0 B9R1.6 C=C(C)C1=CC=CC=C1 2826092 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.6 CC(=O)C1=CC=CC=C1 1043797 [0,0,0,0,0,0|1,0,0]=1 2 B9R1.6 CC(=O)C1=CC=CN=C1 1778688 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.6 CC(=O)C1=CC=NC=C1 2826148 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 CC(=O)C1=NC=CC=C1 2826149 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.6 CC(=O)C1=NC=CN=C1 15386267 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 CC(Br)C1=CC=CC=C1 2024133 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.6 CC(C)C1=CC=CC=C1 2826137 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.6 CC(N)C1=CC=CC=C1 1500421 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.6 CC(O)C1=NC=CC=C1 2422301 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.6 CN(C)C1=CC=CC=C1 2826155 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.6 CN(C)C1=CC=NC=C1 2826184 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.6 N=C(N)C1=CC=CC=C1 3337437 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.6 NC(=O)C1=CC=CC=C1 7113222106 [0,0,0,0,0,0|1,0,0]=1 14 B9R1.6 NC(=O)C1=NC=CN=C1 1375193 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.6 NC(=S)C1=CC=CC=C1 1001334 [0,0,0,0,0,0|1,1,0]=2 16 B9R1.6 NC(=S)C1=CC=CN=C1 2125389 [0,0,0,0,0,0|2,1,0]=3 17 B9R1.6 NC(=S)C1=CC=NC=C1 7020310245 [0,0,0,0,0,0|2,1,0]=3 18 B9R1.6 NC(=S)C1=NC=CC=C1 7213750105 [0,0,0,0,0,0|2,1,0]=3 19 B9R1.6 NC(=S)C1=NC=CC=N1 2818419 [0,0,0,0,0,0|3,1,0]=4 20 B9R1.6 NC(=S)C1=NC=CN=C1 2818418 [0,0,0,0,0,0|3,1,0]=4 21 B9R1.6 O=C(Cl)C1=CC=CN=C1 1051743 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.6 O=C(Cl)C1=CC=NC=C1 4787240 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.6 O=C(O)C1=CC=CC=C1 1778690 [0,0,0,0,0,0|0,0,0]=0 24 B9R1.6 O=C(O)C1=CC=CN=C1 2084332 [0,0,0,0,0,0|1,0,0]=1 25 B9R1.6 O=C(O)C1=CC=NC=C1 22430647 [0,0,0,0,0,0|1,0,0]=1 26 B9R1.6 O=C(O)C1=CC=NC=N1 0125330094 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.6 O=C(O)C1=CN=CC=N1 1051746 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.6 O=C(O)C1=NC=CC=C1 1051744 [0,0,0,0,0,0|1,0,0]=1 29 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 2826202 [0,0,0,0,0,0|1,0,1]=2 30 B9R1.6 OB(O)C1=CC=CC=C1 971211 [0,0,0,0,0,0|1,0,1]=2 31 B8R1.2 BrCC1=CC=CC=C1 2844339 [1,0,0,0,0,0|1,0,1]=3 32 B8R1.2 C=CC1=CC=NC=C1 2825664 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.2 CCC1=CC=CC=C1 2825676 [1,0,0,0,0,0|1,0,1]=3 34 B8R1.2 CNC1=CC=CC=C1 1366528 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.2 COC1=CC=CC=C1 2825706 [1,0,0,0,0,0|2,0,0]=3 36 B8R1.2 CSC1=CC=CC=C1 2826254 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.2 ClCC1=CC=CC=C1 1778716 [1,0,0,0,0,0|1,0,1]=3 38 B8R1.2 N#CC1=CC=CC=C1 1778585 [1,0,0,0,0,0|1,0,1]=3 39 B8R1.2 N#CC1=CC=CC=N1 2129613 [1,0,0,0,0,0|2,0,1]=4 40 B8R1.2 N#CC1=CC=CN=C1 2129614 [1,0,0,0,0,0|2,0,1]=4 41 B8R1.2 N#CC1=CC=NC=C1 2129615 [1,0,0,0,0,0|2,0,1]=4 42 B8R1.2 NCC1=CC=CC=C1 1038608 [1,0,0,0,0,0|1,0,1]=3 43 B8R1.2 NCC1=CC=CC=C1 6057147 [1,0,0,0,0,0|1,0,1]=3 44 B8R1.2 NCC1=CC=CN=C1 1038606 [1,0,0,0,0,0|2,0,1]=4 45 B8R1.2 NCC1=CC=NC=C1 1038607 [1,0,0,0,0,0|2,0,1]=4 46 B8R1.2 NNC1=CC=CC=C1 1156632 [1,0,0,0,0,0|2,0,0]=3 47 B8R1.2 NNC1=CC=CC=C1 6057168 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.2 NNC1=NC=CC=C1 1060375 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.2 O=CC1=CC=CC=C1 988591 [1,0,0,0,0,0|0,0,0]=1 50 B8R1.2 O=CC1=CC=CN=C1 2084334 [1,0,0,0,0,0|1,0,0]=2 51 B8R1.2 O=CC1=CC=NC=C1 988524 [1,0,0,0,0,0|1,0,0]=2 52 B8R1.2 O=CC1=NC=CC=C1 2084333 [1,0,0,0,0,0|1,0,0]=2 53 B8R1.2 OCC1=CC=CC=C1 1778593 [1,0,0,0,0,0|0,0,1]=2 54 B8R1.2 SCC1=CC=CC=C1 1972971 [1,0,0,0,0,0|0,1,1]=3 55 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 1043807 [0,1,0,0,0,0|1,0,0]=2 56 B10R1.13 CC(=O)C1=CC=C(C)C=C1 1043798 [0,1,0,0,0,0|1,0,0]=2 57 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 1043806 [0,1,0,0,0,0|1,0,0]=2 58 B10R1.13 CC(=O)C1=CC=C(F)C=C1 1043805 [0,1,0,0,0,0|1,0,0]=2 59 B10R1.13 CC(=O)C1=CC=C(N)C=C1 7119850616 [0,1,0,0,0,0|1,0,0]=2 60 B10R1.13 CC(=O)C1=CC=C(O)C=C1 1778865 [0,1,0,0,0,0|1,0,0]=2 61 B10R1.13 CC(C)C1=CC=C(N)C=C1 2827066 [0,1,0,0,0,0|2,0,1]=4 62 B10R1.13 CC(C)C1=CC=C(N)C=C1 3585954 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.13 CC(C)C1=CC=C(O)C=C1 2827119 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 1366992 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 1051709 [0,1,0,0,0,0|1,0,0]=2 66 B10R1.13 CC1=CC=C(C(=O)O)C=C1 7119561590 [0,1,0,0,0,0|0,0,0]=1 67 B10R1.13 CC1=CC=C(C(C)Br)C=C1 2024134 [0,1,0,0,0,0|2,0,1]=4 68 B10R1.13 CC1=CC=C(C(C)C)C=C1 2827025 [0,1,0,0,0,0|2,0,1]=4 69 B10R1.13 CC1=CC=C(C(C)O)C=C1 1366658 [0,1,0,0,0,0|1,0,1]=3 70 B10R1.13 CC1=CC=C(C(N)=O)C=C1 1106851 [0,1,0,0,0,0|1,0,0]=2 71 B10R1.13 CC1=CC=C(C(N)=S)C=C1 7020331312 [0,1,0,0,0,0|1,1,0]=3 72 B10R1.13 CC1=CC=C(C(N)=S)N=C1 5031441 [0,1,0,0,0,0|2,1,0]=4 73 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 2839025 [0,1,0,0,0,0|1,0,1]=3 74 B10R1.13 CC1=CC=C([N+](=O)[O-])C=C1 2827170 [0,1,0,0,0,0|1,0,1]=3 75 B10R1.13 CC1=CC=C([N+](=O)[O-])C=N1 6051754 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.13 CC1=CC=C([SH](=O)=O)C=C1 22430375 [0,1,0,0,0,0|1,0,1]=3 77 B10R1.13 CC1=NC=C(C(=O)O)C=C1 19767694 [0,1,0,0,0,0|1,0,0]=2 78 B10R1.13 CC1=NC=C(C(=O)O)N=C1 2827230 [0,1,0,0,0,0|2,0,0]=3 79 B10R1.13 CC1=NC=C(C(N)=O)C=C1 2827093 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.13 CC1=NC=C(C(N)=O)N=C1 2827177 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.13 CN(C)C1=CC=C(Br)C=C1 1362066 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.13 CN(C)C1=CC=C(N)C=C1 1512285 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.13 CN(N)C1=CC=C(F)C=C1 1778934 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 22588257 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 6057545 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.13 N=C(N)C1=CC=C(F)C=C1 22588245 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.13 N=C(N)C1=CC=C(N)C=C1 6300646 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.13 N=C(N)C1=CC=C(O)C=C1 2827095 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 1375914 [0,1,0,0,0,0|1,0,0]=2 90 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 1375258 [0,1,0,0,0,0|1,0,0]=2 91 B10R1.13 NC(=O)C1=CC=C(F)C=C1 1375215 [0,1,0,0,0,0|1,0,0]=2 92 B10R1.13 NC(=O)C1=CC=C(I)C=C1 1445657 [0,1,0,0,0,0|1,0,0]=2 93 B10R1.13 NC(=O)C1=CC=C(N)C=C1 1375210 [0,1,0,0,0,0|1,0,0]=2 94 B10R1.13 NC(=O)C1=CC=C(O)C=C1 1375211 [0,1,0,0,0,0|1,0,0]=2 95 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 1792547 [0,1,0,0,0,0|1,1,0]=3 96 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 7020331320 [0,1,0,0,0,0|1,1,0]=3 97 B10R1.13 NC(=S)C1=CC=C(F)C=C1 7020331313 [0,1,0,0,0,0|1,1,0]=3 98 B10R1.13 NC1=CC=C(B(O)O)C=C1 19767697 [0,1,0,0,0,0|1,0,1]=3 99 B10R1.13 NC1=CC=C(C(=O)O)C=C1 1509951 [0,1,0,0,0,0|0,0,0]=1 100 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 2827229 [0,1,0,0,0,0|1,0,1]=3 101 B10R1.13 NC1=CC=C([N+](=O)[O-])C=N1 7020151022 [0,1,0,0,0,0|2,0,1]=4 102 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 1051742 [0,1,0,0,0,0|1,0,0]=2 103 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 1051712 [0,1,0,0,0,0|1,0,0]=2 104 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 1312865 [0,1,0,0,0,0|0,0,0]=1 105 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 1312854 [0,1,0,0,0,0|0,0,0]=1 106 B10R1.13 O=C(O)C1=CC=C(F)C=C1 1506397 [0,1,0,0,0,0|0,0,0]=1 