0 B7R1.3 BN1=CC=CC=C1 044681 [0,0,0,0,0,0|3,0,0]=3 1 B7R1.3 BrC1=CC=CC=C1 BR1026 [0,0,0,0,0,0|2,0,0]=2 2 B7R1.3 BrC1=CC=CN=C1 008797 [0,0,0,0,0,0|3,0,0]=3 3 B7R1.3 BrC1=CC=NC=C1 045184 [0,0,0,0,0,0|1,0,0]=1 4 B7R1.3 BrC1=CN=CC=N1 049757 [0,0,0,0,0,0|4,0,0]=4 5 B7R1.3 BrC1=CN=CN=C1 036376 [0,0,0,0,0,0|4,0,0]=4 6 B7R1.3 BrC1=NC=CC=C1 036222 [0,0,0,0,0,0|3,0,0]=3 7 B7R1.3 BrC1=NC=CC=N1 036373 [0,0,0,0,0,0|4,0,0]=4 8 B7R1.3 BrC1=NN=CC=C1 078228 [0,0,0,0,0,0|4,0,0]=4 9 B7R1.3 CC1=CC=CC=C1 035922 [0,0,0,0,0,0|2,0,0]=2 10 B7R1.3 CC1=CC=CC=C1 046885 [0,0,0,0,0,0|2,0,0]=2 11 B7R1.3 CC1=CC=CC=C1 099899 [0,0,0,0,0,0|2,0,0]=2 12 B7R1.3 CC1=CC=CC=C1 102149 [0,0,0,0,0,0|2,0,0]=2 13 B7R1.3 CC1=CC=CN=C1 235657 [0,0,0,0,0,0|3,0,0]=3 14 B7R1.3 CC1=CC=CN=N1 236526 [0,0,0,0,0,0|4,0,0]=4 15 B7R1.3 CC1=CC=NC=C1 094587 [0,0,0,0,0,0|1,0,0]=1 16 B7R1.3 CC1=CN=CN=C1 040003 [0,0,0,0,0,0|4,0,0]=4 17 B7R1.3 CC1=NC=CC=C1 235658 [0,0,0,0,0,0|3,0,0]=3 18 B7R1.3 CC1=NC=CN=C1 002726 [0,0,0,0,0,0|4,0,0]=4 19 B7R1.3 CC1=NC=NC=C1 045243 [0,0,0,0,0,0|2,0,0]=2 20 B7R1.3 ClC1=CC=CC=C1 044613 [0,0,0,0,0,0|2,0,0]=2 21 B7R1.3 ClC1=CC=CC=C1 101617 [0,0,0,0,0,0|2,0,0]=2 22 B7R1.3 ClC1=CC=CN=C1 045189 [0,0,0,0,0,0|3,0,0]=3 23 B7R1.3 ClC1=CC=NC=C1 045187 [0,0,0,0,0,0|1,0,0]=1 24 B7R1.3 ClC1=NC=CC=C1 044502 [0,0,0,0,0,0|3,0,0]=3 25 B7R1.3 ClC1=NC=CC=N1 036368 [0,0,0,0,0,0|4,0,0]=4 26 B7R1.3 ClC1=NC=CN=C1 002754 [0,0,0,0,0,0|4,0,0]=4 27 B7R1.3 FC1=CC=CC=C1 001699 [0,0,0,0,0,0|2,0,0]=2 28 B7R1.3 FC1=CC=CN=C1 001298 [0,0,0,0,0,0|3,0,0]=3 29 B7R1.3 FC1=CC=NC=C1 049831 [0,0,0,0,0,0|1,0,0]=1 30 B7R1.3 FC1=CN=CC=N1 050271 [0,0,0,0,0,0|4,0,0]=4 31 B7R1.3 FC1=NC=CC=C1 001297 [0,0,0,0,0,0|3,0,0]=3 32 B7R1.3 IC1=CC=CC=C1 003461 [0,0,0,0,0,0|2,0,0]=2 33 B7R1.3 IC1=CC=CN=C1 008065 [0,0,0,0,0,0|3,0,0]=3 34 B7R1.3 IC1=CC=NC=C1 019463 [0,0,0,0,0,0|1,0,0]=1 35 B7R1.3 IC1=CN=CC=N1 236553 [0,0,0,0,0,0|4,0,0]=4 36 B7R1.3 IC1=NC=CC=C1 067334 [0,0,0,0,0,0|3,0,0]=3 37 B7R1.3 NC1=CC=CC=C1 044723 [0,0,0,0,0,0|1,0,0]=1 38 B7R1.3 NC1=CC=CC=C1 098809 [0,0,0,0,0,0|1,0,0]=1 39 B7R1.3 NC1=CC=CC=C1 228177 [0,0,0,0,0,0|1,0,0]=1 40 B7R1.3 NC1=CC=CN=C1 003677 [0,0,0,0,0,0|2,0,0]=2 41 B7R1.3 NC1=CC=CN=N1 064947 [0,0,0,0,0,0|3,0,0]=3 42 B7R1.3 NC1=CC=NC=C1 047207 [0,0,0,0,0,0|0,0,0]=0 43 B7R1.3 NC1=CC=NC=C1 180633 [0,0,0,0,0,0|0,0,0]=0 44 B7R1.3 NC1=CC=NC=N1 013417 [0,0,0,0,0,0|1,0,0]=1 45 B7R1.3 NC1=CN=CN=C1 046263 [0,0,0,0,0,0|3,0,0]=3 46 B7R1.3 NC1=NC=CC=C1 050259 [0,0,0,0,0,0|2,0,0]=2 47 B7R1.3 NC1=NC=CC=N1 036344 [0,0,0,0,0,0|3,0,0]=3 48 B7R1.3 NC1=NC=CN=C1 043480 [0,0,0,0,0,0|3,0,0]=3 49 B7R1.3 NC1=NC=CN=N1 045802 [0,0,0,0,0,0|4,0,0]=4 50 B7R1.3 NC1=NN=CC=C1 078256 [0,0,0,0,0,0|3,0,0]=3 51 B7R1.3 N[N+]1=CC=CC=C1 091999 [0,0,0,0,0,0|2,0,0]=2 52 B7R1.3 O=C1C=CC=CN1 338426 [0,0,0,0,0,0|3,0,0]=3 53 B7R1.3 O=C1C=CCCC1 040004 [0,0,0,0,0,0|2,0,2]=4 54 B7R1.3 OC1=CC=CC=C1 098645 [0,0,0,0,0,0|2,0,0]=2 55 B7R1.3 OC1=CC=CC=C1 101882 [0,0,0,0,0,0|2,0,0]=2 56 B7R1.3 OC1=CC=CC=C1 102467 [0,0,0,0,0,0|2,0,0]=2 57 B7R1.3 OC1=CC=CN=C1 045225 [0,0,0,0,0,0|3,0,0]=3 58 B7R1.3 OC1=CC=NC=C1 045193 [0,0,0,0,0,0|1,0,0]=1 59 B7R1.3 OC1=CC=NN=C1 077229 [0,0,0,0,0,0|2,0,0]=2 60 B7R1.3 OC1=NC=CC=C1 003423 [0,0,0,0,0,0|3,0,0]=3 61 B7R1.3 OC1=NC=CC=N1 147200 [0,0,0,0,0,0|4,0,0]=4 62 B7R1.3 OC1=NC=CN=C1 076215 [0,0,0,0,0,0|4,0,0]=4 63 B7R1.3 OC1=NC=NC=C1 068731 [0,0,0,0,0,0|2,0,0]=2 64 B7R1.3 PC1=CC=CC=C1 106038 [0,0,0,0,0,0|1,1,0]=2 65 B7R1.3 S=C1C=CC=NN1 180025 [0,0,0,0,0,0|4,0,0]=4 66 B7R1.3 SC1=CC=CC=C1 094667 [0,0,0,0,0,0|2,0,0]=2 67 B7R1.3 SC1=CC=NC=C1 358023 [0,0,0,0,0,0|1,0,0]=1 68 B7R1.3 SC1=NC=CC=C1 023265 [0,0,0,0,0,0|3,0,0]=3 69 B7R1.3 SC1=NC=CC=N1 036415 [0,0,0,0,0,0|4,0,0]=4 70 B7R1.3 [O-]C1=CC=CC=C1 180036 [0,0,0,0,0,0|2,0,0]=2 71 B7R1.3 [O-][N+]1=CC=CC=C1 045196 [0,0,0,0,0,0|3,0,0]=3 72 B7R1.3 [S-]C1=CC=CC=C1 303893 [0,0,0,0,0,0|2,0,0]=2 73 B7R1.3 [SiH3]C1=CC=CC=C1 S13600 [0,0,0,0,0,0|2,0,0]=2 74 B6R1.1 C1=CC=CC=C1 099466 [1,0,0,0,0,0|1,0,0]=2 75 B6R1.1 C1=CC=CC=C1 101960 [1,0,0,0,0,0|1,0,0]=2 76 B6R1.1 C1=CC=NC=C1 002844 [1,0,0,0,0,0|0,0,0]=1 77 B6R1.1 C1=CC=NC=C1 005154 [1,0,0,0,0,0|0,0,0]=1 78 B6R1.1 C1=CC=NC=C1 013123 [1,0,0,0,0,0|0,0,0]=1 79 B6R1.1 C1=CC=NC=C1 034521 [1,0,0,0,0,0|0,0,0]=1 80 B6R1.1 C1=CC=NC=C1 044990 [1,0,0,0,0,0|0,0,0]=1 81 B6R1.1 C1=CC=NC=C1 068549 [1,0,0,0,0,0|0,0,0]=1 82 B6R1.1 C1=CC=NC=C1 094222 [1,0,0,0,0,0|0,0,0]=1 83 B6R1.1 C1=CC=NC=C1 098889 [1,0,0,0,0,0|0,0,0]=1 84 B6R1.1 C1=CC=NC=C1 106150 [1,0,0,0,0,0|0,0,0]=1 85 B6R1.1 C1=CC=NN=C1 079215 [1,0,0,0,0,0|1,0,0]=2 86 B6R1.1 C1=CCC=CC1 102018 [1,0,0,0,0,0|1,0,1]=3 87 B6R1.1 C1=CCCC=C1 123000 [1,0,0,0,0,0|1,0,1]=3 88 B6R1.1 C1=CN=CC=N1 002725 [1,0,0,0,0,0|1,0,0]=2 89 B6R1.1 C1=NC=NC=N1 234994 [1,0,0,0,0,0|2,0,0]=3 90 B8R1.2 BrCC1=CC=CC=C1 003666 [0,1,0,0,0,0|2,0,0]=3 91 B8R1.2 BrCC1=CC=CN=C1 214585 [0,1,0,0,0,0|3,0,0]=4 92 B8R1.2 BrCC1=CC=NC=C1 067829 [0,1,0,0,0,0|1,0,0]=2 93 B8R1.2 BrCC1=NC=CC=C1 067831 [0,1,0,0,0,0|3,0,0]=4 94 B8R1.2 BrCC1=NC=NC=C1 231198 [0,1,0,0,0,0|2,0,0]=3 95 B8R1.2 Br[Mg]C1=CC=CC=C1 103487 [0,1,0,0,0,0|2,0,0]=3 96 B8R1.2 Br[Mg]C1=CC=CC=C1 214282 [0,1,0,0,0,0|2,0,0]=3 97 B8R1.2 C#CC1=CC=CC=C1 003009 [0,1,0,0,0,0|2,0,0]=3 98 B8R1.2 C#CC1=CC=CN=C1 080053 [0,1,0,0,0,0|3,0,0]=4 99 B8R1.2 C#CC1=CC=NC=C1 047652 [0,1,0,0,0,0|1,0,0]=2 100 B8R1.2 C#CC1=NC=CC=C1 078381 [0,1,0,0,0,0|3,0,0]=4 101 B8R1.2 C=CC1=CC=CC=C1 520455 [0,1,0,0,0,0|2,0,0]=3 102 B8R1.2 CCC1=CC=CC=C1 094632 [0,1,0,0,0,0|2,0,0]=3 103 B8R1.2 CCC1=CC=CC=N1 098941 [0,1,0,0,0,0|3,0,0]=4 104 B8R1.2 CCC1=CC=CN=C1 242838 [0,1,0,0,0,0|3,0,0]=4 105 B8R1.2 CCC1=CC=NC=C1 319885 [0,1,0,0,0,0|1,0,0]=2 106 B8R1.2 CC[N+]1=CC=CC=C1 046807 [0,1,0,0,0,0|3,0,0]=4 107 B8R1.2 CNC1=CC=CC=C1 094625 [0,1,0,0,0,0|1,0,0]=2 108 B8R1.2 CNC1=CC=CN=C1 079398 [0,1,0,0,0,0|2,0,0]=3 109 B8R1.2 CNC1=CC=NC=C1 208626 [0,1,0,0,0,0|0,0,0]=1 110 B8R1.2 CNC1=NC=CC=C1 233304 [0,1,0,0,0,0|2,0,0]=3 111 B8R1.2 COC1=CC=CC=C1 M03556 [0,1,0,0,0,0|2,0,0]=3 112 B8R1.2 COC1=CC=CN=C1 079847 [0,1,0,0,0,0|3,0,0]=4 113 B8R1.2 COC1=CC=NC=C1 045194 [0,1,0,0,0,0|1,0,0]=2 114 B8R1.2 COC1=NC=CC=C1 045214 [0,1,0,0,0,0|3,0,0]=4 115 B8R1.2 CSC1=CC=CC=C1 002945 [0,1,0,0,0,0|2,0,0]=3 116 B8R1.2 ClCC1=CC=CC=C1 106800 [0,1,0,0,0,0|2,0,0]=3 117 B8R1.2 ClCC1=CC=CC=N1 026180 [0,1,0,0,0,0|3,0,0]=4 118 B8R1.2 ClCC1=CC=CN=C1 043884 [0,1,0,0,0,0|3,0,0]=4 119 B8R1.2 ClCC1=CC=NC=C1 050512 [0,1,0,0,0,0|1,0,0]=2 120 B8R1.2 Cl[Hg]C1=CC=CC=C1 101463 [0,1,0,0,0,0|2,0,0]=3 121 B8R1.2 Cl[Se]C1=CC=CC=C1 005554 [0,1,0,0,0,0|2,0,0]=3 122 B8R1.2 N#CC1=CC=CC=C1 035786 [0,1,0,0,0,0|1,0,1]=3 123 B8R1.2 N#CC1=CC=CC=C1 102548 [0,1,0,0,0,0|1,0,1]=3 124 B8R1.2 N#CC1=CC=NC=C1 050349 [0,1,0,0,0,0|0,0,1]=2 125 B8R1.2 N#CC1=CN=CC=C1 234028 [0,1,0,0,0,0|2,0,1]=4 126 B8R1.2 N#CC1=NC=CC=C1 050348 [0,1,0,0,0,0|2,0,1]=4 127 B8R1.2 NCC1=CC=CC=C1 098408 [0,1,0,0,0,0|1,0,0]=2 128 B8R1.2 NCC1=CC=CC=C1 241882 [0,1,0,0,0,0|1,0,0]=2 129 B8R1.2 NCC1=CC=CN=C1 078185 [0,1,0,0,0,0|2,0,0]=3 130 B8R1.2 NCC1=CC=NC=C1 065475 [0,1,0,0,0,0|0,0,0]=1 131 B8R1.2 NCC1=CN=CC=N1 043597 [0,1,0,0,0,0|3,0,0]=4 132 B8R1.2 NCC1=NC=CC=C1 009750 [0,1,0,0,0,0|2,0,0]=3 133 B8R1.2 NNC1=CC=CC=C1 079470 [0,1,0,0,0,0|1,0,0]=2 134 B8R1.2 NNC1=CC=CC=C1 098902 [0,1,0,0,0,0|1,0,0]=2 135 B8R1.2 NNC1=CN=CC=C1 044299 [0,1,0,0,0,0|2,0,0]=3 136 B8R1.2 NNC1=NC=CC=C1 093675 [0,1,0,0,0,0|2,0,0]=3 137 B8R1.2 NNC1=NC=CC=N1 044297 [0,1,0,0,0,0|3,0,0]=4 138 B8R1.2 O=CC1=CC=CN=C1 065202 [0,1,0,0,0,0|3,0,0]=4 139 B8R1.2 O=CC1=CC=NC=C1 091501 [0,1,0,0,0,0|1,0,0]=2 140 B8R1.2 O=CC1=NC=CC=C1 065201 [0,1,0,0,0,0|3,0,0]=4 141 B8R1.2 O=NC1=CC=CC=C1 106182 [0,1,0,0,0,0|1,0,1]=3 