0 B7R1.3 BrC1=CC=CN=C1 B11571 [0,0,0,0,0,0|2,0,0]=2 1 B7R1.3 BrC1=CC=NC=C1 B17440 [0,0,0,0,0,0|2,0,0]=2 2 B7R1.3 BrC1=CC=NC=C1 B1969 [0,0,0,0,0,0|2,0,0]=2 3 B7R1.3 BrC1=CC=NC=C1 B1969 [0,0,0,0,0,0|2,0,0]=2 4 B7R1.3 BrC1=CN=CN=C1 B1754 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.3 BrC1=NC=CC=C1 B0120 [0,0,0,0,0,0|2,0,0]=2 6 B7R1.3 BrC1=NC=CC=N1 B3816 [0,0,0,0,0,0|3,0,0]=3 7 B7R1.3 CC1=CN=CN=C1 M17713 [0,0,0,0,0,0|3,0,0]=3 8 B7R1.3 C[N+]1=CC=CC=C1 M7975 [0,0,0,0,0,0|2,0,0]=2 9 B7R1.3 ClC1=CC=CN=C1 C3229 [0,0,0,0,0,0|2,0,0]=2 10 B7R1.3 ClC1=CC=NC=C1 C0128 [0,0,0,0,0,0|2,0,0]=2 11 B7R1.3 ClC1=CC=NC=C1 C0128 [0,0,0,0,0,0|2,0,0]=2 12 B7R1.3 ClC1=CN=CN=C1 C4480 [0,0,0,0,0,0|3,0,0]=3 13 B7R1.3 ClC1=NC=CC=N1 C2137 [0,0,0,0,0,0|3,0,0]=3 14 B7R1.3 ClC1=NC=CN=C1 C1194 [0,0,0,0,0,0|3,0,0]=3 15 B7R1.3 FC1=CC=CN=C1 F0708 [0,0,0,0,0,0|2,0,0]=2 16 B7R1.3 FC1=CN=CN=C1 F12585 [0,0,0,0,0,0|3,0,0]=3 17 B7R1.3 FC1=NC=CC=C1 F11774 [0,0,0,0,0,0|2,0,0]=2 18 B7R1.3 IC1=CC=CN=C1 I9223 [0,0,0,0,0,0|2,0,0]=2 19 B7R1.3 IC1=CC=NC=C1 I2357 [0,0,0,0,0,0|2,0,0]=2 20 B7R1.3 IC1=NC=CC=C1 I11288 [0,0,0,0,0,0|2,0,0]=2 21 B7R1.3 IC1=NC=CN=C1 I4021 [0,0,0,0,0,0|3,0,0]=3 22 B7R1.3 NC1=CC=CN=C1 A11569 [0,0,0,0,0,0|2,0,0]=2 23 B7R1.3 NC1=CC=NC=C1 A0126 [0,0,0,0,0,0|2,0,0]=2 24 B7R1.3 NC1=CC=NC=C1 A0126 [0,0,0,0,0,0|2,0,0]=2 25 B7R1.3 NC1=NC=CC=C1 A11568 [0,0,0,0,0,0|2,0,0]=2 26 B7R1.3 NC1=NC=CC=N1 A3250 [0,0,0,0,0,0|3,0,0]=3 27 B7R1.3 NC1=NC=CN=C1 A13271 [0,0,0,0,0,0|3,0,0]=3 28 B7R1.3 O=C1C=CCCC1 C17765 [0,0,0,0,0,0|0,0,4]=4 29 B7R1.3 OC1=CC=NC=C1 H4081 [0,0,0,0,0,0|1,0,0]=1 30 B7R1.3 OC1=NC=CC=C1 H5719 [0,0,0,0,0,0|1,0,0]=1 31 B7R1.3 OC1=NC=CC=N1 H11053 [0,0,0,0,0,0|2,0,0]=2 32 B7R1.3 OC1=NC=CC=N1 P17609 [0,0,0,0,0,0|2,0,0]=2 33 B7R1.3 OC1=NC=NC=C1 U11252 [0,0,0,0,0,0|2,0,0]=2 34 B7R1.3 SC1=NC=CC=C1 P0646 [0,0,0,0,0,0|1,1,0]=2 35 B7R1.3 SC1=NC=CC=N1 M17738 [0,0,0,0,0,0|2,1,0]=3 36 B8R1.2 C#CC1=CC=CC=C1 P18887 [0,1,0,0,0,0|1,0,0]=2 37 B8R1.2 C#CC1=CC=NC=C1 E11459 [0,1,0,0,0,0|2,0,0]=3 38 B8R1.2 C#CC1=CC=NC=C1 E11459 [0,1,0,0,0,0|2,0,0]=3 39 B8R1.2 C#CC1=CN=CC=C1 E11458 [0,1,0,0,0,0|2,0,0]=3 40 B8R1.2 C#CC1=CN=CN=C1 E15176 [0,1,0,0,0,0|3,0,0]=4 41 B8R1.2 C#CC1=NC=CC=C1 E11413 [0,1,0,0,0,0|2,0,0]=3 42 B8R1.2 C(=O)C1=CC=CN=C1 P11581 [0,1,0,0,0,0|1,0,1]=3 43 B8R1.2 C(=O)C1=CC=NC=C1 P11582 [0,1,0,0,0,0|1,0,1]=3 44 B8R1.2 C=CC1=NC=CN=C1 V13362 [0,1,0,0,0,0|3,0,0]=4 45 B8R1.2 CC[N+]1=CC=CC=C1 E8507 [0,1,0,0,0,0|2,0,0]=3 46 B8R1.2 COC1=CC=NC=C1 M3232 [0,1,0,0,0,0|1,0,0]=2 47 B8R1.2 COC1=CC=NC=C1 M3232 [0,1,0,0,0,0|1,0,0]=2 48 B8R1.2 ClCC1=CC=CN=C1 C1770 [0,1,0,0,0,0|2,0,0]=3 49 B8R1.2 ClCC1=CC=NC=C1 C2804 [0,1,0,0,0,0|2,0,0]=3 50 B8R1.2 ClCC1=NC=CC=C1 C5538 [0,1,0,0,0,0|2,0,0]=3 51 B8R1.2 ClCC1=NC=CC=N1 C13629 [0,1,0,0,0,0|3,0,0]=4 52 B8R1.2 ClCC1=NC=CC=N1 C13629 [0,1,0,0,0,0|3,0,0]=4 53 B8R1.2 N#CC1=CC=CN=C1 C2747 [0,1,0,0,0,0|2,0,0]=3 54 B8R1.2 N#CC1=NC=CC=N1 C2476 [0,1,0,0,0,0|3,0,0]=4 55 B8R1.2 NCC1=CC=CN=C1 P2319 [0,1,0,0,0,0|2,0,0]=3 56 B8R1.2 NCC1=NC=CC=N1 A13173 [0,1,0,0,0,0|3,0,0]=4 57 B8R1.2 NNC1=NC=CC=N1 H19148 [0,1,0,0,0,0|3,0,0]=4 58 B8R1.2 OCC1=CN=CN=C1 P17132 [0,1,0,0,0,0|2,0,0]=3 59 B8R1.2 OCC1=NC=CC=C1 P1495 [0,1,0,0,0,0|1,0,0]=2 60 B8R1.2 OCC1=NC=CC=N1 P17605 [0,1,0,0,0,0|2,0,0]=3 61 B8R1.2 OCC1=NC=NC=C1 P14938 [0,1,0,0,0,0|2,0,0]=3 62 B8R1.3 BrC1=CN=C(Br)C=C1 D0300 [0,1,0,0,0,0|2,0,0]=3 63 B8R1.3 BrC1=CN=C(I)C=C1 B2799 [0,1,0,0,0,0|2,0,0]=3 64 B8R1.3 BrC1=CN=C(I)C=N1 I14524 [0,1,0,0,0,0|3,0,0]=4 65 B8R1.3 BrC1=CN=C(I)N=C1 B11051 [0,1,0,0,0,0|3,0,0]=4 66 B8R1.3 BrC1=CN=C(I)N=C1 B11051 [0,1,0,0,0,0|3,0,0]=4 67 B8R1.3 BrC1=NC=C(I)C=C1 B18506 [0,1,0,0,0,0|2,0,0]=3 68 B8R1.3 CC1=CC=C(Br)C=C1 B18871 [0,1,0,0,0,0|1,0,0]=2 69 B8R1.3 CC1=CC=C(Cl)N=N1 C2320 [0,1,0,0,0,0|3,0,0]=4 70 B8R1.3 CC1=CC=C(N)C=C1 T18863 [0,1,0,0,0,0|1,0,0]=2 71 B8R1.3 CC1=CN=C(Br)C=C1 B5054 [0,1,0,0,0,0|2,0,0]=3 72 B8R1.3 CC1=CN=C(F)C=C1 F16734 [0,1,0,0,0,0|2,0,0]=3 73 B8R1.3 CC1=CN=C(N)C=C1 A1408 [0,1,0,0,0,0|2,0,0]=3 74 B8R1.3 CC1=CN=C(N)C=N1 A18243 [0,1,0,0,0,0|3,0,0]=4 75 B8R1.3 CC1=CN=C(O)C=C1 H11434 [0,1,0,0,0,0|1,0,0]=2 76 B8R1.3 CC1=NC=C(Br)C=C1 B0366 [0,1,0,0,0,0|2,0,0]=3 77 B8R1.3 CC1=NC=C(N)C=C1 A1025 [0,1,0,0,0,0|2,0,0]=3 78 B8R1.3 CC1=NC=C(N)C=C1 A1025 [0,1,0,0,0,0|2,0,0]=3 79 B8R1.3 ClC1=CC=C(Br)C=N1 B1034 [0,1,0,0,0,0|2,0,0]=3 80 B8R1.3 ClC1=CC=C(Cl)N=N1 D1191 [0,1,0,0,0,0|3,0,0]=4 81 B8R1.3 ClC1=CC=C(I)N=N1 C17243 [0,1,0,0,0,0|3,0,0]=4 82 B8R1.3 ClC1=CN=C(Br)C=C1 B1035 [0,1,0,0,0,0|2,0,0]=3 83 B8R1.3 ClC1=CN=C(Cl)C=C1 D3860 [0,1,0,0,0,0|2,0,0]=3 84 B8R1.3 ClC1=CN=C(I)N=C1 C11052 [0,1,0,0,0,0|3,0,0]=4 85 B8R1.3 ClC1=NC=C(Br)C=N1 B3252 [0,1,0,0,0,0|3,0,0]=4 86 B8R1.3 ClC1=NC=C(I)C=C1 C2827 [0,1,0,0,0,0|2,0,0]=3 87 B8R1.3 ClC1=NC=C(I)C=N1 C17328 [0,1,0,0,0,0|3,0,0]=4 88 B8R1.3 FC1=CC=C(Br)C=C1 B11139 [0,1,0,0,0,0|1,0,0]=2 89 B8R1.3 FC1=CC=C(Br)N=C1 B8041 [0,1,0,0,0,0|2,0,0]=3 90 B8R1.3 FC1=CC=C(Cl)C=C1 C11141 [0,1,0,0,0,0|1,0,0]=2 91 B8R1.3 FC1=CC=C(F)C=C1 D0494 [0,1,0,0,0,0|1,0,0]=2 92 B8R1.3 FC1=CC=C(F)N=N1 D12350 [0,1,0,0,0,0|3,0,0]=4 93 B8R1.3 FC1=CC=C(I)C=C1 F9964 [0,1,0,0,0,0|1,0,0]=2 94 B8R1.3 FC1=CC=C(I)C=N1 F4567 [0,1,0,0,0,0|2,0,0]=3 95 B8R1.3 FC1=CC=C(S)C=C1 F0201 [0,1,0,0,0,0|0,1,0]=2 96 B8R1.3 FC1=CN=C(Cl)N=C1 C11600 [0,1,0,0,0,0|3,0,0]=4 97 B8R1.3 FC1=CN=C(Cl)N=C1 C11600 [0,1,0,0,0,0|3,0,0]=4 98 B8R1.3 FC1=NC=C(Br)C=C1 B4562 [0,1,0,0,0,0|2,0,0]=3 99 B8R1.3 FC1=NC=C(Cl)C=C1 C0694 [0,1,0,0,0,0|2,0,0]=3 100 B8R1.3 NC1=CC=C(Br)C=C1 B11593 [0,1,0,0,0,0|1,0,0]=2 101 B8R1.3 NC1=CC=C(Cl)C=C1 C1045 [0,1,0,0,0,0|1,0,0]=2 102 B8R1.3 NC1=CC=C(Cl)N=N1 C12532 [0,1,0,0,0,0|3,0,0]=4 103 B8R1.3 NC1=CC=C(F)C=C1 F5044 [0,1,0,0,0,0|1,0,0]=2 104 B8R1.3 NC1=CC=C(I)C=C1 D11133 [0,1,0,0,0,0|1,0,0]=2 105 B8R1.3 NC1=CC=C(N)C=C1 P8240 [0,1,0,0,0,0|1,0,0]=2 106 B8R1.3 NC1=CC=C(O)C=C1 A9327 [0,1,0,0,0,0|0,0,0]=1 107 B8R1.3 NC1=CC=C(O)C=N1 A15404 [0,1,0,0,0,0|1,0,0]=2 108 B8R1.3 NC1=CC=C(S)C=C1 A0193 [0,1,0,0,0,0|0,1,0]=2 109 B8R1.3 NC1=CN=C(Br)C=C1 A5466 [0,1,0,0,0,0|2,0,0]=3 110 B8R1.3 NC1=CN=C(Br)C=N1 A12579 [0,1,0,0,0,0|3,0,0]=4 111 B8R1.3 NC1=CN=C(Cl)C=C1 A1452 [0,1,0,0,0,0|2,0,0]=3 112 B8R1.3 NC1=CN=C(Cl)N=C1 A12632 [0,1,0,0,0,0|3,0,0]=4 113 B8R1.3 NC1=CN=C(F)C=C1 A4561 [0,1,0,0,0,0|2,0,0]=3 114 B8R1.3 NC1=CN=C(N)C=C1 D11589 [0,1,0,0,0,0|2,0,0]=3 115 B8R1.3 NC1=CN=C(N)C=C1 D5349 [0,1,0,0,0,0|2,0,0]=3 116 B8R1.3 NC1=CN=C(O)C=C1 A18681 [0,1,0,0,0,0|1,0,0]=2 117 B8R1.3 NC1=CN=C(O)C=C1 H2035 [0,1,0,0,0,0|1,0,0]=2 118 B8R1.3 NC1=NC=C(Br)C=C1 A5056 [0,1,0,0,0,0|2,0,0]=3 119 B8R1.3 NC1=NC=C(Br)C=N1 A3251 [0,1,0,0,0,0|3,0,0]=4 120 B8R1.3 NC1=NC=C(Cl)C=C1 A0913 [0,1,0,0,0,0|2,0,0]=3 