(C)C(C)=CC=C1 N24844 [0,1,0,0,0,1|2,0,0]=4 996 B12R1.224 CC1=C(N)C(CC(=O)O)=CC=C1 O32083 [0,1,0,0,0,1|1,0,0]=3 997 B12R1.224 CC1=C(N)C=CC=C1CC(=O)O O31221 [0,1,0,0,0,1|1,0,0]=3 998 B12R1.224 CC1=CC=CN(CC(=O)O)C1=O Q60812 [0,1,0,0,0,1|1,0,1]=4 999 B12R1.224 O=C(O)CC1=CC=CC(O)=C1O P40027 [0,1,0,0,0,1|0,0,0]=2 1000 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 H-8931 [0,1,0,0,0,1|1,0,0]=3 1001 B12R1.233 CC1=CC(Br)=CC=C1CC(=O)O P35776 [0,1,0,0,0,1|1,0,0]=3 1002 B12R1.233 CC1=NC(C)=C(CC(=O)O)C=C1 Q60611 [0,1,0,0,0,1|2,0,0]=4 1003 B12R1.233 NC1=CC(Br)=CN=C1CC(=O)O Q53216 [0,1,0,0,0,1|2,0,0]=4 1004 B12R1.233 O=C(O)CC1=C(F)C=C(Cl)C=N1 Q52754 [0,1,0,0,0,1|2,0,0]=4 1005 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=N1 Q52219 [0,1,0,0,0,1|2,0,0]=4 1006 B12R1.371 CCC(=O)CC1=CC=CC=C1C P39216 [0,1,0,0,0,1|2,0,0]=4 1007 B12R1.371 CCC(=O)CC1=CC=CC=C1F P41070 [0,1,0,0,0,1|2,0,0]=4 1008 B12R1.371 COC(=O)CC1=CC=CC=C1C P38193 [0,1,0,0,0,1|1,0,0]=3 1009 B12R1.371 COC(=O)CC1=CC=CC=C1I M23155 [0,1,0,0,0,1|1,0,0]=3 1010 B12R1.371 COC(=O)CC1=CC=CC=C1O P39566 [0,1,0,0,0,1|0,0,0]=2 1011 B12R1.371 COC(=O)CC1=NC=CC=C1Br C-2928 [0,1,0,0,0,1|2,0,0]=4 1012 B12R1.371 C\C(C=O)=C/C1=CC=CC=C1F Q69219 [0,1,0,0,0,1|2,0,0]=4 1013 B12R1.371 O=C(CBr)CC1=CC=CC=C1Cl O29301 [0,1,0,0,0,1|2,0,0]=4 1014 B12R1.371 O=C(CCl)NC1=CC=CC=C1O Q69317 [0,1,0,0,0,1|1,0,0]=3 1015 B12R1.46 COC1=C(C(=O)O)C=C(C)C=N1 Q60538 [0,2,0,0,0,0|1,0,0]=3 1016 B12R1.46 COC1=CC=C(O)C=C1B(O)O N25586 [0,2,0,0,0,0|1,0,1]=4 1017 B12R1.46 COC1=CC=C(O)C=C1C(=O)O N26109 [0,2,0,0,0,0|0,0,0]=2 1018 B12R1.46 COC1=CN=C(C)N=C1C(=O)O L13051 [0,2,0,0,0,0|2,0,0]=4 1019 B12R1.46 COC1=NC=C(Br)C=C1C(=O)O C-3522 [0,2,0,0,0,0|1,0,0]=3 1020 B12R1.46 CSC1=CC=C(Cl)C=C1C(=O)O N26910 [0,2,0,0,0,0|0,1,0]=3 1021 B12R1.46 CSC1=CC=C(F)C=C1C(=O)O N24824 [0,2,0,0,0,0|0,1,0]=3 1022 B12R1.46 CSC1=NC=C(C)C=C1C(=O)O N26685 [0,2,0,0,0,0|1,1,0]=4 1023 B12R1.46 N#CC1=CC=C(Br)C=C1C(=O)O N24710 [0,2,0,0,0,0|1,0,0]=3 1024 B12R1.46 N#CC1=NC=C(Br)C=C1C(=O)O O29775 [0,2,0,0,0,0|2,0,0]=4 1025 B12R1.46 OCC1=CC=C(F)C=C1B(O)O Q66968 [0,2,0,0,0,0|1,0,1]=4 1026 B12R1.57 CC1=CC=C(B(O)O)C(CO)=C1 N26132 [0,2,0,0,0,0|1,0,1]=4 1027 B12R1.57 CCC1=CC(Br)=CC=C1C(=O)O Q67851 [0,2,0,0,0,0|1,0,0]=3 1028 B12R1.57 CNC1=CC(F)=CC=C1C(=O)O M23715 [0,2,0,0,0,0|1,0,0]=3 1029 B12R1.57 COC1=C(C(=O)O)C=CC(C)=N1 Q60539 [0,2,0,0,0,0|1,0,0]=3 1030 B12R1.57 COC1=C(C(=O)O)C=CC(N)=N1 O34541 [0,2,0,0,0,0|1,0,0]=3 1031 B12R1.57 COC1=C(C(C)=O)C=CC(O)=C1 H-8631 [0,2,0,0,0,0|1,0,0]=3 1032 B12R1.57 COC1=C(C(C)=O)N=CC(Br)=C1 Q52488 [0,2,0,0,0,0|2,0,0]=4 1033 B12R1.57 COC1=CC(Br)=CC=C1B(O)O Q66970 [0,2,0,0,0,0|1,0,1]=4 1034 B12R1.57 COC1=CC(C)=CC=C1B(O)O N25144 [0,2,0,0,0,0|1,0,1]=4 1035 B12R1.57 COC1=CC(Cl)=CC=C1B(O)O Q66423 [0,2,0,0,0,0|1,0,1]=4 1036 B12R1.57 COC1=CC(Cl)=CN=C1C(=O)O L14352 [0,2,0,0,0,0|1,0,0]=3 1037 B12R1.57 COC1=CC(O)=CC=C1B(O)O N25998 [0,2,0,0,0,0|1,0,1]=4 1038 B12R1.57 COC1=CC(O)=CC=C1C(=O)O N25767 [0,2,0,0,0,0|0,0,0]=2 1039 B12R1.57 O=CC1=C(C(=O)O)C=CC(Br)=C1 P45016 [0,2,0,0,0,0|0,0,1]=3 1040 B12R1.57 OCC1=CC(Cl)=CC=C1B(O)O N27262 [0,2,0,0,0,0|1,0,1]=4 1041 B12R1.77 C#CC1=CC=CC=C1C(=O)OC O27981 [0,2,0,0,0,0|1,0,0]=3 1042 B12R1.77 C=CC1=CC=CC=C1C(=O)OC Q70127 [0,2,0,0,0,0|1,0,0]=3 1043 B12R1.77 CNC(=O)C1=CC=CC=C1CN Q69678 [0,2,0,0,0,0|2,0,0]=4 1044 B12R1.77 COC(=O)C1=C(OC)C=CN=C1 O31925 [0,2,0,0,0,0|1,0,0]=3 1045 B12R1.77 COC(=O)C1=CC=CC=C1CBr P39435 [0,2,0,0,0,0|1,0,0]=3 1046 B12R1.77 COC(=O)C1=NC=CC=C1CBr P42480 [0,2,0,0,0,0|2,0,0]=4 1047 B12R1.77 COC1=CC=CC=C1C(N)CO P42721 [0,2,0,0,0,0|1,0,1]=4 1048 B12R1.87 CCN1C(=O)C=CC=C1C(=O)O Q60844 [0,2,0,0,0,0|2,0,0]=4 1049 B12R1.87 COC1=C(B(O)O)C=CC=C1Br N24472 [0,2,0,0,0,0|1,0,1]=4 1050 B12R1.87 COC1=C(B(O)O)C=CC=C1O N26457 [0,2,0,0,0,0|1,0,1]=4 1051 B12R1.87 COC1=C(C(=O)O)C=CC=C1F N24156 [0,2,0,0,0,0|0,0,0]=2 1052 B12R1.87 COC1=C(C(=O)O)C=CC=C1O N25189 [0,2,0,0,0,0|0,0,0]=2 1053 B12R1.87 COC1=C(C(=O)O)C=CN=C1O Q60674 [0,2,0,0,0,0|1,0,0]=3 1054 B12R1.87 COC1=C(C(=O)O)N=CC=C1Cl Q53039 [0,2,0,0,0,0|1,0,0]=3 1055 B12R1.87 COC1=C(Cl)C=CC=C1B(O)O O31689 [0,2,0,0,0,0|1,0,1]=4 1056 B12R1.87 COC1=C(F)C=CC=C1B(O)O Q66490 [0,2,0,0,0,0|1,0,1]=4 1057 B12R1.87 CSC1=C(Br)C=CC=C1C(=O)O N27043 [0,2,0,0,0,0|0,1,0]=3 1058 B12R1.87 CSC1=C(F)C=CC=C1C(=O)O Q68635 [0,2,0,0,0,0|0,1,0]=3 1059 B12R1.87 O=CC1=C(Cl)N=CC=C1C(=O)O Q60209 [0,2,0,0,0,0|1,0,1]=4 1060 B12R1.87 OCC1=C(B(O)O)C=CC=C1Cl N24881 [0,2,0,0,0,0|1,0,1]=4 1061 B12R1.87 OCC1=C(F)C=CC=C1B(O)O Q67085 [0,2,0,0,0,0|1,0,1]=4 1062 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)O Q68876 [0,2,0,0,0,0|0,0,1]=3 1063 B12R1.261 CC(C)C1=C(C(=O)O)C=CC=N1 Q60717 [0,2,0,0,0,0|2,0,0]=4 1064 B12R1.261 CC(O)C1=CC=CC=C1[N+](=O)[O-] P38848 [0,2,0,0,0,0|1,0,1]=4 1065 B12R1.261 CN(C)C1=C(C(=O)O)N=CC=C1 Q60818 [0,2,0,0,0,0|2,0,0]=4 1066 B12R1.261 CN(C)C1=CC=CC=C1C(=O)O P37098 [0,2,0,0,0,0|1,0,0]=3 1067 B12R1.261 CN(C)C1=CC=NC=C1C(=O)O Q60910 [0,2,0,0,0,0|2,0,0]=4 1068 B12R1.261 CN(C)C1=CN=CC=C1C(=O)O Q60817 [0,2,0,0,0,0|2,0,0]=4 1069 B12R1.261 CN(C)C1=NC=CC=C1C(=O)O O29731 [0,2,0,0,0,0|2,0,0]=4 1070 B12R1.261 O=C(O)C1=C([N+](=O)[O-])C=NC=C1 O30888 [0,2,0,0,0,0|1,0,1]=4 1071 B12R1.261 O=C(O)C1=CC=CC=C1B(O)O P41108 [0,2,0,0,0,0|0,0,0]=2 1072 B12R1.261 O=C(O)C1=CC=CC=C1I(=O)=O P36868 [0,2,0,0,0,0|0,0,1]=3 1073 B12R1.261 O=C(O)C1=CC=CN=C1C(F)F F-4836 [0,2,0,0,0,0|2,0,0]=4 1074 B12R1.261 O=C(O)C1=CC=CN=C1[N+](=O)[O-] C-3471 [0,2,0,0,0,0|1,0,1]=4 1075 B12R1.261 O=C(O)C1=CC=NC=C1C(F)F F-4728 [0,2,0,0,0,0|2,0,0]=4 1076 B12R1.261 O=C(O)C1=NC=CC=C1C(F)F O32114 [0,2,0,0,0,0|2,0,0]=4 1077 B12R1.261 O=C(O)C1=NC=CC=C1[N+](=O)[O-] C-2816 [0,2,0,0,0,0|1,0,1]=4 1078 B12R1.283 CNCC1=CC=CC=C1C(=O)O P37625 [0,2,0,0,0,0|1,0,0]=3 1079 B12R1.283 COCC1=CC=CC=C1B(O)O Q66516 [0,2,0,0,0,0|1,0,1]=4 1080 B12R1.283 COCC1=CC=CC=C1C(C)=O K16133 [0,2,0,0,0,0|1,0,0]=3 1081 B12R1.283 CSCC1=CC=CN=C1C(=O)O Q58432 [0,2,0,0,0,0|1,1,0]=4 1082 B12R1.283 N#CCC1=C(C(=O)O)C=CC=N1 Q60780 [0,2,0,0,0,0|2,0,0]=4 1083 B12R1.283 N#CCC1=CC=CC=C1C(=O)O O30748 [0,2,0,0,0,0|1,0,0]=3 1084 B12R1.283 O=[N+]([O-])C1=CC=CC=C1CCO P41037 [0,2,0,0,0,0|1,0,1]=4 1085 B12R1.283 O\N=C\C1=CC=CC=C1B(O)O O34157 [0,2,0,0,0,0|1,0,1]=4 1086 B12R1.437 COC1=C(C(=O)O)C(Br)=CC=C1 Q66688 [0,2,0,0,0,0|0,0,0]=2 1087 B12R1.437 COC1=C(C(=O)O)C(Cl)=NC=C1 H-8241 [0,2,0,0,0,0|1,0,0]=3 1088 B12R1.437 COC1=C(C(=O)O)C(F)=NC=C1 N26179 [0,2,0,0,0,0|1,0,0]=3 1089 B12R1.437 COC1=C(C(N)=O)C(F)=CC=C1 P37611 [0,2,0,0,0,0|1,0,0]=3 1090 B12R1.437 COC1=CN=CC(Cl)=C1C(=O)O Q60651 [0,2,0,0,0,0|1,0,0]=3 1091 B12R1.437 COC1=NC=CC(Br)=C1C(=O)O Q53635 [0,2,0,0,0,0|1,0,0]=3 1092 B12R1.437 COC1=NC=CC(Cl)=C1C(=O)O Q60528 [0,2,0,0,0,0|1,0,0]=3 1093 B12R1.437 COC1=NC=CC(N)=C1C(=O)O Q53196 [0,2,0,0,0,0|1,0,0]=3 1094 B12R1.437 CSC1=C(C(=O)O)C(F)=NC=C1 N26804 [0,2,0,0,0,0|1,1,0]=4 1095 B12R1.437 CSC1=CC=CC(F)=C1C(=O)O N25148 [0,2,0,0,0,0|0,1,0]=3 1096 B12R1.437 N#CC1=C(C(=O)O)C(F)=CC=C1 C-2442 [0,2,0,0,0,0|1,0,0]=3 1097 B12R1.894 CC1=C(Br)C(C(=O)O)=C(Cl)C=C1 Q68747 [0,2,0,0,0,0|1,0,0]=3 1098 B12R1.894 CC1=C(Br)C=CC(O)=C1[N+](=O)[O-] L13081 [0,2,0,0,0,0|1,0,1]=4 1099 B12R1.894 CC1=C(C(=O)O)C(F)=CC=C1F N26422 [0,2,0,0,0,0|1,0,0]=3 1100 B12R1.894 CC1=C(Cl)C(C(=O)O)=C(Cl)C=C1 N24735 [0,2,0,0,0,0|1,0,0]=3 1101 B12R1.894 CC1=C(O)C(B(O)O)=C(F)C=C1 O29005 [0,2,0,0,0,0|1,0,1]=4 1102 B12R1.894 CC1=CC=C(Br)C(C(=O)O)=C1Cl N26860 [0,2,0,0,0,0|1,0,0]=3 1103 B12R1.894 CC1=CC=C(Br)C(C(=O)O)=C1F N24113 [0,2,0,0,0,0|1,0,0]=3 1104 B12R1.894 CC1=CC=C(F)C(C(=O)O)=C1Br N24296 [0,2,0,0,0,0|1,0,0]=3 1105 B12R1.894 CN1C=CC(F)=C(C(=O)O)C1=O Q54505 [0,2,0,0,0,0|1,0,1]=4 1106 B12R1.894 NC(=O)C1=C(F)C=CC(Br)=C1F O29002 [0,2,0,0,0,0|2,0,0]=4 1107 B12R1.894 NC1=C(F)C=CC(Br)=C1C(=O)O O32536 [0,2,0,0,0,0|1,0,0]=3 1108 B12R1.894 O=C(Cl)C1=C(F)C=CC(Br)=C1F Q68454 [0,2,0,0,0,0|2,0,0]=4 1109 B12R1.894 O=C(O)C1=C(Br)C(Cl)=CC=C1F N27767 [0,2,0,0,0,0|1,0,0]=3 1110 B12R1.894 O=C(O)C1=C(Br)C=CC(O)=C1F Q68685 [0,2,0,0,0,0|1,0,0]=3 1111 B12R1.894 O=C(O)C1=C(Cl)C(Br)=CC=C1Cl C-3736 [0,2,0,0,0,0|1,0,0]=3 1112 B12R1.894 O=C(O)C1=C(Cl)C(Cl)=CC=C1Br N25638 [0,2,0,0,0,0|1,0,0]=3 1113 B12R1.894 O=C(O)C1=C(Cl)C=CC(Cl)=C1F Q66909 [0,2,0,0,0,0|1,0,0]=3 1114 B12R1.894 O=C(O)C1=C(Cl)C=CC(F)=C1F Q68199 [0,2,0,0,0,0|1,0,0]=3 1115 B12R1.894 O=C(O)C1=C(Cl)C=CC(O)=C1F Q66904 [0,2,0,0,0,0|1,0,0]=3 1116 B12R1.894 O=C(O)C1=C(F)C(Br)=CC=C1Br N24795 [0,2,0,0,0,0|1,0,0]=3 1117 B12R1.894 O=C(O)C1=C(F)C(Br)=CC=C1Cl N24251 [0,2,0,0,0,0|1,0,0]=3 1118 B12R1.894 O=C(O)C1=C(F)C(Cl)=CC=C1Br N25600 [0,2,0,0,0,0|1,0,0]=3 1119 B12R1.894 O=C(O)C1=C(F)C(F)=CC=C1Br N24292 [0,2,0,0,0,0|1,0,0]=3 1120 B12R1.894 O=C(O)C1=C(F)C(F)=CC=C1O N25746 [0,2,0,0,0,0|0,0,0]=2 1121 B12R1.894 O=C(O)C1=C(F)C(I)=CC=C1Br N26917 [0,2,0,0,0,0|1,0,0]=3 1122 B12R1.894 O=C(O)C1=C(F)C(I)=CC=C1Cl N27354 [0,2,0,0,0,0|1,0,0]=3 1123 B12R1.894 O=C(O)C1=C(F)C=CC(Br)=C1Cl Q66899 [0,2,0,0,0,0|1,0,0]=3 1124 B12R1.894 O=C(O)C1=C(F)C=CC(Br)=C1F Q67754 [0,2,0,0,0,0|1,0,0]=3 1125 B12R1.894 O=C(O)C1=C(F)C=CC(F)=C1Br Q67252 [0,2,0,0,0,0|1,0,0]=3 1126 B12R1.894 O=C(O)C1=C(F)C=CC(I)=C1F Q68235 [0,2,0,0,0,0|1,0,0]=3 1127 B12R1.894 O=C(O)C1=C(O)C(F)=CC=C1F N24483 [0,2,0,0,0,0|0,0,0]=2 1128 B12R1.894 O=C(O)C1=C(O)C=CC(Cl)=C1Cl Q68676 [0,2,0,0,0,0|0,0,0]=2 1129 B12R1.1000 CC1=C(C(=O)O)C(Cl)=CC(Br)=C1 N26183 [0,2,0,0,0,0|1,0,0]=3 1130 B12R1.1000 CC1=C(C(=O)O)C(F)=CC(Br)=C1 M15772 [0,2,0,0,0,0|1,0,0]=3 1131 B12R1.1000 CC1=C(C(=O)O)C(O)=CC(O)=C1 O32459 [0,2,0,0,0,0|0,0,0]=2 1132 B12R1.1000 CC1=CC(Br)=C(C(=O)O)C(Br)=C1 N25054 [0,2,0,0,0,0|1,0,0]=3 1133 B12R1.1000 CC1=CC(Br)=C(C(=O)O)C(F)=C1 N24898 [0,2,0,0,0,0|1,0,0]=3 1134 B12R1.1000 CC1=CC(Br)=CC(C)=C1C(=O)O Q68110 [0,2,0,0,0,0|1,0,0]=3 1135 B12R1.1000 CC1=CC(Cl)=C(C(=O)O)C(Cl)=C1 N24218 [0,2,0,0,0,0|1,0,0]=3 1136 B12R1.1000 CC1=CC(Cl)=CC(C)=C1C(=O)O N25287 [0,2,0,0,0,0|1,0,0]=3 1137 B12R1.1000 CC1=CC(F)=CC(C)=C1C(=O)O Q68261 [0,2,0,0,0,0|1,0,0]=3 1138 B12R1.1000 CC1=CC(O)=C(B(O)O)C(F)=C1 Q68595 [0,2,0,0,0,0|1,0,1]=4 1139 B12R1.1000 NC(=O)C1=C(Br)C=C(Br)C=C1F