142 B8R1.2 OCC1=CC=CC=C1 094986 [0,1,0,0,0,0|2,0,0]=3 143 B8R1.2 OCC1=CC=CC=C1 105725 [0,1,0,0,0,0|2,0,0]=3 144 B8R1.2 OCC1=CC=CN=C1 208628 [0,1,0,0,0,0|3,0,0]=4 145 B8R1.2 OCC1=CC=NC=C1 078602 [0,1,0,0,0,0|1,0,0]=2 146 B8R1.2 OCC1=NC=CC=C1 043374 [0,1,0,0,0,0|3,0,0]=4 147 B8R1.2 SCC1=CC=CC=C1 098994 [0,1,0,0,0,0|2,0,0]=3 148 B8R1.2 [C-]#[N+]C1=CC=CC=C1 180012 [0,1,0,0,0,0|1,0,1]=3 149 B8R1.2 [O-]CC1=CC=CC=C1 105697 [0,1,0,0,0,0|2,0,0]=3 150 B8R1.3 BrC1=CC=C(Br)C=C1 125702 [0,1,0,0,0,0|2,0,0]=3 151 B8R1.3 BrC1=CC=C(I)C=C1 005440 [0,1,0,0,0,0|2,0,0]=3 152 B8R1.3 BrC1=CN=C(Br)C=C1 019467 [0,1,0,0,0,0|3,0,0]=4 153 B8R1.3 BrC1=CN=C(I)C=C1 023885 [0,1,0,0,0,0|3,0,0]=4 154 B8R1.3 BrC1=NC=C(I)C=C1 037034 [0,1,0,0,0,0|3,0,0]=4 155 B8R1.3 CC1=CC=C(Br)C=C1 001435 [0,1,0,0,0,0|2,0,0]=3 156 B8R1.3 CC1=CC=C(C)C=C1 098352 [0,1,0,0,0,0|2,0,0]=3 157 B8R1.3 CC1=CC=C(Cl)C=C1 099073 [0,1,0,0,0,0|2,0,0]=3 158 B8R1.3 CC1=CC=C(Cl)N=C1 049167 [0,1,0,0,0,0|3,0,0]=4 159 B8R1.3 CC1=CC=C(F)C=C1 001443 [0,1,0,0,0,0|2,0,0]=3 160 B8R1.3 CC1=CC=C(F)C=N1 035867 [0,1,0,0,0,0|3,0,0]=4 161 B8R1.3 CC1=CC=C(I)C=C1 001201 [0,1,0,0,0,0|2,0,0]=3 162 B8R1.3 CC1=CC=C(N)C=C1 080317 [0,1,0,0,0,0|1,0,0]=2 163 B8R1.3 CC1=CC=C(N)C=N1 012721 [0,1,0,0,0,0|2,0,0]=3 164 B8R1.3 CC1=CC=C(O)C=C1 240310 [0,1,0,0,0,0|2,0,0]=3 165 B8R1.3 CC1=CC=C(S)C=C1 019192 [0,1,0,0,0,0|2,0,0]=3 166 B8R1.3 CC1=CC=[N+]([O-])C=C1 237882 [0,1,0,0,0,0|1,0,1]=3 167 B8R1.3 CC1=CN=C(Br)C=C1 024508 [0,1,0,0,0,0|3,0,0]=4 168 B8R1.3 CC1=CN=C(F)C=C1 008920 [0,1,0,0,0,0|3,0,0]=4 169 B8R1.3 CC1=CN=C(N)C=C1 003527 [0,1,0,0,0,0|2,0,0]=3 170 B8R1.3 CC1=CN=C(N)C=N1 064501 [0,1,0,0,0,0|3,0,0]=4 171 B8R1.3 CC1=CN=C(O)C=C1 037381 [0,1,0,0,0,0|3,0,0]=4 172 B8R1.3 CC1=CNC(=O)C=C1 318707 [0,1,0,0,0,0|3,0,0]=4 173 B8R1.3 CC1=NC=C(Br)C=C1 033262 [0,1,0,0,0,0|3,0,0]=4 174 B8R1.3 CC1=NC=C(Cl)C=C1 221445 [0,1,0,0,0,0|3,0,0]=4 175 B8R1.3 CC1=NC=C(O)C=C1 076959 [0,1,0,0,0,0|3,0,0]=4 176 B8R1.3 ClC1=CC=C(Br)C=C1 094835 [0,1,0,0,0,0|2,0,0]=3 177 B8R1.3 ClC1=CC=C(Cl)C=C1 094994 [0,1,0,0,0,0|2,0,0]=3 178 B8R1.3 ClC1=CC=C(I)C=C1 001151 [0,1,0,0,0,0|2,0,0]=3 179 B8R1.3 ClC1=CC=C(I)C=N1 046448 [0,1,0,0,0,0|3,0,0]=4 180 B8R1.3 ClC1=CN=C(Br)C=C1 012730 [0,1,0,0,0,0|3,0,0]=4 181 B8R1.3 ClC1=CN=C(Cl)C=C1 045174 [0,1,0,0,0,0|3,0,0]=4 182 B8R1.3 ClC1=NC=C(Br)C=C1 024509 [0,1,0,0,0,0|3,0,0]=4 183 B8R1.3 FC1=CC=C(Br)C=C1 001225 [0,1,0,0,0,0|2,0,0]=3 184 B8R1.3 FC1=CC=C(Br)C=N1 045231 [0,1,0,0,0,0|3,0,0]=4 185 B8R1.3 FC1=CC=C(Cl)C=C1 001147 [0,1,0,0,0,0|2,0,0]=3 186 B8R1.3 FC1=CC=C(F)C=C1 001170 [0,1,0,0,0,0|2,0,0]=3 187 B8R1.3 FC1=CC=C(I)C=C1 001184 [0,1,0,0,0,0|2,0,0]=3 188 B8R1.3 FC1=CC=C(S)C=C1 001625 [0,1,0,0,0,0|2,0,0]=3 189 B8R1.3 FC1=CN=C(Br)C=C1 024928 [0,1,0,0,0,0|3,0,0]=4 190 B8R1.3 FC1=CN=C(F)C=C1 036113 [0,1,0,0,0,0|3,0,0]=4 191 B8R1.3 FC1=NC=C(I)C=C1 036309 [0,1,0,0,0,0|3,0,0]=4 192 B8R1.3 IC1=CC=C(I)C=C1 131402 [0,1,0,0,0,0|2,0,0]=3 193 B8R1.3 NC1=CC=C(Br)C=C1 002472 [0,1,0,0,0,0|1,0,0]=2 194 B8R1.3 NC1=CC=C(Br)N=C1 035207 [0,1,0,0,0,0|2,0,0]=3 195 B8R1.3 NC1=CC=C(Br)N=N1 064946 [0,1,0,0,0,0|3,0,0]=4 196 B8R1.3 NC1=CC=C(Cl)C=C1 046750 [0,1,0,0,0,0|1,0,0]=2 197 B8R1.3 NC1=CC=C(F)C=C1 001439 [0,1,0,0,0,0|1,0,0]=2 198 B8R1.3 NC1=CC=C(F)N=C1 035844 [0,1,0,0,0,0|2,0,0]=3 199 B8R1.3 NC1=CC=C(I)C=C1 005423 [0,1,0,0,0,0|1,0,0]=2 200 B8R1.3 NC1=CC=C(I)N=N1 064949 [0,1,0,0,0,0|3,0,0]=4 201 B8R1.3 NC1=CC=C(N)C=C1 165600 [0,1,0,0,0,0|1,0,0]=2 202 B8R1.3 NC1=CC=C(N)C=C1 238391 [0,1,0,0,0,0|1,0,0]=2 203 B8R1.3 NC1=CC=C(O)C=C1 005060 [0,1,0,0,0,0|1,0,0]=2 204 B8R1.3 NC1=CC=C(O)N=C1 049670 [0,1,0,0,0,0|2,0,0]=3 205 B8R1.3 NC1=CC=C(S)C=C1 050722 [0,1,0,0,0,0|1,0,0]=2 206 B8R1.3 NC1=CN=C(Cl)C=C1 010694 [0,1,0,0,0,0|2,0,0]=3 207 B8R1.3 NC1=CN=C(O)C=C1 040143 [0,1,0,0,0,0|2,0,0]=3 208 B8R1.3 NC1=NC=C(Br)C=C1 003417 [0,1,0,0,0,0|2,0,0]=3 209 B8R1.3 NC1=NC=C(Br)C=N1 045218 [0,1,0,0,0,0|3,0,0]=4 210 B8R1.3 NC1=NC=C(Br)N=C1 036703 [0,1,0,0,0,0|3,0,0]=4 211 B8R1.3 NC1=NC=C(Cl)C=C1 010691 [0,1,0,0,0,0|2,0,0]=3 212 B8R1.3 NC1=NC=C(Cl)C=N1 018177 [0,1,0,0,0,0|3,0,0]=4 213 B8R1.3 NC1=NC=C(F)C=C1 005231 [0,1,0,0,0,0|2,0,0]=3 214 B8R1.3 NC1=NC=C(I)C=C1 005457 [0,1,0,0,0,0|2,0,0]=3 215 B8R1.3 NC1=NC=C(I)C=N1 048092 [0,1,0,0,0,0|3,0,0]=4 216 B8R1.3 NC1=NC=C(I)N=C1 076106 [0,1,0,0,0,0|3,0,0]=4 217 B8R1.3 NC1=NC=C(O)C=C1 077000 [0,1,0,0,0,0|2,0,0]=3 218 B8R1.3 NC1=NN=C(Cl)C=C1 018176 [0,1,0,0,0,0|3,0,0]=4 219 B8R1.3 NC1=NN=C(N)C=C1 093687 [0,1,0,0,0,0|3,0,0]=4 220 B8R1.3 O=C1C=CC(=O)C=C1 094629 [0,1,0,0,0,0|2,0,0]=3 221 B8R1.3 OC1=CC=C(Br)C=C1 008836 [0,1,0,0,0,0|2,0,0]=3 222 B8R1.3 OC1=CC=C(Br)C=N1 035853 [0,1,0,0,0,0|3,0,0]=4 223 B8R1.3 OC1=CC=C(Cl)C=C1 099915 [0,1,0,0,0,0|2,0,0]=3 224 B8R1.3 OC1=CC=C(F)C=C1 001291 [0,1,0,0,0,0|2,0,0]=3 225 B8R1.3 OC1=CC=C(F)C=N1 036288 [0,1,0,0,0,0|3,0,0]=4 226 B8R1.3 OC1=CC=C(F)N=C1 036275 [0,1,0,0,0,0|3,0,0]=4 227 B8R1.3 OC1=CC=C(I)C=C1 008839 [0,1,0,0,0,0|2,0,0]=3 228 B8R1.3 OC1=CC=C(O)C=C1 146000 [0,1,0,0,0,0|2,0,0]=3 229 B8R1.3 OC1=CN=C(Br)C=C1 037033 [0,1,0,0,0,0|3,0,0]=4 230 B8R1.3 OC1=CN=C(Cl)C=C1 024512 [0,1,0,0,0,0|3,0,0]=4 231 B8R1.3 OC1=NC=C(Cl)C=C1 067320 [0,1,0,0,0,0|3,0,0]=4 232 B8R1.3 OC1=NC=C(I)C=C1 067337 [0,1,0,0,0,0|3,0,0]=4 233 B8R1.3 SC1=CC=C(Br)C=C1 023261 [0,1,0,0,0,0|2,0,0]=3 234 B8R1.3 SC1=CC=C(Cl)C=C1 005205 [0,1,0,0,0,0|2,0,0]=3 235 B8R1.3 [O-][N+]1=CC=C(Cl)C=C1 046924 [0,1,0,0,0,0|1,0,1]=3 236 B8R1.4 BrC1=CC(Br)=NC=C1 033112 [0,1,0,0,0,0|1,0,0]=2 237 B8R1.4 BrC1=CC(I)=CC=C1 001125 [0,1,0,0,0,0|2,0,0]=3 238 B8R1.4 BrC1=CC=CC(Br)=C1 001159 [0,1,0,0,0,0|2,0,0]=3 239 B8R1.4 BrC1=CC=CC(Br)=N1 024557 [0,1,0,0,0,0|3,0,0]=4 240 B8R1.4 BrC1=CN=CC(Br)=C1 032698 [0,1,0,0,0,0|3,0,0]=4 241 B8R1.4 BrC1=CN=CC(I)=C1 046191 [0,1,0,0,0,0|3,0,0]=4 242 B8R1.4 CC1=CC(=O)NC=C1 358401 [0,1,0,0,0,0|1,0,1]=3 243 B8R1.4 CC1=CC(Br)=CC=C1 001434 [0,1,0,0,0,0|2,0,0]=3 244 B8R1.4 CC1=CC(Br)=CN=C1 036864 [0,1,0,0,0,0|3,0,0]=4 245 B8R1.4 CC1=CC(Br)=NC=C1 009754 [0,1,0,0,0,0|1,0,0]=2 246 B8R1.4 CC1=CC(C)=NC=C1 242811 [0,1,0,0,0,0|1,0,0]=2 247 B8R1.4 CC1=CC(C)=NC=N1 045792 [0,1,0,0,0,0|2,0,0]=3 248 B8R1.4 CC1=CC(Cl)=CC=C1 243038 [0,1,0,0,0,0|2,0,0]=3 249 B8R1.4 CC1=CC(Cl)=NC=C1 010404 [0,1,0,0,0,0|1,0,0]=2 250 B8R1.4 CC1=CC(F)=CC=C1 001442 [0,1,0,0,0,0|2,0,0]=3 251 B8R1.4 CC1=CC(F)=NC=C1 006287 [0,1,0,0,0,0|1,0,0]=2 252 B8R1.4 CC1=CC(I)=CC=C1 001200 [0,1,0,0,0,0|2,0,0]=3 253 B8R1.4 CC1=CC(N)=NC=C1 013751 [0,1,0,0,0,0|1,0,0]=2 254 B8R1.4 CC1=CC=CC(C)=C1 103820 [0,1,0,0,0,0|2,0,0]=3 255 B8R1.4 CC1=CC=CC(C)=N1 092726 [0,1,0,0,0,0|3,0,0]=4 256 B8R1.4 CC1=CC=CC(C)=N1 104293 [0,1,0,0,0,0|3,0,0]=4 257 B8R1.4 CC1=CC=CC(Cl)=N1 010405 [0,1,0,0,0,0|3,0,0]=4 258 B8R1.4 CC1=CC=CC(F)=N1 006288 [0,1,0,0,0,0|3,0,0]=4 259 B8R1.4 CC1=CC=CC(N)=C1 033242 [0,1,0,0,0,0|1,0,0]=2 260 B8R1.4 CC1=CC=CC(N)=N1 020196 [0,1,0,0,0,0|2,0,0]=3 261 B8R1.4 CC1=CC=CC(O)=C1 094674 [0,1,0,0,0,0|2,0,0]=3 262 B8R1.4 CC1=CC=NC(Cl)=N1 044515 [0,1,0,0,0,0|2,0,0]=3 263 B8R1.4 CC1=CC=NC(N)=N1 003634 [0,1,0,0,0,0|2,0,0]=3 264 B8R1.4 CC1=CN=CC(C)=C1 094626 [0,1,0,0,0,0|3,0,0]=4 265 B8R1.4 CC1=CN=CC(N)=C1 033255 [0,1,0,0,0,0|2,0,0]=3 266 B8R1.4 CC1=C[N+]([O-])=CC=C1 233635 [0,1,0,0,0,0|3,0,0]=4 267 B8R1.4 CC1=NC(Br)=CC=C1 020192 [0,1,0,0,0,0|3,0,0]=4 268 B8R1.4 CC1=NC(Cl)=CC=N1 061014 [0,1,0,0,0,0|2,0,0]=3 269 B8R1.4 CC1=NC(S)=NC=C1 068730 [0,1,0,0,0,0|2,0,0]=3 270 B8R1.4 CC1=NC=CC(Br)=C1 036985 [0,1,0,0,0,0|1,0,0]=2 271 B8R1.4 CC1=NC=CC(Cl)=C1 003362 [0,1,0,0,0,0|1,0,0]=2 272 B8R1.4 CC1=NC=CC(N)=C1 024684 [0,1,0,0,0,0|0,0,0]=1 273 B8R1.4 CC1=NC=CC(O)=C1 076527 [0,1,0,0,0,0|1,0,0]=2 274 B8R1.4 C[N+]1=CC(Br)=CC=C1 