121 B8R1.3 NC1=NC=C(Cl)C=N1 A5036 [0,1,0,0,0,0|3,0,0]=4 122 B8R1.3 NC1=NC=C(F)C=C1 A1918 [0,1,0,0,0,0|2,0,0]=3 123 B8R1.3 NC1=NC=C(I)C=C1 A5502 [0,1,0,0,0,0|2,0,0]=3 124 B8R1.3 NC1=NC=C(I)C=N1 A9928 [0,1,0,0,0,0|3,0,0]=4 125 B8R1.3 OC1=CC=C(Br)C=C1 B18859 [0,1,0,0,0,0|0,0,0]=1 126 B8R1.3 OC1=CC=C(Br)C=N1 B7974 [0,1,0,0,0,0|1,0,0]=2 127 B8R1.3 OC1=CC=C(F)C=C1 F11147 [0,1,0,0,0,0|0,0,0]=1 128 B8R1.3 OC1=CC=C(I)C=C1 I0762 [0,1,0,0,0,0|0,0,0]=1 129 B8R1.3 OC1=CN=C(Br)C=C1 B18504 [0,1,0,0,0,0|1,0,0]=2 130 B8R1.3 OC1=CN=C(Cl)C=C1 C11720 [0,1,0,0,0,0|1,0,0]=2 131 B8R1.3 OC1=CN=C(Cl)C=C1 C11720 [0,1,0,0,0,0|1,0,0]=2 132 B8R1.3 OC1=CN=C(F)C=C1 F17081 [0,1,0,0,0,0|1,0,0]=2 133 B8R1.3 OC1=NC=C(Br)C=N1 B3253 [0,1,0,0,0,0|2,0,0]=3 134 B8R1.3 OC1=NC=C(Br)C=N1 B3253 [0,1,0,0,0,0|2,0,0]=3 135 B8R1.3 OC1=NN=C(O)C=C1 D5063 [0,1,0,0,0,0|2,0,0]=3 136 B8R1.3 ON1=CC=C(Br)C=C1 B17443 [0,1,0,0,0,0|1,0,0]=2 137 B8R1.4 BrC1=CC(Br)=NC=C1 D1833 [0,1,0,0,0,0|2,0,0]=3 138 B8R1.4 BrC1=CC=CC(Br)=C1 D10509 [0,1,0,0,0,0|1,0,0]=2 139 B8R1.4 BrC1=CC=CC(Br)=N1 D3482 [0,1,0,0,0,0|2,0,0]=3 140 B8R1.4 BrC1=CN=CC(Br)=C1 D1834 [0,1,0,0,0,0|2,0,0]=3 141 B8R1.4 BrC1=NC=CC(I)=C1 B1908 [0,1,0,0,0,0|2,0,0]=3 142 B8R1.4 CC1=CC(Br)=CC=N1 B11287 [0,1,0,0,0,0|2,0,0]=3 143 B8R1.4 CC1=CC(Br)=NC=C1 B2654 [0,1,0,0,0,0|2,0,0]=3 144 B8R1.4 CC1=CC(F)=NC=C1 F12483 [0,1,0,0,0,0|2,0,0]=3 145 B8R1.4 CC1=CC(N)=CN=C1 M11544 [0,1,0,0,0,0|2,0,0]=3 146 B8R1.4 CC1=CC(N)=NC=C1 A3549 [0,1,0,0,0,0|2,0,0]=3 147 B8R1.4 CC1=CC(O)=NC=C1 H11433 [0,1,0,0,0,0|1,0,0]=2 148 B8R1.4 CC1=CC=CC(Br)=N1 B7894 [0,1,0,0,0,0|2,0,0]=3 149 B8R1.4 CC1=CC=CC(Cl)=N1 C0781 [0,1,0,0,0,0|2,0,0]=3 150 B8R1.4 CC1=CC=CC(I)=C1 I9818 [0,1,0,0,0,0|1,0,0]=2 151 B8R1.4 CC1=CC=CC(O)=N1 H2705 [0,1,0,0,0,0|1,0,0]=2 152 B8R1.4 CC1=CC=CC(O)=N1 H2705 [0,1,0,0,0,0|1,0,0]=2 153 B8R1.4 CC1=CC=NC(Br)=N1 B7935 [0,1,0,0,0,0|3,0,0]=4 154 B8R1.4 CC1=CN=CC(Br)=C1 B1021 [0,1,0,0,0,0|2,0,0]=3 155 B8R1.4 CC1=CN=CC(Br)=C1 B1021 [0,1,0,0,0,0|2,0,0]=3 156 B8R1.4 CC1=CN=CC(C)=C1 D3192 [0,1,0,0,0,0|2,0,0]=3 157 B8R1.4 CC1=NC(Cl)=NC=C1 C16993 [0,1,0,0,0,0|3,0,0]=4 158 B8R1.4 CC1=NC(N)=CC=C1 A1028 [0,1,0,0,0,0|2,0,0]=3 159 B8R1.4 CC1=NC(O)=NC=C1 H11330 [0,1,0,0,0,0|2,0,0]=3 160 B8R1.4 CC1=NC=CC(N)=C1 A1027 [0,1,0,0,0,0|2,0,0]=3 161 B8R1.4 CC1=NC=NC(Cl)=C1 M4481 [0,1,0,0,0,0|3,0,0]=4 162 B8R1.4 ClC1=CC(Cl)=NC=C1 D1832 [0,1,0,0,0,0|2,0,0]=3 163 B8R1.4 ClC1=CC(Cl)=NC=N1 D1088 [0,1,0,0,0,0|3,0,0]=4 164 B8R1.4 ClC1=CC=NC(Br)=C1 B1838 [0,1,0,0,0,0|2,0,0]=3 165 B8R1.4 ClC1=CC=NC(Cl)=N1 D1230 [0,1,0,0,0,0|3,0,0]=4 166 B8R1.4 ClC1=CC=NC(Cl)=N1 D1230 [0,1,0,0,0,0|3,0,0]=4 167 B8R1.4 ClC1=CN=CC(Br)=C1 B11419 [0,1,0,0,0,0|2,0,0]=3 168 B8R1.4 ClC1=CN=CC(Cl)=C1 D1836 [0,1,0,0,0,0|2,0,0]=3 169 B8R1.4 ClC1=CN=CC(Cl)=N1 D1339 [0,1,0,0,0,0|3,0,0]=4 170 B8R1.4 ClC1=NC(I)=CC=C1 C2815 [0,1,0,0,0,0|2,0,0]=3 171 B8R1.4 ClC1=NC=CC(Br)=C1 B1837 [0,1,0,0,0,0|2,0,0]=3 172 B8R1.4 ClC1=NC=CC(I)=C1 C3227 [0,1,0,0,0,0|2,0,0]=3 173 B8R1.4 ClC1=NC=CC(I)=C1 C3227 [0,1,0,0,0,0|2,0,0]=3 174 B8R1.4 FC1=CC(Cl)=CC=C1 C11140 [0,1,0,0,0,0|1,0,0]=2 175 B8R1.4 FC1=CC(Cl)=NC=C1 C0693 [0,1,0,0,0,0|2,0,0]=3 176 B8R1.4 FC1=CC(S)=CC=C1 F5243 [0,1,0,0,0,0|0,1,0]=2 177 B8R1.4 FC1=CC=CC(Br)=C1 B11138 [0,1,0,0,0,0|1,0,0]=2 178 B8R1.4 FC1=CC=CC(Br)=N1 B4637 [0,1,0,0,0,0|2,0,0]=3 179 B8R1.4 FC1=CC=CC(F)=C1 D11159 [0,1,0,0,0,0|1,0,0]=2 180 B8R1.4 FC1=CC=CC(F)=N1 D11482 [0,1,0,0,0,0|2,0,0]=3 181 B8R1.4 FC1=CC=CC(I)=C1 F9963 [0,1,0,0,0,0|1,0,0]=2 182 B8R1.4 FC1=CN=CC(Br)=C1 B8042 [0,1,0,0,0,0|2,0,0]=3 183 B8R1.4 FC1=CN=CC(Cl)=C1 C11480 [0,1,0,0,0,0|2,0,0]=3 184 B8R1.4 FC1=CN=CC(F)=C1 D11481 [0,1,0,0,0,0|2,0,0]=3 185 B8R1.4 FC1=NC=CC(I)=C1 F16735 [0,1,0,0,0,0|2,0,0]=3 186 B8R1.4 NC1=CC(Br)=CN=C1 B2718 [0,1,0,0,0,0|2,0,0]=3 187 B8R1.4 NC1=CC(Br)=NC=C1 A2081 [0,1,0,0,0,0|2,0,0]=3 188 B8R1.4 NC1=CC(Cl)=NC=C1 A0127 [0,1,0,0,0,0|2,0,0]=3 189 B8R1.4 NC1=CC(Cl)=NC=C1 A0127 [0,1,0,0,0,0|2,0,0]=3 190 B8R1.4 NC1=CC(Cl)=NC=N1 A11506 [0,1,0,0,0,0|3,0,0]=4 191 B8R1.4 NC1=CC(N)=NC=N1 D4319 [0,1,0,0,0,0|3,0,0]=4 192 B8R1.4 NC1=CC(O)=CC=N1 A14644 [0,1,0,0,0,0|1,0,0]=2 193 B8R1.4 NC1=CC(O)=CC=N1 A14644 [0,1,0,0,0,0|1,0,0]=2 194 B8R1.4 NC1=CC(O)=NC=C1 A14552 [0,1,0,0,0,0|1,0,0]=2 195 B8R1.4 NC1=CC=CC(Br)=C1 B11592 [0,1,0,0,0,0|1,0,0]=2 196 B8R1.4 NC1=CC=CC(Br)=N1 A7933 [0,1,0,0,0,0|2,0,0]=3 197 B8R1.4 NC1=CC=CC(F)=C1 F0703 [0,1,0,0,0,0|1,0,0]=2 198 B8R1.4 NC1=CC=CC(O)=N1 A14451 [0,1,0,0,0,0|1,0,0]=2 199 B8R1.4 NC1=CN=CC(Cl)=C1 C1840 [0,1,0,0,0,0|2,0,0]=3 200 B8R1.4 NC1=CN=CC(Cl)=N1 A3767 [0,1,0,0,0,0|3,0,0]=4 201 B8R1.4 NC1=NC(=O)NC=C1 C0377 [0,1,0,0,0,0|2,0,1]=4 202 B8R1.4 NC1=NC(Cl)=CC=C1 A11440 [0,1,0,0,0,0|2,0,0]=3 203 B8R1.4 NC1=NC(Cl)=NC=C1 A1939 [0,1,0,0,0,0|3,0,0]=4 204 B8R1.4 NC1=NC(Cl)=NC=C1 A1939 [0,1,0,0,0,0|3,0,0]=4 205 B8R1.4 NC1=NC=CC(Br)=C1 A11797 [0,1,0,0,0,0|2,0,0]=3 206 B8R1.4 NC1=NC=CC(Cl)=C1 A11778 [0,1,0,0,0,0|2,0,0]=3 207 B8R1.4 NC1=NC=CC(Cl)=N1 A2445 [0,1,0,0,0,0|3,0,0]=4 208 B8R1.4 NC1=NC=CC(Cl)=N1 A2445 [0,1,0,0,0,0|3,0,0]=4 209 B8R1.4 OC1=CC(I)=CC=C1 I9898 [0,1,0,0,0,0|0,0,0]=1 210 B8R1.4 OC1=CC(O)=NC=N1 D1169 [0,1,0,0,0,0|2,0,0]=3 211 B8R1.4 OC1=CC(S)=CC=C1 H4937 [0,1,0,0,0,0|0,0,0]=1 212 B8R1.4 OC1=CC=CC(Br)=C1 B0311 [0,1,0,0,0,0|0,0,0]=1 213 B8R1.4 OC1=CC=CC(Br)=N1 B11447 [0,1,0,0,0,0|1,0,0]=2 214 B8R1.4 OC1=CC=CC(Cl)=C1 C1354 [0,1,0,0,0,0|0,0,0]=1 215 B8R1.4 OC1=CC=CC(F)=C1 F11146 [0,1,0,0,0,0|0,0,0]=1 216 B8R1.4 OC1=CC=CC(O)=N1 D14168 [0,1,0,0,0,0|1,0,0]=2 217 B8R1.4 OC1=CC=NC(Cl)=C1 C2931 [0,1,0,0,0,0|1,0,0]=2 218 B8R1.4 OC1=CC=NC(Cl)=C1 C2931 [0,1,0,0,0,0|1,0,0]=2 219 B8R1.4 OC1=CN=CC(Br)=C1 B11445 [0,1,0,0,0,0|1,0,0]=2 220 B8R1.4 OC1=NC(O)=NC=C1 D17728 [0,1,0,0,0,0|2,0,0]=3 221 B8R1.4 ON1=CC(Cl)=CC=C1 C17292 [0,1,0,0,0,0|1,0,0]=2 222 B8R1.4 SC1=CC=CC(Br)=C1 B0695 [0,1,0,0,0,0|0,1,0]=2 223 B8R1.4 SC1=CC=CC(Cl)=C1 C0701 [0,1,0,0,0,0|0,1,0]=2 224 B8R1.5 BrC1=C(Br)N=CC=C1 D10541 [0,1,0,0,0,0|2,0,0]=3 225 B8R1.5 BrC1=CC=NC=C1Br D1835 [0,1,0,0,0,0|2,0,0]=3 226 B8R1.5 CC1=C(Br)C=CC=N1 B7895 [0,1,0,0,0,0|2,0,0]=3 227 B8R1.5 CC1=C(Br)C=CC=N1 B7895 [0,1,0,0,0,0|2,0,0]=3 228 B8R1.5 CC1=C(Br)C=NC=C1 B5109 [0,1,0,0,0,0|2,0,0]=3 229 B8R1.5 CC1=C(Cl)C=NC=C1 C17294 [0,1,0,0,0,0|2,0,0]=3 230 B8R1.5 CC1=C(F)N=CC=C1 F4563 [0,1,0,0,0,0|2,0,0]=3 231 B8R1.5 CC1=C(N)C=CN=C1 A1026 [0,1,0,0,0,0|2,0,0]=3 232 B8R1.5 CC1=C(N)C=NC=C1 M2783 [0,1,0,0,0,0|2,0,0]=3 233 B8R1.5 CC1=C(N)C=NC=C1 M2783 [0,1,0,0,0,0|2,0,0]=3 234 B8R1.5 CC1=C(S)C=CC=C1 T0861 [0,1,0,0,0,0|0,1,0]=2 235 B8R1.5 CC1=CC=CC=C1I I1272 [0,1,0,0,0,0|1,0,0]=2 236 B8R1.5 CC1=CC=CN=C1Br B1020 [0,1,0,0,0,0|2,0,0]=3 237 B8R1.5 CC1=CC=CN=C1Br B1020 [0,1,0,0,0,0|2,0,0]=3 238 B8R1.5 CC1=CC=CN=C1Cl C1079 [0,1,0,0,0,0|2,0,0]=3 239 B8R1.5 CC1=CC=CN=C1O H11432 [0,1,0,0,0,0|1,0,0]=2 240 B8R1.5 CC1=NC=CC=C1N A5470 [0,1,0,0,0,0|2,0,0]=3 241 B8R1.5 CC1=NC=CC=C1O H6683 [0,1,0,0,0,0|1,0,0]=2 242 B8R1.5 CC1=NC=CN=C1C D0878 [0,1,0,0,0,0|3,0,0]=4 243 B8R1.5 ClC1=C(Br)C=CN=C1 B17251 [0,1,0,0,0,0|2,0,0]=3 244 B8R1.5 ClC1=C(Cl)C=NC=C1 D11763 [0,1,0,0,0,0|2,0,0]=3 245 B8R1.5 ClC1=C(I)C=CN=C1 C17297 [0,1,0,0,0,0|2,0,0]=3 246 B8R1.5 ClC1=C(I)C=NC=N1 C11508 [0,1,0,0,0,0|3,0,0]=4 247 B8R1.5 ClC1=CC=CN=C1Br B17285 [0,1,0,0,0,0|2,0,0]=3 248 B8R1.5 ClC1=CC=CN=C1Cl D3859 [0,1,0,0,0,0|2,0,0]=3 249 B8R1.5 ClC1=CC=CN=C1I C17310 [0,1,0,0,0,0|2,0,0]=3 250 B8R1.5 ClC1=CC=NC=C1Br B8706 [0,1,0,0,0,0|2,0,0]=3 251 B8R1.5 ClC1=NC=CC=C1Br B3796 [0,1,0,0,0,0|2,0,0]=3 252 B8R1.5 ClC1=NC=CC=C1I C2829 [0,1,0,0,0,0|2,0,0]=3 253 B8R1.5 ClC1=NC=CC=C1I C2829 [0,1,0,0,0,0|2,0,0]=3 254 B8R1.5 ClC1=NC=CN=C1Cl D3858 [0,1,0,0,0,0|3,0,0]=4 255 B8R1.5 FC1=C(Br)C=CN=C1 B8043 [0,1,0,0,0,0|2,0,0]=3 256 B8R1.5 FC1=C(Cl)C=CN=C1 C2693 [0,1,0,0,0,0|2,0,0]=3 257 B8R1.5 FC1=C(F)N=CC=C1 D4565 [0,1,0,0,0,0|2,0,0]=3 258 B8R1.5 FC1=C(F)N=CC=C1 D4565 [0,1,0,0,0,0|2,0,0]=3 259 B8R1.5 FC1=C(I)C=CC=C1 F9962 [0,1,0,0,0,0|1,0,0]=2 260 B8R1.5 FC1=CC=CC=C1Br B1067 [0,1,0,0,0,0|1,0,0]=2 261 B8R1.5 FC1=CC=CC=C1Cl C1372 [0,1,0,0,0,0|1,0,0]=2 262 B8R1.5 FC1=CC=CC=C1F D11158 [0,1,0,0,0,0|1,0,0]=2 263 B8R1.5 FC1=CC=CC=C1S F0637 [0,1,0,0,0,0|0,1,0]=2 264 B8R1.5 FC1=CC=CN=C1I F14061 [0,1,0,0,0,0|2,0,0]=3 265 B8R1.5 FC1=NC=CC=C1Cl C4560 [0,1,0,0,0,0|2,0,0]=3 266 B8R1.5 FC1=NC=CC=C1I F10006 [0,1,0,0,0,0|2,0,0]=3 267 B8R1.5 NC1=C(Br)C=CC=C1 B7893 [0,1,0,0,0,0|1,0,0]=2 268 B8R1.5 NC1=C(Br)C=CC=N1 A1029 [0,1,0,0,0,0|2,0,0]=3 269 B8R1.5 NC1=C(Cl)C=CN=C1 A5467 [0,1,0,0,0,0|2,0,0]=3 270 B8R1.5 NC1=C(I)C=CC=C1 I9858 [0,1,0,0,0,0|1,0,0]=2 271 B8R1.5 NC1=C(N)C=NC=C1 D5650 [0,1,0,0,0,0|2,0,0]=3 272 B8R1.5 NC1=C(N)N=CC=C1 D5372 [0,1,0,0,0,0|2,0,0]=3 273 B8R1.5 NC1=C(N)N=CC=C1 D5372 [0,1,0,0,0,0|2,0,0]=3 274 B8R1.5 NC1=C(O)C=CN=C1 A5469 [0,1,0,0,0,0|1,0,0]=2 275 B8R1.5 NC1=C(O)C=CN=C1 A5469 [0,1,0,0,0,0|1,0,0]=2 276 B8R1.5 NC1=C(O)C=NC=C1 A14525 [0,1,0,0,0,0|1,0,0]=2 277 B8R1.5 NC1=C(O)C=NC=C1 A14525 [0,1,0,0,0,0|1,0,0]=2 278 B8R1.5 NC1=CC=CC=C1F F11150 [0,1,0,0,0,0|1,0,0]=2 279 B8R1.5 NC1=CC=CC=C1N P18799 [0,1,0,0,0,0|1,0,0]=2 280 B8R1.5 NC1=CC=CN=C1Br A2720 [0,1,0,0,0,0|2,0,0]=3 281 B8R1.5 NC1=CC=CN=C1Cl A0125 [0,1,0,0,0,0|2,0,0]=3 282 B8R1.5 NC1=CC=CN=C1O A3846 [0,1,0,0,0,0|1,0,0]=2 283 B8R1.5 NC1=CC=CNC1=S A15134 [0,1,0,0,0,0|1,1,0]=3 284 B8R1.5 NC1=CC=CNC1=S A15134 [0,1,0,0,0,0|1,1,0]=3 285 B8R1.5 NC1=CC=NC=C1Br A7934 [0,1,0,0,0,0|2,0,0]=3 286 B8R1.5 NC1=CC=NC=C1Cl A12497 [0,1,0,0,0,0|2,0,0]=3 287 B8R1.5 NC1=CC=NC=C1I I13841 [0,1,0,0,0,0|2,0,0]=3 288 B8R1.5 NC1=CN=CN=C1N F12586 [0,1,0,0,0,0|3,0,0]=4 289 B8R1.5 NC1=NC=CC=C1Cl A7281 [0,1,0,0,0,0|2,0,0]=3 290 B8R1.5 NC1=NC=CC=C1O A0268 [0,1,0,0,0,0|1,0,0]=2 291 B8R1.5 NC1=NC=CN=C1Br A19171 [0,1,0,0,0,0|3,0,0]=4 292 B8R1.5 O=C1NC=CC=C1Cl C17306 [0,1,0,0,0,0|1,0,1]=3 293 B8R1.5 O=C1OC=CC=C1O H13085 [0,1,0,0,0,0|1,0,0]=2 294 B8R1.5 O=C1OC=CC=C1O H13085 [0,1,0,0,0,0|1,0,0]=2 295 B8R1.5 OC1=C(Br)C=CC=C1 B0603 [0,1,0,0,0,0|0,0,0]=1 296 B8R1.5 OC1=C(F)C=NC=N1 F11602 [0,1,0,0,0,0|2,0,0]=3 297 B8R1.5 OC1=C(I)C=CC=C1 I9899 [0,1,0,0,0,0|0,0,0]=1 298 B8R1.5 OC1=C(O)N=CC=C1 D3231 [0,1,0,0,0,0|1,0,0]=2 299 B8R1.5 OC1=CC=CC=C1F D0106 [0,1,0,0,0,0|0,0,0]=1 300 B8R1.5 OC1=CC=CC=C1S H2530 [0,1,0,0,0,0|0,0,0]=1 301 B8R1.5 OC1=CC=CN=C1Br B2507 [0,1,0,0,0,0|1,0,0]=2 302 B8R1.5 OC1=CC=CN=C1Cl C2506 [0,1,0,0,0,0|1,0,0]=2 303 B8R1.5 OC1=CC=CN=C1Cl C2506 [0,1,0,0,0,0|1,0,0]=2 304 B8R1.5 S=C1NC=CC=C1Cl C17304 [0,1,0,0,0,0|1,1,0]=3 305 B8R1.5 SC1=CC=CC=C1Br B0605 [0,1,0,0,0,0|0,1,0]=2 306 B8R1.5 SC1=CC=CC=C1Cl C0629 [0,1,0,0,0,0|0,1,0]=2 307 B8R1.5 [O-][N+]1=C([S-])C=CC=C1 S2834 [0,1,0,0,0,0|1,0,1]=3 308 B6R1.2 BrC1=CC=CS1 B7561 [0,0,0,0,1,0|2,0,0]=3 309 B6R1.2 BrC1=CNC=N1 B11785 [0,0,0,0,1,0|3,0,0]=4 310 B6R1.2 BrC1=CNN=C1 B17685 [0,0,0,0,1,0|3,0,0]=4 311 B6R1.2 BrC1=CSC=C1 B7562 [0,0,0,0,1,0|2,0,0]=3 312 B6R1.2 BrC1=CSC=N1 B12641 [0,0,0,0,1,0|3,0,0]=4 313 B6R1.2 BrC1=NC=CS1 B7609 [0,0,0,0,1,0|3,0,0]=4 314 B6R1.2 BrC1=NSC=C1 B19313 [0,0,0,0,1,0|3,0,0]=4 315 B6R1.2 CC1=CNC=N1 M0110 [0,0,0,0,1,0|3,0,0]=4 316 B6R1.2 CC1=CON=C1 M14375 [0,0,0,0,1,0|3,0,0]=4 317 B6R1.2 CC1=NC=CN1 M18847 [0,0,0,0,1,0|3,0,0]=4 318 B6R1.2 CC1=NC=CS1 M17737 [0,0,0,0,1,0|3,0,0]=4 319 B6R1.2 IC1=CC=CS1 I3940 [0,0,0,0,1,0|2,0,0]=3 320 B6R1.2 IC1=CNC=N1 I4020 [0,0,0,0,1,0|3,0,0]=4 321 B6R1.2 IC1=CNC=N1 I4020 [0,0,0,0,1,0|3,0,0]=4 322 B6R1.2 IC1=CNN=C1 I8759 [0,0,0,0,1,0|3,0,0]=4 323 B6R1.2 NC1=CSC=N1 A19319 [0,0,0,0,1,0|3,0,0]=4 324 B6R1.2 NC1=NC=CN1 A6573 [0,0,0,0,1,0|3,0,0]=4 325 B6R1.2 O=C1C=CCC1 C18886 [0,0,0,0,1,0|0,0,3]=4 326 B6R1.2 O=C1C=CSN1 S19312 [0,0,0,0,1,0|2,0,1]=4 327 B6R1.2 [NH3+]C1=CNN=C1 P12536 [0,0,0,0,1,0|3,0,0]=4 328 B7R1.1 BrCC1=CSC=C1 B8083 [0,1,0,0,1,0|2,0,0]=4 329 B7R1.1 BrCC1=CSC=C1 B8083 [0,1,0,0,1,0|2,0,0]=4 330 B7R1.1 C(=O)C1=CSC=C1 T0722 [0,1,0,0,1,0|1,0,1]=4 331 B7R1.1 C(=O)C1=CSC=C1 T0722 [0,1,0,0,1,0|1,0,1]=4 332 B7R1.1 N#CC1=CC=CS1 T2218 [0,1,0,0,1,0|2,0,0]=4 333 B7R1.1 NCC1=CC=CO1 F2158 [0,1,0,0,1,0|2,0,0]=4 334 B7R1.1 NCC1=CC=CS1 T3333 [0,1,0,0,1,0|2,0,0]=4 335 B7R1.1 O=CC1=CC=CN1 P4103 [0,1,0,0,1,0|1,0,1]=4 336 B7R1.1 O=CC1=CC=CN1 P4103 [0,1,0,0,1,0|1,0,1]=4 337 B7R1.1 O=CC1=CC=CS1 T1387 [0,1,0,0,1,0|1,0,1]=4 338 B7R1.1 OCC1=CN=CS1 H15363 [0,1,0,0,1,0|2,0,0]=4 339 B7R1.1 OCC1=CNC=N1 H11787 [0,1,0,0,1,0|2,0,0]=4 340 B7R1.1 OCC1=CNC=N1 H4012 [0,1,0,0,1,0|2,0,0]=4 341 B7R1.1 OCC1=NC=CN1 I14917 [0,1,0,0,1,0|2,0,0]=4 342 B7R1.1 OCC1=NNC=C1 P17144 [0,1,0,0,1,0|2,0,0]=4 343 B7R1.1 OCC1=NNC=C1 P17144 [0,1,0,0,1,0|2,0,0]=4 344 B7R1.2 BrC1=CC=C(Br)S1 D0151 [0,1,0,0,1,0|2,0,0]=4 345 B7R1.2 CC1=CC(Br)=CS1 B8084 [0,1,0,0,1,0|2,0,0]=4 346 B7R1.2 CC1=CC=C(Br)S1 B3937 [0,1,0,0,1,0|2,0,0]=4 347 B7R1.2 CC1=CC=C(C)N1 D1487 [0,1,0,0,1,0|2,0,0]=4 348 B7R1.2 CC1=CC=C(C)S1 P14109 [0,1,0,0,1,0|2,0,0]=4 349 B7R1.2 ClC1=CC=C(Br)S1 B3948 [0,1,0,0,1,0|2,0,0]=4 350 B7R1.2 ClC1=CC=C(Cl)S1 D1586 [0,1,0,0,1,0|2,0,0]=4 351 B7R1.2 O=C1C=CC(=O)N1 M17760 [0,1,0,0,1,0|1,0,1]=4 352 B7R1.4 BrC1=C(Br)SC=C1 D3934 [0,1,0,0,1,0|2,0,0]=4 353 B7R1.4 BrC1=CSC=C1Br D3935 [0,1,0,0,1,0|2,0,0]=4 354 B7R1.4 CC1=C(Br)SC=C1 B5335 [0,1,0,0,1,0|2,0,0]=4 355 B7R1.4 CC1=C(Cl)SC=C1 C1192 [0,1,0,0,1,0|2,0,0]=4 356 B7R1.4 ClC1=C(Br)C=CS1 B8915 [0,1,0,0,1,0|2,0,0]=4 357 B9R1.5 O=C1C=CC=CC=C1O T2965 [0,1,0,0,0,1|0,0,0]=2 358 B9R1.5 O=C1C=CC=CC=C1O T2965 [0,1,0,0,0,1|0,0,0]=2 359 B9R1.1 