N25065 [0,2,0,0,0,0|2,0,0]=4 1140 B12R1.1000 NC(=O)C1=C(F)C=C(Br)C=C1F Q67460 [0,2,0,0,0,0|2,0,0]=4 1141 B12R1.1000 NC1=C(C(=O)O)C(Cl)=NC(Cl)=C1 Q57198 [0,2,0,0,0,0|2,0,0]=4 1142 B12R1.1000 NC1=CC(F)=CC(F)=C1C(=O)O O34476 [0,2,0,0,0,0|1,0,0]=3 1143 B12R1.1000 O=C(Cl)C1=C(Br)C=C(Br)C=C1F N27763 [0,2,0,0,0,0|2,0,0]=4 1144 B12R1.1000 O=C(Cl)C1=C(F)C=C(Br)C=C1F Q66918 [0,2,0,0,0,0|2,0,0]=4 1145 B12R1.1000 O=C(O)C1=C(Br)C=C(Br)C=C1Br Q67295 [0,2,0,0,0,0|1,0,0]=3 1146 B12R1.1000 O=C(O)C1=C(Br)C=C(Br)C=C1F N24580 [0,2,0,0,0,0|1,0,0]=3 1147 B12R1.1000 O=C(O)C1=C(Br)C=C(Cl)C=C1Br Q68433 [0,2,0,0,0,0|1,0,0]=3 1148 B12R1.1000 O=C(O)C1=C(Br)C=C(F)C=C1Br N27784 [0,2,0,0,0,0|1,0,0]=3 1149 B12R1.1000 O=C(O)C1=C(Cl)C=C(Br)C=C1Cl P39508 [0,2,0,0,0,0|1,0,0]=3 1150 B12R1.1000 O=C(O)C1=C(Cl)C=C(Cl)C=C1Br N27782 [0,2,0,0,0,0|1,0,0]=3 1151 B12R1.1000 O=C(O)C1=C(Cl)C=C(F)C=C1Cl N26056 [0,2,0,0,0,0|1,0,0]=3 1152 B12R1.1000 O=C(O)C1=C(F)C=C(Cl)C=C1Cl O29213 [0,2,0,0,0,0|1,0,0]=3 1153 B12R1.1000 O=C(O)C1=C(F)C=C(Cl)C=C1F Q69983 [0,2,0,0,0,0|1,0,0]=3 1154 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1Br N25333 [0,2,0,0,0,0|1,0,0]=3 1155 B12R1.1000 O=C(O)C1=C(F)N=C(F)C=C1F L19982 [0,2,0,0,0,0|2,0,0]=4 1156 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1C P44682 [0,2,0,0,0,0|1,0,0]=3 1157 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1N M15513 [0,2,0,0,0,0|1,0,0]=3 1158 B12R1.3441 COC(=O)C1=C(Br)C=CN=C1Cl Q67914 [0,2,0,0,0,0|2,0,0]=4 1159 B12R1.3441 COC(=O)C1=C(Br)C=NC=C1Br N25034 [0,2,0,0,0,0|2,0,0]=4 1160 B12R1.3441 COC(=O)C1=C(Br)C=NC=C1C L18322 [0,2,0,0,0,0|2,0,0]=4 1161 B12R1.3441 COC(=O)C1=C(Br)C=NC=C1F N26003 [0,2,0,0,0,0|2,0,0]=4 1162 B12R1.3441 COC(=O)C1=C(C)C=CC=C1Cl P34737 [0,2,0,0,0,0|1,0,0]=3 1163 B12R1.3441 COC(=O)C1=C(C)C=NC=C1F P43387 [0,2,0,0,0,0|2,0,0]=4 1164 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1Br Q67427 [0,2,0,0,0,0|1,0,0]=3 1165 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1O N25334 [0,2,0,0,0,0|0,0,0]=2 1166 B12R1.3441 COC(=O)C1=C(Cl)C=CN=C1C L21947 [0,2,0,0,0,0|2,0,0]=4 1167 B12R1.3441 COC(=O)C1=C(Cl)C=CN=C1Cl N24451 [0,2,0,0,0,0|2,0,0]=4 1168 B12R1.3441 COC(=O)C1=C(Cl)C=NC=C1Cl O29207 [0,2,0,0,0,0|2,0,0]=4 1169 B12R1.3441 COC(=O)C1=C(Cl)N=CC=C1N G-6059 [0,2,0,0,0,0|2,0,0]=4 1170 B12R1.3441 COC(=O)C1=C(F)C=CC=C1Br Q67644 [0,2,0,0,0,0|1,0,0]=3 1171 B12R1.3441 COC(=O)C1=C(F)C=CN=C1Cl L22172 [0,2,0,0,0,0|2,0,0]=4 1172 B12R1.3441 COC(=O)C1=C(I)C=CN=C1Cl Q67941 [0,2,0,0,0,0|2,0,0]=4 1173 B12R1.3441 COC(=O)C1=C(I)C=CN=C1F O30684 [0,2,0,0,0,0|2,0,0]=4 1174 B12R1.3441 O=C(CBr)C1=C(Cl)C=CC=C1Cl 10712 [0,2,0,0,0,0|2,0,0]=4 1175 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1O O33542 [0,2,0,0,0,0|1,0,0]=3 1176 B12R1.24 CCC(=O)C1=CC=CC(F)=C1I O32085 [0,2,0,0,0,0|2,0,0]=4 1177 B12R1.24 COC(=O)C1=C(Br)C(Cl)=NC=C1 O29131 [0,2,0,0,0,0|2,0,0]=4 1178 B12R1.24 COC(=O)C1=C(Br)C(F)=CC=C1 N25375 [0,2,0,0,0,0|1,0,0]=3 1179 B12R1.24 COC(=O)C1=C(C)C(Br)=CN=C1 N25914 [0,2,0,0,0,0|2,0,0]=4 1180 B12R1.24 COC(=O)C1=C(C)C(F)=CC=C1 N25095 [0,2,0,0,0,0|1,0,0]=3 1181 B12R1.24 COC(=O)C1=C(Cl)C(Br)=CN=C1 N26316 [0,2,0,0,0,0|2,0,0]=4 1182 B12R1.24 COC(=O)C1=C(Cl)C(F)=CC=C1 N24748 [0,2,0,0,0,0|1,0,0]=3 1183 B12R1.24 COC(=O)C1=C(F)C(Cl)=NC=C1 N24816 [0,2,0,0,0,0|2,0,0]=4 1184 B12R1.24 COC(=O)C1=C(N)C(C)=NC=C1 L21911 [0,2,0,0,0,0|2,0,0]=4 1185 B12R1.24 COC(=O)C1=CC=CC(Br)=C1Br Q66807 [0,2,0,0,0,0|1,0,0]=3 1186 B12R1.24 COC(=O)C1=CC=CC(Br)=C1C S70878 [0,2,0,0,0,0|1,0,0]=3 1187 B12R1.24 COC(=O)C1=CC=CC(Br)=C1F Q68065 [0,2,0,0,0,0|1,0,0]=3 1188 B12R1.24 COC(=O)C1=CC=CC(Cl)=C1C Q68218 [0,2,0,0,0,0|1,0,0]=3 1189 B12R1.24 COC(=O)C1=CC=CC(Cl)=C1O Q67801 [0,2,0,0,0,0|0,0,0]=2 1190 B12R1.24 COC(=O)C1=CC=CC(N)=C1N P42745 [0,2,0,0,0,0|1,0,0]=3 1191 B12R1.24 COC(=O)C1=CC=CN(C)C1=O L14065 [0,2,0,0,0,0|1,0,1]=4 1192 B12R1.24 COC(=O)C1=CC=NC(Cl)=C1Cl Q67802 [0,2,0,0,0,0|2,0,0]=4 1193 B12R1.24 COC(=O)C1=CC=NC(F)=C1Cl Q68535 [0,2,0,0,0,0|2,0,0]=4 1194 B12R1.24 COC(=O)C1=CN=CC(Cl)=C1Cl P43294 [0,2,0,0,0,0|2,0,0]=4 1195 B12R1.24 COC(=O)C1=NC=CC(Br)=C1C Q60125 [0,2,0,0,0,0|2,0,0]=4 1196 B12R1.440 CC1=C(C(=O)O)C=CC=C1C=O N26189 [0,2,0,0,0,0|1,0,0]=3 1197 B12R1.440 COC1=C(C)C(C(=O)O)=CC=N1 Q60750 [0,2,0,0,0,0|2,0,0]=4 1198 B12R1.440 COC1=C(Cl)C(C(=O)O)=CC=C1 Q66689 [0,2,0,0,0,0|1,0,0]=3 1199 B12R1.440 COC1=C(Cl)C(C(=O)O)=NC=C1 Q60578 [0,2,0,0,0,0|2,0,0]=4 1200 B12R1.440 COC1=C(F)C(C(=O)O)=CC=C1 Q67065 [0,2,0,0,0,0|1,0,0]=3 1201 B12R1.440 COC1=C(N)C(C(=O)O)=CC=C1 G-7024 [0,2,0,0,0,0|1,0,0]=3 1202 B12R1.440 COC1=C(O)C(C(C)=O)=CC=C1 G-7111 [0,2,0,0,0,0|1,0,0]=3 1203 B12R1.440 COC1=CC=NC(C(=O)O)=C1C Q60517 [0,2,0,0,0,0|2,0,0]=4 1204 B12R1.440 COC1=CC=NC(C(=O)O)=C1O Q60603 [0,2,0,0,0,0|1,0,0]=3 1205 B12R1.440 COC1=CN=CC(C(=O)O)=C1C N26253 [0,2,0,0,0,0|2,0,0]=4 1206 B12R1.440 COC1=NC=CC(C(=O)O)=C1Cl N26058 [0,2,0,0,0,0|2,0,0]=4 1207 B12R1.440 COC1=NC=CC(C(=O)O)=C1N Q69141 [0,2,0,0,0,0|2,0,0]=4 1208 B12R1.440 CSC1=CC=CC(C(=O)O)=C1F N25002 [0,2,0,0,0,0|1,0,0]=3 1209 B12R1.440 