182518 [0,1,0,0,0,0|3,0,0]=4 275 B8R1.4 C[N+]1=CC(Cl)=CC=C1 181184 [0,1,0,0,0,0|3,0,0]=4 276 B8R1.4 C[N+]1=CC(I)=CC=C1 182790 [0,1,0,0,0,0|3,0,0]=4 277 B8R1.4 ClC1=CC(Br)=CC=C1 001104 [0,1,0,0,0,0|2,0,0]=3 278 B8R1.4 ClC1=CC(Br)=NC=C1 012729 [0,1,0,0,0,0|1,0,0]=2 279 B8R1.4 ClC1=CC(Cl)=NC=N1 036390 [0,1,0,0,0,0|2,0,0]=3 280 B8R1.4 ClC1=CC(Cl)=NN=C1 077821 [0,1,0,0,0,0|2,0,0]=3 281 B8R1.4 ClC1=CC(I)=CC=C1 001150 [0,1,0,0,0,0|2,0,0]=3 282 B8R1.4 ClC1=CC=CC(Br)=N1 035849 [0,1,0,0,0,0|3,0,0]=4 283 B8R1.4 ClC1=CC=CC(Cl)=C1 241021 [0,1,0,0,0,0|2,0,0]=3 284 B8R1.4 ClC1=CC=CC(Cl)=N1 209011 [0,1,0,0,0,0|3,0,0]=4 285 B8R1.4 ClC1=CC=NC(Cl)=C1 011684 [0,1,0,0,0,0|1,0,0]=2 286 B8R1.4 ClC1=CC=NC(Cl)=N1 032516 [0,1,0,0,0,0|2,0,0]=3 287 B8R1.4 ClC1=CN=CC(Br)=C1 033253 [0,1,0,0,0,0|3,0,0]=4 288 B8R1.4 ClC1=CN=CC(Cl)=C1 049696 [0,1,0,0,0,0|3,0,0]=4 289 B8R1.4 ClC1=NC=CC(Br)=C1 045178 [0,1,0,0,0,0|1,0,0]=2 290 B8R1.4 ClC1=NC=CC(I)=C1 036250 [0,1,0,0,0,0|1,0,0]=2 291 B8R1.4 ClC1=NC=NC(Cl)=N1 040158 [0,1,0,0,0,0|3,0,0]=4 292 B8R1.4 FC1=CC(Br)=NC=C1 050212 [0,1,0,0,0,0|1,0,0]=2 293 B8R1.4 FC1=CC(Cl)=CN=C1 045059 [0,1,0,0,0,0|3,0,0]=4 294 B8R1.4 FC1=CC(F)=NC=C1 046509 [0,1,0,0,0,0|1,0,0]=2 295 B8R1.4 FC1=CC(I)=CC=C1 001183 [0,1,0,0,0,0|2,0,0]=3 296 B8R1.4 FC1=CC(I)=CC=N1 034748 [0,1,0,0,0,0|1,0,0]=2 297 B8R1.4 FC1=CC=CC(Br)=C1 001224 [0,1,0,0,0,0|2,0,0]=3 298 B8R1.4 FC1=CC=CC(Br)=N1 033114 [0,1,0,0,0,0|3,0,0]=4 299 B8R1.4 FC1=CC=CC(Cl)=C1 001146 [0,1,0,0,0,0|2,0,0]=3 300 B8R1.4 FC1=CC=CC(F)=C1 001232 [0,1,0,0,0,0|2,0,0]=3 301 B8R1.4 FC1=CC=CC(F)=N1 001607 [0,1,0,0,0,0|3,0,0]=4 302 B8R1.4 FC1=CC=CC(S)=C1 001299 [0,1,0,0,0,0|2,0,0]=3 303 B8R1.4 FC1=CC=NC(Cl)=C1 045233 [0,1,0,0,0,0|1,0,0]=2 304 B8R1.4 FC1=CC=NC(F)=N1 024448 [0,1,0,0,0,0|2,0,0]=3 305 B8R1.4 FC1=CN=CC(Br)=C1 037143 [0,1,0,0,0,0|3,0,0]=4 306 B8R1.4 FC1=CN=CC(I)=C1 038149 [0,1,0,0,0,0|3,0,0]=4 307 B8R1.4 FC1=NC(Cl)=CC=C1 033248 [0,1,0,0,0,0|3,0,0]=4 308 B8R1.4 FC1=NC=CC(Br)=C1 016230 [0,1,0,0,0,0|1,0,0]=2 309 B8R1.4 IC1=CC=CC(I)=C1 001752 [0,1,0,0,0,0|2,0,0]=3 310 B8R1.4 NC1=CC(=O)CCC1 011075 [0,1,0,0,0,0|1,0,2]=4 311 B8R1.4 NC1=CC(Br)=CC=C1 003072 [0,1,0,0,0,0|1,0,0]=2 312 B8R1.4 NC1=CC(Br)=CC=N1 046160 [0,1,0,0,0,0|1,0,0]=2 313 B8R1.4 NC1=CC(Br)=CN=C1 033123 [0,1,0,0,0,0|2,0,0]=3 314 B8R1.4 NC1=CC(Cl)=CC=C1 038261 [0,1,0,0,0,0|1,0,0]=2 315 B8R1.4 NC1=CC(Cl)=NC=C1 018016 [0,1,0,0,0,0|0,0,0]=1 316 B8R1.4 NC1=CC(Cl)=NC=N1 030770 [0,1,0,0,0,0|1,0,0]=2 317 B8R1.4 NC1=CC(Cl)=NN=C1 092451 [0,1,0,0,0,0|1,0,0]=2 318 B8R1.4 NC1=CC(F)=CC=C1 001438 [0,1,0,0,0,0|1,0,0]=2 319 B8R1.4 NC1=CC(F)=NC=C1 046490 [0,1,0,0,0,0|0,0,0]=1 320 B8R1.4 NC1=CC(N)=NC=N1 092375 [0,1,0,0,0,0|1,0,0]=2 321 B8R1.4 NC1=CC(O)=NC=N1 064927 [0,1,0,0,0,0|1,0,0]=2 322 B8R1.4 NC1=CC=CC(Cl)=N1 012728 [0,1,0,0,0,0|2,0,0]=3 323 B8R1.4 NC1=CC=CC(I)=C1 227695 [0,1,0,0,0,0|1,0,0]=2 324 B8R1.4 NC1=CC=CC(N)=C1 216678 [0,1,0,0,0,0|1,0,0]=2 325 B8R1.4 NC1=CC=CC(N)=N1 077786 [0,1,0,0,0,0|2,0,0]=3 326 B8R1.4 NC1=CC=CC(O)=C1 099283 [0,1,0,0,0,0|1,0,0]=2 327 B8R1.4 NC1=CC=NC(=O)N1 036359 [0,1,0,0,0,0|1,0,0]=2 328 B8R1.4 NC1=CC=NC(Br)=C1 043852 [0,1,0,0,0,0|0,0,0]=1 329 B8R1.4 NC1=CN=CC(F)=C1 045309 [0,1,0,0,0,0|2,0,0]=3 330 B8R1.4 NC1=CN=CC(N)=N1 079286 [0,1,0,0,0,0|3,0,0]=4 331 B8R1.4 NC1=NC(=O)NN=C1 372700 [0,1,0,0,0,0|2,0,1]=4 332 B8R1.4 NC1=NC(Br)=CC=C1 033158 [0,1,0,0,0,0|2,0,0]=3 333 B8R1.4 NC1=NC(Cl)=CN=C1 002753 [0,1,0,0,0,0|3,0,0]=4 334 B8R1.4 NC1=NC(Cl)=NC=C1 049289 [0,1,0,0,0,0|1,0,0]=2 335 B8R1.4 NC1=NC(F)=CC=C1 024171 [0,1,0,0,0,0|2,0,0]=3 336 B8R1.4 NC1=NC(N)=NC=C1 079382 [0,1,0,0,0,0|1,0,0]=2 337 B8R1.4 NC1=NC=CC(Cl)=C1 043622 [0,1,0,0,0,0|1,0,0]=2 338 B8R1.4 NC1=NC=CC(Cl)=N1 036341 [0,1,0,0,0,0|2,0,0]=3 339 B8R1.4 NC1=NC=CC(F)=C1 064880 [0,1,0,0,0,0|1,0,0]=2 340 B8R1.4 NC1=NC=CC(O)=C1 048149 [0,1,0,0,0,0|1,0,0]=2 341 B8R1.4 NC1=NC=CC(O)=C1 223673 [0,1,0,0,0,0|1,0,0]=2 342 B8R1.4 NC1=NC=CC(O)=N1 043460 [0,1,0,0,0,0|2,0,0]=3 343 B8R1.4 NC1=NC=NC(=O)N1 036331 [0,1,0,0,0,0|2,0,0]=3 344 B8R1.4 NC1=NC=NC(Br)=C1 076394 [0,1,0,0,0,0|1,0,0]=2 345 B8R1.4 NC1=NC=NC(N)=N1 041933 [0,1,0,0,0,0|2,0,0]=3 346 B8R1.4 O=C1C=C(Br)C=CN1 338416 [0,1,0,0,0,0|1,0,1]=3 347 B8R1.4 O=C1C=C(Cl)C=NN1 078020 [0,1,0,0,0,0|2,0,1]=4 348 B8R1.4 O=C1C=CNC(=O)N1 176400 [0,1,0,0,0,0|2,0,1]=4 349 B8R1.4 O=C1C=CNC(=S)N1 078506 [0,1,0,0,0,0|2,0,1]=4 350 B8R1.4 OC1=CC(Br)=CC=C1 003059 [0,1,0,0,0,0|2,0,0]=3 351 B8R1.4 OC1=CC(Cl)=CC=C1 121000 [0,1,0,0,0,0|2,0,0]=3 352 B8R1.4 OC1=CC(Cl)=CC=N1 011626 [0,1,0,0,0,0|1,0,0]=2 353 B8R1.4 OC1=CC(F)=CC=C1 002173 [0,1,0,0,0,0|2,0,0]=3 354 B8R1.4 OC1=CC(I)=CC=C1 001308 [0,1,0,0,0,0|2,0,0]=3 355 B8R1.4 OC1=CC(O)=NC=N1 002991 [0,1,0,0,0,0|2,0,0]=3 356 B8R1.4 OC1=CC=CC(O)=C1 168800 [0,1,0,0,0,0|2,0,0]=3 357 B8R1.4 OC1=CC=NC(Cl)=C1 045190 [0,1,0,0,0,0|1,0,0]=2 358 B8R1.4 OC1=CN=CC(Br)=C1 033254 [0,1,0,0,0,0|3,0,0]=4 359 B8R1.4 OC1=CN=CC(F)=C1 079345 [0,1,0,0,0,0|3,0,0]=4 360 B8R1.4 OC1=NC(Cl)=CC=C1 037405 [0,1,0,0,0,0|3,0,0]=4 361 B8R1.4 OC1=NC(F)=CC=C1 038546 [0,1,0,0,0,0|3,0,0]=4 362 B8R1.4 SC1=CC(Br)=CC=C1 001578 [0,1,0,0,0,0|2,0,0]=3 363 B8R1.4 SC1=CC(Cl)=CC=C1 001581 [0,1,0,0,0,0|2,0,0]=3 364 B8R1.4 [NH3+]C1=CC(Cl)=CC=C1 180293 [0,1,0,0,0,0|1,0,1]=3 365 B8R1.4 [O-][N+]1=CC=CC(O)=C1 243131 [0,1,0,0,0,0|3,0,0]=4 366 B8R1.5 BrC1=C(Br)C=CC=C1 001158 [0,1,0,0,0,0|2,0,0]=3 367 B8R1.5 BrC1=C(Br)N=CC=C1 049464 [0,1,0,0,0,0|3,0,0]=4 368 B8R1.5 BrC1=C(I)C=CC=C1 001124 [0,1,0,0,0,0|2,0,0]=3 369 B8R1.5 BrC1=CC=NC=C1Br 049695 [0,1,0,0,0,0|1,0,0]=2 370 B8R1.5 BrC1=NC=CC=C1I 043242 [0,1,0,0,0,0|3,0,0]=4 371 B8R1.5 CC1=C(Br)C=CC=C1 001397 [0,1,0,0,0,0|2,0,0]=3 372 B8R1.5 CC1=C(Br)C=NC=C1 076567 [0,1,0,0,0,0|1,0,0]=2 373 B8R1.5 CC1=C(C)C=CC=C1 094836 [0,1,0,0,0,0|2,0,0]=3 374 B8R1.5 CC1=C(C)C=CC=C1 098283 [0,1,0,0,0,0|2,0,0]=3 375 B8R1.5 CC1=C(C)C=NC=C1 358457 [0,1,0,0,0,0|1,0,0]=2 376 B8R1.5 CC1=C(Cl)C=CN=C1 010406 [0,1,0,0,0,0|1,0,0]=2 377 B8R1.5 CC1=C(Cl)N=CC=C1 048691 [0,1,0,0,0,0|3,0,0]=4 378 B8R1.5 CC1=C(F)C=CC=C1 001423 [0,1,0,0,0,0|2,0,0]=3 379 B8R1.5 CC1=C(F)C=NC=C1 036307 [0,1,0,0,0,0|1,0,0]=2 380 B8R1.5 CC1=C(I)C=CC=C1 001199 [0,1,0,0,0,0|2,0,0]=3 381 B8R1.5 CC1=C(N)C=CC=C1 043316 [0,1,0,0,0,0|1,0,0]=2 382 B8R1.5 CC1=C(S)C=CC=C1 172400 [0,1,0,0,0,0|2,0,0]=3 383 B8R1.5 CC1=C([NH3+])C=CC=C1 180149 [0,1,0,0,0,0|1,0,1]=3 384 B8R1.5 CC1=CC=CC=C1Cl 235783 [0,1,0,0,0,0|2,0,0]=3 385 B8R1.5 CC1=CC=CC=C1O 239923 [0,1,0,0,0,0|2,0,0]=3 386 B8R1.5 CC1=CC=CC=[N+]1C 181294 [0,1,0,0,0,0|3,0,0]=4 387 B8R1.5 CC1=CC=CN=C1Br 036374 [0,1,0,0,0,0|3,0,0]=4 388 B8R1.5 CC1=CC=CN=C1C 477008 [0,1,0,0,0,0|3,0,0]=4 389 B8R1.5 CC1=CC=CN=C1F 001764 [0,1,0,0,0,0|3,0,0]=4 390 B8R1.5 CC1=CC=CN=C1N 032515 [0,1,0,0,0,0|2,0,0]=3 391 B8R1.5 CC1=CC=CNC1=O 077668 [0,1,0,0,0,0|3,0,0]=4 392 B8R1.5 CC1=CN=CC=C1N 045002 [0,1,0,0,0,0|0,0,0]=1 393 B8R1.5 CC1=NC=CC=C1Br 036242 [0,1,0,0,0,0|3,0,0]=4 394 B8R1.5 CC1=NC=CC=C1Cl 047642 [0,1,0,0,0,0|3,0,0]=4 395 B8R1.5 CC1=NC=CC=C1F 092332 [0,1,0,0,0,0|3,0,0]=4 396 B8R1.5 CC1=NC=CC=C1N 036315 [0,1,0,0,0,0|2,0,0]=3 397 B8R1.5 CC1=NC=CC=C1O 044756 [0,1,0,0,0,0|3,0,0]=4 398 B8R1.5 CC1=[N+]([O-])C=CC=C1 037831 [0,1,0,0,0,0|3,0,0]=4 399 B8R1.5 CN1C=CC=CC1=O 233629 [0,1,0,0,0,0|3,0,0]=4 400 B8R1.5 C[N+]1=C(Br)C=CC=C1 182517 [0,1,0,0,0,0|3,0,0]=4 401 B8R1.5 C[N+]1=C(Cl)C=CC=C1 067321 [0,1,0,0,0,0|3,0,0]=4 402 B8R1.5 C[N+]1=CC=CN=C1N 181331 [0,1,0,0,0,0|3,0,0]=4 403 B8R1.5 ClC1=C(Br)C=CC=C1 001103 [0,1,0,0,0,0|2,0,0]=3 404 B8R1.5 ClC1=C(Br)C=CC=N1 045198 [0,1,0,0,0,0|3,0,0]=4 405 B8R1.5 ClC1=C(Cl)C=NC=C1 033115 [0,1,0,0,0,0|1,0,0]=2 406 B8R1.5 ClC1=C(I)C=CC=C1 001149 [0,1,0,0,0,0|2,0,0]=3 407 