BrCC1=CC=C(Br)C=C1 B12509 [0,2,0,0,0,0|1,0,0]=3 360 B9R1.1 C#CC1=CC=C(Br)C=C1 B16946 [0,2,0,0,0,0|1,0,0]=3 361 B9R1.1 C#CC1=CC=C(C)C=C1 E11660 [0,2,0,0,0,0|1,0,0]=3 362 B9R1.1 C#CC1=CC=C(Cl)C=C1 C16997 [0,2,0,0,0,0|1,0,0]=3 363 B9R1.1 C#CC1=CC=C(F)C=C1 E17048 [0,2,0,0,0,0|1,0,0]=3 364 B9R1.1 C#CC1=CC=C(N)C=C1 E11457 [0,2,0,0,0,0|1,0,0]=3 365 B9R1.1 C(=O)C1=CC=C(C)C=C1 M0262 [0,2,0,0,0,0|0,0,1]=3 366 B9R1.1 C(=O)C1=CC=C(F)C=C1 F5017 [0,2,0,0,0,0|0,0,1]=3 367 B9R1.1 C(=O)C1=CC=C(O)C=C1 H0254 [0,2,0,0,0,0|0,0,0]=2 368 B9R1.1 C=CC1=CC=C(Br)C=C1 B8315 [0,2,0,0,0,0|1,0,0]=3 369 B9R1.1 CC1=CC=C(C#N)C=C1 T0293 [0,2,0,0,0,0|1,0,0]=3 370 B9R1.1 CC1=CC=C(CN)C=C1 M4305 [0,2,0,0,0,0|1,0,0]=3 371 B9R1.1 CC1=CC=C(CN)C=C1 M4305 [0,2,0,0,0,0|1,0,0]=3 372 B9R1.1 CC1=CC=C(NN)C=C1 M0766 [0,2,0,0,0,0|1,0,0]=3 373 B9R1.1 CC1=CC=C(NN)C=C1 M0766 [0,2,0,0,0,0|1,0,0]=3 374 B9R1.1 CC1=NC=C(CO)C=N1 M17093 [0,2,0,0,0,0|2,0,0]=4 375 B9R1.1 CCC1=CC=C(Br)C=C1 B8398 [0,2,0,0,0,0|1,0,0]=3 376 B9R1.1 CNC1=CC=C(Br)C=C1 B8439 [0,2,0,0,0,0|1,0,0]=3 377 B9R1.1 CNC1=CC=C(N)C=C1 M8801 [0,2,0,0,0,0|1,0,0]=3 378 B9R1.1 COC1=CC=C(F)C=C1 F0756 [0,2,0,0,0,0|0,0,0]=2 379 B9R1.1 COC1=CC=C(N)N=N1 A12534 [0,2,0,0,0,0|2,0,0]=4 380 B9R1.1 COC1=CC=C(O)C=C1 M0306 [0,2,0,0,0,0|0,0,0]=2 381 B9R1.1 COC1=CC=C(O)C=C1 M0306 [0,2,0,0,0,0|0,0,0]=2 382 B9R1.1 COC1=CC=C(S)C=C1 M0764 [0,2,0,0,0,0|0,0,0]=2 383 B9R1.1 COC1=CN=C(N)C=C1 A18252 [0,2,0,0,0,0|1,0,0]=3 384 B9R1.1 COC1=NC=C(Br)C=C1 B2938 [0,2,0,0,0,0|1,0,0]=3 385 B9R1.1 COC1=NC=C(Br)C=N1 B11790 [0,2,0,0,0,0|2,0,0]=4 386 B9R1.1 COC1=NC=C(N)C=C1 A1857 [0,2,0,0,0,0|1,0,0]=3 387 B9R1.1 COC1=NC=C(O)C=C1 H14190 [0,2,0,0,0,0|1,0,0]=3 388 B9R1.1 CSC1=CC=C(C)C=C1 M3899 [0,2,0,0,0,0|0,1,0]=3 389 B9R1.1 CSC1=CC=C(F)C=C1 F3886 [0,2,0,0,0,0|0,1,0]=3 390 B9R1.1 ClC1=CC=C(CBr)C=C1 C9247 [0,2,0,0,0,0|1,0,0]=3 391 B9R1.1 ClCC1=CC=C(Br)C=C1 B4168 [0,2,0,0,0,0|1,0,0]=3 392 B9R1.1 ClCC1=CN=C(Cl)C=C1 C0611 [0,2,0,0,0,0|2,0,0]=4 393 B9R1.1 FC1=CC=C(CBr)C=C1 F8550 [0,2,0,0,0,0|1,0,0]=3 394 B9R1.1 FC1=CC=C(CCl)C=C1 F5018 [0,2,0,0,0,0|1,0,0]=3 395 B9R1.1 FC1=CC=C(CS)C=C1 F3880 [0,2,0,0,0,0|0,1,0]=3 396 B9R1.1 N#CC1=CC=C(Br)C=C1 B1073 [0,2,0,0,0,0|1,0,0]=3 397 B9R1.1 N#CC1=CC=C(Br)N=C1 B8312 [0,2,0,0,0,0|2,0,0]=4 398 B9R1.1 N#CC1=CC=C(F)C=C1 F0968 [0,2,0,0,0,0|1,0,0]=3 399 B9R1.1 N#CC1=CC=C(I)C=C1 I2732 [0,2,0,0,0,0|1,0,0]=3 400 B9R1.1 N#CC1=CC=C(N)C=C1 A0412 [0,2,0,0,0,0|1,0,0]=3 401 B9R1.1 N#CC1=CC=C(N)C=C1 A0412 [0,2,0,0,0,0|1,0,0]=3 402 B9R1.1 N#CC1=CN=C(Cl)C=C1 C11310 [0,2,0,0,0,0|2,0,0]=4 403 B9R1.1 N#CC1=CN=C(N)C=C1 A6296 [0,2,0,0,0,0|2,0,0]=4 404 B9R1.1 N#CC1=NC=C(Br)C=C1 B2891 [0,2,0,0,0,0|2,0,0]=4 405 B9R1.1 N#CC1=NC=C(Br)C=C1 B2891 [0,2,0,0,0,0|2,0,0]=4 406 B9R1.1 N#CC1=NC=C(N)C=C1 A11834 [0,2,0,0,0,0|2,0,0]=4 407 B9R1.1 NCC1=CC=C(Br)C=C1 B9996 [0,2,0,0,0,0|1,0,0]=3 408 B9R1.1 NCC1=CC=C(O)C=C1 H4008 [0,2,0,0,0,0|0,0,0]=2 409 B9R1.1 NCC1=CC=C(O)C=C1 H4008 [0,2,0,0,0,0|0,0,0]=2 410 B9R1.1 NCC1=CC=C(O)C=C1 H9189 [0,2,0,0,0,0|0,0,0]=2 411 B9R1.1 NCC1=CN=C(N)C=C1 A14418 [0,2,0,0,0,0|2,0,0]=4 412 B9R1.1 NCC1=CNC(=O)C=C1 A18120 [0,2,0,0,0,0|1,0,1]=4 413 B9R1.1 NNC1=CC=C(Br)C=C1 B10048 [0,2,0,0,0,0|1,0,0]=3 414 B9R1.1 NNC1=CC=C(Cl)C=C1 C0754 [0,2,0,0,0,0|1,0,0]=3 415 B9R1.1 NNC1=CC=C(Cl)C=C1 C3479 [0,2,0,0,0,0|1,0,0]=3 416 B9R1.1 NNC1=CC=C(F)C=C1 F3997 [0,2,0,0,0,0|1,0,0]=3 417 B9R1.1 NNC1=NC=C(Br)C=C1 B11539 [0,2,0,0,0,0|2,0,0]=4 418 B9R1.1 O=C1C=CC(CO)=CN1 H11547 [0,2,0,0,0,0|1,0,0]=3 419 B9R1.1 O=CC1=CC=C(Br)C=C1 B8396 [0,2,0,0,0,0|0,0,1]=3 420 B9R1.1 O=CC1=CC=C(Cl)N=C1 C12510 [0,2,0,0,0,0|1,0,1]=4 421 B9R1.1 O=CC1=NC=C(Br)C=C1 B13826 [0,2,0,0,0,0|1,0,1]=4 422 B9R1.1 O=CC1=NC=C(F)C=C1 F17485 [0,2,0,0,0,0|1,0,1]=4 423 B9R1.1 OCC1=CC=C(Br)C=C1 B4308 [0,2,0,0,0,0|0,0,0]=2 424 B9R1.1 OCC1=CC=C(F)C=C1 F11143 [0,2,0,0,0,0|0,0,0]=2 425 B9R1.1 OCC1=CN=C(Cl)C=C1 C1155 [0,2,0,0,0,0|1,0,0]=3 426 B9R1.1 OCC1=NC=C(Br)C=C1 B8505 [0,2,0,0,0,0|1,0,0]=3 427 B9R1.1 SCC1=CC=C(Br)C=C1 B9153 [0,2,0,0,0,0|0,1,0]=3 428 B9R1.1 [C-]#[N+]C1=CC=C(Br)C=C1 B8266 [0,2,0,0,0,0|1,0,0]=3 429 B9R1.2 BrCC1=CC=CC(Br)=C1 B1306 [0,2,0,0,0,0|1,0,0]=3 430 B9R1.2 BrCC1=NC(Br)=CC=C1 B12644 [0,2,0,0,0,0|2,0,0]=4 431 B9R1.2 C#CC1=CC=CC(N)=C1 A0235 [0,2,0,0,0,0|1,0,0]=3 432 B9R1.2 C#CC1=CN=CC(Cl)=C1 C11422 [0,2,0,0,0,0|2,0,0]=4 433 B9R1.2 C(=O)C1=CC(Br)=CN=C1 B11418 [0,2,0,0,0,0|1,0,1]=4 434 B9R1.2 C(=O)C1=CC=CC(Br)=C1 B4204 [0,2,0,0,0,0|0,0,1]=3 435 B9R1.2 C(=O)C1=CC=CC(C)=C1 T4219 [0,2,0,0,0,0|0,0,1]=3 436 B9R1.2 C(=O)C1=CC=CC(F)=C1 F3982 [0,2,0,0,0,0|0,0,1]=3 437 B9R1.2 C(=O)C1=CC=CC(O)=C1 H0367 [0,2,0,0,0,0|0,0,0]=2 438 B9R1.2 C(=O)C1=CC=NC(Cl)=C1 C3153 [0,2,0,0,0,0|1,0,1]=4 439 B9R1.2 C=CC1=CC(C)=CN=C1 M13360 [0,2,0,0,0,0|2,0,0]=4 440 B9R1.2 C=CC1=CC=CC(Br)=C1 B8314 [0,2,0,0,0,0|1,0,0]=3 441 B9R1.2 CC1=CC(C#N)=CC=C1 T5026 [0,2,0,0,0,0|1,0,0]=3 442 B9R1.2 CC1=CC(CN)=CC=C1 M4304 [0,2,0,0,0,0|1,0,0]=3 443 B9R1.2 CC1=CC=CC(C#N)=N1 M2704 [0,2,0,0,0,0|2,0,0]=4 444 B9R1.2 CC1=CC=CC(CO)=N1 M11438 [0,2,0,0,0,0|1,0,0]=3 445 B9R1.2 CCC1=CC(N)=NC=C1 A13449 [0,2,0,0,0,0|2,0,0]=4 446 B9R1.2 CCC1=CC(O)=CC=C1 E18807 [0,2,0,0,0,0|0,0,0]=2 447 B9R1.2 CCC1=CC=CC(Br)=C1 B8399 [0,2,0,0,0,0|1,0,0]=3 448 B9R1.2 CNC1=CC(Br)=CC=C1 B18336 [0,2,0,0,0,0|1,0,0]=3 449 B9R1.2 COC1=CC(N)=NC=C1 A11779 [0,2,0,0,0,0|1,0,0]=3 450 B9R1.2 COC1=CC(N)=NC=C1 A11779 [0,2,0,0,0,0|1,0,0]=3 451 B9R1.2 COC1=CC=CC(Br)=C1 B8466 [0,2,0,0,0,0|0,0,0]=2 452 B9R1.2 COC1=CC=CC(Br)=N1 B11416 [0,2,0,0,0,0|1,0,0]=3 453 B9R1.2 COC1=CC=CC(F)=C1 F0055 [0,2,0,0,0,0|0,0,0]=2 454 B9R1.2 COC1=CC=CC(N)=C1 M18773 [0,2,0,0,0,0|0,0,0]=2 455 B9R1.2 COC1=CC=CC(N)=N1 M0099 [0,2,0,0,0,0|1,0,0]=3 456 B9R1.2 COC1=CN=CC(Br)=C1 B11442 [0,2,0,0,0,0|1,0,0]=3 457 B9R1.2 COC1=CN=CC(Cl)=C1 C17302 [0,2,0,0,0,0|1,0,0]=3 458 B9R1.2 COC1=CN=CC(N)=C1 M11541 [0,2,0,0,0,0|1,0,0]=3 459 B9R1.2 COC1=NC(C)=CC=C1 M2706 [0,2,0,0,0,0|1,0,0]=3 460 B9R1.2 COC1=NC(C)=CC=C1 M2706 [0,2,0,0,0,0|1,0,0]=3 461 B9R1.2 COC1=NC(Cl)=CC=C1 C2489 [0,2,0,0,0,0|1,0,0]=3 462 B9R1.2 COC1=NC=CC(C)=C1 M11590 [0,2,0,0,0,0|1,0,0]=3 463 B9R1.2 COC1=NC=CC(C)=N1 M11332 [0,2,0,0,0,0|2,0,0]=4 464 B9R1.2 COC1=NC=CC(N)=C1 A18270 [0,2,0,0,0,0|1,0,0]=3 465 B9R1.2 COC1=NC=NC(N)=C1 M3752 [0,2,0,0,0,0|2,0,0]=4 466 B9R1.2 CSC1=CC(I)=CC=C1 I3898 [0,2,0,0,0,0|0,1,0]=3 467 B9R1.2 CSC1=CC(N)=CC=C1 M0686 [0,2,0,0,0,0|0,1,0]=3 468 B9R1.2 CSC1=CC=CC(Br)=C1 B0981 [0,2,0,0,0,0|0,1,0]=3 469 B9R1.2 CSC1=CC=CC(Cl)=C1 C3887 [0,2,0,0,0,0|0,1,0]=3 470 B9R1.2 CSC1=CC=CC(F)=C1 F3895 [0,2,0,0,0,0|0,1,0]=3 471 B9R1.2 ClC1=CC(CBr)=CC=C1 C9245 [0,2,0,0,0,0|1,0,0]=3 472 B9R1.2 FC1=CC(CBr)=CC=C1 F0983 [0,2,0,0,0,0|1,0,0]=3 473 B9R1.2 