107 B10R1.13 O=C(O)C1=CC=C(I)C=C1 3054307 [0,1,0,0,0,0|0,0,0]=1 108 B10R1.13 O=C(O)C1=CC=C(O)C=C1 1195424 [0,1,0,0,0,0|0,0,0]=1 109 B10R1.13 O=C(O)C1=CC=C(S)C=C1 2829768 [0,1,0,0,0,0|0,0,0]=1 110 B10R1.13 O=C(O)C1=CC=N(=O)C=C1 12405061 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 2830995 [0,1,0,0,0,0|1,0,0]=2 112 B10R1.13 O=C(O)C1=CN=C(O)C=C1 5970174 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 4015292 [0,1,0,0,0,0|2,0,0]=3 114 B10R1.13 O=C(O)C1=NC=C(O)C=C1 3354843 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.13 O=C(O)C1=NC=C(O)N=C1 5010111 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 3458596 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.13 O=C1C=CC(C(=O)O)=CN1 1313836 [0,1,0,0,0,0|1,0,0]=2 118 B10R1.13 O=C1C=CC(C(=O)O)=NN1 7020410148 [0,1,0,0,0,0|2,0,0]=3 119 B10R1.13 O=C1C=CC([N+](=O)[O-])=CN1 1313837 [0,1,0,0,0,0|2,0,1]=4 120 B10R1.13 O=S(Cl)C1=CC=C(Cl)C=C1 3519061 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 2830996 [0,1,0,0,0,0|1,0,1]=3 122 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)N=C1 7020151025 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 2827558 [0,1,0,0,0,0|1,0,1]=3 124 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 2827327 [0,1,0,0,0,0|1,0,1]=3 125 B10R1.13 O=[N+]([O-])C1=CC=C(O)N=C1 7020151026 [0,1,0,0,0,0|2,0,1]=4 126 B10R1.13 O=[N+]([O-])C1=CC=[N+]([O-])C=C1 2827421 [0,1,0,0,0,0|2,0,1]=4 127 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=C1 2974219 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.13 O=[N+]([O-])C1=CN=C(S)C=C1 2830290 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.13 O=[N+]([O-])C1=NC=C(Cl)C=C1 2831418 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 1179227 [0,1,0,0,0,0|1,0,1]=3 131 B10R1.13 OB(O)C1=CC=C(F)C=C1 1179206 [0,1,0,0,0,0|1,0,1]=3 132 B10R1.15 CC(C#N)C1=CC=CC=C1 1204062 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.15 CC(NO)C1=CC=CC=C1 1204024 [0,1,0,0,0,0|1,0,1]=3 134 B10R1.15 CCC(=O)C1=CC=CC=C1 1043816 [0,1,0,0,0,0|1,0,0]=2 135 B10R1.15 CCC(C)C1=CC=CC=C1 2827022 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.15 CCC(N)C1=CC=CC=C1 1146635 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.15 CN(C=O)C1=CC=CC=C1 2818161 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.15 CNC(=O)C1=CC=CC=C1 5032223 [0,1,0,0,0,0|1,0,0]=2 139 B10R1.15 COC(=O)C1=CC=CC=C1 2132029 [0,1,0,0,0,0|0,0,0]=1 140 B10R1.15 COC(=O)C1=CC=NC=C1 2084305 [0,1,0,0,0,0|1,0,0]=2 141 B10R1.15 COC(=O)C1=NC=CC=C1 1311479 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.15 CSC(=N)C1=CC=CC=C1 22430530 [0,1,0,0,0,0|1,1,0]=3 143 B10R1.15 C\C(=N/O)C1=CC=CC=C1 2827049 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.15 C\C(=N/O)C1=NC=CC=C1 5011323 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.15 NCC(=O)C1=CC=CC=C1 1042947 [0,1,0,0,0,0|1,0,0]=2 146 B10R1.15 NNC(=O)C1=CC=CC=C1 1778868 [0,1,0,0,0,0|1,0,0]=2 147 B10R1.15 N\C(=N\O)C1=CC=CC=C1 4434547 [0,1,0,0,0,0|1,0,0]=2 148 B10R1.15 O=C(CBr)C1=CC=CC=C1 2125402 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.15 O=C(CBr)C1=CC=NC=C1 5980437 [0,1,0,0,0,0|2,0,0]=3 150 B10R1.15 O=C(CBr)C1=CN=CC=C1 4763913 [0,1,0,0,0,0|2,0,0]=3 151 B10R1.15 O=CC(=O)C1=CC=CC=C1 2826987 [0,1,0,0,0,0|0,0,1]=2 152 B10R1.15 OC(CCl)C1=CC=CC=C1 1500436 [0,1,0,0,0,0|1,0,1]=3 153 B10R1.28 CC(C)(C)C1=CC=CC=C1 2827021 [0,1,0,0,0,0|2,0,1]=4 154 B10R1.28 CC(C)(O)C1=CC=NC=C1 5028374 [0,1,0,0,0,0|2,0,1]=4 155 B10R1.28 ClC(Cl)(Cl)C1=CC=CC=C1 2961679 [0,1,0,0,0,0|2,0,1]=4 156 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 1051762 [0,1,0,0,0,0|1,0,1]=3 157 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 4194516 [0,1,0,0,0,0|1,0,0]=2 158 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 1287341 [0,1,0,0,0,0|1,0,0]=2 159 B10R1.61 CC(=O)C1=C(F)C=NC=C1 6902362 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.61 CC(=O)C1=C(O)C=CC=C1 1778867 [0,1,0,0,0,0|1,0,0]=2 161 B10R1.61 CC(=O)C1=CC=CC=C1N 2827048 [0,1,0,0,0,0|1,0,0]=2 162 B10R1.61 CC(C)C1=C(N)C=CC=C1 2827067 [0,1,0,0,0,0|2,0,1]=4 163 B10R1.61 CC(C)C1=C(O)C=CC=C1 2827124 [0,1,0,0,0,0|2,0,1]=4 164 B10R1.61 CC(O)C1=C(F)C=NC=C1 6902371 [0,1,0,0,0,0|2,0,1]=4 165 B10R1.61 CC1=C(C(=O)Cl)C=CC=C1 1051707 [0,1,0,0,0,0|1,0,0]=2 166 B10R1.61 CC1=C(C(=O)O)N=CC=C1 2818254 [0,1,0,0,0,0|1,0,0]=2 167 B10R1.61 CC1=C(C(N)=O)C=CC=C1 1375207 [0,1,0,0,0,0|1,0,0]=2 168 B10R1.61 CC1=C([N+](=O)[O-])C=CC=C1 2827169 [0,1,0,0,0,0|1,0,1]=3 169 B10R1.61 CC1=CC=CC=C1C(=O)O 1901857 [0,1,0,0,0,0|0,0,0]=1 170 B10R1.61 CC1=CC=CC=C1C(N)=S 1288011 [0,1,0,0,0,0|1,1,0]=3 171 B10R1.61 CC1=NN=CC=C1C(=O)O 4059593 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.61 CN(C)C1=C(Br)C=CC=C1 3485526 [0,1,0,0,0,0|3,0,0]=4 173 B10R1.61 N=C(N)C1=C(F)C=CC=C1 3515450 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.61 NC(=O)C1=CC=CC=C1N 0125330235 [0,1,0,0,0,0|1,0,0]=2 175 B10R1.61 NC(=O)C1=CC=CC=C1O 2131902 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.61 NC(=S)C1=C(Cl)C=CC=C1 7020331321 [0,1,0,0,0,0|1,1,0]=3 177 B10R1.61 NC(=S)C1=C(F)C=CC=C1 7020331314 [0,1,0,0,0,0|1,1,0]=3 178 B10R1.61 NC1=C(C(=O)O)C=CC=C1 3585810 [0,1,0,0,0,0|0,0,0]=1 179 B10R1.61 NC1=C([N+](=O)[O-])C=NC=C1 2215007 [0,1,0,0,0,0|2,0,1]=4 180 B10R1.61 NC1=CC=CC=C1[N+](=O)[O-] 2128520 [0,1,0,0,0,0|1,0,1]=3 181 B10R1.61 NC1=NC=CC=C1[N+](=O)[O-] 1197690 [0,1,0,0,0,0|2,0,1]=4 182 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl 1051740 [0,1,0,0,0,0|1,0,0]=2 183 B10R1.61 O=C(Cl)C1=CC=CC=C1F 1051710 [0,1,0,0,0,0|1,0,0]=2 184 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 3686191 [0,1,0,0,0,0|1,0,0]=2 185 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 1902292 [0,1,0,0,0,0|0,0,0]=1 186 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 2830994 [0,1,0,0,0,0|1,0,0]=2 187 B10R1.61 O=C(O)C1=C(I)C=CC=C1 3054308 [0,1,0,0,0,0|0,0,0]=1 188 B10R1.61 O=C(O)C1=C(S)C=CC=C1 2829766 [0,1,0,0,0,0|0,0,0]=1 189 B10R1.61 O=C(O)C1=CC=CC=C1Br 7119571920 [0,1,0,0,0,0|0,0,0]=1 190 B10R1.61 O=C(O)C1=CC=CC=C1F 1901890 [0,1,0,0,0,0|0,0,0]=1 191 B10R1.61 O=C(O)C1=CC=CC=C1O 2129564 [0,1,0,0,0,0|0,0,0]=1 192 B10R1.61 O=C(O)C1=CC=CNC1=O 4059409 [0,1,0,0,0,0|1,0,0]=2 193 B10R1.61 O=C(O)C1=NC=NC=C1Br 1157350 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 2830993 [0,1,0,0,0,0|1,0,1]=3 195 B10R1.61 O=[N+]([O-])C1=C(Cl)N=CC=C1 2831417 [0,1,0,0,0,0|2,0,1]=4 196 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 2827556 [0,1,0,0,0,0|1,0,1]=3 197 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 7211720040 [0,1,0,0,0,0|1,0,1]=3 198 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=N1 2827420 [0,1,0,0,0,0|2,0,1]=4 199 B10R1.61 O=[N+]([O-])C1=CC=CC=C1Br 1362061 [0,1,0,0,0,0|1,0,1]=3 200 B10R1.61 OB(O)C1=C(F)C=CC=C1 1586067 [0,1,0,0,0,0|1,0,1]=3 201 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 1287349 [0,1,0,0,0,0|1,0,0]=2 202 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 1287348 [0,1,0,0,0,0|1,0,0]=2 203 B10R1.113 CC(=O)C1=CC(N)=CC=C1 1366640 [0,1,0,0,0,0|1,0,0]=2 204 B10R1.113 CC(=O)C1=CC=CC(O)=C1 1901859 [0,1,0,0,0,0|1,0,0]=2 205 B10R1.113 CC(C)C1=CC=CC(O)=C1 2827127 [0,1,0,0,0,0|2,0,1]=4 206 B10R1.113 CC1=CC(C(=O)O)=CN=C1 2818253 [0,1,0,0,0,0|1,0,0]=2 207 B10R1.113 CC1=CC([N+](=O)[O-])=CC=C1 2827171 [0,1,0,0,0,0|1,0,1]=3 208 B10R1.113 CC1=CC=CC(C(=N)N)=C1 5012379 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 1051708 [0,1,0,0,0,0|1,0,0]=2 210 B10R1.113 CC1=CC=CC(C(=O)O)=C1 1901858 [0,1,0,0,0,0|0,0,0]=1 211 B10R1.113 