B8R1.5 ClC1=C(I)C=CC=N1 035857 [0,1,0,0,0,0|3,0,0]=4 408 B8R1.5 ClC1=CC=CC=C1Cl 216310 [0,1,0,0,0,0|2,0,0]=3 409 B8R1.5 ClC1=CC=CN=C1Br 067340 [0,1,0,0,0,0|3,0,0]=4 410 B8R1.5 ClC1=CC=CN=C1Cl 037323 [0,1,0,0,0,0|3,0,0]=4 411 B8R1.5 ClC1=NC=NC=C1Br 079813 [0,1,0,0,0,0|2,0,0]=3 412 B8R1.5 FC1=C(Br)C=CC=C1 001121 [0,1,0,0,0,0|2,0,0]=3 413 B8R1.5 FC1=C(Br)C=CN=C1 079196 [0,1,0,0,0,0|1,0,0]=2 414 B8R1.5 FC1=C(Cl)C=CC=C1 001145 [0,1,0,0,0,0|2,0,0]=3 415 B8R1.5 FC1=C(F)C=CC=C1 001169 [0,1,0,0,0,0|2,0,0]=3 416 B8R1.5 FC1=C(F)N=CC=C1 033562 [0,1,0,0,0,0|3,0,0]=4 417 B8R1.5 FC1=C(I)C=CC=C1 001182 [0,1,0,0,0,0|2,0,0]=3 418 B8R1.5 FC1=C(S)C=CC=C1 003237 [0,1,0,0,0,0|2,0,0]=3 419 B8R1.5 FC1=CC=CN=C1Br 033268 [0,1,0,0,0,0|3,0,0]=4 420 B8R1.5 FC1=CC=CN=C1Cl 013882 [0,1,0,0,0,0|3,0,0]=4 421 B8R1.5 FC1=CN=CC=C1Cl 045234 [0,1,0,0,0,0|1,0,0]=2 422 B8R1.5 FC1=NC=CC=C1Br 016228 [0,1,0,0,0,0|3,0,0]=4 423 B8R1.5 FC1=NC=CC=C1Cl 034858 [0,1,0,0,0,0|3,0,0]=4 424 B8R1.5 FC1=NC=CC=C1I 036278 [0,1,0,0,0,0|3,0,0]=4 425 B8R1.5 IC1=C(I)C=CC=C1 001039 [0,1,0,0,0,0|2,0,0]=3 426 B8R1.5 NC1=C(Br)C=CC=C1 005347 [0,1,0,0,0,0|1,0,0]=2 427 B8R1.5 NC1=C(Cl)C=CC=C1 097866 [0,1,0,0,0,0|1,0,0]=2 428 B8R1.5 NC1=C(Cl)C=NC=C1 012738 [0,1,0,0,0,0|0,0,0]=1 429 B8R1.5 NC1=C(Cl)N=CC=N1 035839 [0,1,0,0,0,0|3,0,0]=4 430 B8R1.5 NC1=C(F)C=CC=C1 001430 [0,1,0,0,0,0|1,0,0]=2 431 B8R1.5 NC1=C(I)C=CC=C1 001038 [0,1,0,0,0,0|1,0,0]=2 432 B8R1.5 NC1=C(I)C=CC=N1 043682 [0,1,0,0,0,0|2,0,0]=3 433 B8R1.5 NC1=C(N)C=CC=C1 094521 [0,1,0,0,0,0|1,0,0]=2 434 B8R1.5 NC1=C(N)C=NC=C1 043674 [0,1,0,0,0,0|0,0,0]=1 435 B8R1.5 NC1=C(O)C=CC=C1 094977 [0,1,0,0,0,0|1,0,0]=2 436 B8R1.5 NC1=C(O)C=CN=C1 012737 [0,1,0,0,0,0|1,0,0]=2 437 B8R1.5 NC1=C(S)C=CC=C1 002470 [0,1,0,0,0,0|1,0,0]=2 438 B8R1.5 NC1=CC=CN=C1Br 064879 [0,1,0,0,0,0|2,0,0]=3 439 B8R1.5 NC1=CC=CN=C1Cl 045182 [0,1,0,0,0,0|2,0,0]=3 440 B8R1.5 NC1=CC=CN=C1F 033249 [0,1,0,0,0,0|2,0,0]=3 441 B8R1.5 NC1=CC=CN=C1N 013506 [0,1,0,0,0,0|2,0,0]=3 442 B8R1.5 NC1=CC=CN=C1O 047643 [0,1,0,0,0,0|2,0,0]=3 443 B8R1.5 NC1=CC=NC=C1Br 064869 [0,1,0,0,0,0|0,0,0]=1 444 B8R1.5 NC1=CC=NC=C1F 045062 [0,1,0,0,0,0|0,0,0]=1 445 B8R1.5 NC1=CC=NC=C1I 046498 [0,1,0,0,0,0|0,0,0]=1 446 B8R1.5 NC1=CN=CN=C1Cl 077408 [0,1,0,0,0,0|2,0,0]=3 447 B8R1.5 NC1=CN=CN=C1N 049440 [0,1,0,0,0,0|1,0,0]=2 448 B8R1.5 NC1=NC=CC=C1Br 049777 [0,1,0,0,0,0|2,0,0]=3 449 B8R1.5 NC1=NC=CC=C1F 045834 [0,1,0,0,0,0|2,0,0]=3 450 B8R1.5 NC1=NC=CC=C1O 045183 [0,1,0,0,0,0|2,0,0]=3 451 B8R1.5 NC1=NC=CN=C1N 080010 [0,1,0,0,0,0|3,0,0]=4 452 B8R1.5 NC1=NC=CN=C1O 079883 [0,1,0,0,0,0|3,0,0]=4 453 B8R1.5 OC1=C(Br)C=CC=C1 008838 [0,1,0,0,0,0|2,0,0]=3 454 B8R1.5 OC1=C(F)C=CC=C1 001290 [0,1,0,0,0,0|2,0,0]=3 455 B8R1.5 OC1=C(I)C=CC=C1 033689 [0,1,0,0,0,0|2,0,0]=3 456 B8R1.5 OC1=C(S)C=CC=C1 008733 [0,1,0,0,0,0|2,0,0]=3 457 B8R1.5 OC1=CC=CC=C1Cl 242866 [0,1,0,0,0,0|2,0,0]=3 458 B8R1.5 OC1=CC=CC=C1O 005090 [0,1,0,0,0,0|2,0,0]=3 459 B8R1.5 OC1=CC=CN=C1Br 045186 [0,1,0,0,0,0|3,0,0]=4 460 B8R1.5 OC1=CC=CN=C1Cl 045045 [0,1,0,0,0,0|3,0,0]=4 461 B8R1.5 OC1=CC=CN=C1F 043791 [0,1,0,0,0,0|3,0,0]=4 462 B8R1.5 OC1=CC=CN=C1O 045191 [0,1,0,0,0,0|3,0,0]=4 463 B8R1.5 OC1=CC=CNC1=S 180068 [0,1,0,0,0,0|3,0,0]=4 464 B8R1.5 SC1=C(Br)C=CC=C1 001577 [0,1,0,0,0,0|2,0,0]=3 465 B8R1.5 SC1=C(Cl)C=CC=C1 001580 [0,1,0,0,0,0|2,0,0]=3 466 B8R1.5 [O-][N+]1=CC=CC=C1O 078762 [0,1,0,0,0,0|3,0,0]=4 467 B6R0.6 C\C=C\C=C\C=O 242913 [0,0,1,0,0,0|2,0,1]=4 468 B8R2.34 C1=CC2C=CC1C2 304282 [0,0,0,1,0,0|2,0,1]=4 469 B6R1.2 BrC1=CC=CO1 067357 [0,0,0,0,1,0|2,0,0]=3 470 B6R1.2 BrC1=CC=CS1 001055 [0,0,0,0,1,0|2,0,0]=3 471 B6R1.2 BrC1=CNC=N1 047684 [0,0,0,0,1,0|2,0,1]=4 472 B6R1.2 BrC1=CNN=C1 036347 [0,0,0,0,1,0|2,0,0]=3 473 B6R1.2 BrC1=COC=C1 013445 [0,0,0,0,1,0|2,0,0]=3 474 B6R1.2 BrC1=CSC=C1 003082 [0,0,0,0,1,0|2,0,0]=3 475 B6R1.2 BrC1=CSC=N1 016178 [0,0,0,0,1,0|3,0,0]=4 476 B6R1.2 BrC1=NC=CS1 021802 [0,0,0,0,1,0|3,0,0]=4 477 B6R1.2 BrC1=NN=CS1 046500 [0,0,0,0,1,0|3,0,0]=4 478 B6R1.2 BrC1=NNC=C1 079925 [0,0,0,0,1,0|2,0,1]=4 479 B6R1.2 CC1=CC=CN1 214609 [0,0,0,0,1,0|2,0,0]=3 480 B6R1.2 CC1=CC=CO1 463359 [0,0,0,0,1,0|2,0,0]=3 481 B6R1.2 CC1=CC=CS1 001209 [0,0,0,0,1,0|2,0,0]=3 482 B6R1.2 CC1=CNC=N1 078608 [0,0,0,0,1,0|2,0,1]=4 483 B6R1.2 CC1=CNN=C1 043307 [0,0,0,0,1,0|2,0,0]=3 484 B6R1.2 CC1=COC=N1 224056 [0,0,0,0,1,0|3,0,0]=4 485 B6R1.2 CC1=CSC=C1 003448 [0,0,0,0,1,0|2,0,0]=3 486 B6R1.2 CC1=CSC=N1 002765 [0,0,0,0,1,0|3,0,0]=4 487 B6R1.2 CC1=NC=CN1 157400 [0,0,0,0,1,0|3,0,0]=4 488 B6R1.2 CC1=NNC=C1 033183 [0,0,0,0,1,0|2,0,1]=4 489 B6R1.2 CN1C=CC=C1 044896 [0,0,0,0,1,0|2,0,0]=3 490 B6R1.2 CN1C=CC=N1 046854 [0,0,0,0,1,0|3,0,0]=4 491 B6R1.2 CN1C=CN=C1 005002 [0,0,0,0,1,0|2,0,0]=3 492 B6R1.2 CN1C=CN=C1 245803 [0,0,0,0,1,0|2,0,0]=3 493 B6R1.2 CN1C=NC=N1 043664 [0,0,0,0,1,0|3,0,0]=4 494 B6R1.2 ClC1=CC=CS1 002954 [0,0,0,0,1,0|2,0,0]=3 495 B6R1.2 ClC1=CNN=C1 026202 [0,0,0,0,1,0|2,0,0]=3 496 B6R1.2 ClC1=CSC=C1 001747 [0,0,0,0,1,0|2,0,0]=3 497 B6R1.2 IC1=CC=CS1 001058 [0,0,0,0,1,0|2,0,0]=3 498 B6R1.2 IC1=CNC=N1 067394 [0,0,0,0,1,0|2,0,1]=4 499 B6R1.2 IC1=CNN=C1 005458 [0,0,0,0,1,0|2,0,0]=3 500 B6R1.2 IC1=CSC=C1 079489 [0,0,0,0,1,0|2,0,0]=3 501 B6R1.2 IC1=NNC=C1 046994 [0,0,0,0,1,0|2,0,1]=4 502 B6R1.2 NC1=CNN=C1 043675 [0,0,0,0,1,0|1,0,0]=2 503 B6R1.2 NC1=CSC=C1 049735 [0,0,0,0,1,0|1,0,0]=2 504 B6R1.2 NC1=NC=CN1 013113 [0,0,0,0,1,0|2,0,0]=3 505 B6R1.2 NC1=NC=CN1 076511 [0,0,0,0,1,0|2,0,0]=3 506 B6R1.2 NC1=NC=CO1 043635 [0,0,0,0,1,0|2,0,0]=3 507 B6R1.2 NC1=NC=CS1 078568 [0,0,0,0,1,0|2,0,0]=3 508 B6R1.2 NC1=NC=NS1 013903 [0,0,0,0,1,0|2,0,0]=3 509 B6R1.2 NC1=NN=CS1 064997 [0,0,0,0,1,0|2,0,0]=3 510 B6R1.2 NC1=NN=NN1 494182 [0,0,0,0,1,0|3,0,0]=4 511 B6R1.2 NC1=NNC=C1 035587 [0,0,0,0,1,0|1,0,1]=3 512 B6R1.2 NC1=NNC=N1 080352 [0,0,0,0,1,0|2,0,1]=4 513 B6R1.2 NC1=NNN=N1 098774 [0,0,0,0,1,0|3,0,0]=4 514 B6R1.2 NC1=NOC=C1 064896 [0,0,0,0,1,0|2,0,0]=3 515 B6R1.2 NC1CC=CC1 011352 [0,0,0,0,1,0|0,0,3]=4 516 B6R1.2 NN1C=CC=C1 105200 [0,0,0,0,1,0|1,0,0]=2 517 B6R1.2 NN1C=NN=C1 013753 [0,0,0,0,1,0|2,0,0]=3 518 B6R1.2 O=C1C=CCC1 049816 [0,0,0,0,1,0|1,0,2]=4 519 B6R1.2 O=C1C=CCO1 095003 [0,0,0,0,1,0|2,0,1]=4 520 B6R1.2 S=C1NC=CS1 180040 [0,0,0,0,1,0|3,0,0]=4 521 B6R1.2 SC1=CC=CS1 018767 [0,0,0,0,1,0|2,0,0]=3 522 B5R0.2 C=CCCC=C 106336 [1,0,1,0,0,0|1,0,1]=4 523 B5R0.2 C\C=C\C=C\C 046824 [1,0,1,0,0,0|1,0,1]=4 524 B7R1.1 C(=O)C1=CC=CS1 003419 [0,1,0,0,1,0|2,0,0]=4 525 B7R1.1 C=CN1C=CN=C1 098891 [0,1,0,0,1,0|2,0,0]=4 526 B7R1.1 CCC1=CC=CN1 002567 [0,1,0,0,1,0|2,0,0]=4 527 B7R1.1 CCC1=CC=CS1 001177 [0,1,0,0,1,0|2,0,0]=4 528 B7R1.1 CCC1=CSC=C1 006141 [0,1,0,0,1,0|2,0,0]=4 529 B7R1.1 CCN1C=CC=C1 002566 [0,1,0,0,1,0|2,0,0]=4 530 B7R1.1 CCN1C=CN=C1 078976 [0,1,0,0,1,0|2,0,0]=4 531 B7R1.1 COC1=CSC=C1 013627 [0,1,0,0,1,0|2,0,0]=4 532 B7R1.1 N#CC1=CC=CN1 024315 [0,1,0,0,1,0|1,0,1]=4 533 B7R1.1 N#CC1=CC=CS1 008056 [0,1,0,0,1,0|1,0,1]=4 534 B7R1.1 N#CC1=CSC=C1 049749 [0,1,0,0,1,0|1,0,1]=4 535 B7R1.1 NCC1=CC=CO1 358202 [0,1,0,0,1,0|1,0,0]=3 536 B7R1.1 NCC1=CC=CS1 092186 [0,1,0,0,1,0|1,0,0]=3 537 B7R1.1 NCC1=CN=CO1 076442 [0,1,0,0,1,0|1,0,0]=3 538 B7R1.1 NCC1=COC=N1 219245 [0,1,0,0,1,0|2,0,0]=4 539 B7R1.1 NCC1=NC=CS1 013114 [0,1,0,0,1,0|2,0,0]=4 540 B7R1.1 NCC1=NNC=C1 043021 [0,1,0,0,1,0|1,0,1]=4 541 B7R1.1 O=CC1=CC=CN1 043867 [0,1,0,0,1,0|2,0,0]=4 542 B7R1.1 O=CC1=CC=CO1 053252 [0,1,0,0,1,0|2,0,0]=4 543 B7R1.1 O=CC1=CC=CO1 104085 [0,1,0,0,1,0|2,0,0]=4 544 B7R1.1 O=CC1=CC=NN1 046433 [0,1,0,0,1,0|2,0,0]=4 545 B7R1.1 O=CC1=CN=CS1 016172 [0,1,0,0,1,0|2,0,0]=4 546 B7R1.1 O=CC1=CNN=C1 076572 [0,1,0,0,1,0|2,0,0]=4 547 B7R1.1 O=CC1=CSC=C1 045073 [0,1,0,0,1,0|2,0,0]=4 