FC1=CC(CBr)=CC=C1 F0983 [0,2,0,0,0,0|1,0,0]=3 474 B9R1.2 N#CC1=CC(Br)=CC=C1 B4223 [0,2,0,0,0,0|1,0,0]=3 475 B9R1.2 N#CC1=CC(Br)=CN=C1 B8311 [0,2,0,0,0,0|2,0,0]=4 476 B9R1.2 N#CC1=CC(Cl)=CC=C1 C3461 [0,2,0,0,0,0|1,0,0]=3 477 B9R1.2 N#CC1=CC(Cl)=NC=C1 C1072 [0,2,0,0,0,0|2,0,0]=4 478 B9R1.2 N#CC1=CC(N)=NC=C1 A13497 [0,2,0,0,0,0|2,0,0]=4 479 B9R1.2 N#CC1=CC(O)=CC=C1 H1345 [0,2,0,0,0,0|0,0,0]=2 480 B9R1.2 N#CC1=CC=CC(F)=C1 F4221 [0,2,0,0,0,0|1,0,0]=3 481 B9R1.2 N#CC1=CC=CC(I)=C1 I4222 [0,2,0,0,0,0|1,0,0]=3 482 B9R1.2 N#CC1=CC=CC(N)=C1 A0959 [0,2,0,0,0,0|1,0,0]=3 483 B9R1.2 N#CC1=NC(Br)=CC=C1 B0376 [0,2,0,0,0,0|2,0,0]=4 484 B9R1.2 N#CC1=NC(F)=CC=C1 C9104 [0,2,0,0,0,0|2,0,0]=4 485 B9R1.2 N#CC1=NC=CC(Br)=C1 B17444 [0,2,0,0,0,0|2,0,0]=4 486 B9R1.2 NC1=CC=CC(C=O)=C1 A14455 [0,2,0,0,0,0|0,0,1]=3 487 B9R1.2 NC1=NC=CC(CO)=C1 A13817 [0,2,0,0,0,0|1,0,0]=3 488 B9R1.2 NCC1=CC=CC(Br)=C1 B9995 [0,2,0,0,0,0|1,0,0]=3 489 B9R1.2 NCC1=CC=CC(Cl)=C1 C4293 [0,2,0,0,0,0|1,0,0]=3 490 B9R1.2 NCC1=CC=CN(=O)=C1 A18259 [0,2,0,0,0,0|1,0,1]=4 491 B9R1.2 NCC1=NC(Br)=CC=C1 B0272 [0,2,0,0,0,0|2,0,0]=4 492 B9R1.2 O=CC1=CC(Br)=NC=C1 B2189 [0,2,0,0,0,0|1,0,1]=4 493 B9R1.2 O=CC1=CC(O)=NC=C1 H13246 [0,2,0,0,0,0|1,0,0]=3 494 B9R1.2 O=CC1=CC=CC(Br)=N1 B8433 [0,2,0,0,0,0|1,0,1]=4 495 B9R1.2 OCC1=CC(Br)=CN=C1 B2855 [0,2,0,0,0,0|1,0,0]=3 496 B9R1.2 OCC1=CC(Cl)=NC=C1 C14253 [0,2,0,0,0,0|1,0,0]=3 497 B9R1.2 OCC1=CC=CC(F)=C1 F0982 [0,2,0,0,0,0|0,0,0]=2 498 B9R1.2 OCC1=NC(Br)=CC=C1 B8506 [0,2,0,0,0,0|1,0,0]=3 499 B9R1.2 SCC1=CC=CC(Br)=C1 B9154 [0,2,0,0,0,0|0,1,0]=3 500 B9R1.2 [C-]#[N+]C1=CC(Br)=CC=C1 B8267 [0,2,0,0,0,0|1,0,0]=3 501 B9R1.6 CC(=O)C1=CN=CC=C1 P2763 [0,2,0,0,0,0|1,0,1]=4 502 B9R1.6 CC(=O)C1=NC=CC=C1 A1164 [0,2,0,0,0,0|1,0,1]=4 503 B9R1.6 CN(C)C1=CC=NC=C1 D2370 [0,2,0,0,0,0|2,0,0]=4 504 B9R1.6 C[C@@H](N)C1=CC=CC=C1 M5022 [0,2,0,0,0,0|1,0,0]=3 505 B9R1.6 C[C@H](N)C1=CC=CC=C1 M5997 [0,2,0,0,0,0|1,0,0]=3 506 B9R1.6 N=C(N)C1=CC=CC=C1 B11293 [0,2,0,0,0,0|1,0,0]=3 507 B9R1.6 N=C(N)C1=CC=CC=C1 B13002 [0,2,0,0,0,0|1,0,0]=3 508 B9R1.6 N=C(N)C1=CC=CC=C1 T1538 [0,2,0,0,0,0|1,0,0]=3 509 B9R1.6 N=C(N)C1=CC=CN=C1 P13006 [0,2,0,0,0,0|2,0,0]=4 510 B9R1.6 N=C(N)C1=NC=CC=C1 P13904 [0,2,0,0,0,0|2,0,0]=4 511 B9R1.6 N=C(\C1=CC=NC=C1)N P13011 [0,2,0,0,0,0|2,0,0]=4 512 B9R1.6 NC(=O)C1=CC=NC=C1 P1409 [0,2,0,0,0,0|1,0,1]=4 513 B9R1.6 O=C(O)C1=CC=CN=C1 N0837 [0,2,0,0,0,0|1,0,0]=3 514 B9R1.6 O=C(O)C1=CC=CN=C1 N0837 [0,2,0,0,0,0|1,0,0]=3 515 B9R1.6 O=C(O)C1=CC=NN=C1 P12249 [0,2,0,0,0,0|2,0,0]=4 516 B9R1.6 O=C(O)C1=CN=CN=C1 P12245 [0,2,0,0,0,0|2,0,0]=4 517 B9R1.6 O=C(O)C1=NC=CC=C1 P0843 [0,2,0,0,0,0|1,0,0]=3 518 B9R1.6 O=C(O)C1=NC=CC=C1 P0843 [0,2,0,0,0,0|1,0,0]=3 519 B9R1.6 O=C(O)C1=NC=CC=N1 P12246 [0,2,0,0,0,0|2,0,0]=4 520 B9R1.6 O=C(O)C1=NC=CN=C1 P4976 [0,2,0,0,0,0|2,0,0]=4 521 B9R1.6 O=C(O)C1=NC=NC=C1 P12243 [0,2,0,0,0,0|2,0,0]=4 522 B9R1.6 OB(O)C1=CC=CC=C1 N2145 [0,2,0,0,0,0|0,0,0]=2 523 B9R1.6 OB(O)C1=CC=CC=N1 P4048 [0,2,0,0,0,0|1,0,0]=3 524 B9R1.6 OB(O)C1=CC=CN=C1 P4049 [0,2,0,0,0,0|1,0,0]=3 525 B9R1.6 OB(O)C1=CC=CN=C1 P4049 [0,2,0,0,0,0|1,0,0]=3 526 B9R1.6 OB(O)C1=CC=NC=C1 P2873 [0,2,0,0,0,0|1,0,0]=3 527 B9R1.6 OB(O)C1=CN=CN=C1 P11652 [0,2,0,0,0,0|2,0,0]=4 528 B9R1.8 BrCCC1=CC=CC=C1 B1499 [0,2,0,0,0,0|1,0,0]=3 529 B9R1.8 BrCCC1=NC=CC=C1 B18468 [0,2,0,0,0,0|2,0,0]=4 530 B9R1.8 CCC[N+]1=CC=CC=C1 P9114 [0,2,0,0,0,0|2,0,0]=4 531 B9R1.8 CNCC1=CC=CC=C1 C12471 [0,2,0,0,0,0|1,0,0]=3 532 B9R1.8 CNCC1=CN=CC=C1 M13405 [0,2,0,0,0,0|2,0,0]=4 533 B9R1.8 C\N=C/C1=CC=CC=C1 B11532 [0,2,0,0,0,0|1,0,0]=3 534 B9R1.8 NCCC1=CC=CC=C1 P18797 [0,2,0,0,0,0|1,0,0]=3 535 B9R1.8 NCCC1=CC=CC=C1 P19425 [0,2,0,0,0,0|1,0,0]=3 536 B9R1.8 NCCC1=CC=CC=N1 P3233 [0,2,0,0,0,0|2,0,0]=4 537 B9R1.8 NCCC1=CC=CN=C1 A18111 [0,2,0,0,0,0|2,0,0]=4 538 B9R1.8 NCCC1=CC=NC=C1 A18195 [0,2,0,0,0,0|2,0,0]=4 539 B9R1.8 NCCC1=CN=CC=C1 A12910 [0,2,0,0,0,0|2,0,0]=4 540 B9R1.8 NNCC1=CC=CC=C1 B8798 [0,2,0,0,0,0|1,0,0]=3 541 B9R1.8 NOCC1=CC=CC=C1 B7490 [0,2,0,0,0,0|0,0,0]=2 542 B9R1.8 NOCC1=CC=CC=C1 B7490 [0,2,0,0,0,0|0,0,0]=2 543 B9R1.8 OCCC1=NC=CC=C1 P0121 [0,2,0,0,0,0|1,0,0]=3 544 B9R1.8 OCCC1=NC=CN=C1 H13361 [0,2,0,0,0,0|2,0,0]=4 545 B9R1.8 O\N=C/C1=CC=CC=C1 B18348 [0,2,0,0,0,0|0,0,0]=2 546 B9R1.15 BrCC1=C(Br)C=CC=C1 B0602 [0,2,0,0,0,0|1,0,0]=3 547 B9R1.15 C(=O)C1=CC=CC=C1C T4218 [0,2,0,0,0,0|0,0,1]=3 548 B9R1.15 C(=O)C1=CC=CN=C1Br B11429 [0,2,0,0,0,0|1,0,1]=4 549 B9R1.15 C(=O)C1=CC=CN=C1Cl C11431 [0,2,0,0,0,0|1,0,1]=4 550 B9R1.15 C(=O)C1=CC=CN=C1N A2849 [0,2,0,0,0,0|1,0,1]=4 551 B9R1.15 C=CC1=CC=CC=C1Br B8313 [0,2,0,0,0,0|1,0,0]=3 552 B9R1.15 CC1=C(C#N)C=NC=C1 C11567 [0,2,0,0,0,0|2,0,0]=4 553 B9R1.15 CC1=C(CN)C=CN=C1 A13473 [0,2,0,0,0,0|2,0,0]=4 554 B9R1.15 CC1=CC=CN=C1C#N C0144 [0,2,0,0,0,0|2,0,0]=4 555 B9R1.15 CC1=CC=CN=C1C=O M12711 [0,2,0,0,0,0|1,0,1]=4 556 B9R1.15 CC1=CC=CN=C1CN A13472 [0,2,0,0,0,0|2,0,0]=4 557 B9R1.15 CC1=CC=CN=C1CO H13471 [0,2,0,0,0,0|1,0,0]=3 558 B9R1.15 CCC1=CC=CC=C1Cl C0487 [0,2,0,0,0,0|1,0,0]=3 559 B9R1.15 CNC1=C(F)C=CC=C1 F2547 [0,2,0,0,0,0|1,0,0]=3 560 B9R1.15 CNC1=CC=CC=C1N M8800 [0,2,0,0,0,0|1,0,0]=3 561 B9R1.15 COC1=C(Cl)N=CN=C1 C12499 [0,2,0,0,0,0|2,0,0]=4 562 B9R1.15 COC1=C(N)C=CN=C1 A17646 [0,2,0,0,0,0|1,0,0]=3 563 B9R1.15 COC1=CC=CC=C1S M0642 [0,2,0,0,0,0|0,0,0]=2 564 B9R1.15 COC1=CC=CN=C1Br B18487 [0,2,0,0,0,0|1,0,0]=3 565 B9R1.15 COC1=NC=CC=C1Cl C17305 [0,2,0,0,0,0|1,0,0]=3 566 B9R1.15 COC1=NC=CC=C1N M11591 [0,2,0,0,0,0|1,0,0]=3 567 B9R1.15 COC1=NC=CN=C1C M1133 [0,2,0,0,0,0|2,0,0]=4 568 B9R1.15 COC1=NC=CN=C1Cl C3838 [0,2,0,0,0,0|2,0,0]=4 569 B9R1.15 CSC1=C(Br)C=CC=C1 B9152 [0,2,0,0,0,0|0,1,0]=3 570 B9R1.15 CSC1=CC=CC=C1Cl C2117 [0,2,0,0,0,0|0,1,0]=3 571 B9R1.15 CSC1=CC=CC=C1F F3885 [0,2,0,0,0,0|0,1,0]=3 572 B9R1.15 CSC1=CC=CC=C1I I3892 [0,2,0,0,0,0|0,1,0]=3 573 B9R1.15 CSC1=CC=CC=C1N M0578 [0,2,0,0,0,0|0,1,0]=3 574 B9R1.15 CSC1=CC=CC=C1O H3897 [0,2,0,0,0,0|0,0,0]=2 575 B9R1.15 CSC1=NC=CC=C1N A15135 [0,2,0,0,0,0|1,1,0]=4 576 B9R1.15 ClCC1=C(Cl)C=CC=C1 C18855 [0,2,0,0,0,0|1,0,0]=3 577 B9R1.15 FC1=CC=CC=C1CBr F4170 [0,2,0,0,0,0|1,0,0]=3 578 B9R1.15 N#CC1=C(Br)C=CN=C1 B17448 [0,2,0,0,0,0|2,0,0]=4 579 B9R1.15 N#CC1=C(Cl)C=NC=C1 C16921 [0,2,0,0,0,0|2,0,0]=4 580 B9R1.15 N#CC1=C(O)C=CC=C1 H4225 [0,2,0,0,0,0|0,0,0]=2 581 B9R1.15 N#CC1=CC=CC=C1Br B0601 [0,2,0,0,0,0|1,0,0]=3 582 B9R1.15 N#CC1=CC=CC=C1F F0066 [0,2,0,0,0,0|1,0,0]=3 583 B9R1.15 N#CC1=CC=CC=C1I I4224 [0,2,0,0,0,0|1,0,0]=3 584 B9R1.15 N#CC1=CC=CC=C1N A0976 [0,2,0,0,0,0|1,0,0]=3 585 B9R1.15 N#CC1=CC=CN=C1Cl C0628 [0,2,0,0,0,0|2,0,0]=4 586 B9R1.15 N#CC1=CC=CN=C1F C6092 [0,2,0,0,0,0|2,0,0]=4 587 B9R1.15 N#CC1=CC=CN=C1N A14928 [0,2,0,0,0,0|2,0,0]=4 