CC1=CC=CC(C(=O)O)=N1 2214917 [0,1,0,0,0,0|1,0,0]=2 212 B10R1.113 CC1=CC=CC(C(N)=O)=C1 1375208 [0,1,0,0,0,0|1,0,0]=2 213 B10R1.113 CC1=NC=CC(C(=O)O)=C1 3666565 [0,1,0,0,0,0|1,0,0]=2 214 B10R1.113 CN(C)C1=CC=CC(Br)=C1 1287426 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.113 CN(C)C1=CC=CC(N)=C1 1232815 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.113 NC(=O)C1=CC(Cl)=CC=C1 1375257 [0,1,0,0,0,0|1,0,0]=2 217 B10R1.113 NC(=O)C1=CC=C[N+]([O-])=C1 3463886 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 7217960159 [0,1,0,0,0,0|1,0,1]=3 219 B10R1.113 NC1=CC=CC(C(=O)O)=C1 2827166 [0,1,0,0,0,0|0,0,0]=1 220 B10R1.113 NC1=CN=CC(C(=O)O)=C1 7017520056 [0,1,0,0,0,0|1,0,0]=2 221 B10R1.113 NC1=NC(C(=O)O)=CC=C1 1218791 [0,1,0,0,0,0|1,0,0]=2 222 B10R1.113 NC1=NC=CC(C(=O)O)=C1 2214529 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.113 O=C(Cl)C1=CC=CC(Br)=C1 1051714 [0,1,0,0,0,0|1,0,0]=2 224 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 1051741 [0,1,0,0,0,0|1,0,0]=2 225 B10R1.113 O=C(Cl)C1=CC=CC(F)=C1 1051711 [0,1,0,0,0,0|1,0,0]=2 226 B10R1.113 O=C(Cl)C1=NC=NC(Cl)=C1 7154126 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.113 O=C(O)C1=CC(=S)NC=C1 13577371 [0,1,0,0,0,0|1,0,0]=2 228 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 973807 [0,1,0,0,0,0|0,0,0]=1 229 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 2214915 [0,1,0,0,0,0|1,0,0]=2 230 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 3508030 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.113 O=C(O)C1=CC(F)=CC=C1 1901891 [0,1,0,0,0,0|0,0,0]=1 232 B10R1.113 O=C(O)C1=CC(O)=NC=C1 2223344 [0,1,0,0,0,0|1,0,0]=2 233 B10R1.113 O=C(O)C1=CC(S)=NC=C1 2223361 [0,1,0,0,0,0|1,0,0]=2 234 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 1906408 [0,1,0,0,0,0|0,0,0]=1 235 B10R1.113 O=C(O)C1=CC=CC(O)=C1 2827221 [0,1,0,0,0,0|0,0,0]=1 236 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 0109160011 [0,1,0,0,0,0|1,0,0]=2 237 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 5110090024 [0,1,0,0,0,0|1,0,0]=2 238 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 7017520050 [0,1,0,0,0,0|1,0,0]=2 239 B10R1.113 O=C(O)C1=NC=CC(O)=C1 7017520047 [0,1,0,0,0,0|1,0,0]=2 240 B10R1.113 O=C1C=C(C(=O)O)N=CN1 3508017 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.113 O=[N+]([O-])C1=CC(Cl)=NC=C1 7017520053 [0,1,0,0,0,0|2,0,1]=4 242 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 1362062 [0,1,0,0,0,0|1,0,1]=3 243 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 2827328 [0,1,0,0,0,0|1,0,1]=3 244 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 1179274 [0,1,0,0,0,0|1,0,1]=3 245 B10R1.113 OB(O)C1=CC=CC(F)=C1 1586087 [0,1,0,0,0,0|1,0,1]=3 246 B10R2.6 C1=CC=C(C2CN2)C=C1 4194135 [0,0,0,1,0,0|2,0,1]=4 247 B10R2.6 C1=CC=C(C2CO2)C=C1 1205184 [0,0,0,1,0,0|1,0,1]=3 248 B8R1.7 C1=NC(C(=O)O)=CS1 1088027 [0,0,0,0,1,0|2,0,0]=3 249 B8R1.7 CC(=O)C1=CC=CO1 1778595 [0,0,0,0,1,0|2,0,0]=3 250 B8R1.7 CC(=O)C1=CC=CS1 14605036 [0,0,0,0,1,0|2,0,0]=3 251 B8R1.7 CC(=O)C1=CN=CS1 2422437 [0,0,0,0,1,0|3,0,0]=4 252 B8R1.7 CC(O)C1=CC=CS1 1366588 [0,0,0,0,1,0|2,0,1]=4 253 B8R1.7 N=C(N)C1=CC=CS1 22588250 [0,0,0,0,1,0|3,0,0]=4 254 B8R1.7 N=C(N)C1=CSC=C1 22588249 [0,0,0,0,1,0|3,0,0]=4 255 B8R1.7 NC(=O)C1=CSC=N1 2422477 [0,0,0,0,1,0|3,0,0]=4 256 B8R1.7 NC(=S)C1=CC=CS1 7020331311 [0,0,0,0,1,0|2,1,0]=4 257 B8R1.7 O=C(Cl)C1=CC=CO1 1051704 [0,0,0,0,1,0|2,0,0]=3 258 B8R1.7 O=C(Cl)C1=CC=CS1 1051705 [0,0,0,0,1,0|2,0,0]=3 259 B8R1.7 O=C(O)C1=CC=CN1 2825772 [0,0,0,0,1,0|1,0,0]=2 260 B8R1.7 O=C(O)C1=CC=CO1 2825796 [0,0,0,0,1,0|1,0,0]=2 261 B8R1.7 O=C(O)C1=CC=CS1 1509751 [0,0,0,0,1,0|1,0,0]=2 262 B8R1.7 O=C(O)C1=CN=CO1 3488494 [0,0,0,0,1,0|2,0,0]=3 263 B8R1.7 O=C(O)C1=COC=C1 2825797 [0,0,0,0,1,0|1,0,0]=2 264 B8R1.7 O=C(O)C1=CSC=N1 2225865 [0,0,0,0,1,0|2,0,0]=3 265 B8R1.7 O=C(O)C1=CSN=N1 3665882 [0,0,0,0,1,0|3,0,0]=4 266 B8R1.7 O=C(O)C1=NNC=C1 2128182 [0,0,0,0,1,0|2,0,0]=3 267 B8R1.7 O=C(O)C1=NON=C1 5970752 [0,0,0,0,1,0|3,0,0]=4 268 B8R1.7 OB(O)C1=CC=CS1 2817633 [0,0,0,0,1,0|2,0,1]=4 269 B10R1.18 CC(=O)NC1=CC=CC=C1 0118671148 [0,0,0,0,0,1|1,0,0]=2 270 B10R1.18 CC(=O)OC1=CC=CC=C1 5970182 [0,0,0,0,0,1|1,0,0]=2 271 B10R1.18 CC(C)NC1=CC=CC=C1 1220423 [0,0,0,0,0,1|2,0,1]=4 272 B10R1.18 CN(C)CC1=CC=CC=C1 2827061 [0,0,0,0,0,1|3,0,0]=4 273 B10R1.18 FC(F)SC1=CC=CC=C1 1779696 [0,0,0,0,0,1|2,0,1]=4 274 B10R1.18 NC(=O)NC1=CC=CC=C1 1778870 [0,0,0,0,0,1|1,0,0]=2 275 B10R1.18 NC(=S)CC1=CC=CC=C1 7018890438 [0,0,0,0,0,1|1,1,0]=3 276 B10R1.18 NC(=S)NC1=CC=CC=C1 1001333 [0,0,0,0,0,1|1,1,0]=3 277 B10R1.18 O=C(Cl)CC1=CC=CC=C1 1051728 [0,0,0,0,0,1|1,0,0]=2 278 B10R1.18 O=C(O)CC1=CC=CC=C1 1500423 [0,0,0,0,0,1|0,0,0]=1 279 B7R0.4 C\C=C\C=C\C(=O)O 5810252 [1,0,1,0,0,0|0,0,1]=3 280 B7R1.3 BrC1=CC=CC=C1 1362060 [2,0,0,0,0,0|1,0,0]=3 281 B7R1.3 BrC1=CC=CN=C1 1361113 [2,0,0,0,0,0|2,0,0]=4 282 B7R1.3 BrC1=CC=NC=C1 1361114 [2,0,0,0,0,0|2,0,0]=4 283 B7R1.3 BrC1=NC=CC=C1 1361112 [2,0,0,0,0,0|2,0,0]=4 284 B7R1.3 CC1=CC=CC=C1 3585912 [2,0,0,0,0,0|0,0,1]=3 285 B7R1.3 CC1=CC=NC=C1 2825452 [2,0,0,0,0,0|1,0,1]=4 286 B7R1.3 CC1=CN=CC=C1 2825453 [2,0,0,0,0,0|1,0,1]=4 287 B7R1.3 CC1=NC=CC=C1 2825451 [2,0,0,0,0,0|1,0,1]=4 288 B7R1.3 ClC1=CC=CC=C1 2825843 [2,0,0,0,0,0|1,0,0]=3 289 B7R1.3 ClC1=NC=CC=C1 2825881 [2,0,0,0,0,0|2,0,0]=4 290 B7R1.3 FC1=CC=CC=C1 2825477 [2,0,0,0,0,0|1,0,0]=3 291 B7R1.3 IC1=CC=CC=C1 3040212 [2,0,0,0,0,0|1,0,0]=3 292 B7R1.3 IC1=CC=CN=C1 5012913 [2,0,0,0,0,0|2,0,0]=4 293 B7R1.3 NC1=CC=CC=C1 2825450 [2,0,0,0,0,0|1,0,0]=3 294 B7R1.3 NC1=CC=CC=C1 5753507 [2,0,0,0,0,0|1,0,0]=3 295 B7R1.3 NC1=CC=NC=C1 2825458 [2,0,0,0,0,0|2,0,0]=4 296 B7R1.3 NC1=CN=CC=C1 7119850615 [2,0,0,0,0,0|2,0,0]=4 297 B7R1.3 NC1=NC=CC=C1 2825459 [2,0,0,0,0,0|2,0,0]=4 298 B7R1.3 O=C1C=CC=CN1 2024672 [2,0,0,0,0,0|1,0,0]=3 299 B7R1.3 OC1=CC=CC=C1 2825456 [2,0,0,0,0,0|0,0,0]=2 300 B7R1.3 OC1=CC=CN=C1 22430584 [2,0,0,0,0,0|1,0,0]=3 301 B7R1.3 SC1=CC=CC=C1 2825764 [2,0,0,0,0,0|0,1,0]=3 302 B7R1.3 SC1=NC=CC=C1 3585967 [2,0,0,0,0,0|1,1,0]=4 303 B7R1.3 [O-][N+]1=CC=CC=C1 6057284 [2,0,0,0,0,0|1,0,1]=4 304 B9R1.1 CC1=CC=C(C#N)C=C1 1778674 [1,1,0,0,0,0|1,0,1]=4 305 B9R1.1 CC1=CC=C(C=O)C=C1 1901707 [1,1,0,0,0,0|0,0,0]=2 306 B9R1.1 CC1=CC=C(CCl)C=C1 1778944 [1,1,0,0,0,0|1,0,1]=4 307 B9R1.1 CC1=CC=C(CN)C=C1 7020330616 [1,1,0,0,0,0|1,0,1]=4 308 B9R1.1 CC1=CC=C(NN)C=C1 1156633 [1,1,0,0,0,0|2,0,0]=4 309 B9R1.1 CC1=CC=C(NN)C=C1 2831425 [1,1,0,0,0,0|2,0,0]=4 310 B9R1.1 CC1=NC=C(C=O)C=C1 2652418 [1,1,0,0,0,0|1,0,0]=3 311 B9R1.1 CCC1=CC=C(Br)C=C1 1904109 [1,1,0,0,0,0|1,0,1]=4 312 B9R1.1 CCC1=CC=C(N)C=C1 1271733 [1,1,0,0,0,0|1,0,1]=4 313 B9R1.1 CCC1=CC=C(O)C=C1 1506641 [1,1,0,0,0,0|1,0,1]=4 314 B9R1.1 CNC1=CC=C(O)C=C1 2216139 [1,1,0,0,0,0|2,0,0]=4 315 B9R1.1 COC1=CC=C(Br)C=C1 1287415 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.1 COC1=CC=C(C)C=C1 2125386 [1,1,0,0,0,0|2,0,0]=4 317 B9R1.1 COC1=CC=C(F)C=C1 2826315 [1,1,0,0,0,0|2,0,0]=4 318 B9R1.1 COC1=CC=C(N)C=C1 1314578 [1,1,0,0,0,0|2,0,0]=4 319 B9R1.1 COC1=CC=C(O)C=C1 2826230 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.1 ClCC1=CC=C(Cl)C=C1 1779740 [1,1,0,0,0,0|1,0,1]=4 321 B9R1.1 FC1=CC=C(CCl)C=C1 1779086 [1,1,0,0,0,0|1,0,1]=4 322 B9R1.1 N#CC1=CC=C(Br)C=C1 1506352 [1,1,0,0,0,0|1,0,1]=4 323 B9R1.1 N#CC1=CC=C(Cl)C=C1 7119850520 [1,1,0,0,0,0|1,0,1]=4 324 B9R1.1 N#CC1=CC=C(F)C=C1 1506429 [1,1,0,0,0,0|1,0,1]=4 325 B9R1.1 N#CC1=CC=C(N)C=C1 1509976 [1,1,0,0,0,0|1,0,1]=4 326 B9R1.1 N#CC1=CC=C(O)C=C1 2826111 [1,1,0,0,0,0|1,0,1]=4 327 B9R1.1 NC1=CC=C(N=O)C=C1 