548 B7R1.1 OCC1=CC=CO1 143000 [0,1,0,0,1,0|2,0,0]=4 549 B7R1.1 OCC1=CC=CS1 208652 [0,1,0,0,1,0|2,0,0]=4 550 B7R1.1 OCC1=CN=CS1 016175 [0,1,0,0,1,0|2,0,0]=4 551 B7R1.1 OCC1=COC=C1 092657 [0,1,0,0,1,0|2,0,0]=4 552 B7R1.1 OCC1=CSC=C1 067714 [0,1,0,0,1,0|2,0,0]=4 553 B7R1.1 SCC1=CC=CO1 002796 [0,1,0,0,1,0|2,0,0]=4 554 B7R1.1 SCC1=CC=CS1 104865 [0,1,0,0,1,0|2,0,0]=4 555 B7R1.2 BrC1=CC=C(Br)S1 001056 [0,1,0,0,1,0|2,0,0]=4 556 B7R1.2 BrC1=CN=C(Br)S1 046206 [0,1,0,0,1,0|2,0,0]=4 557 B7R1.2 CC1=CC(Br)=CS1 022016 [0,1,0,0,1,0|2,0,0]=4 558 B7R1.2 CC1=CC(Br)=NN1 079115 [0,1,0,0,1,0|2,0,0]=4 559 B7R1.2 CC1=CC(C)=NN1 037857 [0,1,0,0,1,0|2,0,0]=4 560 B7R1.2 CC1=CC(C)=NO1 023218 [0,1,0,0,1,0|2,0,0]=4 561 B7R1.2 CC1=CC(N)=NN1 005985 [0,1,0,0,1,0|1,0,1]=4 562 B7R1.2 CC1=CC(N)=NO1 227902 [0,1,0,0,1,0|2,0,0]=4 563 B7R1.2 CC1=CC=C(Br)S1 024230 [0,1,0,0,1,0|2,0,0]=4 564 B7R1.2 CC1=CC=C(C)N1 236653 [0,1,0,0,1,0|2,0,0]=4 565 B7R1.2 CC1=CC=C(C)S1 002791 [0,1,0,0,1,0|2,0,0]=4 566 B7R1.2 CC1=CC=C(I)S1 002582 [0,1,0,0,1,0|2,0,0]=4 567 B7R1.2 CC1=CN=C(Br)S1 067363 [0,1,0,0,1,0|2,0,0]=4 568 B7R1.2 CC1=CN=C(N)S1 011366 [0,1,0,0,1,0|2,0,0]=4 569 B7R1.2 CC1=COC(N)=N1 016110 [0,1,0,0,1,0|2,0,0]=4 570 B7R1.2 CC1=CSC(N)=N1 023295 [0,1,0,0,1,0|2,0,0]=4 571 B7R1.2 CC1=NC=C(I)N1 077607 [0,1,0,0,1,0|2,0,0]=4 572 B7R1.2 CC1=NN=C(N)N1 009886 [0,1,0,0,1,0|2,0,0]=4 573 B7R1.2 CC1=NN=C(N)O1 009900 [0,1,0,0,1,0|2,0,0]=4 574 B7R1.2 CC1=NN=C(N)S1 013407 [0,1,0,0,1,0|2,0,0]=4 575 B7R1.2 CC1=NSC(N)=C1 021671 [0,1,0,0,1,0|1,0,0]=3 576 B7R1.2 CC1=NSC(N)=N1 009666 [0,1,0,0,1,0|2,0,0]=4 577 B7R1.2 CN1C=C(Br)C=N1 033223 [0,1,0,0,1,0|2,0,0]=4 578 B7R1.2 CN1C=C(I)C=N1 067375 [0,1,0,0,1,0|2,0,0]=4 579 B7R1.2 CN1C=C(N)C=N1 030187 [0,1,0,0,1,0|1,0,0]=3 580 B7R1.2 CN1C=CC(N)=N1 025069 [0,1,0,0,1,0|1,0,1]=4 581 B7R1.2 ClC1=CC=C(Cl)S1 002955 [0,1,0,0,1,0|2,0,0]=4 582 B7R1.2 ClC1=CN=C(Br)S1 077385 [0,1,0,0,1,0|2,0,0]=4 583 B7R1.2 NC1=CC(Br)=NN1 079692 [0,1,0,0,1,0|1,0,0]=3 584 B7R1.2 NC1=CSC(N)=N1 223229 [0,1,0,0,1,0|2,0,0]=4 585 B7R1.2 NC1=NC(Br)=CS1 076229 [0,1,0,0,1,0|2,0,0]=4 586 B7R1.2 NC1=NC(O)=CS1 319245 [0,1,0,0,1,0|2,0,0]=4 587 B7R1.2 NC1=NC=C(Br)S1 013397 [0,1,0,0,1,0|2,0,0]=4 588 B7R1.2 NC1=NN=C(S)S1 094214 [0,1,0,0,1,0|2,0,0]=4 589 B7R1.2 NC1=NNC(N)=N1 223200 [0,1,0,0,1,0|2,0,0]=4 590 B7R1.2 NC1=NNC(O)=C1 064901 [0,1,0,0,1,0|1,0,1]=4 591 B7R1.2 O=C1C=CC(=O)N1 011793 [0,1,0,0,1,0|2,0,0]=4 592 B7R1.2 O=C1C=CC(=O)O1 101524 [0,1,0,0,1,0|2,0,0]=4 593 B7R1.2 O=C1C=CC(=O)O1 241019 [0,1,0,0,1,0|2,0,0]=4 594 B7R1.4 BrC1=C(Br)SC=C1 024261 [0,1,0,0,1,0|2,0,0]=4 595 B7R1.4 BrC1=CNN=C1Br 104589 [0,1,0,0,1,0|2,0,0]=4 596 B7R1.4 BrC1=CSC=C1Br 001057 [0,1,0,0,1,0|2,0,0]=4 597 B7R1.4 CC1=C(Br)NC=N1 209278 [0,1,0,0,1,0|2,0,0]=4 598 B7R1.4 CC1=C(Br)SC=C1 013451 [0,1,0,0,1,0|2,0,0]=4 599 B7R1.4 CC1=C(C)SC=N1 002761 [0,1,0,0,1,0|2,0,0]=4 600 B7R1.4 CC1=C(Cl)SC=C1 024249 [0,1,0,0,1,0|2,0,0]=4 601 B7R1.4 CC1=CC=NN1C 026155 [0,1,0,0,1,0|2,0,0]=4 602 B7R1.4 CC1=CNN=C1O 312908 [0,1,0,0,1,0|2,0,0]=4 603 B7R1.4 CC1=CSC=C1Br 024231 [0,1,0,0,1,0|2,0,0]=4 604 B7R1.4 CC1=NC=CN1C 093937 [0,1,0,0,1,0|2,0,0]=4 605 B7R1.4 CC1=NNC=C1Br 064560 [0,1,0,0,1,0|2,0,0]=4 606 B7R1.4 CC1=NNC=C1I 093372 [0,1,0,0,1,0|2,0,0]=4 607 B7R1.4 CN1C=CN=C1I 216361 [0,1,0,0,1,0|2,0,0]=4 608 B7R1.4 CN1N=CC=C1N 030129 [0,1,0,0,1,0|1,0,0]=3 609 B7R1.4 ClC1=C(Cl)NC=N1 208842 [0,1,0,0,1,0|2,0,0]=4 610 B7R1.4 ClC1=C(Cl)SC=C1 024868 [0,1,0,0,1,0|2,0,0]=4 611 B7R1.4 IC1=C(I)NC=N1 067398 [0,1,0,0,1,0|2,0,0]=4 612 B7R1.4 NC1=CSC=C1N 225299 [0,1,0,0,1,0|1,0,0]=3 613 B7R1.4 NC1=NNC=C1Br 005504 [0,1,0,0,1,0|1,0,1]=4 614 B7R1.4 NC1=NNC=C1I 046978 [0,1,0,0,1,0|1,0,1]=4 615 B7R1.4 NC1=NON=C1N 013501 [0,1,0,0,1,0|2,0,0]=4 616 B7R1.4 NN1C=NN=C1S 009880 [0,1,0,0,1,0|2,0,0]=4 617 B9R1.1 BrCC1=CC=C(Br)C=C1 001368 [0,2,0,0,0,0|2,0,0]=4 618 B9R1.1 BrCC1=CC=C(I)C=C1 018740 [0,2,0,0,0,0|2,0,0]=4 619 B9R1.1 C#CC1=CC=C(Br)C=C1 040352 [0,2,0,0,0,0|2,0,0]=4 620 B9R1.1 C#CC1=CC=C(C)C=C1 040031 [0,2,0,0,0,0|2,0,0]=4 621 B9R1.1 C#CC1=CC=C(Cl)C=C1 040093 [0,2,0,0,0,0|2,0,0]=4 622 B9R1.1 C#CC1=CC=C(F)C=C1 008808 [0,2,0,0,0,0|2,0,0]=4 623 B9R1.1 C#CC1=CC=C(N)C=C1 045242 [0,2,0,0,0,0|1,0,0]=3 624 B9R1.1 C(=O)C1=CC=C(Br)C=C1 005082 [0,2,0,0,0,0|2,0,0]=4 625 B9R1.1 C(=O)C1=CC=C(F)C=C1 001460 [0,2,0,0,0,0|2,0,0]=4 626 B9R1.1 C=CC1=CC=C(Br)C=C1 001138 [0,2,0,0,0,0|2,0,0]=4 627 B9R1.1 C=CC1=CC=C(C)C=C1 236761 [0,2,0,0,0,0|2,0,0]=4 628 B9R1.1 C=CC1=CC=C(Cl)C=C1 001267 [0,2,0,0,0,0|2,0,0]=4 629 B9R1.1 C=CC1=CC=C(F)C=C1 001296 [0,2,0,0,0,0|2,0,0]=4 630 B9R1.1 C=CC1=CC=C(N)C=C1 001223 [0,2,0,0,0,0|1,0,0]=3 631 B9R1.1 C=CC1=CC=C(O)C=C1 240601 [0,2,0,0,0,0|2,0,0]=4 632 B9R1.1 CC1=CC=C(C#N)C=C1 035883 [0,2,0,0,0,0|1,0,1]=4 633 B9R1.1 CC1=CC=C(C=O)C=C1 236923 [0,2,0,0,0,0|2,0,0]=4 634 B9R1.1 CC1=CC=C(CBr)C=C1 227793 [0,2,0,0,0,0|2,0,0]=4 635 B9R1.1 CC1=CC=C(CCl)C=C1 088360 [0,2,0,0,0,0|2,0,0]=4 636 B9R1.1 CC1=CC=C(CN)C=C1 078842 [0,2,0,0,0,0|1,0,0]=3 637 B9R1.1 CC1=CC=C(CO)C=C1 216000 [0,2,0,0,0,0|2,0,0]=4 638 B9R1.1 CC1=CC=C(NN)C=C1 043499 [0,2,0,0,0,0|1,0,0]=3 639 B9R1.1 CC1=CC=C(NN)C=C1 043656 [0,2,0,0,0,0|1,0,0]=3 640 B9R1.1 CCC1=CC=C(Br)C=C1 001119 [0,2,0,0,0,0|2,0,0]=4 641 B9R1.1 CCC1=CC=C(C)C=C1 235264 [0,2,0,0,0,0|2,0,0]=4 642 B9R1.1 CCC1=CC=C(Cl)C=C1 001266 [0,2,0,0,0,0|2,0,0]=4 643 B9R1.1 CCC1=CC=C(F)C=C1 018681 [0,2,0,0,0,0|2,0,0]=4 644 B9R1.1 CCC1=CC=C(I)C=C1 006113 [0,2,0,0,0,0|2,0,0]=4 645 B9R1.1 CCC1=CC=C(N)C=C1 099641 [0,2,0,0,0,0|1,0,0]=3 646 B9R1.1 CCC1=CC=C(O)C=C1 241020 [0,2,0,0,0,0|2,0,0]=4 647 B9R1.1 CCC1=CC=[N+]([O-])C=C1 180055 [0,2,0,0,0,0|1,0,1]=4 648 B9R1.1 CNC1=CC=C(Br)C=C1 009647 [0,2,0,0,0,0|1,0,0]=3 649 B9R1.1 CNC1=CC=C(C)C=C1 009655 [0,2,0,0,0,0|1,0,0]=3 650 B9R1.1 CNC1=CC=C(Cl)C=C1 009650 [0,2,0,0,0,0|1,0,0]=3 651 B9R1.1 CNC1=CC=C(F)C=C1 009651 [0,2,0,0,0,0|1,0,0]=3 652 B9R1.1 CNC1=CC=C(O)C=C1 102940 [0,2,0,0,0,0|1,0,0]=3 653 B9R1.1 CNC1=NC=C(Br)C=C1 078710 [0,2,0,0,0,0|2,0,0]=4 654 B9R1.1 CNC1=NC=C(Cl)C=C1 075169 [0,2,0,0,0,0|2,0,0]=4 655 B9R1.1 COC1=CC=C(Br)C=C1 BR1023 [0,2,0,0,0,0|2,0,0]=4 656 B9R1.1 COC1=CC=C(C)C=C1 239388 [0,2,0,0,0,0|2,0,0]=4 657 B9R1.1 COC1=CC=C(Cl)C=C1 080276 [0,2,0,0,0,0|2,0,0]=4 658 B9R1.1 COC1=CC=C(F)C=C1 001698 [0,2,0,0,0,0|2,0,0]=4 659 B9R1.1 COC1=CC=C(I)C=C1 001304 [0,2,0,0,0,0|2,0,0]=4 660 B9R1.1 COC1=CC=C(N)C=C1 043321 [0,2,0,0,0,0|1,0,0]=3 661 B9R1.1 COC1=CC=C(O)C=C1 078679 [0,2,0,0,0,0|2,0,0]=4 662 B9R1.1 COC1=CC=C(S)C=C1 001774 [0,2,0,0,0,0|2,0,0]=4 663 B9R1.1 COC1=CC=[N+]([O-])C=C1 102569 [0,2,0,0,0,0|1,0,1]=4 664 B9R1.1 COC1=CN=C(N)C=C1 036797 [0,2,0,0,0,0|2,0,0]=4 665 B9R1.1 COC1=NC=C(N)C=C1 024176 [0,2,0,0,0,0|2,0,0]=4 666 B9R1.1 CSC1=CC=C(Br)C=C1 003696 [0,2,0,0,0,0|2,0,0]=4 667 B9R1.1 CSC1=CC=C(C)C=C1 001781 [0,2,0,0,0,0|2,0,0]=4 668 B9R1.1 CSC1=CC=C(Cl)C=C1 002972 [0,2,0,0,0,0|2,0,0]=4 669 B9R1.1 CSC1=CC=C(F)C=C1 003730 [0,2,0,0,0,0|2,0,0]=4 670 B9R1.1 CSC1=CC=C(I)C=C1 008044 [0,2,0,0,0,0|2,0,0]=4 671 B9R1.1 CSC1=CC=C(N)C=C1 003091 [0,2,0,0,0,0|1,0,0]=3 672 B9R1.1 CSC1=CC=C(N)C=C1 104919 [0,2,0,0,0,0|1,0,0]=3 673 B9R1.1 CSC1=CC=C(O)C=C1 003883 [0,2,0,0,0,0|2,0,0]=4 674 B9R1.1 C[N+]1=CC=C(C#N)C=C1 181502 [0,2,0,0,0,0|0,0,2]=4 675 B9R1.1 ClC1=CC=C(CBr)C=C1 118700 [0,2,0,0,0,0|2,0,0]=4 676 B9R1.1 ClC1=CC=C([Mg]Br)C=C1 102566 [0,2,0,0,0,0|2,0,0]=4 677 B9R1.1 ClCC1=CC=C(Br)C=C1 002483 [0,2,0,0,0,0|2,0,0]=4 678 B9R1.1 ClCC1=CC=C(Cl)C=C1 079221 [0,2,0,0,0,0|2,0,0]=4 679 B9R1.1 FC1=CC=C(CBr)C=C1 002963 [0,2,0,0,0,0|2,0,0]=4 680 B9R1.1 FC1=CC=C(CCl)C=C1 006201 [0,2,0,0,0,0|2,0,0]=4 681 B9R1.1 FC1=CC=C(CS)C=C1 006206 [0,2,0,0,0,0|2,0,0]=4 682 B9R1.1 N#CC1=CC=C(Br)C=C1 