588 B9R1.15 N#CC1=NC=CC=C1Cl C11487 [0,2,0,0,0,0|2,0,0]=4 589 B9R1.15 N#CC1=NC=CC=C1F C11491 [0,2,0,0,0,0|2,0,0]=4 590 B9R1.15 N#CC1=NC=CC=C1O C11780 [0,2,0,0,0,0|1,0,0]=3 591 B9R1.15 NC1=C(CO)C=CN=C1 A14447 [0,2,0,0,0,0|1,0,0]=3 592 B9R1.15 NC1=C(CO)C=NC=C1 A14446 [0,2,0,0,0,0|1,0,0]=3 593 B9R1.15 NC1=CC=CC=C1C=O A1785 [0,2,0,0,0,0|0,0,1]=3 594 B9R1.15 NC1=CC=CC=C1CO A18123 [0,2,0,0,0,0|0,0,0]=2 595 B9R1.15 NC1=NC=CC=C1CO A11759 [0,2,0,0,0,0|1,0,0]=3 596 B9R1.15 NCC1=CC=CC=C1Br B9994 [0,2,0,0,0,0|1,0,0]=3 597 B9R1.15 NCC1=CC=CC=C1Cl C0974 [0,2,0,0,0,0|1,0,0]=3 598 B9R1.15 NCC1=CC=CC=C1F F2669 [0,2,0,0,0,0|1,0,0]=3 599 B9R1.15 NCC1=CC=CC=C1N A18056 [0,2,0,0,0,0|1,0,0]=3 600 B9R1.15 NCC1=CC=CN=C1Cl A17808 [0,2,0,0,0,0|2,0,0]=4 601 B9R1.15 NCC1=NC=CC=C1F A11835 [0,2,0,0,0,0|2,0,0]=4 602 B9R1.15 NNC1=CC=CC=C1Br B10047 [0,2,0,0,0,0|1,0,0]=3 603 B9R1.15 O=CC1=C(Br)C=CC=C1 B8395 [0,2,0,0,0,0|0,0,1]=3 604 B9R1.15 O=CC1=C(Br)C=NC=C1 B17452 [0,2,0,0,0,0|1,0,1]=4 605 B9R1.15 O=CC1=C(Cl)C=CN=C1 C19295 [0,2,0,0,0,0|1,0,1]=4 606 B9R1.15 O=CC1=C(Cl)C=NC=C1 C17295 [0,2,0,0,0,0|1,0,1]=4 607 B9R1.15 O=CC1=C(F)C=NC=C1 F17484 [0,2,0,0,0,0|1,0,1]=4 608 B9R1.15 O=CC1=CC=CN=C1F F17481 [0,2,0,0,0,0|1,0,1]=4 609 B9R1.15 O=CC1=NC=CC=C1O H16738 [0,2,0,0,0,0|1,0,0]=3 610 B9R1.15 OCC1=CC=CC=C1Br B4306 [0,2,0,0,0,0|0,0,0]=2 611 B9R1.15 OCC1=CC=CC=C1Cl C0385 [0,2,0,0,0,0|0,0,0]=2 612 B9R1.15 OCC1=CC=CC=C1F F11142 [0,2,0,0,0,0|0,0,0]=2 613 B9R1.15 OCC1=CC=CN=C1Cl C15615 [0,2,0,0,0,0|1,0,0]=3 614 B9R1.15 OCC1=NC=CC=C1O H16739 [0,2,0,0,0,0|1,0,0]=3 615 B9R1.15 SCC1=CC=CC=C1Br B3883 [0,2,0,0,0,0|0,1,0]=3 616 B9R1.15 [C-]#[N+]C1=C(Br)C=CC=C1 B8265 [0,2,0,0,0,0|1,0,0]=3 617 B9R1.15 [NH3+]C1=C(C=O)C=CC=N1 A12904 [0,2,0,0,0,0|1,0,1]=4 618 B9R1.15 [NH3+]C1=CC=CC=C1C=O A12970 [0,2,0,0,0,0|0,0,1]=3 619 B9R1.69 CC1=C(Br)C=CC(N)=C1 B8436 [0,2,0,0,0,0|1,0,0]=3 620 B9R1.69 CC1=C(Br)N=CC(Br)=C1 D5055 [0,2,0,0,0,0|2,0,0]=4 621 B9R1.69 CC1=C(Br)N=CC(N)=C1 A1023 [0,2,0,0,0,0|2,0,0]=4 622 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 B9250 [0,2,0,0,0,0|1,0,0]=3 623 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 B9246 [0,2,0,0,0,0|1,0,0]=3 624 B9R1.69 CC1=C(Cl)N=CC(N)=C1 A15257 [0,2,0,0,0,0|2,0,0]=4 625 B9R1.69 CC1=C(F)C=CC(Br)=N1 B4568 [0,2,0,0,0,0|2,0,0]=4 626 B9R1.69 CC1=C(F)C=CC(Br)=N1 B4568 [0,2,0,0,0,0|2,0,0]=4 627 B9R1.69 CC1=C(N)C=C(O)C=C1 A14457 [0,2,0,0,0,0|0,0,0]=2 628 B9R1.69 CC1=C(N)C=CC(Br)=C1 B8435 [0,2,0,0,0,0|1,0,0]=3 629 B9R1.69 CC1=C(N)C=CC(O)=C1 A0741 [0,2,0,0,0,0|0,0,0]=2 630 B9R1.69 CC1=C(O)C=C(N)C=C1 A1435 [0,2,0,0,0,0|0,0,0]=2 631 B9R1.69 CC1=C(O)C=CC(Br)=C1 B8468 [0,2,0,0,0,0|0,0,0]=2 632 B9R1.69 CC1=CC(Br)=C(O)C=C1 B8467 [0,2,0,0,0,0|0,0,0]=2 633 B9R1.69 CC1=CC(Br)=CC=C1F B4536 [0,2,0,0,0,0|1,0,0]=3 634 B9R1.69 CC1=CC(Br)=CN=C1C B19461 [0,2,0,0,0,0|2,0,0]=4 635 B9R1.69 CC1=CC(Br)=CN=C1Cl B1829 [0,2,0,0,0,0|2,0,0]=4 636 B9R1.69 CC1=CC(Br)=CN=C1I B13853 [0,2,0,0,0,0|2,0,0]=4 637 B9R1.69 CC1=CC(Br)=CN=C1N A1022 [0,2,0,0,0,0|2,0,0]=4 638 B9R1.69 CC1=CC(Br)=NC=C1Br D11588 [0,2,0,0,0,0|2,0,0]=4 639 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 B9248 [0,2,0,0,0,0|1,0,0]=3 640 B9R1.69 CC1=CC(Cl)=CC=C1Br B5507 [0,2,0,0,0,0|1,0,0]=3 641 B9R1.69 CC1=CC(Cl)=CC=C1F C0665 [0,2,0,0,0,0|1,0,0]=3 642 B9R1.69 CC1=CC(Cl)=CN=C1Cl D1830 [0,2,0,0,0,0|2,0,0]=4 643 B9R1.69 CC1=CC(F)=C(Cl)C=C1 C5204 [0,2,0,0,0,0|1,0,0]=3 644 B9R1.69 CC1=CC(F)=C(I)C=C1 F5267 [0,2,0,0,0,0|1,0,0]=3 645 B9R1.69 CC1=CC(F)=C(N)C=C1 F4671 [0,2,0,0,0,0|1,0,0]=3 646 B9R1.69 CC1=CC(F)=C(N)C=C1 F4671 [0,2,0,0,0,0|1,0,0]=3 647 B9R1.69 CC1=CC(F)=CC=C1Br B2552 [0,2,0,0,0,0|1,0,0]=3 648 B9R1.69 CC1=CC(F)=CC=C1Cl C2556 [0,2,0,0,0,0|1,0,0]=3 649 B9R1.69 CC1=CC(F)=CC=C1F D0666 [0,2,0,0,0,0|1,0,0]=3 650 B9R1.69 CC1=CC(F)=CC=C1N F11151 [0,2,0,0,0,0|1,0,0]=3 651 B9R1.69 CC1=CC(F)=CC=C1N F11151 [0,2,0,0,0,0|1,0,0]=3 652 B9R1.69 CC1=CC(I)=CC=C1F F5221 [0,2,0,0,0,0|1,0,0]=3 653 B9R1.69 CC1=CC(N)=C(O)C=C1 A5003 [0,2,0,0,0,0|0,0,0]=2 654 B9R1.69 CC1=CC(N)=CC=C1F F4537 [0,2,0,0,0,0|1,0,0]=3 655 B9R1.69 CC1=CC(N)=CC=C1N D1380 [0,2,0,0,0,0|1,0,0]=3 656 B9R1.69 CC1=CC(N)=CC=C1N D8799 [0,2,0,0,0,0|1,0,0]=3 657 B9R1.69 CC1=CC(O)=C(N)C=C1 A6849 [0,2,0,0,0,0|0,0,0]=2 658 B9R1.69 CC1=CC(O)=NC=C1Br H11587 [0,2,0,0,0,0|1,0,0]=3 659 B9R1.69 CC1=CC=C(Br)C(Cl)=N1 B18492 [0,2,0,0,0,0|2,0,0]=4 660 B9R1.69 CC1=CC=C(Br)C(F)=C1 B0071 [0,2,0,0,0,0|1,0,0]=3 661 B9R1.69 CC1=CC=C(Br)C(F)=C1 B0071 [0,2,0,0,0,0|1,0,0]=3 662 B9R1.69 CC1=CC=C(Br)C=C1C B17706 [0,2,0,0,0,0|1,0,0]=3 663 B9R1.69 CC1=CC=C(Br)C=C1F B0744 [0,2,0,0,0,0|1,0,0]=3 664 B9R1.69 CC1=CC=C(Br)C=C1N A4538 [0,2,0,0,0,0|1,0,0]=3 665 B9R1.69 CC1=CC=C(Br)N=C1Br D1831 [0,2,0,0,0,0|2,0,0]=4 666 B9R1.69 CC1=CC=C(C)C(S)=C1 D0558 [0,2,0,0,0,0|0,1,0]=3 667 B9R1.69 CC1=CC=C(Cl)C(Br)=C1 B5331 [0,2,0,0,0,0|1,0,0]=3 668 B9R1.69 CC1=CC=C(Cl)C=C1Br B9249 [0,2,0,0,0,0|1,0,0]=3 669 B9R1.69 CC1=CC=C(Cl)C=C1F C0751 [0,2,0,0,0,0|1,0,0]=3 670 B9R1.69 CC1=CC=C(F)C(Br)=C1 B2672 [0,2,0,0,0,0|1,0,0]=3 671 B9R1.69 CC1=CC=C(F)C(Cl)=C1 C5203 [0,2,0,0,0,0|1,0,0]=3 672 B9R1.69 CC1=CC=C(F)C(F)=C1 D4539 [0,2,0,0,0,0|1,0,0]=3 673 B9R1.69 CC1=CC=C(F)C(I)=C1 F5223 [0,2,0,0,0,0|1,0,0]=3 674 B9R1.69 CC1=CC=C(F)C(N)=C1 F1378 [0,2,0,0,0,0|1,0,0]=3 675 B9R1.69 CC1=CC=C(F)C=C1Br B0599 [0,2,0,0,0,0|1,0,0]=3 676 B9R1.69 CC1=CC=C(F)C=C1Cl C0608 [0,2,0,0,0,0|1,0,0]=3 677 B9R1.69 CC1=CC=C(F)C=C1F D2869 [0,2,0,0,0,0|1,0,0]=3 678 B9R1.69 CC1=CC=C(F)C=C1I F5222 [0,2,0,0,0,0|1,0,0]=3 679 B9R1.69 CC1=CC=C(F)C=C1N F2617 [0,2,0,0,0,0|1,0,0]=3 680 B9R1.69 CC1=CC=C(I)C(N)=C1 I10430 [0,2,0,0,0,0|1,0,0]=3 681 B9R1.69 CC1=CC=C(I)C=C1F F5220 [0,2,0,0,0,0|1,0,0]=3 682 B9R1.69 CC1=CC=C(N)C(Br)=C1 B5509 [0,2,0,0,0,0|1,0,0]=3 683 B9R1.69 CC1=CC=C(N)C(Cl)=N1 A15272 [0,2,0,0,0,0|2,0,0]=4 684 B9R1.69 CC1=CC=C(N)C(N)=C1 D9910 [0,2,0,0,0,0|1,0,0]=3 685 B9R1.69 CC1=CC=C(N)C=C1Br B8437 [0,2,0,0,0,0|1,0,0]=3 686 B9R1.69 CC1=CC=C(N)C=C1F F5091 [0,2,0,0,0,0|1,0,0]=3 687 B9R1.69 CC1=CC=C(N)C=C1O A9939 [0,2,0,0,0,0|0,0,0]=2 688 B9R1.69 CC1=CC=C(S)C(C)=C1 D0551 [0,2,0,0,0,0|0,1,0]=3 689 B9R1.69 CC1=CN=C(Cl)C(N)=C1 A15273 [0,2,0,0,0,0|2,0,0]=4 690 B9R1.69 CC1=CN=C(N)C(Br)=C1 A5323 [0,2,0,0,0,0|2,0,0]=4 691 B9R1.69 CC1=C[N+]([O-])=C(N)C=C1 P17220 [0,2,0,0,0,0|1,0,1]=4 692 B9R1.69 CC1=NC(Br)=C(N)C=C1 A1033 [0,2,0,0,0,0|2,0,0]=4 693 B9R1.69 CC1=NC(Br)=C(N)C=C1 A1033 [0,2,0,0,0,0|2,0,0]=4 694 B9R1.69 CC1=NC(C)=C(Br)C=C1 B8438 [0,2,0,0,0,0|2,0,0]=4 695 B9R1.69 CC1=NC(Cl)=CC=C1N A18276 [0,2,0,0,0,0|2,0,0]=4 696 B9R1.69 CC1=NC(N)=C(Br)C=C1 A1031 [0,2,0,0,0,0|2,0,0]=4 697 B9R1.69 CC1=NC(N)=CC=C1Br A3762 [0,2,0,0,0,0|2,0,0]=4 698 