3354442 [1,1,0,0,0,0|1,0,0]=3 328 B9R1.1 NCC1=CC=C(Br)C=C1 1782635 [1,1,0,0,0,0|1,0,1]=4 329 B9R1.1 NCC1=CC=C(Cl)C=C1 1038614 [1,1,0,0,0,0|1,0,1]=4 330 B9R1.1 NCC1=CC=C(F)C=C1 5946938 [1,1,0,0,0,0|1,0,1]=4 331 B9R1.1 NCC1=CC=C(F)C=C1 7020330617 [1,1,0,0,0,0|1,0,1]=4 332 B9R1.1 NCC1=CC=C(O)C=C1 2084288 [1,1,0,0,0,0|1,0,1]=4 333 B9R1.1 NNC1=CC=C(Br)C=C1 1156639 [1,1,0,0,0,0|2,0,0]=4 334 B9R1.1 NNC1=CC=C(Br)C=C1 22430444 [1,1,0,0,0,0|2,0,0]=4 335 B9R1.1 NNC1=CC=C(Cl)C=C1 1156638 [1,1,0,0,0,0|2,0,0]=4 336 B9R1.1 NNC1=CC=C(Cl)C=C1 3463727 [1,1,0,0,0,0|2,0,0]=4 337 B9R1.1 NNC1=CC=C(F)C=C1 4434688 [1,1,0,0,0,0|2,0,0]=4 338 B9R1.1 O=C1C=CC(=NO)C=C1 5974233 [1,1,0,0,0,0|1,0,0]=3 339 B9R1.1 O=CC1=CC=C(Br)C=C1 988590 [1,1,0,0,0,0|0,0,0]=2 340 B9R1.1 O=CC1=CC=C(Cl)C=C1 1901925 [1,1,0,0,0,0|0,0,0]=2 341 B9R1.1 O=CC1=CC=C(F)C=C1 1901719 [1,1,0,0,0,0|0,0,0]=2 342 B9R1.1 O=CC1=CC=C(O)C=C1 1194810 [1,1,0,0,0,0|0,0,0]=2 343 B9R1.1 O=NC1=CC=C(O)C=C1 11185890 [1,1,0,0,0,0|1,0,0]=3 344 B9R1.1 OCC1=CC=C(Cl)C=C1 1779009 [1,1,0,0,0,0|0,0,1]=3 345 B9R1.1 OCC1=CC=C(F)C=C1 1778712 [1,1,0,0,0,0|0,0,1]=3 346 B9R1.2 CC1=CC(C#N)=CC=C1 1901689 [1,1,0,0,0,0|1,0,1]=4 347 B9R1.2 CC1=CC=CC(C=O)=C1 1901706 [1,1,0,0,0,0|0,0,0]=2 348 B9R1.2 CC1=CC=CC(CCl)=C1 2048752 [1,1,0,0,0,0|1,0,1]=4 349 B9R1.2 CC1=CC=CC(CN)=C1 1038610 [1,1,0,0,0,0|1,0,1]=4 350 B9R1.2 CCC1=CC(O)=CC=C1 2826182 [1,1,0,0,0,0|1,0,1]=4 351 B9R1.2 CNC1=CC(O)=CC=C1 2225858 [1,1,0,0,0,0|2,0,0]=4 352 B9R1.2 COC1=CC(N)=CC=C1 1314579 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.2 COC1=CC=CC(Br)=C1 1287416 [1,1,0,0,0,0|2,0,0]=4 354 B9R1.2 COC1=CC=CC(O)=C1 1366571 [1,1,0,0,0,0|2,0,0]=4 355 B9R1.2 ClCC1=CC(Cl)=CC=C1 2048847 [1,1,0,0,0,0|1,0,1]=4 356 B9R1.2 FC1=CC(CCl)=CC=C1 2048769 [1,1,0,0,0,0|1,0,1]=4 357 B9R1.2 N#CC1=CC(N)=CC=C1 2826072 [1,1,0,0,0,0|1,0,1]=4 358 B9R1.2 N#CC1=CC=CC(Br)=C1 1903842 [1,1,0,0,0,0|1,0,1]=4 359 B9R1.2 N#CC1=CC=CC(Cl)=C1 1901869 [1,1,0,0,0,0|1,0,1]=4 360 B9R1.2 N#CC1=CC=CC(F)=C1 1901710 [1,1,0,0,0,0|1,0,1]=4 361 B9R1.2 NCC1=CC=CC(N)=C1 6922927 [1,1,0,0,0,0|1,0,1]=4 362 B9R1.2 NNC1=CC(Cl)=CC=C1 1156640 [1,1,0,0,0,0|2,0,0]=4 363 B9R1.2 NNC1=CC(Cl)=CC=C1 3585957 [1,1,0,0,0,0|2,0,0]=4 364 B9R1.2 O=CC1=CC(Br)=CC=C1 1904103 [1,1,0,0,0,0|0,0,0]=2 365 B9R1.2 O=CC1=CC(O)=CC=C1 2826165 [1,1,0,0,0,0|0,0,0]=2 366 B9R1.2 O=CC1=CC=CC(Cl)=C1 1901924 [1,1,0,0,0,0|0,0,0]=2 367 B9R1.2 O=CC1=CC=CC(F)=C1 1901720 [1,1,0,0,0,0|0,0,0]=2 368 B9R1.8 BrCCC1=CC=CC=C1 2889217 [1,1,0,0,0,0|1,0,1]=4 369 B9R1.8 CCCC1=CC=CC=C1 2826136 [1,1,0,0,0,0|1,0,1]=4 370 B9R1.8 CCNC1=CC=CC=C1 1220427 [1,1,0,0,0,0|1,0,1]=4 371 B9R1.8 CCOC1=CC=CC=C1 2826174 [1,1,0,0,0,0|1,0,1]=4 372 B9R1.8 CNCC1=CC=CC=C1 1268163 [1,1,0,0,0,0|1,0,1]=4 373 B9R1.8 ClCCC1=CC=CC=C1 2827551 [1,1,0,0,0,0|1,0,1]=4 374 B9R1.8 N#CCC1=CC=CC=C1 1519434 [1,1,0,0,0,0|1,0,1]=4 375 B9R1.8 NCCC1=CC=CC=C1 1038619 [1,1,0,0,0,0|1,0,1]=4 376 B9R1.8 NNCC1=CC=CC=C1 1972969 [1,1,0,0,0,0|1,0,1]=4 377 B9R1.8 O=C=NC1=CC=CC=C1 1051736 [1,1,0,0,0,0|0,0,1]=3 378 B9R1.8 O=C=NC1=CN=CC=C1 2817269 [1,1,0,0,0,0|1,0,1]=4 379 B9R1.8 O=CCC1=CC=CC=C1 1204419 [1,1,0,0,0,0|0,0,0]=2 380 B9R1.8 O=CNC1=CC=CC=C1 2826151 [1,1,0,0,0,0|0,0,0]=2 381 B9R1.8 OCCC1=CC=CC=C1 1204382 [1,1,0,0,0,0|0,0,1]=3 382 B9R1.8 OCCC1=CC=CC=N1 1204379 [1,1,0,0,0,0|1,0,1]=4 383 B9R1.8 [C]=NCC1=CC=CC=C1 5679156 [1,1,0,0,0,0|1,0,1]=4 384 B9R1.15 BrCC1=C(Br)C=CC=C1 4435191 [1,1,0,0,0,0|1,0,1]=4 385 B9R1.15 CC1=C(C#N)C=CC=C1 1901688 [1,1,0,0,0,0|1,0,1]=4 386 B9R1.15 CC1=C(C=O)C=CC=C1 1901705 [1,1,0,0,0,0|0,0,0]=2 387 B9R1.15 CC1=C(CCl)C=CC=C1 2048751 [1,1,0,0,0,0|1,0,1]=4 388 B9R1.15 CC1=C(CN)C=CC=C1 1038609 [1,1,0,0,0,0|1,0,1]=4 389 B9R1.15 CC1=C(CO)N=CC=C1 2817350 [1,1,0,0,0,0|1,0,1]=4 390 B9R1.15 CCC1=C(N)C=CC=C1 2826161 [1,1,0,0,0,0|1,0,1]=4 391 B9R1.15 CCC1=C(O)C=CC=C1 2826180 [1,1,0,0,0,0|1,0,1]=4 392 B9R1.15 CNC1=CC=CC=C1N 6871417 [1,1,0,0,0,0|2,0,0]=4 393 B9R1.15 COC1=C(Br)C=CC=C1 1287441 [1,1,0,0,0,0|2,0,0]=4 394 B9R1.15 COC1=C(C)C=CC=C1 2826177 [1,1,0,0,0,0|2,0,0]=4 395 B9R1.15 COC1=C(Cl)C=CC=C1 2827881 [1,1,0,0,0,0|2,0,0]=4 396 B9R1.15 COC1=C(F)C=CC=C1 2826313 [1,1,0,0,0,0|2,0,0]=4 397 B9R1.15 COC1=C(N)C=CC=C1 1314580 [1,1,0,0,0,0|2,0,0]=4 398 B9R1.15 COC1=C(O)C=CC=C1 2826229 [1,1,0,0,0,0|2,0,0]=4 399 B9R1.15 CSC1=CC=CC=C1Br 22430606 [1,1,0,0,0,0|2,0,0]=4 400 B9R1.15 ClCC1=C(Cl)C=CC=C1 2048846 [1,1,0,0,0,0|1,0,1]=4 401 B9R1.15 FC1=CC=CC=C1CCl 2048768 [1,1,0,0,0,0|1,0,1]=4 402 B9R1.15 N#CC1=C(N)C=CC=C1 2826071 [1,1,0,0,0,0|1,0,1]=4 403 B9R1.15 N#CC1=CC=CC=C1Cl 7119850361 [1,1,0,0,0,0|1,0,1]=4 404 B9R1.15 N#CC1=CC=CC=C1F 1901709 [1,1,0,0,0,0|1,0,1]=4 405 B9R1.15 N#CC1=CC=CC=C1O 2129603 [1,1,0,0,0,0|1,0,1]=4 406 B9R1.15 NCC1=C(Cl)C=CC=C1 1038613 [1,1,0,0,0,0|1,0,1]=4 407 B9R1.15 NCC1=C(F)C=CC=C1 7020330618 [1,1,0,0,0,0|1,0,1]=4 408 B9R1.15 NNC1=C(Cl)C=CC=C1 1156642 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.15 NNC1=C(F)C=CC=C1 2832682 [1,1,0,0,0,0|2,0,0]=4 410 B9R1.15 O=CC1=C(Cl)C=CC=C1 1901923 [1,1,0,0,0,0|0,0,0]=2 411 B9R1.15 O=CC1=C(Cl)N=CC=C1 3667461 [1,1,0,0,0,0|1,0,0]=3 412 B9R1.15 O=CC1=C(F)C=CC=C1 1901718 [1,1,0,0,0,0|0,0,0]=2 413 B9R1.15 O=CC1=C(O)C=CC=C1 2129572 [1,1,0,0,0,0|0,0,0]=2 414 B9R1.15 O=CC1=CC=CC=C1Br 1904102 [1,1,0,0,0,0|0,0,0]=2 415 B9R1.15 O=CC1=NC=CC=C1Br 5161726 [1,1,0,0,0,0|1,0,0]=3 416 B9R1.15 OCC1=C(Cl)C=CC=C1 2048757 [1,1,0,0,0,0|0,0,1]=3 417 B9R1.15 OCC1=C(Cl)N=CC=C1 2819188 [1,1,0,0,0,0|1,0,1]=4 418 B9R1.15 OCC1=CC=CC=C1Br 2049225 [1,1,0,0,0,0|0,0,1]=3 419 B9R1.15 OCC1=NC=CC=C1Br 11186520 [1,1,0,0,0,0|1,0,1]=4 420 B9R1.11 CCC(=O)C1=CC=CS1 1043815 [0,1,0,0,1,0|2,0,0]=4 421 B9R1.11 COC(=O)C1=CC=CN1 6300636 [0,1,0,0,1,0|1,0,0]=3 422 B9R1.11 COC(=O)C1=CC=CO1 2826302 [0,1,0,0,1,0|1,0,0]=3 423 B9R1.11 COC(=O)C1=CC=NO1 6902354 [0,1,0,0,1,0|2,0,0]=4 424 B9R1.11 NNC(=O)C1=CC=CO1 7113240459 [0,1,0,0,1,0|2,0,0]=4 425 B9R1.11 NNC(=O)C1=CC=CS1 7210740705 [0,1,0,0,1,0|2,0,0]=4 426 B9R1.11 O=C(CCl)C1=CC=CS1 1313194 [0,1,0,0,1,0|2,0,0]=4 427 B9R1.11 O=C(CO)C1=CC=CO1 2826306 [0,1,0,0,1,0|1,0,0]=3 428 B9R1.35 CC(=O)C1=CC=C(Br)O1 3765393 [0,1,0,0,1,0|2,0,0]=4 429 B9R1.35 CC1=CC(C(=O)O)=NN1 1055332 [0,1,0,0,1,0|2,0,0]=4 430 B9R1.35 CC1=CC(C(=O)O)=NO1 1055331 [0,1,0,0,1,0|2,0,0]=4 431 B9R1.35 CC1=CC(C(=O)O)=NS1 4058296 [0,1,0,0,1,0|2,0,0]=4 432 B9R1.35 CC1=CC=C(C(=O)O)O1 2215003 [0,1,0,0,1,0|1,0,0]=3 433 B9R1.35 CC1=NC=C(C(=O)O)S1 1118927 [0,1,0,0,1,0|2,0,0]=4 434 B9R1.35 CN1C=CC(C(=O)O)=N1 3488437 [0,1,0,0,1,0|2,0,0]=4 435 B9R1.35 NC1=NC(C(=O)O)=CS1 2217365 [0,1,0,0,1,0|2,0,0]=4 436 B9R1.35 O=C(O)C1=CC(Cl)=CS1 3488431 [0,1,0,0,1,0|1,0,0]=3 437 B9R1.35 O=C(O)C1=CC(O)=NN1 6062886 [0,1,0,0,1,0|2,0,0]=4 438 B9R1.35 O=C(O)C1=CC=C(Br)O1 0125160212 [0,1,0,0,1,0|1,0,0]=3 439 B9R1.35 O=C(O)C1=CC=C(Cl)S1 1313196 [0,1,0,0,1,0|1,0,0]=3 440 B9R1.35 O=C(O)C1=CN=C(Br)S1 3488498 [0,1,0,0,1,0|2,0,0]=4 441 B9R1.35 O=C(O)C1=CSC(Br)=N1 1977957 [0,1,0,0,1,0|2,0,0]=4 442 B9R1.35 O=C(O)C1=CSC(Cl)=N1 4813546 [0,1,0,0,1,0|2,0,0]=4 443 B9R1.41 CC1=C(C(=O)O)C=NN1 1218391 [0,1,0,0,1,0|2,0,0]=4 444 B9R1.41 CC1=C(C(=O)O)OC=N1 1972995 [0,1,0,0,1,0|2,0,0]=4 445 B9R1.41 CC1=C(C(=O)O)SC=C1 2084328 [0,1,0,0,1,0|1,0,0]=3 446 B9R1.41 CN1N=CC=C1C(=O)O 3665402 [0,1,0,0,1,0|2,0,0]=4 447 B9R1.41 NC(=O)C1=C(O)C=CS1 7020542496 [0,1,0,0,1,0|2,0,0]=4 448 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 2084123 [0,1,0,0,0,1|1,0,0]=3 449 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 7112901193 [0,1,0,0,0,1|1,0,0]=3 450 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 1166810 [0,1,0,0,0,1|1,0,0]=3 451 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 0125160280 [0,1,0,0,0,1|1,0,0]=3 452 B11R1.20 CC(=O)NC1=CN=C(S)C=C1 1514513 [0,1,0,0,0,1|2,0,0]=4 453 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 7020330563 [0,1,0,0,0,1|0,0,0]=2 454 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 0112150026 [0,1,0,0,0,1|1,1,0]=4 455 B11R1.20 N=C(N)NC1=CC=C(O)C=C1 12405421 [0,1,0,0,0,1|2,0,0]=4 456 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 1060383 [0,1,0,0,0,1|1,0,0]=3 457 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 1782632 [0,1,0,0,0,1|1,1,0]=4 458 B11R1.20 NC(=S)NC1=CC=C(F)C=C1 7110950115 [0,1,0,0,0,1|1,1,0]=4 459 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 1509952 [0,1,0,0,0,1|0,0,0]=2 460 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 1051730 [0,1,0,0,0,1|1,0,0]=3 461 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 1287087 [0,1,0,0,0,1|0,0,0]=2 462 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 1113743 [0,1,0,0,0,1|0,0,0]=2 463 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 7020330564 [0,1,0,0,0,1|0,0,0]=2 464 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 2630838 [0,1,0,0,0,1|0,0,0]=2 465 B11R1.20 S=C(S)NC1=CC=C(Br)C=C1 22430333 [0,1,0,0,0,1|0,2,0]=4 466 B11R1.36 CC(=O)C(O)C1=CC=CC=C1 3355149 [0,1,0,0,0,1|1,0,0]=3 467 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 1188626 [0,1,0,0,0,1|0,0,0]=2 468 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 2829226 [0,1,0,0,0,1|0,0,0]=2 469 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 3585975 [0,1,0,0,0,1|0,0,0]=2 470 B11R1.36 O=C(C1=CC=CC=C1)C(O)O 12405446 [0,1,0,0,0,1|0,0,2]=4 471 B11R1.36 O=C(Cl)C(Cl)C1=CC=CC=C1 2932604 [0,1,0,0,0,1|1,0,0]=3 472 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 1780492 [0,1,0,0,0,1|0,0,0]=2 473 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 1779303 [0,1,0,0,0,1|0,0,0]=2 474 B11R1.40 COC(=O)CC1=CC=CC=C1 1902120 [0,1,0,0,0,1|0,0,0]=2 475 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 1902056 [0,1,0,0,0,1|1,0,0]=3 476 B11R1.40 NC(CO)CC1=CC=CC=C1 7020694207 [0,1,0,0,0,1|1,0,1]=4 477 B11R1.40 NCC(=O)NC1=CC=CC=C1 7020432301 [0,1,0,0,0,1|1,0,0]=3 478 B11R1.40 NNC(=S)NC1=CC=CC=C1 2125396 [0,1,0,0,0,1|1,1,0]=4 479 B11R1.40 N\C(CC1=CC=CC=C1)=N/O 5011248 [0,1,0,0,0,1|1,0,0]=3 480 B11R1.40 O=C(CCl)NC1=CC=CC=C1 1195629 [0,1,0,0,0,1|1,0,0]=3 481 B11R1.40 O=C(CCl)NC1=NC=CC=C1 1194680 [0,1,0,0,0,1|2,0,0]=4 482 B11R1.40 O=C(CO)NC1=CC=CC=C1 1015594 [0,1,0,0,0,1|0,0,0]=2 483 B11R1.40 O=C(CS)NC1=CC=CC=C1 7414270001 [0,1,0,0,0,1|0,1,0]=3 484 B11R1.86 CC(=O)C[N+]1=C(C)C=CC=C1 7012270716 [0,1,0,0,0,1|2,0,0]=4 485 B11R1.86 CC(=O)NC1=C(C)C=CC=C1 0118671324 [0,1,0,0,0,1|1,0,0]=3 486 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 2829216 [0,1,0,0,0,1|1,0,0]=3 487 B11R1.86 CC1=C(NC(N)=O)C=CC=C1 1779236 [0,1,0,0,0,1|1,0,0]=3 488 B11R1.86 CC1=C(NC(N)=S)C=CC=C1 0104540046 [0,1,0,0,0,1|1,1,0]=4 489 B11R1.86 CC1=CC=CC=C1NC(=N)N 2125462 [0,1,0,0,0,1|2,0,0]=4 490 B11R1.86 NC(=S)NC1=CC=CC=C1F 1001120 [0,1,0,0,0,1|1,1,0]=4 491 B11R1.86 O=C(O)CC1=CC=CC=C1F 7020330565 [0,1,0,0,0,1|0,0,0]=2 492 B11R1.86 O=C(O)CN1C=CC=CC1=O 1333568 [0,1,0,0,0,1|1,0,0]=3 493 B11R1.157 CC(=O)CC1=CC(C)=CC=C1 1056056 [0,1,0,0,0,1|1,0,0]=3 494 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 14049612 [0,1,0,0,0,1|1,0,0]=3 495 B11R1.157 CC(=O)NC1=CC(Cl)=CC=C1 7112901220 [0,1,0,0,0,1|1,0,0]=3 496 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 7017520046 [0,1,0,0,0,1|2,0,0]=4 497 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 974398 [0,1,0,0,0,1|1,0,0]=3 498 B11R1.157 CC(=O)NC1=CC=CC(O)=C1 1014712 [0,1,0,0,0,1|1,0,0]=3 499 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 1287089 [0,1,0,0,0,1|0,0,0]=2 500 B11R1.157 CC1=CC=CC(NC(N)=S)=C1 0104540045 [0,1,0,0,0,1|1,1,0]=4 501 B11R1.157 NC(=S)NC1=CC=CC(O)=C1 1001124 [0,1,0,0,0,1|1,1,0]=4 502 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 2024108 [0,1,0,0,0,1|0,0,0]=2 503 B11R1.157 O=C(O)CC1=CC(O)=NC=C1 11186508 [0,1,0,0,0,1|1,0,0]=3 504 B11R1.509 CC(C)(O)CC1=CC=CC=C1 1271932 [0,1,0,0,0,1|1,0,1]=4 505 B11R1.509 O=S(=O)(Cl)CC1=CC=CC=C1 7020430779 [0,1,0,0,0,1|1,0,1]=4 506 B11R1.509 O=S(=O)(Cl)NC1=CC=CC=C1 5008871 [0,1,0,0,0,1|1,0,1]=4 507 B11R1.3 CCC1=CC=C(C(=N)N)C=C1 22588246 [0,2,0,0,0,0|2,0,0]=4 508 B11R1.3 CCC1=CC=C(C(=N)N)C=C1 2828925 [0,2,0,0,0,0|2,0,0]=4 509 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 7018912388 [0,2,0,0,0,0|0,0,0]=2 510 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 1043799 [0,2,0,0,0,0|1,0,0]=3 511 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 7020331315 [0,2,0,0,0,0|1,1,0]=4 512 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 1866367 [0,2,0,0,0,0|0,0,0]=2 513 B11R1.3 COC1=CC=C(B(O)O)C=C1 1179159 [0,2,0,0,0,0|1,0,1]=4 514 B11R1.3 COC1=CC=C(C(=N)N)C=C1 7119984893 [0,2,0,0,0,0|2,0,0]=4 515 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 1051718 [0,2,0,0,0,0|1,0,0]=3 516 B11R1.3 COC1=CC=C(C(=O)O)C=C1 1779304 [0,2,0,0,0,0|0,0,0]=2 517 B11R1.3 COC1=CC=C(C(C)=O)C=C1 1043808 [0,2,0,0,0,0|1,0,0]=3 518 B11R1.3 COC1=CC=C(C(C)O)C=C1 1366882 [0,2,0,0,0,0|1,0,1]=4 519 B11R1.3 COC1=CC=C(C(N)=S)C=C1 7020331318 [0,2,0,0,0,0|1,1,0]=4 520 B11R1.3 CSC1=CC=C(C(=N)N)C=C1 2426864 [0,2,0,0,0,0|2,0,0]=4 521 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 6849842 [0,2,0,0,0,0|1,0,1]=4 522 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 2828771 [0,2,0,0,0,0|0,0,0]=2 523 B11R1.3 N#CC1=CC=C([N+](=O)[O-])C=C1 1902091 [0,2,0,0,0,0|1,0,1]=4 524 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 5752165 [0,2,0,0,0,0|1,0,0]=3 525 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 2829211 [0,2,0,0,0,0|0,0,0]=2 526 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 1198652 [0,2,0,0,0,0|1,0,0]=3 527 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 6057544 [0,2,0,0,0,0|1,0,0]=3 528 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 7018801956 [0,2,0,0,0,0|0,0,0]=2 529 B11R1.3 O=CC1=CC=C([N+](=O)[O-])C=C1 1902136 [0,2,0,0,0,0|1,0,1]=4 530 B11R1.3 O=[N+]([O-])C1=CC=C(CCl)C=C1 2845068 [0,2,0,0,0,0|1,0,1]=4 531 B11R1.19 CC(C)(O)C1=CC=C(N)C=C1 5028378 [0,2,0,0,0,0|1,0,1]=4 532 B11R1.19 CC1=CC=C(S(=O)(=O)Cl)C=C1 1051763 [0,2,0,0,0,0|1,0,1]=4 533 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 22430619 [0,2,0,0,0,0|1,0,0]=3 534 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 2845160 [0,2,0,0,0,0|1,0,0]=3 535 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 6927010 [0,2,0,0,0,0|1,0,0]=3 536 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 2845931 [0,2,0,0,0,0|1,0,0]=3 537 B11R1.19 NC1=CC=C(S(N)(=O)=O)C=C1 2845165 [0,2,0,0,0,0|1,0,1]=4 538 B11R1.19 NC1=CC=C([As](=O)(O)O)C=C1 15017053 [0,2,0,0,0,0|1,0,0]=3 539 B11R1.19 NC1=NC=C(S(=O)(=O)O)C=C1 0111070132 [0,2,0,0,0,0|2,0,0]=4 540 B11R1.19 O=S(=O)(Cl)C1=CC=C(Br)C=C1 7214190553 [0,2,0,0,0,0|1,0,1]=4 541 B11R1.19 O=S(=O)(Cl)C1=CC=C(Cl)C=C1 1051765 [0,2,0,0,0,0|1,0,1]=4 542 B11R1.19 O=S(=O)(Cl)C1=CC=C(F)C=C1 1051764 [0,2,0,0,0,0|1,0,1]=4 543 B11R1.19 O=S(=O)(O)C1=CC=C(Cl)C=C1 7020020683 [0,2,0,0,0,0|1,0,0]=3 544 B11R1.21 CC(=O)C1=CC(C)=C(C)C=C1 1043802 [0,2,0,0,0,0|1,0,0]=3 545 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 1043809 [0,2,0,0,0,0|1,0,0]=3 546 B11R1.21 CC(=O)C1=CC(C)=C(O)C=C1 1667601 [0,2,0,0,0,0|1,0,0]=3 547 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 0125290200 [0,2,0,0,0,0|1,0,0]=3 548 B11R1.21 CC(=O)C1=CC(O)=C(Cl)C=C1 3674368 [0,2,0,0,0,0|1,0,0]=3 549 B11R1.21 CC(=O)C1=CC=C(C)C(N)=C1 1366797 [0,2,0,0,0,0|1,0,0]=3 550 B11R1.21 CC(=O)C1=CC=C(Cl)C(N)=C1 1367449 [0,2,0,0,0,0|1,0,0]=3 551 B11R1.21 CC(=O)C1=CC=C(F)C(F)=C1 7020410077 [0,2,0,0,0,0|1,0,0]=3 552 B11R1.21 CC(=O)C1=CC=C(N)C(Cl)=C1 3644604 [0,2,0,0,0,0|1,0,0]=3 553 B11R1.21 CC1=C(Cl)C=CC([N+](=O)[O-])=C1 2835820 [0,2,0,0,0,0|1,0,1]=4 554 B11R1.21 CC1=C(I)C=C(C(N)=O)C=C1 7214930347 [0,2,0,0,0,0|1,0,0]=3 555 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 1509557 [0,2,0,0,0,0|0,0,0]=2 556 B11R1.21 CC1=C(N)C=C([N+](=O)[O-])C=C1 1195614 [0,2,0,0,0,0|1,0,1]=4 557 B11R1.21 CC1=C(O)C=CC([N+](=O)[O-])=C1 2820357 [0,2,0,0,0,0|1,0,1]=4 558 B11R1.21 CC1=CC([N+](=O)[O-])=CC=C1N 2829316 [0,2,0,0,0,0|1,0,1]=4 559 B11R1.21 CC1=CC=C(C(=O)Cl)C=C1C 1051721 [0,2,0,0,0,0|1,0,0]=3 560 B11R1.21 CC1=CC=C(C(=O)O)C=C1C 1312864 [0,2,0,0,0,0|0,0,0]=2 561 B11R1.21 CC1=CC=C(C(=O)O)C=C1Cl 1902916 [0,2,0,0,0,0|0,0,0]=2 562 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1Br 1362064 [0,2,0,0,0,0|1,0,1]=4 563 B11R1.21 CN1N=C(C(=O)O)C=CC1=O 7020410400 [0,2,0,0,0,0|2,0,0]=4 564 B11R1.21 NC(=O)C1=CC(Cl)=C(Cl)C=C1 1375628 [0,2,0,0,0,0|1,0,0]=3 565 B11R1.21 NC(=S)C1=CC(Cl)=C(Cl)C=C1 7020331336 [0,2,0,0,0,0|1,1,0]=4 566 B11R1.21 NC1=C(Cl)C=C([N+](=O)[O-])C=C1 2845889 [0,2,0,0,0,0|1,0,1]=4 567 B11R1.21 NC1=C(Cl)C=CC([N+](=O)[O-])=C1 989395 [0,2,0,0,0,0|1,0,1]=4 568 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 6850842 [0,2,0,0,0,0|0,0,0]=2 569 B11R1.21 NC1=C(I)C=C([N+](=O)[O-])C=C1 5662514 [0,2,0,0,0,0|1,0,1]=4 570 B11R1.21 NC1=C(N)C=C([N+](=O)[O-])C=C1 2829528 [0,2,0,0,0,0|1,0,1]=4 571 B11R1.21 NC1=CC(C(=O)O)=CC=C1O 1392631 [0,2,0,0,0,0|0,0,0]=2 572 B11R1.21 NC1=CC([N+](=O)[O-])=CC=C1O 1112097 [0,2,0,0,0,0|1,0,1]=4 573 B11R1.21 NC1=CC=C(C(=O)O)C=C1N 1509978 [0,2,0,0,0,0|0,0,0]=2 574 B11R1.21 NC1=CC=C(C(=O)O)C=C1O 1514172 [0,2,0,0,0,0|0,0,0]=2 575 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1O 2829704 [0,2,0,0,0,0|1,0,1]=4 576 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 3337432 [0,2,0,0,0,0|0,0,0]=2 577 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 1312846 [0,2,0,0,0,0|0,0,0]=2 578 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 1051719 [0,2,0,0,0,0|0,0,0]=2 579 B11R1.21 O=C(O)C1=CC=C(F)C(F)=C1 1902328 [0,2,0,0,0,0|0,0,0]=2 580 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(Cl)C=C1 2957220 [0,2,0,0,0,0|1,0,1]=4 581 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(O)C=C1 2846754 [0,2,0,0,0,0|1,0,1]=4 582 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Br)C=C1 1362081 [0,2,0,0,0,0|1,0,1]=4 583 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 3026336 [0,2,0,0,0,0|1,0,0]=3 584 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 0109160035 [0,2,0,0,0,0|1,0,0]=3 585 B11R1.22 CC1=CC=C(C(C)CO)C=C1 1779249 [0,2,0,0,0,0|1,0,1]=4 586 B11R1.22 CC1=CC=C(C(O)CN)C=C1 1055862 [0,2,0,0,0,0|1,0,1]=4 587 B11R1.22 CC1=CC=C(\C(N)=N\O)C=C1 2829097 [0,2,0,0,0,0|1,0,0]=3 588 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 1043826 [0,2,0,0,0,0|1,0,0]=3 589 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 1043817 [0,2,0,0,0,0|1,0,0]=3 590 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 1043824 [0,2,0,0,0,0|1,0,0]=3 591 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 1271489 [0,2,0,0,0,0|1,0,0]=3 592 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 7210540047 [0,2,0,0,0,0|1,0,0]=3 593 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 7112895235 [0,2,0,0,0,0|1,0,0]=3 594 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 1134985 [0,2,0,0,0,0|1,0,0]=3 595 B11R1.22 COC(=O)C1=CC=C(C)C=C1 2084121 [0,2,0,0,0,0|0,0,0]=2 596 B11R1.22 COC(=O)C1=CC=C(F)C=C1 2084250 [0,2,0,0,0,0|0,0,0]=2 597 B11R1.22 COC(=O)C1=CC=C(N)C=C1 974407 [0,2,0,0,0,0|0,0,0]=2 598 B11R1.22 COC(=O)C1=CC=C(O)C=C1 1310956 [0,2,0,0,0,0|0,0,0]=2 599 B11R1.22 COC(=O)C1=CC=C(S)C=C1 6137666 [0,2,0,0,0,0|0,0,0]=2 600 B11R1.22 COC(=O)C1=CC=[N+]([O-])C=C1 15298713 [0,2,0,0,0,0|1,0,0]=3 601 B11R1.22 COC(=O)C1=CN=C(N)C=C1 3354042 [0,2,0,0,0,0|1,0,0]=3 602 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 6594998 [0,2,0,0,0,0|2,0,0]=4 603 B11R1.22 COC(=O)C1=NC=C(C)N=C1 2829323 [0,2,0,0,0,0|2,0,0]=4 604 B11R1.22 COC(=O)C1=NC=C(O)N=C1 6051767 [0,2,0,0,0,0|2,0,0]=4 605 B11R1.22 COC(C)C1=CC=C(F)C=C1 3644488 [0,2,0,0,0,0|1,0,1]=4 606 B11R1.22 C\C(=N/O)C1=CC=C(F)C=C1 5012413 [0,2,0,0,0,0|1,0,0]=3 607 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 1780587 [0,2,0,0,0,0|1,0,1]=4 608 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 4788108 [0,2,0,0,0,0|1,0,0]=3 609 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 1042955 [0,2,0,0,0,0|1,0,0]=3 610 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 1909733 [0,2,0,0,0,0|1,0,1]=4 611 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 1055871 [0,2,0,0,0,0|1,0,1]=4 612 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 22430310 [0,2,0,0,0,0|1,0,1]=4 613 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 7115241108 [0,2,0,0,0,0|1,0,0]=3 614 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 7119842867 [0,2,0,0,0,0|1,0,0]=3 615 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 7119846924 [0,2,0,0,0,0|1,0,0]=3 616 B11R1.22 N\C(=N\O)C1=CC=C(Br)C=C1 5012363 [0,2,0,0,0,0|1,0,0]=3 617 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 1106005 [0,2,0,0,0,0|1,0,0]=3 618 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 1106004 [0,2,0,0,0,0|1,0,0]=3 619 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 2125403 [0,2,0,0,0,0|1,0,0]=3 620 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 1313074 [0,2,0,0,0,0|1,0,0]=3 621 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 1312995 [0,2,0,0,0,0|1,0,0]=3 622 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 2829713 [0,2,0,0,0,0|0,0,0]=2 623 B11R1.22 [NH3+]CC(=O)C1=CC=C(F)C=C1 0125210483 [0,2,0,0,0,0|1,0,0]=3 624 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 3674367 [0,2,0,0,0,0|1,0,0]=3 625 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 4670824 [0,2,0,0,0,0|1,0,0]=3 626 B11R1.166 CC(=O)C1=CC=C(C)C=C1C 1500425 [0,2,0,0,0,0|1,0,0]=3 627 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Cl 1506218 [0,2,0,0,0,0|1,0,0]=3 628 B11R1.166 CC(=O)C1=CC=C(F)C=C1F 1902266 [0,2,0,0,0,0|1,0,0]=3 629 B11R1.166 CC(=O)C1=CC=C(O)C=C1O 1685131 [0,2,0,0,0,0|1,0,0]=3 630 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 1506467 [0,2,0,0,0,0|0,0,0]=2 631 B11R1.166 CC1=CC(Cl)=C([N+](=O)[O-])C=C1 22430515 [0,2,0,0,0,0|1,0,1]=4 632 B11R1.166 CC1=CC(F)=C([N+](=O)[O-])C=C1 6849689 [0,2,0,0,0,0|1,0,1]=4 633 B11R1.166 CC1=CC(F)=CC=C1[N+](=O)[O-] 22430504 [0,2,0,0,0,0|1,0,1]=4 634 B11R1.166 CC1=CC(O)=C([N+](=O)[O-])C=C1 2829519 [0,2,0,0,0,0|1,0,1]=4 635 B11R1.166 CC1=CC(O)=CC=C1[N+](=O)[O-] 1023289 [0,2,0,0,0,0|1,0,1]=4 636 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 2829972 [0,2,0,0,0,0|0,0,0]=2 637 B11R1.166 NC1=C([N+](=O)[O-])C=CC(F)=C1 2222383 [0,2,0,0,0,0|1,0,1]=4 638 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 2835821 [0,2,0,0,0,0|0,0,0]=2 639 B11R1.166 NC1=CC(F)=C([N+](=O)[O-])C=C1 6053934 [0,2,0,0,0,0|1,0,1]=4 640 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 2829520 [0,2,0,0,0,0|0,0,0]=2 641 B11R1.166 NC1=CC(O)=C(C(=O)[O-])C=C1 6057319 [0,2,0,0,0,0|0,0,1]=3 642 B11R1.166 O=C(Cl)C1=C(Cl)C=C(Cl)C=C1 1376301 [0,2,0,0,0,0|1,0,0]=3 643 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 2829700 [0,2,0,0,0,0|0,0,0]=2 