002988 [0,2,0,0,0,0|1,0,1]=4 683 B9R1.1 N#CC1=CC=C(Cl)C=C1 035205 [0,2,0,0,0,0|1,0,1]=4 684 B9R1.1 N#CC1=CC=C(F)C=C1 002237 [0,2,0,0,0,0|1,0,1]=4 685 B9R1.1 N#CC1=CC=C(I)C=C1 147902 [0,2,0,0,0,0|1,0,1]=4 686 B9R1.1 N#CC1=CC=C(N)C=C1 024179 [0,2,0,0,0,0|1,0,0]=3 687 B9R1.1 N#CC1=CC=C(O)C=C1 003632 [0,2,0,0,0,0|1,0,1]=4 688 B9R1.1 N#CC1=CN=C(N)C=C1 020194 [0,2,0,0,0,0|2,0,0]=4 689 B9R1.1 N#CC1=NC=C(N)C=C1 040038 [0,2,0,0,0,0|2,0,0]=4 690 B9R1.1 NC1=CC=C(CO)C=C1 092096 [0,2,0,0,0,0|1,0,0]=3 691 B9R1.1 NC1=CC=C(CO)C=N1 077326 [0,2,0,0,0,0|2,0,0]=4 692 B9R1.1 NC1=CC=C(CO)C=N1 104746 [0,2,0,0,0,0|2,0,0]=4 693 B9R1.1 NC1=NC=C(C=O)C=C1 241082 [0,2,0,0,0,0|2,0,0]=4 694 B9R1.1 NCC1=CC=C(Br)C=C1 042893 [0,2,0,0,0,0|1,0,0]=3 695 B9R1.1 NCC1=CC=C(Cl)C=C1 092218 [0,2,0,0,0,0|1,0,0]=3 696 B9R1.1 NCC1=CC=C(F)C=C1 006199 [0,2,0,0,0,0|1,0,0]=3 697 B9R1.1 NCC1=CC=C(O)C=C1 023452 [0,2,0,0,0,0|1,0,0]=3 698 B9R1.1 NCC1=CC=C(O)C=C1 047973 [0,2,0,0,0,0|1,0,0]=3 699 B9R1.1 NCC1=CN=C(Cl)C=C1 065444 [0,2,0,0,0,0|2,0,0]=4 700 B9R1.1 NNC1=CC=C(Br)C=C1 024571 [0,2,0,0,0,0|1,0,0]=3 701 B9R1.1 NNC1=CC=C(Br)C=C1 224144 [0,2,0,0,0,0|1,0,0]=3 702 B9R1.1 NNC1=CC=C(Cl)C=C1 008962 [0,2,0,0,0,0|1,0,0]=3 703 B9R1.1 NNC1=CC=C(Cl)C=C1 012720 [0,2,0,0,0,0|1,0,0]=3 704 B9R1.1 NNC1=CC=C(F)C=C1 001712 [0,2,0,0,0,0|1,0,0]=3 705 B9R1.1 NNC1=CC=C(F)C=C1 043658 [0,2,0,0,0,0|1,0,0]=3 706 B9R1.1 O=CC1=CC=C(Cl)C=C1 216307 [0,2,0,0,0,0|2,0,0]=4 707 B9R1.1 O=CC1=CC=C(I)C=C1 043849 [0,2,0,0,0,0|2,0,0]=4 708 B9R1.1 O=CC1=CC=C(O)C=C1 BR1235 [0,2,0,0,0,0|2,0,0]=4 709 B9R1.1 OCC1=CC=C(Br)C=C1 008822 [0,2,0,0,0,0|2,0,0]=4 710 B9R1.1 OCC1=CC=C(Cl)C=C1 008823 [0,2,0,0,0,0|2,0,0]=4 711 B9R1.1 OCC1=CC=C(F)C=C1 001624 [0,2,0,0,0,0|2,0,0]=4 712 B9R1.1 OCC1=CC=C(I)C=C1 093387 [0,2,0,0,0,0|2,0,0]=4 713 B9R1.1 OCC1=CC=C(O)C=C1 078884 [0,2,0,0,0,0|2,0,0]=4 714 B9R1.1 SCC1=CC=C(Br)C=C1 024343 [0,2,0,0,0,0|2,0,0]=4 715 B9R1.1 SCC1=CC=C(Cl)C=C1 545320 [0,2,0,0,0,0|2,0,0]=4 716 B9R1.2 BrCC1=CC(Br)=CC=C1 001367 [0,2,0,0,0,0|2,0,0]=4 717 B9R1.2 BrCC1=CC(I)=CC=C1 018739 [0,2,0,0,0,0|2,0,0]=4 718 B9R1.2 C#CC1=CC(C)=CC=C1 040032 [0,2,0,0,0,0|2,0,0]=4 719 B9R1.2 C#CC1=CC(F)=CC=C1 008807 [0,2,0,0,0,0|2,0,0]=4 720 B9R1.2 C#CC1=CC=CC(Br)=C1 040351 [0,2,0,0,0,0|2,0,0]=4 721 B9R1.2 C#CC1=CC=CC(Cl)=C1 040092 [0,2,0,0,0,0|2,0,0]=4 722 B9R1.2 C#CC1=CC=CC(N)=C1 034282 [0,2,0,0,0,0|1,0,0]=3 723 B9R1.2 C#CC1=CC=CC(O)=C1 239150 [0,2,0,0,0,0|2,0,0]=4 724 B9R1.2 C(=O)C1=CC(Br)=CC=C1 003060 [0,2,0,0,0,0|2,0,0]=4 725 B9R1.2 C(=O)C1=CC(C)=CC=C1 001390 [0,2,0,0,0,0|2,0,0]=4 726 B9R1.2 C=CC1=CC(Br)=CC=C1 001731 [0,2,0,0,0,0|2,0,0]=4 727 B9R1.2 CC1=CC(C#N)=NC=C1 068419 [0,2,0,0,0,0|1,0,0]=3 728 B9R1.2 CC1=CC(C=O)=NC=C1 033041 [0,2,0,0,0,0|1,0,0]=3 729 B9R1.2 CC1=CC(NN)=CC=C1 033721 [0,2,0,0,0,0|1,0,0]=3 730 B9R1.2 CC1=CC=CC(C#N)=C1 035881 [0,2,0,0,0,0|1,0,1]=4 731 B9R1.2 CC1=CC=CC(CBr)=C1 067812 [0,2,0,0,0,0|2,0,0]=4 732 B9R1.2 CC1=CC=CC(CN)=C1 008878 [0,2,0,0,0,0|1,0,0]=3 733 B9R1.2 CC1=CC=CC(CO)=C1 102453 [0,2,0,0,0,0|2,0,0]=4 734 B9R1.2 CC1=NC(NN)=CC=C1 038575 [0,2,0,0,0,0|2,0,0]=4 735 B9R1.2 CCC1=CC(I)=CC=C1 037712 [0,2,0,0,0,0|2,0,0]=4 736 B9R1.2 CCC1=CC=CC(Br)=C1 024168 [0,2,0,0,0,0|2,0,0]=4 737 B9R1.2 CCC1=CC=CC(N)=C1 043276 [0,2,0,0,0,0|1,0,0]=3 738 B9R1.2 CCC1=CC=CC(N)=N1 095025 [0,2,0,0,0,0|2,0,0]=4 739 B9R1.2 CNC1=CC(Cl)=CC=C1 009649 [0,2,0,0,0,0|1,0,0]=3 740 B9R1.2 CNC1=CC(F)=CC=C1 019287 [0,2,0,0,0,0|1,0,0]=3 741 B9R1.2 CNC1=CC=CC(Br)=C1 045857 [0,2,0,0,0,0|1,0,0]=3 742 B9R1.2 CNC1=NC=CC(Br)=C1 339611 [0,2,0,0,0,0|1,0,0]=3 743 B9R1.2 COC1=CC(Br)=CC=C1 003058 [0,2,0,0,0,0|2,0,0]=4 744 B9R1.2 COC1=CC(Cl)=NC=N1 079953 [0,2,0,0,0,0|2,0,0]=4 745 B9R1.2 COC1=CC(Cl)=NN=C1 093603 [0,2,0,0,0,0|2,0,0]=4 746 B9R1.2 COC1=CC(F)=CC=C1 002695 [0,2,0,0,0,0|2,0,0]=4 747 B9R1.2 COC1=CC(F)=NC=C1 043905 [0,2,0,0,0,0|1,0,0]=3 748 B9R1.2 COC1=CC(I)=CC=C1 001303 [0,2,0,0,0,0|2,0,0]=4 749 B9R1.2 COC1=CC(N)=NC=C1 043010 [0,2,0,0,0,0|1,0,0]=3 750 B9R1.2 COC1=CC(O)=CC=C1 235567 [0,2,0,0,0,0|2,0,0]=4 751 B9R1.2 COC1=CC=CC(C)=C1 342147 [0,2,0,0,0,0|2,0,0]=4 752 B9R1.2 COC1=CC=CC(Cl)=C1 118300 [0,2,0,0,0,0|2,0,0]=4 753 B9R1.2 COC1=CC=CC(N)=C1 043402 [0,2,0,0,0,0|1,0,0]=3 754 B9R1.2 COC1=CC=CC(N)=N1 043829 [0,2,0,0,0,0|2,0,0]=4 755 B9R1.2 COC1=CC=CC(S)=C1 001309 [0,2,0,0,0,0|2,0,0]=4 756 B9R1.2 COC1=CC=NC(Cl)=N1 067422 [0,2,0,0,0,0|2,0,0]=4 757 B9R1.2 COC1=CN=CC(N)=C1 048102 [0,2,0,0,0,0|2,0,0]=4 758 B9R1.2 COC1=NC=CC(Br)=C1 036245 [0,2,0,0,0,0|1,0,0]=3 759 B9R1.2 COC1=NC=CC(Br)=N1 078127 [0,2,0,0,0,0|2,0,0]=4 760 B9R1.2 COC1=NC=CC(Cl)=N1 078129 [0,2,0,0,0,0|2,0,0]=4 761 B9R1.2 COC1=NC=CC(F)=C1 208735 [0,2,0,0,0,0|1,0,0]=3 762 B9R1.2 COC1=NC=CC(N)=C1 036821 [0,2,0,0,0,0|0,0,0]=2 763 B9R1.2 COC1=NC=NC(N)=C1 064930 [0,2,0,0,0,0|1,0,0]=3 764 B9R1.2 CSC1=CC(Br)=CC=C1 003661 [0,2,0,0,0,0|2,0,0]=4 765 B9R1.2 CSC1=CC(C)=CC=C1 019356 [0,2,0,0,0,0|2,0,0]=4 766 B9R1.2 CSC1=CC(Cl)=CC=C1 003553 [0,2,0,0,0,0|2,0,0]=4 767 B9R1.2 CSC1=CC(F)=CC=C1 019273 [0,2,0,0,0,0|2,0,0]=4 768 B9R1.2 CSC1=CC(I)=CC=C1 094459 [0,2,0,0,0,0|2,0,0]=4 769 B9R1.2 CSC1=CC([Mg+])=CC=C1 397737 [0,2,0,0,0,0|2,0,0]=4 770 B9R1.2 CSC1=CC=CC(N)=C1 018141 [0,2,0,0,0,0|1,0,0]=3 771 B9R1.2 CSC1=NC=CC(Cl)=N1 049172 [0,2,0,0,0,0|2,0,0]=4 772 B9R1.2 CSC1=NC=CC(O)=N1 076764 [0,2,0,0,0,0|2,0,0]=4 773 B9R1.2 ClC1=CC=CC(CBr)=C1 024563 [0,2,0,0,0,0|2,0,0]=4 774 B9R1.2 FC1=CC=CC(CBr)=C1 002171 [0,2,0,0,0,0|2,0,0]=4 775 B9R1.2 FC1=CC=CC(CCl)=C1 001632 [0,2,0,0,0,0|2,0,0]=4 776 B9R1.2 FC1=CC=CC(CS)=C1 024342 [0,2,0,0,0,0|2,0,0]=4 777 B9R1.2 N#CC1=CC(Br)=CC=C1 036058 [0,2,0,0,0,0|1,0,1]=4 778 B9R1.2 N#CC1=CC(Cl)=CC=C1 035197 [0,2,0,0,0,0|1,0,1]=4 779 B9R1.2 N#CC1=CC(Cl)=CC=N1 038180 [0,2,0,0,0,0|1,0,0]=3 780 B9R1.2 N#CC1=CC(Cl)=NC=C1 009501 [0,2,0,0,0,0|0,0,1]=3 781 B9R1.2 N#CC1=CC(F)=CC=C1 001644 [0,2,0,0,0,0|1,0,1]=4 782 B9R1.2 N#CC1=CC(F)=NC=C1 046505 [0,2,0,0,0,0|0,0,1]=3 783 B9R1.2 N#CC1=CC(I)=CC=C1 147901 [0,2,0,0,0,0|1,0,1]=4 784 B9R1.2 N#CC1=CC(N)=CC=C1 011369 [0,2,0,0,0,0|1,0,0]=3 785 B9R1.2 N#CC1=CC(O)=CC=C1 049834 [0,2,0,0,0,0|1,0,1]=4 786 B9R1.2 N#CC1=CC(O)=NC=C1 023614 [0,2,0,0,0,0|0,0,1]=3 787 B9R1.2 N#CC1=CC=NC(N)=C1 038335 [0,2,0,0,0,0|0,0,1]=3 788 B9R1.2 N#CC1=NC(Cl)=NC=C1 068727 [0,2,0,0,0,0|1,0,1]=4 789 B9R1.2 N#CC1=NC=CC(Br)=C1 049881 [0,2,0,0,0,0|1,0,0]=3 790 B9R1.2 NC1=CC=CC(CO)=C1 008828 [0,2,0,0,0,0|1,0,0]=3 791 B9R1.2 NCC1=CC(Br)=CC=C1 075951 [0,2,0,0,0,0|1,0,0]=3 792 B9R1.2 NCC1=CC(Cl)=CC=C1 008869 [0,2,0,0,0,0|1,0,0]=3 793 B9R1.2 NCC1=CC(F)=CC=C1 006198 [0,2,0,0,0,0|1,0,0]=3 794 B9R1.2 NCC1=CC(N)=NC=C1 077092 [0,2,0,0,0,0|0,0,0]=2 795 B9R1.2 NCC1=CC=CC(Br)=C1 242605 [0,2,0,0,0,0|1,0,0]=3 796 B9R1.2 NCC1=CC=CC(I)=C1 079620 [0,2,0,0,0,0|1,0,0]=3 797 B9R1.2 NCC1=CC=CC(O)=C1 023455 [0,2,0,0,0,0|1,0,0]=3 798 B9R1.2 NCC1=CN=CC(Cl)=C1 091239 [0,2,0,0,0,0|2,0,0]=4 799 B9R1.2 NCC1=NC(Br)=CC=C1 215138 [0,2,0,0,0,0|2,0,0]=4 800 B9R1.2 NNC1=CC(Br)=CC=C1 385028 [0,2,0,0,0,0|1,0,0]=3 801 B9R1.2 NNC1=CC(Cl)=CC=C1 044382 [0,2,0,0,0,0|1,0,0]=3 802 B9R1.2 NNC1=CC(F)=CC=C1 006333 [0,2,0,0,0,0|1,0,0]=3 803 B9R1.2 NNC1=CC(F)=CC=C1 043659 [0,2,0,0,0,0|1,0,0]=3 804 B9R1.2 NNC1=CC=CC(Br)=C1 044881 [0,2,0,0,0,0|1,0,0]=3 805 B9R1.2 NNC1=CC=CC(Br)=N1 091912 [0,2,0,0,0,0|2,0,0]=4 806 B9R1.2 NNC1=CC=CC(Cl)=C1 078722 [0,2,0,0,0,0|1,0,0]=3 807 B9R1.2 O=CC1=CC(Cl)=CC=C1 032762 [0,2,0,0,0,0|2,0,0]=4 808 B9R1.2 O=CC1=CC(F)=CC=C1 001668 [0,2,0,0,0,0|2,0,0]=4 809 B9R1.2 O=CC1=CC(F)=NC=C1 036282 [0,2,0,0,0,0|1,0,0]=3 810 B9R1.2 O=CC1=CC(O)=CC=C1 044196 [0,2,0,0,0,0|2,0,0]=4 811 B9R1.2 O=CC1=CC=CC(I)=C1 079137 [0,2,0,0,0,0|2,0,0]=4 812 B9R1.2 O=CC1=NC=CC(Br)=C1 