CSC1=CN=CC(C(=O)O)=C1C Q68479 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.440 O=C(O)C1=C(Cl)C(CBr)=CC=C1 F-4193 [0,2,0,0,0,0|1,0,0]=3 1211 B12R1.440 O=CC1=C(Br)C(C(=O)O)=CC=C1 P43469 [0,2,0,0,0,0|1,0,0]=3 1212 B12R1.440 O=CC1=CC=CC(C(=O)O)=C1F N26299 [0,2,0,0,0,0|1,0,0]=3 1213 B12R1.511 CC1=C(Br)C=C(F)C=C1C(=O)O Q68690 [0,2,0,0,0,0|1,0,0]=3 1214 B12R1.511 CC1=C(Cl)C(C(=O)O)=CC(F)=C1 Q68226 [0,2,0,0,0,0|1,0,0]=3 1215 B12R1.511 CC1=C(Cl)C=C(Cl)C=C1C(=O)O Q68588 [0,2,0,0,0,0|1,0,0]=3 1216 B12R1.511 CC1=C(F)C(C(=O)O)=CC(Br)=C1 Q68605 [0,2,0,0,0,0|1,0,0]=3 1217 B12R1.511 CC1=C(N)C(C(=O)O)=CC(Br)=C1 O34492 [0,2,0,0,0,0|1,0,0]=3 1218 B12R1.511 CC1=C(N)C=C(Br)C=C1C(=O)O Q69347 [0,2,0,0,0,0|1,0,0]=3 1219 B12R1.511 CC1=C(O)C=C(Br)C=C1C(=O)O Q69329 [0,2,0,0,0,0|1,0,0]=3 1220 B12R1.511 CC1=CC(Br)=C(F)C(C(=O)O)=C1 Q68653 [0,2,0,0,0,0|1,0,0]=3 1221 B12R1.511 CC1=CC(Br)=C(N)C(C(=O)O)=C1 Q69370 [0,2,0,0,0,0|1,0,0]=3 1222 B12R1.511 CC1=CC(C)=C(Cl)C(C(=O)O)=C1 N26159 [0,2,0,0,0,0|1,0,0]=3 1223 B12R1.511 CC1=CC(F)=C(Cl)C(C(=O)O)=C1 Q68575 [0,2,0,0,0,0|1,0,0]=3 1224 B12R1.511 CC1=CN(C)C(=O)C(C(=O)O)=C1 Q60897 [0,2,0,0,0,0|1,0,1]=4 1225 B12R1.511 CC1=NC(O)=C(O)C(C(=O)O)=N1 M15746 [0,2,0,0,0,0|2,0,0]=4 1226 B12R1.511 CN1C=C(Br)C=C(C(=O)O)C1=O C-3342 [0,2,0,0,0,0|1,0,1]=4 1227 B12R1.511 NC1=C(C(=O)O)C=C(Cl)N=C1Cl H-8674 [0,2,0,0,0,0|2,0,0]=4 1228 B12R1.511 NC1=C(Cl)C(C(=O)O)=CC(Cl)=C1 P51310 [0,2,0,0,0,0|1,0,0]=3 1229 B12R1.511 NC1=C(F)C=C(Br)C=C1C(=O)O Q53436 [0,2,0,0,0,0|1,0,0]=3 1230 B12R1.511 NC1=CC(Cl)=NC(C(=O)O)=C1Cl Q52688 [0,2,0,0,0,0|2,0,0]=4 1231 B12R1.511 NC1=CC(N)=C(O)C(C(=O)O)=C1 P50999 [0,2,0,0,0,0|0,0,0]=2 1232 B12R1.511 O=C(O)C1=C(Cl)C(F)=CC(F)=C1 N25281 [0,2,0,0,0,0|1,0,0]=3 1233 B12R1.511 O=C(O)C1=C(F)C(Br)=CC(Cl)=C1 N25425 [0,2,0,0,0,0|1,0,0]=3 1234 B12R1.511 O=C(O)C1=C(F)C(Cl)=CC(Br)=C1 N25579 [0,2,0,0,0,0|1,0,0]=3 1235 B12R1.511 O=C(O)C1=CC(Cl)=CC(Br)=C1Cl O29145 [0,2,0,0,0,0|1,0,0]=3 1236 B12R1.511 O=C(O)C1=CC(Cl)=CC(Cl)=C1F N25059 [0,2,0,0,0,0|1,0,0]=3 1237 B12R1.511 O=C(O)C1=CC(Cl)=CC(F)=C1Cl O29232 [0,2,0,0,0,0|1,0,0]=3 1238 B12R1.511 O=C(O)C1=CC(F)=CC(Cl)=C1O Q68427 [0,2,0,0,0,0|0,0,0]=2 1239 B12R1.511 OB(O)C1=CC(F)=CC(Cl)=C1O O29056 [0,2,0,0,0,0|1,0,1]=4 1240 B12R1.511 OB(O)C1=CC(F)=CC(F)=C1O N25386 [0,2,0,0,0,0|1,0,1]=4 1241 B12R1.893 CC(=O)C1=CC=C(F)C(F)=C1Br P43171 [0,2,0,0,0,0|2,0,0]=4 1242 B12R1.893 CC1=C(C(=O)O)C=CC(Br)=C1Cl N26904 [0,2,0,0,0,0|1,0,0]=3 1243 B12R1.893 CC1=C(C)C(C(=O)O)=CC=C1Br Q68239 [0,2,0,0,0,0|1,0,0]=3 1244 B12R1.893 CC1=C(Cl)C(C)=C(C(=O)O)C=C1 N27468 [0,2,0,0,0,0|1,0,0]=3 1245 B12R1.893 CC1=C(Cl)C(Cl)=C(C(=O)O)C=C1 N26009 [0,2,0,0,0,0|1,0,0]=3 1246 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1C N26199 [0,2,0,0,0,0|1,0,0]=3 1247 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1F N27139 [0,2,0,0,0,0|1,0,0]=3 1248 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1Br M15788 [0,2,0,0,0,0|1,0,0]=3 1249 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1F Q68366 [0,2,0,0,0,0|1,0,0]=3 1250 B12R1.893 CC1=C(F)C(Cl)=CC=C1C(=O)O Q68516 [0,2,0,0,0,0|1,0,0]=3 1251 B12R1.893 CC1=C(F)C(F)=CC=C1C(=O)O Q68145 [0,2,0,0,0,0|1,0,0]=3 1252 B12R1.893 CC1=CC=C(C(=O)Cl)C(F)=C1F Q68232 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.893 CC1=CC=C(C(=O)O)C(C)=C1F O29103 [0,2,0,0,0,0|1,0,0]=3 1254 B12R1.893 CC1=CC=C(C(N)=O)C(F)=C1F Q68233 [0,2,0,0,0,0|2,0,0]=4 1255 B12R1.893 CC1=NC=C(C(=O)O)C(C)=C1Cl Q60527 [0,2,0,0,0,0|2,0,0]=4 1256 B12R1.893 CN1C(=O)C=CC(C(=O)O)=C1Cl Q53132 [0,2,0,0,0,0|2,0,0]=4 1257 B12R1.893 NC1=C(C(=O)O)C=CC(Br)=C1F L14645 [0,2,0,0,0,0|1,0,0]=3 1258 B12R1.893 O=C(O)C1=C(Cl)C(Cl)=C(Br)C=C1 N26329 [0,2,0,0,0,0|1,0,0]=3 1259 B12R1.893 O=C(O)C1=C(Cl)C(F)=C(Cl)N=C1 L18326 [0,2,0,0,0,0|2,0,0]=4 1260 B12R1.893 O=C(O)C1=C(Cl)C(F)=C(F)C=C1 N25497 [0,2,0,0,0,0|1,0,0]=3 1261 B12R1.893 O=C(O)C1=C(Cl)C(F)=C(F)N=C1 D-2712 [0,2,0,0,0,0|2,0,0]=4 1262 B12R1.893 O=C(O)C1=C(F)C(Cl)=C(Br)C=C1 N24966 [0,2,0,0,0,0|1,0,0]=3 1263 B12R1.893 O=C(O)C1=CC=C(Br)C(F)=C1Cl Q69535 [0,2,0,0,0,0|1,0,0]=3 1264 B12R1.893 O=C(O)C1=CC=C(Br)C(F)=C1F Q68384 [0,2,0,0,0,0|1,0,0]=3 1265 B12R1.893 O=C(O)C1=CC=C(Br)C(I)=C1F N26582 [0,2,0,0,0,0|1,0,0]=3 1266 B12R1.893 O=C(O)C1=CC=C(Cl)C(Cl)=C1F Q68659 [0,2,0,0,0,0|1,0,0]=3 1267 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1Cl Q68315 [0,2,0,0,0,0|1,0,0]=3 1268 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1F Q68361 [0,2,0,0,0,0|1,0,0]=3 1269 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1O Q68475 [0,2,0,0,0,0|0,0,0]=2 1270 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1O Q67575 [0,2,0,0,0,0|0,0,0]=2 1271 B12R1.893 O=C(O)C1=CC=C(O)C(F)=C1F K13413 [0,2,0,0,0,0|1,0,0]=3 1272 B12R1.893 O=C(O)C1=CN=C(Cl)C(Br)=C1Cl Q52586 [0,2,0,0,0,0|2,0,0]=4 1273 B12R1.893 O=C(O)C1=CN=C(Cl)C(Cl)=C1Cl N26355 [0,2,0,0,0,0|2,0,0]=4 1274 B12R1.893 OB(O)C1=CC=C(Cl)C(F)=C1O Q68497 [0,2,0,0,0,0|1,0,1]=4 1275 B12R1.893 OB(O)C1=CC=C(F)C(F)=C1O Q67436 [0,2,0,0,0,0|1,0,1]=4 1276 B12R1.232 CC(=O)C1=CC(Br)=C(Cl)C=C1N