B9R1.69 CC1=NC(N)=CC=C1Br A3762 [0,2,0,0,0,0|2,0,0]=4 699 B9R1.69 CC1=NC=C(Br)C=C1Br M11134 [0,2,0,0,0,0|2,0,0]=4 700 B9R1.69 ClC1=CC(Br)=C(Cl)C=C1 B10128 [0,2,0,0,0,0|1,0,0]=3 701 B9R1.69 ClC1=CC(Cl)=C(Br)C=C1 B10127 [0,2,0,0,0,0|1,0,0]=3 702 B9R1.69 ClC1=CC(Cl)=C(Br)N=C1 B10171 [0,2,0,0,0,0|2,0,0]=4 703 B9R1.69 ClC1=CC=C(Br)C=C1Cl B11601 [0,2,0,0,0,0|1,0,0]=3 704 B9R1.69 ClC1=CN=C(Cl)C(Cl)=C1 T1771 [0,2,0,0,0,0|2,0,0]=4 705 B9R1.69 ClC1=CN=C(Cl)C=C1Cl T5084 [0,2,0,0,0,0|2,0,0]=4 706 B9R1.69 FC1=C(Br)C=C(Cl)C=C1 B9430 [0,2,0,0,0,0|1,0,0]=3 707 B9R1.69 FC1=CC(Br)=CC=C1Cl B2563 [0,2,0,0,0,0|1,0,0]=3 708 B9R1.69 FC1=CC(Cl)=CC=C1Br B9428 [0,2,0,0,0,0|1,0,0]=3 709 B9R1.69 FC1=CC(Cl)=CN=C1F C3677 [0,2,0,0,0,0|2,0,0]=4 710 B9R1.69 FC1=CC(Cl)=CN=C1F C3677 [0,2,0,0,0,0|2,0,0]=4 711 B9R1.69 FC1=CC=C(Br)C(Cl)=C1 B9429 [0,2,0,0,0,0|1,0,0]=3 712 B9R1.69 FC1=CC=C(Br)C(F)=C1 B0499 [0,2,0,0,0,0|1,0,0]=3 713 B9R1.69 FC1=CC=C(Br)C=C1Br D11137 [0,2,0,0,0,0|1,0,0]=3 714 B9R1.69 FC1=CC=C(Br)C=C1Cl B1367 [0,2,0,0,0,0|1,0,0]=3 715 B9R1.69 FC1=CC=C(Br)C=C1F B0662 [0,2,0,0,0,0|1,0,0]=3 716 B9R1.69 FC1=CC=C(Cl)C(Br)=C1 B9427 [0,2,0,0,0,0|1,0,0]=3 717 B9R1.69 FC1=CC=C(Cl)C(Cl)=C1 D7661 [0,2,0,0,0,0|1,0,0]=3 718 B9R1.69 FC1=CC=C(Cl)C(F)=C1 C3904 [0,2,0,0,0,0|1,0,0]=3 719 B9R1.69 FC1=CC=C(Cl)C=C1Cl D0489 [0,2,0,0,0,0|1,0,0]=3 720 B9R1.69 FC1=CC=C(F)C(Br)=C1 B1371 [0,2,0,0,0,0|1,0,0]=3 721 B9R1.69 FC1=CC=C(F)C(Br)=C1 B1371 [0,2,0,0,0,0|1,0,0]=3 722 B9R1.69 FC1=CC=C(F)C(F)=C1 T0427 [0,2,0,0,0,0|1,0,0]=3 723 B9R1.69 FC1=CC=C(I)C(F)=C1 D10640 [0,2,0,0,0,0|1,0,0]=3 724 B9R1.69 FC1=CC=C(I)C=C1F D10641 [0,2,0,0,0,0|1,0,0]=3 725 B9R1.69 FC1=CC=C(S)C(Cl)=C1 C7553 [0,2,0,0,0,0|0,1,0]=3 726 B9R1.69 FC1=CC=C(S)C=C1Cl C7554 [0,2,0,0,0,0|0,1,0]=3 727 B9R1.69 FC1=CN=C(Cl)C(Br)=C1 P6733 [0,2,0,0,0,0|2,0,0]=4 728 B9R1.69 FC1=CN=C(F)C(F)=C1 T11478 [0,2,0,0,0,0|2,0,0]=4 729 B9R1.69 FC1=NC=C(Cl)C=C1Cl F11479 [0,2,0,0,0,0|2,0,0]=4 730 B9R1.69 NC1=C(Br)C=C(Cl)C=C1 B9295 [0,2,0,0,0,0|1,0,0]=3 731 B9R1.69 NC1=C(Cl)C=C(Br)C=C1 B9293 [0,2,0,0,0,0|1,0,0]=3 732 B9R1.69 NC1=C(Cl)C=C(Cl)C=C1 D18824 [0,2,0,0,0,0|1,0,0]=3 733 B9R1.69 NC1=C(Cl)C=C(O)C=C1 A11060 [0,2,0,0,0,0|0,0,0]=2 734 B9R1.69 NC1=C(Cl)C=CC(Br)=C1 B9296 [0,2,0,0,0,0|1,0,0]=3 735 B9R1.69 NC1=C(F)C=C(I)C=C1 F10545 [0,2,0,0,0,0|1,0,0]=3 736 B9R1.69 NC1=C(F)C=CC(Br)=C1 B8585 [0,2,0,0,0,0|1,0,0]=3 737 B9R1.69 NC1=C(F)C=CC(Br)=C1 B8585 [0,2,0,0,0,0|1,0,0]=3 738 B9R1.69 NC1=C(I)C=CC(F)=C1 F5264 [0,2,0,0,0,0|1,0,0]=3 739 B9R1.69 NC1=C(N)C=C(Br)C=C1 B19046 [0,2,0,0,0,0|1,0,0]=3 740 B9R1.69 NC1=CC(Br)=C(F)C=C1 B8586 [0,2,0,0,0,0|1,0,0]=3 741 B9R1.69 NC1=CC(Br)=CC=C1Br D3304 [0,2,0,0,0,0|1,0,0]=3 742 B9R1.69 NC1=CC(Br)=CC=C1O A18152 [0,2,0,0,0,0|0,0,0]=2 743 B9R1.69 NC1=CC(Br)=CC=C1O A5541 [0,2,0,0,0,0|0,0,0]=2 744 B9R1.69 NC1=CC(Br)=CC=C1O A5541 [0,2,0,0,0,0|0,0,0]=2 745 B9R1.69 NC1=CC(Br)=CN=C1Cl B15333 [0,2,0,0,0,0|2,0,0]=4 746 B9R1.69 NC1=CC(Br)=CN=C1N D11565 [0,2,0,0,0,0|2,0,0]=4 747 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 B9294 [0,2,0,0,0,0|1,0,0]=3 748 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 D2700 [0,2,0,0,0,0|1,0,0]=3 749 B9R1.69 NC1=CC(Cl)=C(N)C=C1 C1441 [0,2,0,0,0,0|1,0,0]=3 750 B9R1.69 NC1=CC(Cl)=C(O)C=C1 A0931 [0,2,0,0,0,0|0,0,0]=2 751 B9R1.69 NC1=CC(Cl)=CC=C1F C2538 [0,2,0,0,0,0|1,0,0]=3 752 B9R1.69 NC1=CC(Cl)=CN=C1Cl A15284 [0,2,0,0,0,0|2,0,0]=4 753 B9R1.69 NC1=CC(F)=CC=C1Br B5248 [0,2,0,0,0,0|1,0,0]=3 754 B9R1.69 NC1=CC(F)=CC=C1Br B5248 [0,2,0,0,0,0|1,0,0]=3 755 B9R1.69 NC1=CC(F)=CC=C1Cl C3476 [0,2,0,0,0,0|1,0,0]=3 756 B9R1.69 NC1=CC(F)=CC=C1F D0556 [0,2,0,0,0,0|1,0,0]=3 757 B9R1.69 NC1=CC(I)=CN=C1Cl A13422 [0,2,0,0,0,0|2,0,0]=4 758 B9R1.69 NC1=CC(N)=C(Cl)C=C1 C18766 [0,2,0,0,0,0|1,0,0]=3 759 B9R1.69 NC1=CC(O)=C(Cl)C=C1 A11291 [0,2,0,0,0,0|0,0,0]=2 760 B9R1.69 NC1=CC(O)=CC=C1F A11733 [0,2,0,0,0,0|0,0,0]=2 761 B9R1.69 NC1=CC(O)=CC=C1F A11733 [0,2,0,0,0,0|0,0,0]=2 762 B9R1.69 NC1=CC=C(Br)C(F)=C1 B5249 [0,2,0,0,0,0|1,0,0]=3 763 B9R1.69 NC1=CC=C(Br)C(F)=C1 B5249 [0,2,0,0,0,0|1,0,0]=3 764 B9R1.69 NC1=CC=C(Br)C=C1F B0743 [0,2,0,0,0,0|1,0,0]=3 765 B9R1.69 NC1=CC=C(Br)N=C1Br A5468 [0,2,0,0,0,0|2,0,0]=4 766 B9R1.69 NC1=CC=C(Cl)C(F)=C1 C5198 [0,2,0,0,0,0|1,0,0]=3 767 B9R1.69 NC1=CC=C(Cl)C(F)=C1 C5198 [0,2,0,0,0,0|1,0,0]=3 768 B9R1.69 NC1=CC=C(Cl)C=C1F C0750 [0,2,0,0,0,0|1,0,0]=3 769 B9R1.69 NC1=CC=C(Cl)N=C1Cl A5325 [0,2,0,0,0,0|2,0,0]=4 770 B9R1.69 NC1=CC=C(F)C(Cl)=C1 C7198 [0,2,0,0,0,0|1,0,0]=3 771 B9R1.69 NC1=CC=C(F)C(F)=C1 D0661 [0,2,0,0,0,0|1,0,0]=3 772 B9R1.69 NC1=CC=C(F)C=C1Br B5188 [0,2,0,0,0,0|1,0,0]=3 773 B9R1.69 NC1=CC=C(F)C=C1Cl C3477 [0,2,0,0,0,0|1,0,0]=3 774 B9R1.69 NC1=CC=C(F)C=C1F D0414 [0,2,0,0,0,0|1,0,0]=3 775 B9R1.69 NC1=CC=C(F)C=C1I F0028 [0,2,0,0,0,0|1,0,0]=3 776 B9R1.69 NC1=CC=C(F)C=C1I F0028 [0,2,0,0,0,0|1,0,0]=3 777 B9R1.69 NC1=CC=C(I)C(F)=C1 F6632 [0,2,0,0,0,0|1,0,0]=3 778 B9R1.69 NC1=CC=C(I)C=C1Cl C0179 [0,2,0,0,0,0|1,0,0]=3 779 B9R1.69 NC1=CC=C(I)C=C1Cl C0179 [0,2,0,0,0,0|1,0,0]=3 780 B9R1.69 NC1=CC=C(O)C=C1F A12492 [0,2,0,0,0,0|0,0,0]=2 781 B9R1.69 NC1=CC=C(O)C=C1F A2667 [0,2,0,0,0,0|0,0,0]=2 782 B9R1.69 NC1=CN=C(Cl)C(N)=C1 C15664 [0,2,0,0,0,0|2,0,0]=4 783 B9R1.69 NC1=NC=C(Br)C=C1Br A11721 [0,2,0,0,0,0|2,0,0]=4 784 B9R1.69 NC1=NC=C(Br)C=C1I A13818 [0,2,0,0,0,0|2,0,0]=4 785 B9R1.69 NC1=NC=C(Cl)C=C1Cl D2327 [0,2,0,0,0,0|2,0,0]=4 786 B9R1.69 NC1=NC=C(F)C=C1Br F6750 [0,2,0,0,0,0|2,0,0]=4 787 B9R1.69 O=C1NC=C(Br)C=C1Cl B18720 [0,2,0,0,0,0|1,0,1]=4 788 B9R1.69 OC1=C(F)C=CC(Br)=C1 B8635 [0,2,0,0,0,0|0,0,0]=2 789 B9R1.69 OC1=C(F)C=CC(Br)=C1 B8635 [0,2,0,0,0,0|0,0,0]=2 790 B9R1.69 OC1=CC(Cl)=C(Cl)C=C1 D7559 [0,2,0,0,0,0|0,0,0]=2 791 B9R1.69 OC1=CC(F)=C(Br)C=C1 B8633 [0,2,0,0,0,0|0,0,0]=2 792 B9R1.69 OC1=CC(F)=CC=C1Br B3802 [0,2,0,0,0,0|0,0,0]=2 793 B9R1.69 OC1=CC(F)=CC=C1F D2665 [0,2,0,0,0,0|0,0,0]=2 794 B9R1.69 OC1=CC(O)=C(Br)C=C1 B8548 [0,2,0,0,0,0|0,0,0]=2 795 B9R1.69 OC1=CC(O)=C(Cl)C=N1 G3084 [0,2,0,0,0,0|1,0,0]=3 796 B9R1.69 OC1=CC(O)=C(Cl)C=N1 G3084 [0,2,0,0,0,0|1,0,0]=3 797 B9R1.69 OC1=CC=C(Br)C=C1F B5193 [0,2,0,0,0,0|0,0,0]=2 798 B9R1.69 OC1=CC=C(Cl)C=C1Br B3297 [0,2,0,0,0,0|0,0,0]=2 799 B9R1.69 OC1=CC=C(Cl)C=C1F C11144 [0,2,0,0,0,0|0,0,0]=2 800 B9R1.69 OC1=CC=C(Cl)C=C1O C11266 [0,2,0,0,0,0|0,0,0]=2 801 B9R1.69 OC1=CC=C(F)C(Br)=C1 B8634 [0,2,0,0,0,0|0,0,0]=2 802 B9R1.69 OC1=CC=C(F)C(Br)=C1 B8634 [0,2,0,0,0,0|0,0,0]=2 803 B9R1.69 OC1=CC=C(F)C(Cl)=C1 C5202 [0,2,0,0,0,0|0,0,0]=2 804 B9R1.69 OC1=CC=C(F)C(F)=C1 D0052 [0,2,0,0,0,0|0,0,0]=2 805 B9R1.69 OC1=CC=C(F)C(F)=C1 D0052 [0,2,0,0,0,0|0,0,0]=2 806 B9R1.69 OC1=CC=C(F)C=C1Br B3801 [0,2,0,0,0,0|0,0,0]=2 807 B9R1.69 