077333 [0,2,0,0,0,0|1,0,0]=3 813 B9R1.2 OCC1=CC(Br)=CC=C1 001365 [0,2,0,0,0,0|2,0,0]=4 814 B9R1.2 OCC1=CC(Cl)=CC=C1 001376 [0,2,0,0,0,0|2,0,0]=4 815 B9R1.2 OCC1=CC(F)=CC=C1 002170 [0,2,0,0,0,0|2,0,0]=4 816 B9R1.2 OCC1=NC=CC(Br)=C1 075766 [0,2,0,0,0,0|1,0,0]=3 817 B9R1.2 SCC1=CC(Br)=CC=C1 024349 [0,2,0,0,0,0|2,0,0]=4 818 B9R1.6 BrC(Br)C1=CC=CC=C1 243023 [0,2,0,0,0,0|2,0,0]=4 819 B9R1.6 C=C(C)C1=CC=CC=C1 245708 [0,2,0,0,0,0|2,0,0]=4 820 B9R1.6 CC(=O)C1=CC=CC=C1 043319 [0,2,0,0,0,0|2,0,0]=4 821 B9R1.6 CC(=O)C1=CC=NC=C1 033067 [0,2,0,0,0,0|1,0,0]=3 822 B9R1.6 CC(Br)C1=CC=CC=C1 001003 [0,2,0,0,0,0|2,0,0]=4 823 B9R1.6 CC(C)C1=CC=CC=C1 094649 [0,2,0,0,0,0|2,0,0]=4 824 B9R1.6 CC(C)C1=CC=NC=C1 024693 [0,2,0,0,0,0|1,0,0]=3 825 B9R1.6 CC(N)C1=CC=CC=C1 208695 [0,2,0,0,0,0|1,0,0]=3 826 B9R1.6 CC(N)C1=CC=NC=C1 030534 [0,2,0,0,0,0|0,0,0]=2 827 B9R1.6 CC(N)C1=CC=NC=C1 097930 [0,2,0,0,0,0|0,0,0]=2 828 B9R1.6 CC(N)C1=CN=CC=C1 030750 [0,2,0,0,0,0|2,0,0]=4 829 B9R1.6 CC(N)C1=NC=CC=C1 060819 [0,2,0,0,0,0|2,0,0]=4 830 B9R1.6 CC(O)C1=CC=CC=C1 098924 [0,2,0,0,0,0|2,0,0]=4 831 B9R1.6 CN(C)C1=CC=CC=C1 098810 [0,2,0,0,0,0|1,0,0]=3 832 B9R1.6 CN(C)C1=CC=CN=C1 032574 [0,2,0,0,0,0|2,0,0]=4 833 B9R1.6 CN(C)C1=CC=NC=C1 001704 [0,2,0,0,0,0|0,0,0]=2 834 B9R1.6 CN(C)C1=CC=NC=C1 133700 [0,2,0,0,0,0|0,0,0]=2 835 B9R1.6 CN(C)C1=NC=CC=C1 219108 [0,2,0,0,0,0|2,0,0]=4 836 B9R1.6 CS(=O)C1=CC=CC=C1 180124 [0,2,0,0,0,0|2,0,0]=4 837 B9R1.6 C[C@@H](N)C1=CC=CC=C1 037431 [0,2,0,0,0,0|1,0,0]=3 838 B9R1.6 C[C@@H](N)C1=NC=CC=C1 078110 [0,2,0,0,0,0|2,0,0]=4 839 B9R1.6 C[C@@H](O)C1=CC=CC=C1 222634 [0,2,0,0,0,0|2,0,0]=4 840 B9R1.6 C[C@H](N)C1=CC=CC=C1 037432 [0,2,0,0,0,0|1,0,0]=3 841 B9R1.6 C[SiH](C)C1=CC=CC=C1 S13425 [0,2,0,0,0,0|2,0,0]=4 842 B9R1.6 C[SiH](Cl)C1=CC=CC=C1 S13525 [0,2,0,0,0,0|2,0,0]=4 843 B9R1.6 ClP(Cl)C1=CC=CC=C1 223201 [0,2,0,0,0,0|1,1,0]=4 844 B9R1.6 Cl[SiH](Cl)C1=CC=CC=C1 S13350 [0,2,0,0,0,0|2,0,0]=4 845 B9R1.6 FC(F)C1=CC=CC=C1 035819 [0,2,0,0,0,0|2,0,0]=4 846 B9R1.6 FC(F)C1=CC=NC=C1 050447 [0,2,0,0,0,0|1,0,0]=3 847 B9R1.6 N=C(N)C1=CC=CC=C1 044622 [0,2,0,0,0,0|1,0,0]=3 848 B9R1.6 N=C(N)C1=CC=CC=C1 067951 [0,2,0,0,0,0|1,0,0]=3 849 B9R1.6 N=C(N)C1=CC=CC=C1 099104 [0,2,0,0,0,0|1,0,0]=3 850 B9R1.6 N=C(N)C1=CC=CC=C1 102340 [0,2,0,0,0,0|1,0,0]=3 851 B9R1.6 N=C(N)C1=CC=CC=N1 044914 [0,2,0,0,0,0|2,0,0]=4 852 B9R1.6 N=C(N)C1=CC=CN=C1 068345 [0,2,0,0,0,0|2,0,0]=4 853 B9R1.6 N=C(N)C1=CC=NC=C1 209227 [0,2,0,0,0,0|0,0,0]=2 854 B9R1.6 NC(=O)C1=CC=CC=C1 099462 [0,2,0,0,0,0|1,0,0]=3 855 B9R1.6 NC(=O)C1=CC=NC=C1 079012 [0,2,0,0,0,0|0,0,0]=2 856 B9R1.6 NC(=O)C1=CN=CC=C1 239905 [0,2,0,0,0,0|2,0,0]=4 857 B9R1.6 NC(=O)C1=NC=CC=C1 235663 [0,2,0,0,0,0|2,0,0]=4 858 B9R1.6 NC(=S)C1=CC=CC=C1 067940 [0,2,0,0,0,0|1,0,0]=3 859 B9R1.6 NC(=S)C1=CC=CN=C1 021345 [0,2,0,0,0,0|2,0,0]=4 860 B9R1.6 NC(=S)C1=CC=NC=C1 021346 [0,2,0,0,0,0|0,0,0]=2 861 B9R1.6 NC(=S)C1=NC=CC=C1 021344 [0,2,0,0,0,0|2,0,0]=4 862 B9R1.6 O=C(Cl)C1=CC=CC=C1 097787 [0,2,0,0,0,0|2,0,0]=4 863 B9R1.6 O=C(Cl)C1=CC=CC=C1 102565 [0,2,0,0,0,0|2,0,0]=4 864 B9R1.6 O=C(Cl)C1=CC=NC=C1 066672 [0,2,0,0,0,0|1,0,0]=3 865 B9R1.6 O=C(O)C1=CC=CC=C1 102544 [0,2,0,0,0,0|2,0,0]=4 866 B9R1.6 O=C(O)C1=CC=CC=C1 237766 [0,2,0,0,0,0|2,0,0]=4 867 B9R1.6 O=C(O)C1=CC=NC=C1 045226 [0,2,0,0,0,0|1,0,0]=3 868 B9R1.6 O=C(O)C1=CC=NN=C1 023601 [0,2,0,0,0,0|2,0,0]=4 869 B9R1.6 O=C(O)C1=NC=NC=C1 066253 [0,2,0,0,0,0|2,0,0]=4 870 B9R1.6 O=C([O-])C1=CC=CC=C1 094455 [0,2,0,0,0,0|2,0,0]=4 871 B9R1.6 O=C([O-])C1=CC=CC=C1 095369 [0,2,0,0,0,0|2,0,0]=4 872 B9R1.6 O=C([O-])C1=CC=CC=C1 099144 [0,2,0,0,0,0|2,0,0]=4 873 B9R1.6 O=C([O-])C1=CC=CC=C1 239403 [0,2,0,0,0,0|2,0,0]=4 874 B9R1.6 O=S([O-])C1=CC=CC=C1 003814 [0,2,0,0,0,0|2,0,0]=4 875 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 094600 [0,2,0,0,0,0|1,0,1]=4 876 B9R1.6 O=[PH](O)C1=CC=CC=C1 003643 [0,2,0,0,0,0|1,1,0]=4 877 B9R1.6 O=[Se](O)C1=CC=CC=C1 005551 [0,2,0,0,0,0|2,0,0]=4 878 B9R1.6 OB(O)C1=CC=CC=C1 019491 [0,2,0,0,0,0|2,0,0]=4 879 B9R1.6 OB(O)C1=CC=NC=C1 010820 [0,2,0,0,0,0|1,0,0]=3 880 B9R1.6 OB(O)C1=CC=NC=C1 017173 [0,2,0,0,0,0|1,0,0]=3 881 B9R1.8 BrCCC1=CC=CC=C1 019261 [0,2,0,0,0,0|2,0,0]=4 882 B9R1.8 Br\C=C\C1=CC=CC=C1 049835 [0,2,0,0,0,0|2,0,0]=4 883 B9R1.8 C#CCC1=CC=CC=C1 080054 [0,2,0,0,0,0|2,0,0]=4 884 B9R1.8 C=CCC1=CC=CC=C1 005425 [0,2,0,0,0,0|2,0,0]=4 885 B9R1.8 C=CSC1=CC=CC=C1 008052 [0,2,0,0,0,0|2,0,0]=4 886 B9R1.8 CC#CC1=CC=CC=C1 166000 [0,2,0,0,0,0|2,0,0]=4 887 B9R1.8 CCCC1=CC=CC=C1 095067 [0,2,0,0,0,0|2,0,0]=4 888 B9R1.8 CCCC1=CC=NC=C1 235894 [0,2,0,0,0,0|1,0,0]=3 889 B9R1.8 CCNC1=CC=CC=C1 216665 [0,2,0,0,0,0|1,0,0]=3 890 B9R1.8 CCOC1=CC=CC=C1 098890 [0,2,0,0,0,0|2,0,0]=4 891 B9R1.8 CCSC1=CC=CC=C1 001759 [0,2,0,0,0,0|2,0,0]=4 892 B9R1.8 CNCC1=CC=CC=C1 020695 [0,2,0,0,0,0|1,0,0]=3 893 B9R1.8 CNCC1=CC=NC=C1 046176 [0,2,0,0,0,0|0,0,0]=2 894 B9R1.8 CSCC1=CC=CC=C1 099640 [0,2,0,0,0,0|2,0,0]=4 895 B9R1.8 C\C=C/C1=CC=CC=C1 167700 [0,2,0,0,0,0|2,0,0]=4 896 B9R1.8 C\C=C\C1=CC=CC=C1 018868 [0,2,0,0,0,0|2,0,0]=4 897 B9R1.8 C\N=C\C1=CC=CC=C1 240625 [0,2,0,0,0,0|1,0,1]=4 898 B9R1.8 ClCCC1=CC=CC=C1 208883 [0,2,0,0,0,0|2,0,0]=4 899 B9R1.8 Cl[Mg]CC1=CC=CC=C1 103558 [0,2,0,0,0,0|2,0,0]=4 900 B9R1.8 ICCC1=CC=CC=C1 001087 [0,2,0,0,0,0|2,0,0]=4 901 B9R1.8 N#C[Se]C1=CC=CC=C1 005429 [0,2,0,0,0,0|1,0,1]=4 902 B9R1.8 NCCC1=CC=CC=C1 046873 [0,2,0,0,0,0|1,0,0]=3 903 B9R1.8 NCCC1=CC=CN=C1 010689 [0,2,0,0,0,0|2,0,0]=4 904 B9R1.8 NCCC1=CC=CN=C1 033239 [0,2,0,0,0,0|2,0,0]=4 905 B9R1.8 NCCC1=CC=CN=C1 065473 [0,2,0,0,0,0|2,0,0]=4 906 B9R1.8 NCCC1=CC=NC=C1 010690 [0,2,0,0,0,0|0,0,0]=2 907 B9R1.8 NCCC1=NC=CC=C1 013702 [0,2,0,0,0,0|2,0,0]=4 908 B9R1.8 NNCC1=CC=CC=C1 036859 [0,2,0,0,0,0|1,0,0]=3 909 B9R1.8 NOCC1=CC=CC=C1 036957 [0,2,0,0,0,0|1,0,0]=3 910 B9R1.8 O=C=NC1=CC=CC=C1 165700 [0,2,0,0,0,0|1,0,1]=4 911 B9R1.8 O=CCC1=CC=CC=C1 098878 [0,2,0,0,0,0|2,0,0]=4 912 B9R1.8 O=CNC1=CC=CC=C1 239406 [0,2,0,0,0,0|1,0,0]=3 913 B9R1.8 O=CNC1=NC=CC=C1 474802 [0,2,0,0,0,0|2,0,0]=4 914 B9R1.8 O=S=NC1=CC=CC=C1 341767 [0,2,0,0,0,0|1,0,1]=4 915 B9R1.8 OCCC1=CC=CC=C1 222397 [0,2,0,0,0,0|2,0,0]=4 916 B9R1.8 OCCC1=CC=NC=C1 228335 [0,2,0,0,0,0|1,0,0]=3 917 B9R1.8 ONCC1=CC=CC=C1 091512 [0,2,0,0,0,0|1,0,0]=3 918 B9R1.8 ONCC1=CC=CC=C1 238633 [0,2,0,0,0,0|1,0,0]=3 919 B9R1.8 S=C=NC1=CC=CC=C1 358191 [0,2,0,0,0,0|1,0,1]=4 920 B9R1.15 BrCC1=C(Br)C=CC=C1 001366 [0,2,0,0,0,0|2,0,0]=4 921 B9R1.15 BrCC1=C(I)C=CC=C1 044924 [0,2,0,0,0,0|2,0,0]=4 922 B9R1.15 C#CC1=C(F)C=CC=C1 008806 [0,2,0,0,0,0|2,0,0]=4 923 B9R1.15 C(=O)C1=C(C)C=CC=C1 001389 [0,2,0,0,0,0|2,0,0]=4 924 B9R1.15 C=CC1=C(Br)C=CC=C1 003018 [0,2,0,0,0,0|2,0,0]=4 925 B9R1.15 C=CC1=CC=CC=C1Cl 003707 [0,2,0,0,0,0|2,0,0]=4 926 B9R1.15 CC1=C(N=O)C=CC=C1 099261 [0,2,0,0,0,0|1,0,1]=4 927 B9R1.15 CC1=CC=CC=C1CBr 227715 [0,2,0,0,0,0|2,0,0]=4 928 B9R1.15 CC1=CC=CC=C1CN 227781 [0,2,0,0,0,0|1,0,0]=3 929 B9R1.15 CC1=CC=CN=C1CN 020197 [0,2,0,0,0,0|2,0,0]=4 930 B9R1.15 CC1=CC=CN=C1NN 061270 [0,2,0,0,0,0|2,0,0]=4 931 B9R1.15 CC1=CC=NC=C1C#N 040036 [0,2,0,0,0,0|1,0,0]=3 932 B9R1.15 CCC1=C(Br)C=CC=C1 018276 [0,2,0,0,0,0|2,0,0]=4 933 B9R1.15 CCC1=C(Cl)C=CC=C1 018372 [0,2,0,0,0,0|2,0,0]=4 934 B9R1.15 CCC1=C(I)C=CC=C1 001197 [0,2,0,0,0,0|2,0,0]=4 935 B9R1.15 CCC1=C(N)C=CC=C1 043275 [0,2,0,0,0,0|1,0,0]=3 936 B9R1.15 CCC1=C(S)C=CC=C1 001289 [0,2,0,0,0,0|2,0,0]=4 937 B9R1.15 CCC1=CC=CC=C1O 240992 [0,2,0,0,0,0|2,0,0]=4 938 B9R1.15 CCC1=CC=NC=C1C 188677 [0,2,0,0,0,0|1,0,0]=3 939 B9R1.15 CCC1=NC=NC=C1F 079955 [0,2,0,0,0,0|2,0,0]=4 940 B9R1.15 CNC1=C(Cl)C=CC=C1 009648 [0,2,0,0,0,0|1,0,0]=3 941 B9R1.15 CNC1=C(F)C=CC=C1 019280 [0,2,0,0,0,0|1,0,0]=3 942 B9R1.15 