O32577 [0,2,0,0,0,0|2,0,0]=4 1277 B12R1.232 CC(=O)C1=CC(C)=C(C)C=C1O Q65601 [0,2,0,0,0,0|1,0,0]=3 1278 B12R1.232 CC(=O)C1=CC(Cl)=C(Br)C=C1O Q69474 [0,2,0,0,0,0|1,0,0]=3 1279 B12R1.232 CC(=O)C1=CC(Cl)=C(Cl)C=C1O P39550 [0,2,0,0,0,0|1,0,0]=3 1280 B12R1.232 CC1=C(Br)C=C(C(=O)O)C(F)=C1 N24864 [0,2,0,0,0,0|1,0,0]=3 1281 B12R1.232 CC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 N26358 [0,2,0,0,0,0|1,0,0]=3 1282 B12R1.232 CC1=C(Cl)C=C(F)C(C(=O)O)=C1 N26027 [0,2,0,0,0,0|1,0,0]=3 1283 B12R1.232 CC1=C(N)C=C(C(=O)O)C(Br)=C1 O34469 [0,2,0,0,0,0|1,0,0]=3 1284 B12R1.232 CC1=CC(Br)=C(Cl)C=C1C(=O)O N25847 [0,2,0,0,0,0|1,0,0]=3 1285 B12R1.232 CC1=CC(Br)=C(F)C=C1C(=O)O Q68706 [0,2,0,0,0,0|1,0,0]=3 1286 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1Br N24915 [0,2,0,0,0,0|1,0,0]=3 1287 B12R1.232 CC1=CC(C(=O)O)=C(O)N=C1C Q60518 [0,2,0,0,0,0|1,0,0]=3 1288 B12R1.232 CC1=CC(C)=C(Br)C=C1C(=O)O O34019 [0,2,0,0,0,0|1,0,0]=3 1289 B12R1.232 CC1=CC(F)=C(Br)C=C1C(=O)O O29561 [0,2,0,0,0,0|1,0,0]=3 1290 B12R1.232 CC1=NC(Cl)=C(Cl)C=C1C(=O)O Q62347 [0,2,0,0,0,0|2,0,0]=4 1291 B12R1.232 NC(=O)C1=CC(F)=C(Br)C=C1F Q67969 [0,2,0,0,0,0|2,0,0]=4 1292 B12R1.232 NC(=O)C1=CC(F)=C(F)C=C1F P34764 [0,2,0,0,0,0|2,0,0]=4 1293 B12R1.232 NC1=CC(Br)=C(Cl)C=C1C(=O)O K16111 [0,2,0,0,0,0|1,0,0]=3 1294 B12R1.232 NC1=CC(Cl)=C(Br)C=C1C(=O)O H-8923 [0,2,0,0,0,0|1,0,0]=3 1295 B12R1.232 NC1=CC(F)=C(C(=O)O)C=C1N H-8817 [0,2,0,0,0,0|1,0,0]=3 1296 B12R1.232 O=C(Cl)C1=CC(F)=C(Br)C=C1F N27818 [0,2,0,0,0,0|2,0,0]=4 1297 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(I)=N1 P45531 [0,2,0,0,0,0|2,0,0]=4 1298 B12R1.232 O=C(O)C1=C(F)C=C(F)C(Br)=C1 N24640 [0,2,0,0,0,0|1,0,0]=3 1299 B12R1.232 O=C(O)C1=C(F)C=C(F)C(F)=N1 Q52218 [0,2,0,0,0,0|2,0,0]=4 1300 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1Cl O29098 [0,2,0,0,0,0|1,0,0]=3 1301 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1Br N26034 [0,2,0,0,0,0|1,0,0]=3 1302 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1F P39072 [0,2,0,0,0,0|1,0,0]=3 1303 B12R1.232 O=C(O)C1=CC(F)=C(O)C=C1F N25280 [0,2,0,0,0,0|1,0,0]=3 1304 B12R1.232 O=[N+]([O-])C1=CC(I)=C(Cl)C=C1O Q69283 [0,2,0,0,0,0|1,0,1]=4 1305 B12R1.452 CC1=CC(C#N)=CN=C1C(=O)O O29650 [0,2,0,0,0,0|2,0,0]=4 1306 B12R1.452 CC1=CC(C=O)=CC=C1C(=O)O N26360 [0,2,0,0,0,0|1,0,0]=3 1307 B12R1.452 CCC1=CC=C(C(=O)O)C(F)=C1 K12290 [0,2,0,0,0,0|1,0,0]=3 1308 B12R1.452 CCC1=CC=C(C(=O)O)C(N)=C1 K12293 [0,2,0,0,0,0|1,0,0]=3 1309 B12R1.452 COC1=CC(C)=C(C(=O)O)C=N1 Q67661 [0,2,0,0,0,0|2,0,0]=4 1310 B12R1.452 COC1=CC(N)=C(C(=O)O)C=N1 P44270 [0,2,0,0,0,0|2,0,0]=4 1311 B12R1.452 COC1=CC(O)=C(B(O)O)C=C1 N27743 [0,2,0,0,0,0|1,0,1]=4 1312 B12R1.452 COC1=CC=C(C(=O)O)C(C)=N1 N24695 [0,2,0,0,0,0|2,0,0]=4 1313 B12R1.452 COC1=CC=C(C(=O)O)C(Cl)=N1 N24433 [0,2,0,0,0,0|2,0,0]=4 1314 B12R1.452 COC1=CC=C(C(N)=O)C(N)=C1 M23146 [0,2,0,0,0,0|2,0,0]=4 1315 B12R1.452 COC1=CN=C(C(=O)O)C(C)=C1 Q60878 [0,2,0,0,0,0|2,0,0]=4 1316 B12R1.452 COC1=CN=C(C(=O)O)C(Cl)=C1 L13826 [0,2,0,0,0,0|2,0,0]=4 1317 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 P51606 [0,2,0,0,0,0|2,0,0]=4 1318 B12R1.452 COC1=NC=C(C(=O)O)C(C)=C1 Q60522 [0,2,0,0,0,0|2,0,0]=4 1319 B12R1.452 CSC1=CC=C(C(=O)O)C(C)=C1 N26500 [0,2,0,0,0,0|1,0,0]=3 1320 B12R1.452 CSC1=NC=C(C(=O)O)C(C)=C1 N27762 [0,2,0,0,0,0|2,0,0]=4 1321 B12R1.452 N#CC1=CC(Cl)=C(C(=O)O)C=C1 L21511 [0,2,0,0,0,0|1,0,0]=3 1322 B12R1.452 N#CC1=CC(Cl)=C(C(=O)O)N=C1 Q60499 [0,2,0,0,0,0|2,0,0]=4 1323 B12R1.452 N#CC1=CN=C(C(=O)O)C(F)=C1 O29919 [0,2,0,0,0,0|2,0,0]=4 1324 B12R1.452 NCC1=CC=C(C(=O)O)C(Cl)=C1 P42290 [0,2,0,0,0,0|1,0,0]=3 1325 B12R1.1703 CCC(=O)C1=CC=C(F)C=C1Cl O29563 [0,2,0,0,0,0|2,0,0]=4 1326 B12R1.1703 COC(=O)C1=C(Br)N=C(C)C=C1 Q62372 [0,2,0,0,0,0|2,0,0]=4 1327 B12R1.1703 COC(=O)C1=C(C)C=C(N)C=N1 Q56679 [0,2,0,0,0,0|2,0,0]=4 1328 B12R1.1703 COC(=O)C1=C(Cl)C=C(F)C=C1 C-3675 [0,2,0,0,0,0|1,0,0]=3 1329 B12R1.1703 COC(=O)C1=C(Cl)N=C(Br)C=C1 Q57231 [0,2,0,0,0,0|2,0,0]=4 1330 B12R1.1703 COC(=O)C1=C(Cl)N=C(Cl)C=C1 Q67449 [0,2,0,0,0,0|2,0,0]=4 1331 B12R1.1703 COC(=O)C1=C(N)C=C(C)N=C1 P44959 [0,2,0,0,0,0|2,0,0]=4 1332 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1Br N25439 [0,2,0,0,0,0|2,0,0]=4 1333 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1C O29091 [0,2,0,0,0,0|2,0,0]=4 1334 B12R1.1703 COC(=O)C1=CC=C(C)C=C1Cl Q67996 [0,2,0,0,0,0|1,0,0]=3 1335 B12R1.1703 COC(=O)C1=CC=C(C)C=C1F P36301 [0,2,0,0,0,0|1,0,0]=3 1336 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Cl O31910 [0,2,0,0,0,0|2,0,0]=4 1337 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1Br P37321 [0,2,0,0,0,0|1,0,0]=3 1338 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1C N25853 [0,2,0,0,0,0|2,0,0]=4 1339 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1N C-2358 [0,2,0,0,0,0|2,0,0]=4 1340 B12R1.1703 COC(=O)C1=CC=C(F)N=C1C N26081 [0,2,0,0,0,0|2,0,0]=4 1341 B12R1.1703 COC(=O)C1=CC=C(F)N=C1F Q67310 [0,2,0,0,0,0|2,0,0]=4 1342 B12R1.1703 COC(=O)C1=CC=C(N)C=C1Br F-4587 [0,2,0,0,0,0|1,0,0]=3 1343 B12R1.1703 