OC1=CC=C(F)C=C1Cl C5201 [0,2,0,0,0,0|0,0,0]=2 808 B9R1.69 OC1=CC=C(F)C=C1F D0549 [0,2,0,0,0,0|0,0,0]=2 809 B9R1.69 OC1=CC=C(F)C=C1O F11263 [0,2,0,0,0,0|0,0,0]=2 810 B9R1.69 SC1=CC(Cl)=C(Cl)C=C1 D8154 [0,2,0,0,0,0|0,1,0]=3 811 B9R1.69 SC1=CC(Cl)=CC=C1Cl D0553 [0,2,0,0,0,0|0,1,0]=3 812 B9R1.69 SC1=CC(S)=C(Cl)C=C1 C8078 [0,2,0,0,0,0|0,1,0]=3 813 B9R1.69 SC1=CC=C(Cl)C=C1Cl D0538 [0,2,0,0,0,0|0,1,0]=3 814 B9R1.3 BrC1=CC=CC(Br)=C1Br T16679 [0,2,0,0,0,0|1,0,0]=3 815 B9R1.3 CC1=C(Cl)C(Br)=CC=C1 B9251 [0,2,0,0,0,0|1,0,0]=3 816 B9R1.3 CC1=C(F)C(Cl)=NC=C1 C4564 [0,2,0,0,0,0|2,0,0]=4 817 B9R1.3 CC1=C(F)C=CC=C1Br B5194 [0,2,0,0,0,0|1,0,0]=3 818 B9R1.3 CC1=C(F)C=CC=C1N F5227 [0,2,0,0,0,0|1,0,0]=3 819 B9R1.3 CC1=C(I)C=CC=C1F F5266 [0,2,0,0,0,0|1,0,0]=3 820 B9R1.3 CC1=C(N)C(Cl)=NC=C1 C2360 [0,2,0,0,0,0|2,0,0]=4 821 B9R1.3 CC1=C(N)C(F)=CC=C1 A4544 [0,2,0,0,0,0|1,0,0]=3 822 B9R1.3 CC1=C(N)C(F)=CC=C1 A4544 [0,2,0,0,0,0|1,0,0]=3 823 B9R1.3 CC1=C(N)C=CC=C1Br B11080 [0,2,0,0,0,0|1,0,0]=3 824 B9R1.3 CC1=C(N)C=CC=C1N D1118 [0,2,0,0,0,0|1,0,0]=3 825 B9R1.3 CC1=C(O)C=CC=C1O D0914 [0,2,0,0,0,0|0,0,0]=2 826 B9R1.3 CC1=CC=CC(Br)=C1F B6633 [0,2,0,0,0,0|1,0,0]=3 827 B9R1.3 CC1=CC=CC(Br)=C1F B6633 [0,2,0,0,0,0|1,0,0]=3 828 B9R1.3 CC1=CC=CC(C)=C1Br B8397 [0,2,0,0,0,0|1,0,0]=3 829 B9R1.3 CC1=CC=CC(Cl)=C1F C2560 [0,2,0,0,0,0|1,0,0]=3 830 B9R1.3 CC1=CC=CC(F)=C1Br B0669 [0,2,0,0,0,0|1,0,0]=3 831 B9R1.3 CC1=CC=CC(F)=C1Br B0669 [0,2,0,0,0,0|1,0,0]=3 832 B9R1.3 CC1=CC=CC(F)=C1Cl C4540 [0,2,0,0,0,0|1,0,0]=3 833 B9R1.3 CC1=CC=CC(F)=C1F D2567 [0,2,0,0,0,0|1,0,0]=3 834 B9R1.3 CC1=CC=CC(I)=C1F F10512 [0,2,0,0,0,0|1,0,0]=3 835 B9R1.3 CC1=CC=CC(N)=C1C D18844 [0,2,0,0,0,0|1,0,0]=3 836 B9R1.3 CC1=CC=CC(N)=[N+]1[O-] M17188 [0,2,0,0,0,0|1,0,1]=4 837 B9R1.3 ClC1=CC=CC(Br)=C1Br C16506 [0,2,0,0,0,0|1,0,0]=3 838 B9R1.3 ClC1=CN=CC(Cl)=C1Br B10172 [0,2,0,0,0,0|2,0,0]=4 839 B9R1.3 ClC1=CN=CC(Cl)=C1Cl T8296 [0,2,0,0,0,0|2,0,0]=4 840 B9R1.3 FC1=C(Br)C=CC=C1Cl B9431 [0,2,0,0,0,0|1,0,0]=3 841 B9R1.3 FC1=C(Cl)C=CC=C1Cl D0488 [0,2,0,0,0,0|1,0,0]=3 842 B9R1.3 FC1=C(Cl)C=NC=C1Cl D7692 [0,2,0,0,0,0|2,0,0]=4 843 B9R1.3 FC1=C(F)C(Br)=CC=C1 B0999 [0,2,0,0,0,0|1,0,0]=3 844 B9R1.3 FC1=CC=CC(Br)=C1Br D16551 [0,2,0,0,0,0|1,0,0]=3 845 B9R1.3 FC1=CC=CC(F)=C1Br B11155 [0,2,0,0,0,0|1,0,0]=3 846 B9R1.3 FC1=CC=CC(F)=C1Cl C11833 [0,2,0,0,0,0|1,0,0]=3 847 B9R1.3 FC1=CC=CC(F)=C1F T0428 [0,2,0,0,0,0|1,0,0]=3 848 B9R1.3 FC1=CC=CC(F)=C1F T0428 [0,2,0,0,0,0|1,0,0]=3 849 B9R1.3 NC1=C(Br)C=NC=C1Br A7323 [0,2,0,0,0,0|2,0,0]=4 850 B9R1.3 NC1=C(Cl)C=CC=C1Cl D0563 [0,2,0,0,0,0|1,0,0]=3 851 B9R1.3 NC1=C(Cl)C=CC=C1F C4958 [0,2,0,0,0,0|1,0,0]=3 852 B9R1.3 NC1=C(Cl)C=CN=C1Cl D15937 [0,2,0,0,0,0|2,0,0]=4 853 B9R1.3 NC1=C(Cl)C=NC=C1Cl A1769 [0,2,0,0,0,0|2,0,0]=4 854 B9R1.3 NC1=C(F)C=CC=C1Br B8584 [0,2,0,0,0,0|1,0,0]=3 855 B9R1.3 NC1=C(F)C=CC=C1F D0572 [0,2,0,0,0,0|1,0,0]=3 856 B9R1.3 NC1=C(I)C=CC=C1O A18687 [0,2,0,0,0,0|0,0,0]=2 857 B9R1.3 NC1=C(O)C(Br)=CC=C1 A11454 [0,2,0,0,0,0|0,0,0]=2 858 B9R1.3 NC1=CC=CC(Cl)=C1F C2539 [0,2,0,0,0,0|1,0,0]=3 859 B9R1.3 NC1=CC=CC(F)=C1Br B6631 [0,2,0,0,0,0|1,0,0]=3 860 B9R1.3 NC1=CC=CC(F)=C1F D2564 [0,2,0,0,0,0|1,0,0]=3 861 B9R1.3 NC1=CC=CC(F)=C1I I6628 [0,2,0,0,0,0|1,0,0]=3 862 B9R1.3 OC1=C(Br)C(Br)=CC=C1 D15141 [0,2,0,0,0,0|0,0,0]=2 863 B9R1.3 OC1=C(Br)C(Cl)=CC=C1 B15078 [0,2,0,0,0,0|0,0,0]=2 864 B9R1.3 OC1=C(Br)C(F)=CC=C1 B15077 [0,2,0,0,0,0|0,0,0]=2 865 B9R1.3 OC1=C(Br)C=CC=C1Br D0951 [0,2,0,0,0,0|0,0,0]=2 866 B9R1.3 OC1=C(Br)C=CC=C1F B5309 [0,2,0,0,0,0|0,0,0]=2 867 B9R1.3 OC1=C(Cl)C(Br)=CC=C1 B15084 [0,2,0,0,0,0|0,0,0]=2 868 B9R1.3 OC1=C(Cl)C(I)=CC=C1 C15125 [0,2,0,0,0,0|0,0,0]=2 869 B9R1.3 OC1=C(Cl)C=CC=C1Cl D7558 [0,2,0,0,0,0|0,0,0]=2 870 B9R1.3 OC1=C(Cl)C=CC=C1F C18777 [0,2,0,0,0,0|0,0,0]=2 871 B9R1.3 OC1=C(F)C=CC=C1F D0054 [0,2,0,0,0,0|0,0,0]=2 872 B9R1.3 OC1=C(I)C(Br)=CC=C1 B15079 [0,2,0,0,0,0|0,0,0]=2 873 B9R1.3 OC1=C(I)C(Cl)=CC=C1 C15124 [0,2,0,0,0,0|0,0,0]=2 874 B9R1.3 OC1=C(I)C=CC=C1F F6629 [0,2,0,0,0,0|0,0,0]=2 875 B9R1.3 OC1=CC=CC(F)=C1F D0243 [0,2,0,0,0,0|0,0,0]=2 876 B9R1.3 OC1=CC=CC(O)=C1O T3395 [0,2,0,0,0,0|0,0,0]=2 877 B9R1.3 OC1=NC=NC(O)=C1Br B8632 [0,2,0,0,0,0|2,0,0]=4 878 B9R1.3 ON1=C(Cl)C(Cl)=CC=C1 D17340 [0,2,0,0,0,0|1,0,0]=3 879 B9R1.3 SC1=C(Cl)C(Cl)=CC=C1 D8155 [0,2,0,0,0,0|0,1,0]=3 880 B9R1.3 SC1=C(Cl)C=CC=C1Cl D0566 [0,2,0,0,0,0|0,1,0]=3 881 B9R1.34 BrC1=CC(Br)=CC(Br)=C1 T0446 [0,2,0,0,0,0|1,0,0]=3 882 B9R1.34 CC1=CC(C)=CC(Br)=C1 B5332 [0,2,0,0,0,0|1,0,0]=3 883 B9R1.34 CC1=CC(C)=NC(C)=C1 C4992 [0,2,0,0,0,0|2,0,0]=4 884 B9R1.34 CC1=CC(C)=NC(O)=N1 D11684 [0,2,0,0,0,0|2,0,0]=4 885 B9R1.34 CC1=CC(F)=CC(Br)=C1 B4543 [0,2,0,0,0,0|1,0,0]=3 886 B9R1.34 CC1=CC(F)=CC(Br)=C1 B4543 [0,2,0,0,0,0|1,0,0]=3 887 B9R1.34 CC1=CC(F)=CC(F)=C1 D4541 [0,2,0,0,0,0|1,0,0]=3 888 B9R1.34 CC1=CC(O)=CC(=O)O1 H5525 [0,2,0,0,0,0|1,0,0]=3 889 B9R1.34 CC1=CC(O)=CC(C)=N1 D17467 [0,2,0,0,0,0|1,0,0]=3 890 B9R1.34 CC1=CC(O)=CC(O)=C1 M18881 [0,2,0,0,0,0|0,0,0]=2 891 B9R1.34 CC1=CC(O)=NC(C)=N1 D0626 [0,2,0,0,0,0|2,0,0]=4 892 B9R1.34 CC1=NC(O)=CC(O)=N1 D1154 [0,2,0,0,0,0|2,0,0]=4 893 B9R1.34 CC1=NC(O)=CC(O)=N1 D1154 [0,2,0,0,0,0|2,0,0]=4 894 B9R1.34 ClC1=CC(Cl)=CC(Br)=C1 B2047 [0,2,0,0,0,0|1,0,0]=3 895 B9R1.34 FC1=CC(Br)=CC(Br)=C1 D5205 [0,2,0,0,0,0|1,0,0]=3 896 B9R1.34 FC1=CC(Cl)=CC(Br)=C1 B4290 [0,2,0,0,0,0|1,0,0]=3 897 B9R1.34 FC1=CC(Cl)=CC(Cl)=C1 D11492 [0,2,0,0,0,0|1,0,0]=3 898 B9R1.34 FC1=CC(F)=CC(Br)=C1 B0076 [0,2,0,0,0,0|1,0,0]=3 899 B9R1.34 FC1=CC(F)=CC(Cl)=C1 C11493 [0,2,0,0,0,0|1,0,0]=3 900 B9R1.34 FC1=CC(F)=CC(F)=C1 T0426 [0,2,0,0,0,0|1,0,0]=3 901 B9R1.34 FC1=CC(F)=CC(I)=C1 D10642 [0,2,0,0,0,0|1,0,0]=3 902 B9R1.34 NC1=CC(Br)=CC(N)=N1 D7306 [0,2,0,0,0,0|2,0,0]=4 903 B9R1.34 NC1=CC(Cl)=CC(F)=C1 C3478 [0,2,0,0,0,0|1,0,0]=3 904 B9R1.34 NC1=CC(Cl)=CC(F)=C1 C3478 [0,2,0,0,0,0|1,0,0]=3 905 B9R1.34 NC1=CC(F)=CC(F)=C1 D5024 [0,2,0,0,0,0|1,0,0]=3 906 B9R1.34 NC1=CC(O)=NC(N)=N1 D1256 [0,2,0,0,0,0|2,0,0]=4 907 B9R1.34 NC1=CC(O)=NC(N)=N1 D1256 [0,2,0,0,0,0|2,0,0]=4 908 B9R1.34 NC1=CC(O)=NC(O)=N1 A4323 [0,2,0,0,0,0|2,0,0]=4 909 B9R1.34 NC1=NC(Cl)=CC(Cl)=C1 A18254 [0,2,0,0,0,0|2,0,0]=4 910 B9R1.34 NC1=NC(Cl)=CC(O)=N1 A18212 [0,2,0,0,0,0|2,0,0]=4 911 B9R1.34 NC1=NC(O)=CC(O)=N1 A0953 [0,2,0,0,0,0|2,0,0]=4 912 B9R1.34 NC1=NC(S)=NC(O)=C1 A4364 [0,2,0,0,0,0|2,0,0]=4 913 B9R1.34 OC1=CC(Cl)=CC(Cl)=C1 D0670 [0,2,0,0,0,0|0,0,0]=2 914 B9R1.34 OC1=CC(F)=CC(F)=C1 D4950 [0,2,0,0,0,0|0,0,0]=2 915 B9R1.34 OC1=CC(O)=CC(O)=C1 P4975 [0,2,0,0,0,0|0,0,0]=2 916 B9R1.34 ON1=CC(Cl)=CC(Cl)=C1 D17337 [0,2,0,0,0,0|1,0,0]=3 917 B5R1.1 C1=CNC=N1 I18837 [1,0,0,0,1,0|2,0,0]=4 918 B5R1.1 C1=CON=C1 I12950 [1,0,0,0,1,0|2,0,0]=4