644 B11R1.166 O=C(O)C1=CC=C(Cl)C=C1Cl 1506213 [0,2,0,0,0,0|0,0,0]=2 645 B11R1.166 O=C(O)C1=CC=C(F)C=C1F 1902327 [0,2,0,0,0,0|0,0,0]=2 646 B11R1.166 O=[N+]([O-])C1=C(F)C=C(F)C=C1 2831437 [0,2,0,0,0,0|1,0,1]=4 647 B11R1.166 O=[N+]([O-])C1=C(F)C=C(O)C=C1 2821470 [0,2,0,0,0,0|1,0,1]=4 648 B11R1.166 O=[N+]([O-])C1=C(O)C=C(F)C=C1 2830604 [0,2,0,0,0,0|1,0,1]=4 649 B11R1.166 OB(O)C1=CC=C(F)C=C1F 1586108 [0,2,0,0,0,0|1,0,1]=4 650 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 1779178 [0,2,0,0,0,0|1,0,1]=4 651 B11R1.7 CC(C)(CO)C1=CC=CC=C1 1366827 [0,2,0,0,0,0|1,0,1]=4 652 B11R1.7 CC(O)(CN)C1=CC=CC=C1 1056081 [0,2,0,0,0,0|1,0,1]=4 653 B11R1.12 CC\C(=N\O)C1=CC=CC=C1 19767653 [0,2,0,0,0,0|1,0,0]=3 654 B11R1.12 N#CC(C=O)C1=CC=CC=C1 1902003 [0,2,0,0,0,0|1,0,1]=4 655 B11R1.16 N#C\N=C(/N)C1=CC=CC=C1 5010119 [0,2,0,0,0,0|2,0,0]=4 656 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 7119846921 [0,2,0,0,0,0|1,0,0]=3 657 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 974790 [0,2,0,0,0,0|1,0,0]=3 658 B11R1.23 COC(=O)C1=CC(N)=CC=C1 1232820 [0,2,0,0,0,0|0,0,0]=2 659 B11R1.23 COC(=O)C1=CC(N)=CC=C1 1311369 [0,2,0,0,0,0|0,0,0]=2 660 B11R1.23 COC(=O)C1=CC(N)=NC=C1 3669271 [0,2,0,0,0,0|1,0,0]=3 661 B11R1.23 COC(=O)C1=CC(O)=NC=C1 7135552 [0,2,0,0,0,0|1,0,0]=3 662 B11R1.23 COC(=O)C1=CC=CC(O)=C1 971220 [0,2,0,0,0,0|0,0,0]=2 663 B11R1.23 NC(CO)C1=CC(Br)=CC=C1 1792542 [0,2,0,0,0,0|1,0,1]=4 664 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 2237611 [0,2,0,0,0,0|1,0,0]=3 665 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 1055870 [0,2,0,0,0,0|1,0,1]=4 666 B11R1.23 NNC(=O)C1=CC(Cl)=CC=C1 0125160195 [0,2,0,0,0,0|1,0,0]=3 667 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 7119920344 [0,2,0,0,0,0|1,0,0]=3 668 B11R1.23 N\C(=N/O)C1=CC(O)=CC=C1 2424046 [0,2,0,0,0,0|1,0,0]=3 669 B11R1.23 O=C(CBr)C1=CC=CC(Cl)=C1 3145804 [0,2,0,0,0,0|1,0,0]=3 670 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 2845888 [0,2,0,0,0,0|0,0,0]=2 671 B11R1.222 CC1=C(\C(N)=N\O)C=CC=C1 2829096 [0,2,0,0,0,0|1,0,0]=3 672 B11R1.222 CCC(=O)C1=CC=CC=C1Br 1909091 [0,2,0,0,0,0|1,0,0]=3 673 B11R1.222 CNC(=O)C1=CC=CC=C1N 971816 [0,2,0,0,0,0|1,0,0]=3 674 B11R1.222 COC(=O)C1=C(F)C=CC=C1 2829710 [0,2,0,0,0,0|0,0,0]=2 675 B11R1.222 COC(=O)C1=C(N)C=CC=C1 1867348 [0,2,0,0,0,0|0,0,0]=2 676 B11R1.222 COC(=O)C1=C(N)C=CC=C1 7138607 [0,2,0,0,0,0|0,0,0]=2 677 B11R1.222 COC(=O)C1=C(O)C=CC=C1 1311035 [0,2,0,0,0,0|0,0,0]=2 678 B11R1.222 COC(=O)C1=C(S)C=CC=C1 2824881 [0,2,0,0,0,0|0,0,0]=2 679 B11R1.222 COC(=O)C1=CC=CC=C1C 2084120 [0,2,0,0,0,0|0,0,0]=2 680 B11R1.222 COC(=O)C1=CC=CC=C1Cl 2084248 [0,2,0,0,0,0|0,0,0]=2 681 B11R1.222 COC(=O)C1=NC=CN=C1N 15386266 [0,2,0,0,0,0|2,0,0]=4 682 B11R1.222 NCC(O)C1=CC=CC=C1O 4670414 [0,2,0,0,0,0|1,0,1]=4 683 B11R1.222 NNC(=O)C1=CC=CC=C1Br 7119846925 [0,2,0,0,0,0|1,0,0]=3 684 B11R1.222 NNC(=O)C1=CC=CC=C1F 7119846922 [0,2,0,0,0,0|1,0,0]=3 685 B11R1.222 NNC(=O)C1=CC=CC=C1N 974743 [0,2,0,0,0,0|1,0,0]=3 686 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 3015492 [0,2,0,0,0,0|1,0,0]=3 687 B11R1.222 O=C(NO)C1=CC=CC=C1O 7119720021 [0,2,0,0,0,0|0,0,0]=2 688 B11R1.87 NC1=C(S(=O)(=O)O)C=CC=C1 22430645 [0,2,0,0,0,0|1,0,0]=3 689 B11R1.87 O=S(=O)(Cl)C1=CC=CC=C1Cl 1179324 [0,2,0,0,0,0|1,0,1]=4 690 B11R1.155 CC(C)(O)C1=CC(O)=CC=C1 3355237 [0,2,0,0,0,0|1,0,1]=4 691 B11R1.155 CC1=CC=CC(S(=O)(=O)Cl)=C1 7020694376 [0,2,0,0,0,0|1,0,1]=4 692 B11R1.155 NC1=CC(S(=O)(=O)O)=CC=C1 2845932 [0,2,0,0,0,0|1,0,0]=3 693 B11R1.155 NC1=CC(S(=O)(=O)[O-])=CC=C1 14900677 [0,2,0,0,0,0|1,0,1]=4 694 B11R1.155 O=S(=O)(Cl)C1=CC(Cl)=CC=C1 1179270 [0,2,0,0,0,0|1,0,1]=4 695 B11R1.53 COC1=C(C(=O)O)C=CC=C1 1779305 [0,2,0,0,0,0|0,0,0]=2 696 B11R1.53 COC1=C(C(C)=O)C=CC=C1 1505978 [0,2,0,0,0,0|1,0,0]=3 697 B11R1.53 COC1=CC=CC=C1C(=O)Cl 1051716 [0,2,0,0,0,0|1,0,0]=3 698 B11R1.53 COC1=CC=CN=C1C(=O)O 22430297 [0,2,0,0,0,0|1,0,0]=3 699 B11R1.53 CSC1=C(C(=O)O)C=CC=N1 2843226 [0,2,0,0,0,0|1,0,0]=3 700 B11R1.53 N#CC1=CC=CC=C1[N+](=O)[O-] 1902090 [0,2,0,0,0,0|1,0,1]=4 701 B11R1.53 NNC1=CC=CC=C1C(=O)O 7020542803 [0,2,0,0,0,0|0,0,0]=2 702 B11R1.53 O=C(O)C1=C(NO)C=CC=C1 11185879 [0,2,0,0,0,0|0,0,0]=2 703 B11R1.53 O=CC1=CC=CC=C1C(=O)O 7018801964 [0,2,0,0,0,0|0,0,0]=2 704 B11R1.53 O=CC1=CC=CC=C1[N+](=O)[O-] 14960794 [0,2,0,0,0,0|1,0,1]=4 705 B11R1.53 O=NC1=CC=CC=C1C(=O)O 3355188 [0,2,0,0,0,0|0,0,0]=2 706 B11R1.156 CC(=O)C1=C(O)C=CC=C1O 6849562 [0,2,0,0,0,0|1,0,0]=3 707 B11R1.156 CC1=CC=CC(C)=C1C(N)=O 5029553 [0,2,0,0,0,0|1,0,0]=3 708 B11R1.156 NC(=S)C1=C(Cl)C=CC=C1F 7020331327 [0,2,0,0,0,0|1,1,0]=4 709 B11R1.156 NC(=S)C1=C(F)C=CC=C1F 1436701 [0,2,0,0,0,0|1,1,0]=4 710 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1Cl 2851294 [0,2,0,0,0,0|1,0,0]=3 711 B11R1.156 O=C(O)C1=C(F)C=CC=C1Cl 1051751 [0,2,0,0,0,0|0,0,0]=2 712 B11R1.159 CC1=C(O)C(C(=O)O)=CC=C1 22430485 [0,2,0,0,0,0|0,0,0]=2 713 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1Br 3012948 [0,2,0,0,0,0|1,0,1]=4 714 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1N 2829328 [0,2,0,0,0,0|1,0,1]=4 715 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1O 2820356 [0,2,0,0,0,0|1,0,1]=4 716 B11R1.159 CN1C=CC=C(C(=O)O)C1=O 1902184 [0,2,0,0,0,0|1,0,0]=3 717 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O 2215353 [0,2,0,0,0,0|0,0,0]=2 718 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl 1218749 [0,2,0,0,0,0|0,0,0]=2 719 B11R1.159 NC1=C(F)C=CC=C1C(=O)O 2215103 [0,2,0,0,0,0|0,0,0]=2 720 B11R1.159 NC1=C(N)C(C(=O)O)=CC=C1 3669272 [0,2,0,0,0,0|0,0,0]=2 721 B11R1.159 NC1=C(O)C([N+](=O)[O-])=CC=C1 1112099 [0,2,0,0,0,0|1,0,1]=4 722 B11R1.159 NC1=C(O)C=CC=C1[N+](=O)[O-] 2820537 [0,2,0,0,0,0|1,0,1]=4 723 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Cl 3701420 [0,2,0,0,0,0|0,0,0]=2 724 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F 5031684 [0,2,0,0,0,0|0,0,0]=2 725 B11R1.159 O=C(O)C1=CC=CC(F)=C1Br 5827095 [0,2,0,0,0,0|0,0,0]=2 726 B11R1.159 O=[N+]([O-])C1=C(Cl)C(Cl)=CC=C1 2957222 [0,2,0,0,0,0|1,0,1]=4 727 B11R1.159 O=[N+]([O-])C1=C(O)C(Cl)=CC=C1 6641946 [0,2,0,0,0,0|1,0,1]=4 728 B11R1.167 CC(=O)C1=C(Cl)C=CC(O)=C1 3674370 [0,2,0,0,0,0|1,0,0]=3 729 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 1500435 [0,2,0,0,0,0|1,0,0]=3 730 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 3691415 [0,2,0,0,0,0|1,0,0]=3 731 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 3674007 [0,2,0,0,0,0|1,0,0]=3 732 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 7013941401 [0,2,0,0,0,0|1,0,0]=3 733 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 1779363 [0,2,0,0,0,0|1,0,0]=3 734 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 1881372 [0,2,0,0,0,0|1,0,0]=3 735 B11R1.167 CC(=O)C1=CC(Br)=CC=C1O 2192099 [0,2,0,0,0,0|1,0,0]=3 736 B11R1.167 CC(=O)C1=CC(C)=CC=C1C 1043803 [0,2,0,0,0,0|1,0,0]=3 737 B11R1.167 CC(=O)C1=CC(O)=CC=C1O 7119860208 [0,2,0,0,0,0|1,0,0]=3 738 B11R1.167 CC1=C([N+](=O)[O-])C=C(Br)C=C1 1284658 [0,2,0,0,0,0|1,0,1]=4 739 B11R1.167 CC1=C([N+](=O)[O-])C=C(F)C=C1 22430559 [0,2,0,0,0,0|1,0,1]=4 740 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 7019091163 [0,2,0,0,0,0|0,0,0]=2 741 B11R1.167 CC1=CC([N+](=O)[O-])=C(Br)C=C1 6594966 [0,2,0,0,0,0|1,0,1]=4 742 B11R1.167 CC1=CC=C(Br)C(C(=O)O)=C1 1312863 [0,2,0,0,0,0|0,0,0]=2 743 B11R1.167 CC1=CC=C(N)C(C(=O)O)=C1 7719100016 [0,2,0,0,0,0|0,0,0]=2 744 B11R1.167 CC1=CC=C(N)C([N+](=O)[O-])=C1 2128521 [0,2,0,0,0,0|1,0,1]=4 745 B11R1.167 CC1=NN=C(O)C(C(=O)O)=C1 5679531 [0,2,0,0,0,0|2,0,0]=4 746 B11R1.167 NC(=O)C1=C(F)C=CC(N)=C1 2215443 [0,2,0,0,0,0|1,0,0]=3 747 B11R1.167 NC(=S)C1=CC(Br)=CC=C1O 7020682353 [0,2,0,0,0,0|1,1,0]=4 748 B11R1.167 NC(=S)C1=CC(Cl)=CC=C1O 7020681857 [0,2,0,0,0,0|1,1,0]=4 749 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 1220686 [0,2,0,0,0,0|0,0,0]=2 750 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 7020040772 [0,2,0,0,0,0|0,0,0]=2 751 B11R1.167 NC1=CC([N+](=O)[O-])=C(Cl)C=C1 2845891 [0,2,0,0,0,0|1,0,1]=4 752 B11R1.167 NC1=CC=C(Br)C=C1[N+](=O)[O-] 2128523 [0,2,0,0,0,0|1,0,1]=4 753 B11R1.167 NC1=CC=C(Cl)C(C(=O)O)=C1 2845077 [0,2,0,0,0,0|0,0,0]=2 754 B11R1.167 NC1=CC=C(Cl)C=C1[N+](=O)[O-] 2128522 [0,2,0,0,0,0|1,0,1]=4 755 B11R1.167 NC1=CC=C(F)C=C1[N+](=O)[O-] 7020654143 [0,2,0,0,0,0|1,0,1]=4 756 B11R1.167 NC1=CC=C(I)C=C1C(=O)O 1232805 [0,2,0,0,0,0|0,0,0]=2 757 B11R1.167 NC1=CC=C(O)C(C(=O)O)=C1 2829513 [0,2,0,0,0,0|0,0,0]=2 758 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 2831007 [0,2,0,0,0,0|0,0,0]=2 759 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 3015489 [0,2,0,0,0,0|0,0,0]=2 760 B11R1.167 O=C(O)C1=C(O)C=CC(Cl)=C1 2845887 [0,2,0,0,0,0|0,0,0]=2 761 B11R1.167 O=C(O)C1=CC(Br)=CC=C1Cl 3064193 [0,2,0,0,0,0|0,0,0]=2 762 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1Cl 1312862 [0,2,0,0,0,0|0,0,0]=2 763 B11R1.167 O=C(O)C1=CC(O)=NC=C1Br 22430302 [0,2,0,0,0,0|1,0,0]=3 764 B11R1.167 O=C1C=C(C(=O)O)C(Br)=CN1 3988942 [0,2,0,0,0,0|1,0,0]=3 765 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(F)=C1 2831436 [0,2,0,0,0,0|1,0,1]=4 766 B11R1.167 O=[N+]([O-])C1=CC(Br)=CC=C1O 2129076 [0,2,0,0,0,0|1,0,1]=4 767 B11R1.167 O=[N+]([O-])C1=CC(F)=CC=C1O 2125376 [0,2,0,0,0,0|1,0,1]=4 768 B11R1.74 CC1=CC(Br)=CC([N+](=O)[O-])=C1 7125982 [0,2,0,0,0,0|1,0,1]=4 769 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 1902121 [0,2,0,0,0,0|0,0,0]=2 770 B11R1.74 CC1=CC(C)=NC(C(=O)O)=C1 7110952569 [0,2,0,0,0,0|1,0,0]=3 771 B11R1.74 CC1=NC(C(=O)O)=CC(=O)N1 2103915 [0,2,0,0,0,0|2,0,0]=4 772 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 3337431 [0,2,0,0,0,0|0,0,0]=2 773 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 1904807 [0,2,0,0,0,0|0,0,0]=2 774 B11R1.74 O=C(O)C1=CC(F)=CC(Br)=C1 3353956 [0,2,0,0,0,0|0,0,0]=2 775 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 3585944 [0,2,0,0,0,0|0,0,0]=2 776 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 2213754 [0,2,0,0,0,0|1,0,0]=3 777 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 2846777 [0,2,0,0,0,0|2,0,0]=4 778 B11R1.74 O=C1C=C(O)N=C(C(=O)O)N1 2128101 [0,2,0,0,0,0|2,0,0]=4 779 B11R1.266 COC1=CC(B(O)O)=CC=C1 1179508 [0,2,0,0,0,0|1,0,1]=4 780 B11R1.266 COC1=CC(C(=O)Cl)=CC=C1 1051717 [0,2,0,0,0,0|1,0,0]=3 781 B11R1.266 COC1=CC=CC(C(=N)N)=C1 22588256 [0,2,0,0,0,0|2,0,0]=4 782 B11R1.266 COC1=CC=CC(C(=O)O)=C1 0109160003 [0,2,0,0,0,0|0,0,0]=2 783 B11R1.266 COC1=CC=CC(C(C)=O)=C1 1505979 [0,2,0,0,0,0|1,0,0]=3 784 B11R1.266 COC1=CC=CC(C(N)=O)=C1 1375244 [0,2,0,0,0,0|1,0,0]=3 785 B11R1.266 COC1=CC=CC(C(N)=S)=C1 7020331317 [0,2,0,0,0,0|1,1,0]=4 786 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 2828770 [0,2,0,0,0,0|0,0,0]=2 787 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 6871428 [0,2,0,0,0,0|0,0,0]=2 788 B11R1.266 NCC1=NC=CC(C(=O)O)=C1 4056490 [0,2,0,0,0,0|1,0,0]=3 789 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 1232689 [0,2,0,0,0,0|0,0,0]=2 790 B11R1.266 O=CC1=CC(B(O)O)=CC=C1 7110951391 [0,2,0,0,0,0|1,0,1]=4 791 B11R1.266 O=CC1=CC=CC([N+](=O)[O-])=C1 988588 [0,2,0,0,0,0|1,0,1]=4 792 B9R1.13 O=C(O)CC1=CC=CO1 1287105 [0,0,1,1,0,0|1,0,1]=4 793 B9R1.13 O=C(O)CC1=CC=CS1 1287112 [0,0,1,1,0,0|1,0,1]=4 794 B11R2.10 CC1=CC2=CC=CC=C2N1 7210741752 [0,0,0,1,0,1|2,0,0]=4 795 B11R2.10 CC1=CC2=CC=CC=C2S1 3504244 [0,0,0,1,0,1|1,1,0]=4 796 B11R2.10 CC1=NC2=C(C=CC=C2)S1 2829019 [0,0,0,1,0,1|1,1,0]=4 797 B11R2.10 ClC1=NC2=CC=CC=C2N1 1436700 [0,0,0,1,0,1|2,0,0]=4 798 B11R2.10 NC1=NC2=CC=CC=C2N1 7119850621 [0,0,0,1,0,1|2,0,0]=4 799 B11R2.10 O=C1CC2=CC=CC=C2C1 15296930 [0,0,0,1,0,1|1,0,0]=3 800 B11R2.10 O=C1CC2=CC=CC=C2N1 7017680945 [0,0,0,1,0,1|1,0,0]=3 801 B11R2.10 O=C1NC2=CC=CC=C2N1 7214190567 [0,0,0,1,0,1|1,0,0]=3 802 B11R2.10 O=C1NC2=CC=CC=C2O1 2129121 [0,0,0,1,0,1|0,0,0]=2 803 B11R2.10 O=C1NC2=NC=CC=C2O1 1499982 [0,0,0,1,0,1|1,0,0]=3 804 B11R2.10 S=C1NC2=C(C=CC=C2)O1 2829241 [0,0,0,1,0,1|0,1,0]=3 805 B11R2.10 S=C1NC2=CC=CC=C2S1 2139255 [0,0,0,1,0,1|0,2,0]=4 806 B11R2.10 SC1=NC2=CC=CC=C2S1 3585800 [0,0,0,1,0,1|0,2,0]=4 807 B11R2.1 BrC1=NNC2=C1C=CC=C2 0111070064 [0,1,0,1,0,0|2,0,0]=4 808 B11R2.1 CC1=NOC2=C1C=CN=C2 7135493 [0,1,0,1,0,0|2,0,0]=4 809 B11R2.1 NC1=C2C=CC=CC2=NS1 7110952728 [0,1,0,1,0,0|1,1,0]=4 810 B11R2.1 NC1=NNC2=C1C=CC=C2 1218431 [0,1,0,1,0,0|2,0,0]=4 811 B11R2.1 O=C1CCC2=CC=CC=C12 1202552 [0,1,0,1,0,0|1,0,0]=3 812 B11R2.1 O=C1NCC2=C1C=CC=C2 2422687 [0,1,0,1,0,0|1,0,0]=3 813 B11R2.1 O=C1OCC2=C1C=CC=C2 2826988 [0,1,0,1,0,0|0,0,0]=2 814 B11R2.1 OC1=NNC2=CC=CC=C21 7020542804 [0,1,0,1,0,0|1,0,0]=3 815 B11R2.1 OC1=NOC2=CC=CC=C21 5011377 [0,1,0,1,0,0|0,0,1]=3 816 B11R2.1 ON1N=NC2=CC=CC=C21 1194818 [0,1,0,1,0,0|2,0,0]=4 817 B11R2.1 ON1N=NC2=CC=CC=C21 22430535 [0,1,0,1,0,0|2,0,0]=4 818 B7R1.1 O=CC1=CC=CN1 7020420392 [1,0,0,0,1,0|1,0,0]=3 819 B7R1.1 O=CC1=CC=CO1 988493 [1,0,0,0,1,0|1,0,0]=3 820 B7R1.1 O=CC1=CC=CS1 2048717 [1,0,0,0,1,0|1,0,0]=3 821 B7R1.1 O=CC1=CN=CN1 22430527 [1,0,0,0,1,0|2,0,0]=4 822 B7R1.1 O=CC1=CSC=C1 22430573 [1,0,0,0,1,0|1,0,0]=3 823 B7R1.1 OCC1=CC=CO1 2084339 [1,0,0,0,1,0|1,0,1]=4 824 B7R1.1 OCC1=COC=C1 2816728 [1,0,0,0,1,0|1,0,1]=4 825 B11R1.91 C=C(C)COC1=CC=CC=C1 5914055 [0,0,0,0,0,2|2,0,0]=4 826 B11R1.91 CC(=O)CCC1=CC=CC=C1 1043589 [0,0,0,0,0,2|1,0,0]=3 827 B11R1.91 CC(=O)NCC1=CC=CC=N1 3851354 [0,0,0,0,0,2|2,0,0]=4 828 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 2129779 [0,0,0,0,0,2|1,0,0]=3 829 B11R1.91 CC(O)\C=C\C1=CC=CC=C1 3355102 [0,0,0,0,0,2|1,0,1]=4 830 B11R1.91 N=C(N)SCC1=CC=CC=C1 4434567 [0,0,0,0,0,2|2,0,0]=4 831 B11R1.91 NC(=O)COC1=CC=CC=C1 1375246 [0,0,0,0,0,2|1,0,0]=3 832 B11R1.91 NC(=O)CSC1=CC=CC=C1 1375325 [0,0,0,0,0,2|1,0,0]=3 833 B11R1.91 NC(=O)NCC1=CC=CC=C1 1779235 [0,0,0,0,0,2|1,0,0]=3 834 B11R1.91 NC(=O)OCC1=CC=CC=C1 2829213 [0,0,0,0,0,2|1,0,0]=3 835 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 5009290 [0,0,0,0,0,2|1,0,0]=3 836 B11R1.91 NC(=S)COC1=CC=CC=C1 7020331590 [0,0,0,0,0,2|1,1,0]=4 837 B11R1.91 NC(=S)NNC1=CC=CC=C1 2842441 [0,0,0,0,0,2|1,1,0]=4 838 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 1051731 [0,0,0,0,0,2|1,0,0]=3 839 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 4787343 [0,0,0,0,0,2|1,0,0]=3 840 B11R1.91 O=C(O)CCC1=CC=CC=C1 7020400414 [0,0,0,0,0,2|0,0,0]=2 841 B11R1.91 O=C(O)CCC1=CC=CC=N1 1499995 [0,0,0,0,0,2|1,0,0]=3 842 B11R1.91 O=C(O)CCC1=CN=CN=C1 4056519 [0,0,0,0,0,2|2,0,0]=4 843 B11R1.91 O=C(O)CNC1=CC=CC=C1 1142601 [0,0,0,0,0,2|0,0,0]=2 844 B11R1.91 O=C(O)CNC1=CC=CN=C1 3355230 [0,0,0,0,0,2|1,0,0]=3 845 B11R1.91 O=C(O)CNC1=NC=CC=N1 2140105 [0,0,0,0,0,2|2,0,0]=4 846 B11R1.91 O=C(O)COC1=CC=CC=C1 7113231893 [0,0,0,0,0,2|0,0,0]=2 847 B11R1.91 O=C(O)CSC1=CC=CC=C1 7110950354 [0,0,0,0,0,2|0,0,0]=2 848 B11R1.91 O=C(O)CSC1=CC=CC=N1 1500183 [0,0,0,0,0,2|1,0,0]=3 849 B11R1.91 O=C(O)CSC1=NC=NC=C1 2289397 [0,0,0,0,0,2|2,0,0]=4 850 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 7020400360 [0,0,0,0,0,2|0,0,0]=2 851 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 1314146 [0,0,0,0,0,2|1,0,0]=3 852 B11R1.91 O=C(O)\C=C\C1=CN=CN=C1 2254538 [0,0,0,0,0,2|2,0,0]=4 853 B11R1.91 S=C(S)NNC1=CC=CC=C1 22430428 [0,0,0,0,0,2|0,2,0]=4