COC(=O)C1=CC=C(N)N=C1Cl O30146 [0,2,0,0,0,0|2,0,0]=4 1344 B12R1.1703 COC(=O)C1=CC=C(O)C=C1Cl N24324 [0,2,0,0,0,0|1,0,0]=3 1345 B12R1.1703 COC(=O)C1=CC=C(O)C=C1F O29247 [0,2,0,0,0,0|1,0,0]=3 1346 B12R1.1703 COC(=O)C1=CN=C(Br)C=C1C N26797 [0,2,0,0,0,0|2,0,0]=4 1347 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1C N26194 [0,2,0,0,0,0|2,0,0]=4 1348 B12R1.1703 COC(=O)C1=CNC(=O)C=C1C Q57089 [0,2,0,0,0,0|2,0,0]=4 1349 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C N24191 [0,2,0,0,0,0|2,0,0]=4 1350 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1Cl O31878 [0,2,0,0,0,0|2,0,0]=4 1351 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1F G-7655 [0,2,0,0,0,0|2,0,0]=4 1352 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1N L13676 [0,2,0,0,0,0|2,0,0]=4 1353 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1O P44325 [0,2,0,0,0,0|1,0,0]=3 1354 B12R1.1703 COC(=O)C1=NC=C(C)C=C1Br O30162 [0,2,0,0,0,0|2,0,0]=4 1355 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1Br O31792 [0,2,0,0,0,0|2,0,0]=4 1356 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1F O31157 [0,2,0,0,0,0|2,0,0]=4 1357 B12R1.1703 COC(=O)C1=NC=C(F)C=C1Br O31049 [0,2,0,0,0,0|2,0,0]=4 1358 B12R1.1703 COC(=O)C1=NC=C(F)C=C1C Q54929 [0,2,0,0,0,0|2,0,0]=4 1359 B12R1.1703 COC(=O)C1=NC=C(F)C=C1Cl O29980 [0,2,0,0,0,0|2,0,0]=4 1360 B12R1.1703 COC(=O)C1=NC=C(F)C=C1F O30901 [0,2,0,0,0,0|2,0,0]=4 1361 B12R1.1703 COC(=O)C1=NC=C(F)C=C1N Q52646 [0,2,0,0,0,0|2,0,0]=4 1362 B12R1.1703 COC(=O)C1=NC=C(N)C=C1Cl O29989 [0,2,0,0,0,0|2,0,0]=4 1363 B12R1.1703 COC(=O)C1=NC=C(N)C=C1F O31421 [0,2,0,0,0,0|2,0,0]=4 1364 B12R1.1703 COC(=O)C1=NC=C(O)C=C1Cl O29588 [0,2,0,0,0,0|2,0,0]=4 1365 B12R1.1703 COC(=O)C1=NC=C(O)C=C1F L21939 [0,2,0,0,0,0|2,0,0]=4 1366 B12R1.1703 COC(=O)C1=NN=C(O)C=C1O K12460 [0,2,0,0,0,0|2,0,0]=4 1367 B12R1.1703 NCC(=O)C1=CC=C(Cl)C=C1Cl P36823 [0,2,0,0,0,0|2,0,0]=4 1368 B12R1.1703 NCC(=O)C1=CC=C(F)C=C1F P36056 [0,2,0,0,0,0|2,0,0]=4 1369 B12R1.1703 O=C(CBr)C1=CC=C(F)C=C1Cl O31207 [0,2,0,0,0,0|2,0,0]=4 1370 B12R1.1703 O=CC(=O)C1=CC=C(F)C=C1F P36005 [0,2,0,0,0,0|1,0,1]=4 1371 B12R1.354 COC(=O)C1=C(Br)C=CC(C)=N1 Q53064 [0,2,0,0,0,0|2,0,0]=4 1372 B12R1.354 COC(=O)C1=C(Br)C=CC(Cl)=N1 L14943 [0,2,0,0,0,0|2,0,0]=4 1373 B12R1.354 COC(=O)C1=C(Br)C=NC(Cl)=C1 Q68002 [0,2,0,0,0,0|2,0,0]=4 1374 B12R1.354 COC(=O)C1=C(C)N=CC(Cl)=C1 O32525 [0,2,0,0,0,0|2,0,0]=4 1375 B12R1.354 COC(=O)C1=C(F)C=NC(N)=C1 Q54918 [0,2,0,0,0,0|2,0,0]=4 1376 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=N1 L22304 [0,2,0,0,0,0|1,0,0]=3 1377 B12R1.354 COC(=O)C1=C(O)C=NC(Br)=C1 Q62293 [0,2,0,0,0,0|1,0,0]=3 1378 B12R1.354 COC(=O)C1=CC(Br)=CC=C1Cl P39362 [0,2,0,0,0,0|1,0,0]=3 1379 B12R1.354 COC(=O)C1=CC(Br)=CC=C1F Q67664 [0,2,0,0,0,0|1,0,0]=3 1380 B12R1.354 COC(=O)C1=CC(Br)=CN=C1Br Q67506 [0,2,0,0,0,0|2,0,0]=4 1381 B12R1.354 COC(=O)C1=CC(Br)=CN=C1F N24317 [0,2,0,0,0,0|2,0,0]=4 1382 B12R1.354 COC(=O)C1=CC(Br)=CNC1=O G-6765 [0,2,0,0,0,0|1,0,1]=4 1383 B12R1.354 COC(=O)C1=CC(Br)=NC=C1Br N25929 [0,2,0,0,0,0|2,0,0]=4 1384 B12R1.354 COC(=O)C1=CC(Br)=NC=C1F O30526 [0,2,0,0,0,0|2,0,0]=4 1385 B12R1.354 COC(=O)C1=CC(Br)=NC=C1N G-5063 [0,2,0,0,0,0|2,0,0]=4 1386 B12R1.354 COC(=O)C1=CC(C)=CC=C1Cl N24140 [0,2,0,0,0,0|1,0,0]=3 1387 B12R1.354 COC(=O)C1=CC(C)=CN=C1F N26166 [0,2,0,0,0,0|2,0,0]=4 1388 B12R1.354 COC(=O)C1=CC(Cl)=CC=C1I N24306 [0,2,0,0,0,0|1,0,0]=3 1389 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1Br N25893 [0,2,0,0,0,0|2,0,0]=4 1390 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1F N24942 [0,2,0,0,0,0|2,0,0]=4 1391 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1Cl N25259 [0,2,0,0,0,0|2,0,0]=4 1392 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1F N25133 [0,2,0,0,0,0|2,0,0]=4 1393 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1N O30171 [0,2,0,0,0,0|2,0,0]=4 1394 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1O Q62292 [0,2,0,0,0,0|1,0,0]=3 1395 B12R1.354 COC(=O)C1=CC(F)=CC=C1Cl Q68234 [0,2,0,0,0,0|1,0,0]=3 1396 B12R1.354 COC(=O)C1=CC(F)=CN=C1Br O30079 [0,2,0,0,0,0|2,0,0]=4 1397 B12R1.354 COC(=O)C1=CC(F)=CN=C1C Q62262 [0,2,0,0,0,0|2,0,0]=4 1398 B12R1.354 COC(=O)C1=CC(F)=CN=C1Cl I-9441 [0,2,0,0,0,0|2,0,0]=4 1399 B12R1.354 COC(=O)C1=CC(F)=CN=C1N Q53686 [0,2,0,0,0,0|2,0,0]=4 1400 B12R1.354 COC(=O)C1=CC(F)=NC=C1Br N27079 [0,2,0,0,0,0|2,0,0]=4 1401 B12R1.354 COC(=O)C1=CC(I)=CC=C1Br Q68603 [0,2,0,0,0,0|1,0,0]=3 1402 B12R1.354 COC(=O)C1=CC(I)=CC=C1F Q68001 [0,2,0,0,0,0|1,0,0]=3 1403 B12R1.354 COC(=O)C1=CC(O)=CN=C1Cl L18307 [0,2,0,0,0,0|2,0,0]=4 1404 B12R1.354 COC(=O)C1=NC(Br)=CC=C1Br P51148 [0,2,0,0,0,0|2,0,0]=4 1405 B12R1.354 COC(=O)C1=NC(Br)=CC=C1F O30961 [0,2,0,0,0,0|2,0,0]=4 1406 B12R1.354 COC(=O)C1=NC(Br)=CC=C1N O34325 [0,2,0,0,0,0|2,0,0]=4 1407 B12R1.354 COC(=O)C1=NC(C)=CC=C1F P43479 [0,2,0,0,0,0|2,0,0]=4 1408 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1C O30400 [0,2,0,0,0,0|2,0,0]=4 1409 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1N O34343 [0,2,0,0,0,0|2,0,0]=4 1410 B12R1.354 COC(=O)C1=NC(N)=CC=C1Br O34454 [0,2,0,0,0,0|2,0,0]=4 1411 B12R1.354 COC(=O)C1=NC(N)=CC=C1F Q63907 [0,2,0,0,0,0|2,0,0]=4 1412 B12R1.453 CC1=C(C(=O)O)C=C(C#N)C=N1 Q60659 [0,2,0,0,0,0|2,0,0]=4 1413 B12R1.453 CC1=CC=C(C=O)C=C1C(=O)O N24954 [0,2,0,0,0,0|1,0,0]=3 1414 B12R1.453 CCC1=CC(C(=O)O)=C(C)N=C1 Q60747 [0,2,0,0,0,0|2,0,0]=4 1415 B12R1.453 CCC1=CC=C(Br)C(C(=O)O)=C1 O32076 [0,2,0,0,0,0|1,0,0]=3 1416 B12R1.453 CCC1=CC=C(F)C(C(=O)O)=C1 O29092 [0,2,0,0,0,0|1,0,0]=3 1417 B12R1.453 CCC1=CC=C(I)C(C(=O)O)=C1 O29417 [0,2,0,0,0,0|1,0,0]=3 1418 B12R1.453 COC1=CC(C(=O)O)=C(Br)C=N1 Q66949 [0,2,0,0,0,0|2,0,0]=4 1419 B12R1.453 COC1=CC(C(=O)O)=C(C)N=C1 Q60882 [0,2,0,0,0,0|2,0,0]=4 1420 B12R1.453 COC1=CC(C(=O)O)=C(Cl)N=C1 G-7393 [0,2,0,0,0,0|2,0,0]=4 1421 B12R1.453 COC1=CC=C(C)C(C(=O)O)=C1 Q66691 [0,2,0,0,0,0|1,0,0]=3 1422 B12R1.453 COC1=CC=C(Cl)C(C(=O)O)=C1 Q66692 [0,2,0,0,0,0|1,0,0]=3 1423 B12R1.453 COC1=CC=C(F)C(C(=O)O)=C1 Q67721 [0,2,0,0,0,0|1,0,0]=3 1424 B12R1.453 COC1=CC=C(F)C(C(C)=O)=C1 Q69718 [0,2,0,0,0,0|2,0,0]=4 1425 B12R1.453 COC1=CC=C(O)C(B(O)O)=C1 Q67261 [0,2,0,0,0,0|1,0,1]=4 1426 B12R1.453 COC1=CN=C(F)C(C(=O)O)=C1 N26085 [0,2,0,0,0,0|2,0,0]=4 1427 B12R1.453 COC1=CN=C(O)C(C(C)=O)=C1 Q62403 [0,2,0,0,0,0|2,0,0]=4 1428 B12R1.453 COC1=NC=C(Cl)C(C(=O)O)=C1 Q67209 [0,2,0,0,0,0|2,0,0]=4 1429 B12R1.453 COC1=NC=C(N)C(C(=O)O)=C1 O33527 [0,2,0,0,0,0|2,0,0]=4 1430 B12R1.453 CSC1=CC=C(F)C(C(=O)O)=C1 N25477 [0,2,0,0,0,0|1,0,0]=3 1431 B12R1.453 NCC1=CC=C(Cl)C(C(=O)O)=C1 P35249 [0,2,0,0,0,0|1,0,0]=3 1432 B12R1.453 O=C(O)C1=CC(CO)=CC=C1Br P42410 [0,2,0,0,0,0|1,0,0]=3 1433 B12R1.453 O=CC1=CC(C(=O)O)=C(F)C=C1 N24848 [0,2,0,0,0,0|1,0,0]=3 1434 B12R1.453 O=CC1=CC=C(Br)C(C(=O)O)=C1 P43470 [0,2,0,0,0,0|1,0,0]=3 1435 B12R1.453 O=CC1=CC=C(Cl)C(C(=O)O)=C1 Q68578 [0,2,0,0,0,0|1,0,0]=3 1436 B12R1.453 O=CC1=CC=C(O)C(B(O)O)=C1 N24902 [0,2,0,0,0,0|1,0,1]=4 1437 B12R1.308 CC1=CC=CC=C1C(=O)CC#N P38597 [0,2,0,0,0,0|2,0,0]=4 1438 B12R1.308 CCCC(=O)C1=CC=CC=C1Cl P39717 [0,2,0,0,0,0|2,0,0]=4 1439 B12R1.308 CCOC(=O)C1=C(Br)C=CN=C1 Q68311 [0,2,0,0,0,0|2,0,0]=4 1440 B12R1.308 CCOC(=O)C1=C(C)C=CN=C1 Q52550 [0,2,0,0,0,0|2,0,0]=4 1441 B12R1.308 CCOC(=O)C1=C(Cl)C=NC=C1 N24826 [0,2,0,0,0,0|2,0,0]=4 1442 B12R1.308 CCOC(=O)C1=C(O)C=NC=C1 O31134 [0,2,0,0,0,0|1,0,0]=3 1443 B12R1.308 CCOC(=O)C1=CC=NC=C1Br N24339 [0,2,0,0,0,0|2,0,0]=4 1444 B12R1.308 CCOC(=O)C1=CC=NC=C1N P43437 [0,2,0,0,0,0|2,0,0]=4 1445 B12R1.308 CCOC(=O)C1=NC=CC=C1Br P38096 [0,2,0,0,0,0|2,0,0]=4 1446 B12R1.308 CCOC(=O)C1=NC=CC=C1F P43512 [0,2,0,0,0,0|2,0,0]=4 1447 B12R1.308 N#CCC(=O)C1=CC=CC=C1F O30850 [0,2,0,0,0,0|2,0,0]=4 1448 B12R1.308 N#CCC(=O)C1=CC=CC=C1I P40903 [0,2,0,0,0,0|2,0,0]=4 1449 B10R1.66 O=C(O)\C=C\C1=CC=CO1 P45498 [0,0,1,1,0,0|0,0,0]=2 1450 B10R1.23 NC(C(=O)O)C1=CC=CO1 P40590 [0,0,1,1,0,0|1,0,1]=4 1451 B10R2.7 B1OC2=C(C=CC=C2)O1 P39136 [1,0,0,1,0,0|2,0,0]=4 1452 B10R2.7 C1=CC2=C(C=CO2)C=N1 O30086 [1,0,0,1,0,0|2,0,0]=4 1453 B10R2.7 C1=CC2=C(C=CO2)N=C1 C-3657 [1,0,0,1,0,0|2,0,0]=4 1454 B10R2.7 C1=CN=C2OC=CC2=C1 O31056 [1,0,0,1,0,0|2,0,0]=4 1455 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 P39429 [0,0,0,1,0,1|2,0,0]=4 1456 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 O34499 [0,0,0,1,0,1|2,0,0]=4 1457 B12R2.24 O=C1COC2=NC=CC=C2N1 Q70041 [0,0,0,1,0,1|2,0,0]=4 1458 B12R2.24 O=C1CSC2=C(C=CC=C2)C1 P51461 [0,0,0,1,0,1|1,1,0]=4 1459 B12R2.24 OC1=CC2=CC=CC=C2C=N1 G-6644 [0,0,0,1,0,1|2,0,0]=4 1460 B12R2.24 OC1=CC2=CC=CC=C2N=C1 Q67519 [0,0,0,1,0,1|2,0,0]=4 1461 B12R2.95 O=P1(Cl)OC2=C(C=CC=C2)O1 10653 [0,0,0,1,0,1|2,0,0]=4 1462 B12R2.202 CC1=CC=CC2=C1CC(=O)N2 M15511 [0,0,0,1,0,1|2,0,0]=4 1463 B12R2.202 CC1=NC2=C(O)C=CC=C2S1 O29691 [0,0,0,1,0,1|1,1,0]=4 1464 B12R2.202 NC1=CC=CC2=C1CC(=O)N2 O30052 [0,0,0,1,0,1|2,0,0]=4 1465 B12R2.202 NC1=NC2=C(O)C=CC=C2S1 Q55820 [0,0,0,1,0,1|1,1,0]=4 1466 B12R2.202 NC1=NC2=CC=CC(O)=C2S1 L13188 [0,0,0,1,0,1|2,0,0]=4 1467 B12R2.202 O=C1CC2=C(C1)C(Br)=CC=C2 G-5797 [0,0,0,1,0,1|2,0,0]=4 1468 B12R2.202 O=C1CC2=C(C=CC=C2Br)N1 S86334 [0,0,0,1,0,1|2,0,0]=4 1469 B12R2.202 O=C1CC2=C(C=CC=C2I)N1 M15095 [0,0,0,1,0,1|2,0,0]=4 1470 B12R2.202 O=C1CC2=C(C=CC=C2O)N1 M15233 [0,0,0,1,0,1|1,0,0]=3 1471 B12R2.202 O=C1CC2=C(Cl)C=CC=C2N1 O32907 [0,0,0,1,0,1|2,0,0]=4 1472 B12R2.202 OC1=C2SC(Cl)=NC2=CC=C1 L13815 [0,0,0,1,0,1|2,0,0]=4 1473 B12R2.1081 O=C1C=NNC2=C1C=CC=C2 Q65380 [0,1,0,1,0,0|2,0,0]=4 1474 B12R2.1081 O=C1CCNC2=C1C=CC=C2 B-1121 [0,1,0,1,0,0|2,0,0]=4 1475 B12R2.1081 O=C1CCNC2=C1C=CC=C2 O34422 [0,1,0,1,0,0|2,0,0]=4 1476 B12R2.1081 O=C1COCC2=CC=CC=C12 C-2359 [0,1,0,1,0,0|1,0,0]=3 1477 B12R2.1081 O=C1NCCC2=C1C=CC=C2 O30459 [0,1,0,1,0,0|2,0,0]=4 1478 B12R2.1081 OC1=CN=CC2=C1C=CC=C2 O30770 [0,1,0,1,0,0|2,0,0]=4 1479 B12R2.1081 OC1=NC=CC2=C1C=CC=C2 P51313 [0,1,0,1,0,0|2,0,0]=4 1480 B12R2.1081 OC1=NC=NC2=C1C=CC=C2 G-7025 [0,1,0,1,0,0|2,0,0]=4 1481 B12R2.2028 CC1OB(O)C2=CC=CC=C21 N27110 [0,1,0,1,0,0|1,0,1]=4 1482 B12R2.2048 COC1=CC=CC=C1C2CO2 P45385 [0,1,0,1,0,0|1,0,1]=4 1483 B12R2.2048 COC1=CC=CC=C1[C@H]2CO2 O33513 [0,1,0,1,0,0|1,0,1]=4 1484 B12R2.203 CC1=CNC2=C1C(O)=CC=C2 Q55294 [0,1,0,1,0,0|2,0,0]=4 1485 B12R2.203 NC1=C2C(=O)NCC2=CC=C1 L13702 [0,1,0,1,0,0|2,0,0]=4 1486 B12R2.203 NC1=CC=CC2=C1C(=O)CC2 O30109 [0,1,0,1,0,0|2,0,0]=4 1487 B12R2.203 O=C1COC2=CC=CC(Br)=C12 P51087 [0,1,0,1,0,0|1,0,0]=3 1488 B12R2.203 O=C1NCC2=C1C(Br)=CC=C2 L22234 [0,1,0,1,0,0|2,0,0]=4 1489 B12R2.203 OC1=NNC2=C1C(Br)=CC=C2 Q56599 [0,1,0,1,0,0|2,0,0]=4 1490 B12R2.196 NC1=C2CNC(=O)C2=CC=C1 L13741 [0,1,0,1,0,0|2,0,0]=4 1491 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 E-3117 [0,1,0,1,0,0|2,0,0]=4 1492 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 C-2426 [0,1,0,1,0,0|2,0,0]=4 1493 B12R2.196 O=C1CCC2=C1C=CC=C2F P36547 [0,1,0,1,0,0|2,0,0]=4 1494 B12R2.196 O=C1COC2=C(Br)C=CC=C12 L22354 [0,1,0,1,0,0|1,0,0]=3 1495 B12R2.196 O=C1COC2=C1C=CC=C2F S72794 [0,1,0,1,0,0|1,0,0]=3 1496 B12R2.196 O=C1CSC2=C(F)C=CC=C12 L19573 [0,1,0,1,0,0|1,1,0]=4 1497 B12R2.196 O=C1NCC2=C1C=CC=C2Br A-616 [0,1,0,1,0,0|2,0,0]=4 1498 B12R2.196 O=C1NCC2=C1C=CC=C2O A-651 [0,1,0,1,0,0|2,0,0]=4 1499 B12R2.196 O=C1OCC2=C1C=CC=C2Br P42977 [0,1,0,1,0,0|1,0,0]=3 1500 B12R2.196 OC1=NNC2=C1C=CC=C2F M15118 [0,1,0,1,0,0|2,0,0]=4 1501 B12R2.612 NC1=CC2=C(C=C1)C(=O)NN2 O34341 [0,1,0,1,0,0|2,0,0]=4 1502 B12R2.612 NC1=CC=C2C(=O)NCC2=C1 C-2439 [0,1,0,1,0,0|2,0,0]=4 1503 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 O31598 [0,1,0,1,0,0|2,0,0]=4 1504 B12R2.612 O=C1COC2=CC(Br)=CC=C12 F-4089 [0,1,0,1,0,0|1,0,0]=3 1505 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 P51039 [0,1,0,1,0,0|2,0,0]=4 1506 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 O32491 [0,1,0,1,0,0|2,0,0]=4 1507 B12R2.612 O=C1NCC2=C1C=CC(I)=C2 M15861 [0,1,0,1,0,0|2,0,0]=4 1508 B12R2.612 O=C1NCC2=CC(Br)=CC=C12 D-2558 [0,1,0,1,0,0|2,0,0]=4 1509 B12R2.612 O=C1OCC2=CC(Cl)=NC=C12 L21981 [0,1,0,1,0,0|2,0,0]=4 1510 B12R2.612 OC1=NNC2=C1C=CC(Br)=C2 M15267 [0,1,0,1,0,0|2,0,0]=4 1511 B12R2.132 CC1=CC2=C(C=C1)ON=C2Cl L19234 [0,1,0,1,0,0|2,0,0]=4 1512 B12R2.132 ClC1=NOC2=CC=C(Br)C=C21 10619 [0,1,0,1,0,0|2,0,0]=4 1513 B12R2.132 NC1=CC2=C(C=C1)CNC2=O G-6420 [0,1,0,1,0,0|2,0,0]=4 1514 B12R2.132 NC1=CC2=C(C=C1)COC2=O P37328 [0,1,0,1,0,0|1,0,0]=3 1515 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 A-507 [0,1,0,1,0,0|2,0,0]=4 1516 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 I-9219 [0,1,0,1,0,0|2,0,0]=4 1517 B12R2.132 O=C1CCC2=C1C=C(I)C=C2 P41205 [0,1,0,1,0,0|2,0,0]=4 1518 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 A-509 [0,1,0,1,0,0|2,0,0]=4 1519 B12R2.132 O=C1COC2=CC=C(Br)C=C12 B-1771 [0,1,0,1,0,0|1,0,0]=3 1520 B12R2.132 O=C1COC2=CC=C(Cl)C=C12 B-1796 [0,1,0,1,0,0|1,0,0]=3 1521 B12R2.132 O=C1COC2=CC=C(F)C=C12 B-1139 [0,1,0,1,0,0|1,0,0]=3 1522 B12R2.132 O=C1NCC2=C1C=C(Br)C=C2 A-637 [0,1,0,1,0,0|2,0,0]=4 1523 B12R2.132 O=C1NCC2=C1C=C(F)C=C2 O33569 [0,1,0,1,0,0|2,0,0]=4 1524 B12R2.132 O=C1NOC2=CC=C(Br)C=C12 M15623 [0,1,0,1,0,0|1,0,0]=3 1525 B12R2.132 O=C1OCC2=CC=C(I)C=C12 L18429 [0,1,0,1,0,0|1,0,0]=3 1526 B12R2.1 C(=O)C1=CNC2=C1C=CC=C2 P45569 [0,1,0,1,0,0|2,0,0]=4 1527 B12R2.1 N#CC1=COC2=C1C=CC=C2 O34105 [0,1,0,1,0,0|2,0,0]=4 1528 B12R2.1 O=CC1=COC2=C1N=CC=C2 Q60417 [0,1,0,1,0,0|2,0,0]=4 1529 B12R2.1 O=CC1=COC2=CC=CC=C12 O34082 [0,1,0,1,0,0|1,0,0]=3 1530 B12R2.1 O=CC1=COC2=CC=NC=C12 Q60457 [0,1,0,1,0,0|2,0,0]=4 1531 B12R2.1 O=CC1=COC2=CN=CC=C12 Q60459 [0,1,0,1,0,0|2,0,0]=4 1532 B12R2.1 OCC1=NNC2=C1C=CC=C2 G-5612 [0,1,0,1,0,0|2,0,0]=4 1533 B12R2.1 OCC1=NOC2=NC=CC=C12 M15726 [0,1,0,1,0,0|2,0,0]=4 1534 B8R1.7 NC(=O)C1=CC=CN1 P38018 [1,0,0,0,1,0|2,0,0]=4 1535 B8R1.7 O=C(O)C1=CC=NS1 P51141 [1,0,0,0,1,0|2,0,0]=4 1536 B8R1.7 O=C(O)C1=CNN=C1 G-5584 [1,0,0,0,1,0|2,0,0]=4 1537 B8R1.7 O=C(O)C1=COC=N1 I-9284 [1,0,0,0,1,0|2,0,0]=4 1538 B8R1.7 O=C(O)C1=CSN=C1 L22423 [1,0,0,0,1,0|2,0,0]=4 1539 B8R1.7 O=C(O)C1=NC=CO1 F-4564 [1,0,0,0,1,0|2,0,0]=4 1540 B8R1.7 O=C(O)C1=NNC=C1 I-9172 [1,0,0,0,1,0|2,0,0]=4 1541 B8R1.7 O=C(O)C1=NSC=C1 O30998 [1,0,0,0,1,0|2,0,0]=4 1542 B8R1.11 CC1=C(C=O)C=CS1 O30366 [1,0,0,0,1,0|2,0,0]=4 1543 B8R1.11 CC1=CSC=C1C=O L14435 [1,0,0,0,1,0|2,0,0]=4 1544 B8R1.11 O=CC1=C(Br)C=CS1 Q66577 [1,0,0,0,1,0|2,0,0]=4 1545 B8R1.11 O=CC1=CSC=C1Br Q67166 [1,0,0,0,1,0|2,0,0]=4 1546 B12R1.125 CC(=O)NCC1=CC=CC=C1Br P36330 [0,0,0,0,0,2|2,0,0]=4 1547 B12R1.125 CC1=C(CCC(=O)O)C=CC=N1 Q60514 [0,0,0,0,0,2|2,0,0]=4 1548 B12R1.125 CC1=CC=CC=C1NCC(=O)O M22929 [0,0,0,0,0,2|1,0,0]=3 1549 B12R1.125 CC1=CC=NC=C1CCC(=O)O Q60489 [0,0,0,0,0,2|2,0,0]=4 1550 B12R1.125 CC1=CN=CC=C1CCC(=O)O Q60512 [0,0,0,0,0,2|2,0,0]=4 1551 B12R1.125 NC(=O)CCC1=CC=CC=C1Br P37474 [0,0,0,0,0,2|2,0,0]=4 1552 B12R1.125 NC1=CC=CC=C1CCC(=O)[O-] M22770 [0,0,0,0,0,2|1,0,1]=4 1553 B12R1.125 O=C(O)CCC1=CC=NC=C1Cl Q60724 [0,0,0,0,0,2|2,0,0]=4 1554 B12R1.125 O=C(O)CNC1=CC=CC=C1Br P38198 [0,0,0,0,0,2|1,0,0]=3 1555 B12R1.125 O=C(O)CNC1=CC=CC=C1F P37600 [0,0,0,0,0,2|1,0,0]=3 1556 B12R1.125 O=C(O)COC1=CC=CC=C1Cl M22951 [0,0,0,0,0,2|1,0,0]=3 1557 B12R1.125 O=C(O)COC1=NC=CC=C1F Q70039 [0,0,0,0,0,2|2,0,0]=4