CNC1=CC=CC=C1N 078664 [0,2,0,0,0,0|1,0,0]=3 943 B9R1.15 CNC1=CC=CC=C1N 220032 [0,2,0,0,0,0|1,0,0]=3 944 B9R1.15 COC1=C(Br)C=CC=C1 002965 [0,2,0,0,0,0|2,0,0]=4 945 B9R1.15 COC1=C(Br)C=NC=C1 210035 [0,2,0,0,0,0|1,0,0]=3 946 B9R1.15 COC1=C(F)C=CC=C1 002694 [0,2,0,0,0,0|2,0,0]=4 947 B9R1.15 COC1=C(I)C=CC=C1 001302 [0,2,0,0,0,0|2,0,0]=4 948 B9R1.15 COC1=C(N)C=CC=C1 043317 [0,2,0,0,0,0|1,0,0]=3 949 B9R1.15 COC1=C(N)C=NC=C1 076885 [0,2,0,0,0,0|1,0,0]=3 950 B9R1.15 COC1=C(S)C=CC=C1 003589 [0,2,0,0,0,0|2,0,0]=4 951 B9R1.15 COC1=CC=CC=C1C 242932 [0,2,0,0,0,0|2,0,0]=4 952 B9R1.15 COC1=CC=CC=C1O 241127 [0,2,0,0,0,0|2,0,0]=4 953 B9R1.15 COC1=CC=CN=C1N 064878 [0,2,0,0,0,0|2,0,0]=4 954 B9R1.15 CSC1=C(Br)C=CC=C1 001732 [0,2,0,0,0,0|2,0,0]=4 955 B9R1.15 CSC1=C(Cl)C=CC=C1 003552 [0,2,0,0,0,0|2,0,0]=4 956 B9R1.15 CSC1=C(F)C=CC=C1 019279 [0,2,0,0,0,0|2,0,0]=4 957 B9R1.15 CSC1=C(I)C=CC=C1 003738 [0,2,0,0,0,0|2,0,0]=4 958 B9R1.15 CSC1=C(N)C=CC=C1 002979 [0,2,0,0,0,0|1,0,0]=3 959 B9R1.15 CSC1=C(O)C=CC=C1 001770 [0,2,0,0,0,0|2,0,0]=4 960 B9R1.15 ClC1=C(CBr)C=CC=C1 001008 [0,2,0,0,0,0|2,0,0]=4 961 B9R1.15 ClCC1=CC=CC=C1Cl 088365 [0,2,0,0,0,0|2,0,0]=4 962 B9R1.15 FC1=C(CBr)C=CC=C1 006200 [0,2,0,0,0,0|2,0,0]=4 963 B9R1.15 FC1=C(CCl)C=CC=C1 001422 [0,2,0,0,0,0|2,0,0]=4 964 B9R1.15 FC1=C(CS)C=CC=C1 024341 [0,2,0,0,0,0|2,0,0]=4 965 B9R1.15 N#CC1=C(Br)C=CC=C1 001053 [0,2,0,0,0,0|1,0,1]=4 966 B9R1.15 N#CC1=C(Cl)C=CC=C1 094274 [0,2,0,0,0,0|1,0,1]=4 967 B9R1.15 N#CC1=C(F)C=CC=C1 001656 [0,2,0,0,0,0|1,0,1]=4 968 B9R1.15 N#CC1=C(I)C=CC=C1 147900 [0,2,0,0,0,0|1,0,1]=4 969 B9R1.15 N#CC1=C(N)C=CC=C1 023851 [0,2,0,0,0,0|1,0,0]=3 970 B9R1.15 N#CC1=C(O)C=CC=C1 023900 [0,2,0,0,0,0|1,0,1]=4 971 B9R1.15 N#CC1=CC=CN=C1N 033252 [0,2,0,0,0,0|2,0,0]=4 972 B9R1.15 N#CC1=CC=NC=C1Cl 049090 [0,2,0,0,0,0|0,0,1]=3 973 B9R1.15 N#CC1=CN=CN=C1N 068724 [0,2,0,0,0,0|1,0,0]=3 974 B9R1.15 NC1=C(C=O)C=NC=C1 023581 [0,2,0,0,0,0|0,0,0]=2 975 B9R1.15 NC1=CC=CC=C1CO 036679 [0,2,0,0,0,0|1,0,0]=3 976 B9R1.15 NC1=NC=CC=C1C=O 023408 [0,2,0,0,0,0|2,0,0]=4 977 B9R1.15 NCC1=C(Cl)C=CC=C1 008868 [0,2,0,0,0,0|1,0,0]=3 978 B9R1.15 NCC1=C(F)C=CC=C1 006197 [0,2,0,0,0,0|1,0,0]=3 979 B9R1.15 NCC1=C(O)C=CC=C1 023454 [0,2,0,0,0,0|1,0,0]=3 980 B9R1.15 NCC1=CC=CC=C1Br 065390 [0,2,0,0,0,0|1,0,0]=3 981 B9R1.15 NCC1=CC=CC=C1N 076007 [0,2,0,0,0,0|1,0,0]=3 982 B9R1.15 NNC1=C(F)C=CC=C1 006332 [0,2,0,0,0,0|1,0,0]=3 983 B9R1.15 NNC1=CC=CC=C1Br 061122 [0,2,0,0,0,0|1,0,0]=3 984 B9R1.15 NNC1=CC=CC=C1Br 369917 [0,2,0,0,0,0|1,0,0]=3 985 B9R1.15 NNC1=CC=CC=C1F 047697 [0,2,0,0,0,0|1,0,0]=3 986 B9R1.15 O=CC1=C(Br)C=CC=C1 109700 [0,2,0,0,0,0|2,0,0]=4 987 B9R1.15 O=CC1=C(Cl)C=CC=C1 118500 [0,2,0,0,0,0|2,0,0]=4 988 B9R1.15 O=CC1=C(Cl)C=NC=C1 076446 [0,2,0,0,0,0|1,0,0]=3 989 B9R1.15 O=CC1=C(F)C=CC=C1 001671 [0,2,0,0,0,0|2,0,0]=4 990 B9R1.15 O=CC1=C(I)C=CC=C1 024292 [0,2,0,0,0,0|2,0,0]=4 991 B9R1.15 O=CC1=C(O)C=CC=C1 169200 [0,2,0,0,0,0|2,0,0]=4 992 B9R1.15 O=CC1=CC=NC=C1Br 065208 [0,2,0,0,0,0|1,0,0]=3 993 B9R1.15 O=CC1=CC=NC=C1F 036286 [0,2,0,0,0,0|1,0,0]=3 994 B9R1.15 OCC1=C(Cl)C=CC=C1 001375 [0,2,0,0,0,0|2,0,0]=4 995 B9R1.15 OCC1=C(F)C=CC=C1 006196 [0,2,0,0,0,0|2,0,0]=4 996 B9R1.15 OCC1=C(F)C=NC=C1 237155 [0,2,0,0,0,0|1,0,0]=3 997 B9R1.15 OCC1=C(S)C=CC=C1 001239 [0,2,0,0,0,0|2,0,0]=4 998 B9R1.15 OCC1=CC=CC=C1I 093337 [0,2,0,0,0,0|2,0,0]=4 999 B9R1.15 OCC1=CC=CC=C1O 078974 [0,2,0,0,0,0|2,0,0]=4 1000 B9R1.15 SCC1=C(Br)C=CC=C1 024350 [0,2,0,0,0,0|2,0,0]=4 1001 B9R1.69 BrC1=C(Br)C=C(I)C=C1 035609 [0,2,0,0,0,0|2,0,0]=4 1002 B9R1.69 BrC1=CC(Br)=C(I)C=C1 035714 [0,2,0,0,0,0|2,0,0]=4 1003 B9R1.69 BrC1=CC=C(Br)C(I)=C1 237418 [0,2,0,0,0,0|2,0,0]=4 1004 B9R1.69 BrC1=CN=C(Br)C=C1Br 104824 [0,2,0,0,0,0|1,0,0]=3 1005 B9R1.69 CC1=C(Br)C=C(Cl)C=C1 018259 [0,2,0,0,0,0|2,0,0]=4 1006 B9R1.69 CC1=C(Br)C=C(F)C=C1 001605 [0,2,0,0,0,0|2,0,0]=4 1007 B9R1.69 CC1=C(Br)C=C(I)C=C1 038632 [0,2,0,0,0,0|2,0,0]=4 1008 B9R1.69 CC1=C(Br)C=CC(Br)=C1 024524 [0,2,0,0,0,0|2,0,0]=4 1009 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 110800 [0,2,0,0,0,0|2,0,0]=4 1010 B9R1.69 CC1=C(Br)C=CC(F)=C1 001613 [0,2,0,0,0,0|2,0,0]=4 1011 B9R1.69 CC1=C(Br)C=CC(I)=C1 018282 [0,2,0,0,0,0|2,0,0]=4 1012 B9R1.69 CC1=C(Br)C=CC(N)=C1 001128 [0,2,0,0,0,0|1,0,0]=3 1013 B9R1.69 CC1=C(Br)C=NC(F)=C1 045050 [0,2,0,0,0,0|1,0,0]=3 1014 B9R1.69 CC1=C(Br)C=NC(N)=C1 049682 [0,2,0,0,0,0|1,0,0]=3 1015 B9R1.69 CC1=C(C)C=C(F)C=C1 002578 [0,2,0,0,0,0|2,0,0]=4 1016 B9R1.69 CC1=C(C)C=C(I)C=C1 004948 [0,2,0,0,0,0|2,0,0]=4 1017 B9R1.69 CC1=C(C)C=C(N)C=C1 038327 [0,2,0,0,0,0|1,0,0]=3 1018 B9R1.69 CC1=C(C)C=C(O)C=C1 094083 [0,2,0,0,0,0|2,0,0]=4 1019 B9R1.69 CC1=C(C)C=C(S)C=C1 001347 [0,2,0,0,0,0|2,0,0]=4 1020 B9R1.69 CC1=C(C)N=C(N)C=C1 024688 [0,2,0,0,0,0|2,0,0]=4 1021 B9R1.69 CC1=C(Cl)C=C(Cl)C=C1 046773 [0,2,0,0,0,0|2,0,0]=4 1022 B9R1.69 CC1=C(Cl)C=C(F)C=C1 001597 [0,2,0,0,0,0|2,0,0]=4 1023 B9R1.69 CC1=C(Cl)C=C(I)C=C1 001152 [0,2,0,0,0,0|2,0,0]=4 1024 B9R1.69 CC1=C(Cl)C=C(N)C=C1 024181 [0,2,0,0,0,0|1,0,0]=3 1025 B9R1.69 CC1=C(Cl)C=CC(F)=C1 001598 [0,2,0,0,0,0|2,0,0]=4 1026 B9R1.69 CC1=C(Cl)C=CC(N)=C1 013941 [0,2,0,0,0,0|1,0,0]=3 1027 B9R1.69 CC1=C(F)C=C(Br)C=C1 002191 [0,2,0,0,0,0|2,0,0]=4 1028 B9R1.69 CC1=C(F)C=C(Cl)C=C1 001672 [0,2,0,0,0,0|2,0,0]=4 1029 B9R1.69 CC1=C(F)C=C(I)C=C1 006247 [0,2,0,0,0,0|2,0,0]=4 1030 B9R1.69 CC1=C(F)C=C(N)C=C1 001685 [0,2,0,0,0,0|1,0,0]=3 1031 B9R1.69 CC1=C(F)C=CC(Br)=C1 001620 [0,2,0,0,0,0|2,0,0]=4 1032 B9R1.69 CC1=C(F)C=CC(Cl)=C1 001743 [0,2,0,0,0,0|2,0,0]=4 1033 B9R1.69 CC1=C(F)C=CC(F)=C1 001466 [0,2,0,0,0,0|2,0,0]=4 1034 B9R1.69 CC1=C(F)C=CC(N)=C1 006273 [0,2,0,0,0,0|1,0,0]=3 1035 B9R1.69 CC1=C(F)C=CC(O)=C1 006284 [0,2,0,0,0,0|2,0,0]=4 1036 B9R1.69 CC1=C(I)C=C(Br)C=C1 037478 [0,2,0,0,0,0|2,0,0]=4 1037 B9R1.69 CC1=C(I)C=C(F)C=C1 006249 [0,2,0,0,0,0|2,0,0]=4 1038 B9R1.69 CC1=C(I)C=CC(Br)=C1 018284 [0,2,0,0,0,0|2,0,0]=4 1039 B9R1.69 CC1=C(I)C=CC(F)=C1 005416 [0,2,0,0,0,0|2,0,0]=4 1040 B9R1.69 CC1=C(N)C=C(Br)C=C1 036299 [0,2,0,0,0,0|1,0,0]=3 1041 B9R1.69 CC1=C(N)C=C(Cl)C=C1 035843 [0,2,0,0,0,0|1,0,0]=3 1042 B9R1.69 CC1=C(N)C=C(F)C=C1 001692 [0,2,0,0,0,0|1,0,0]=3 1043 B9R1.69 CC1=C(N)C=CC(Br)=C1 024831 [0,2,0,0,0,0|1,0,0]=3 1044 B9R1.69 CC1=C(N)C=CC(Cl)=C1 024872 [0,2,0,0,0,0|1,0,0]=3 1045 B9R1.69 CC1=C(N)C=CC(F)=C1 001687 [0,2,0,0,0,0|1,0,0]=3 1046 B9R1.69 CC1=C(N)C=CC(I)=C1 005444 [0,2,0,0,0,0|1,0,0]=3 1047 B9R1.69 CC1=C(O)C=C(F)C=C1 013052 [0,2,0,0,0,0|2,0,0]=4 1048 B9R1.69 CC1=C(O)C=CC(Cl)=C1 034267 [0,2,0,0,0,0|2,0,0]=4 1049 B9R1.69 CC1=C(O)C=CC(F)=C1 006283 [0,2,0,0,0,0|2,0,0]=4 1050 B9R1.69 CC1=C(O)C=CC(N)=C1 046721 [0,2,0,0,0,0|1,0,0]=3 1051 B9R1.69 CC1=C(S)C=C(Br)C=C1 038013 [0,2,0,0,0,0|2,0,0]=4 1052 B9R1.69 CC1=C(S)C=CC(Cl)=C1 023129 [0,2,0,0,0,0|2,0,0]=4 1053 B9R1.69 CC1=CC(Br)=C(C)C=C1 019270 [0,2,0,0,0,0|2,0,0]=4 1054 B9R1.69 CC1=CC(Br)=C(F)C=C1 004234 [0,2,0,0,0,0|2,0,0]=4 1055 B9R1.69 CC1=CC(Br)=C(I)C=C1 018283 [0,2,0,0,0,0|2,0,0]=4 1056 B9R1.69 CC1=CC(Br)=C(N)C=C1 001127 [0,2,0,0,0,0|1,0,0]=3 1057 B9R1.69 CC1=CC(Br)=CC=C1Cl 018264 [0,2,0,0,0,0|2,0,0]=4 1058 B9R1.69 CC1=CC(Br)=CC=C1O 018299 [0,2,0,0,0,0|2,0,0]=4 1059 B9R1.69 CC1=CC(Br)=CN=C1N 002494 [0,2,0,0,0,0|2,0,0]=4 1060 B9R1.69 CC1=CC(Br)=NC=C1Br 067342 [0,2,0,0,0,0|1,0,0]=3 1061 B9R1.69 CC1=CC(C)=C(I)C=C1 001771 [0,2,0,0,0,0|2,0,0]=4 1062 B9R1.69 CC1=CC(C)=C(S)C=C1 001344 [0,2,0,0,0,0|2,0,0]=4 1063 B9R1.69 CC1=CC(Cl)=C(F)C=C1 009090 [0,2,0,0,0,0|2,0,0]=4 1064 B9R1.69 CC1=CC(Cl)=C(N)C=C1 036215 [0,2,0,0,0,0|1,0,0]=3 1065 B9R1.69 CC1=CC(Cl)=CC=C1I 018386 [0,2,0,0,0,0|2,0,0]=4 1066 B9R1.69 CC1=CC(Cl)=CN=C1N 033113 [0,2,0,0,0,0|2,0,0]=4 1067 B9R1.69 CC1=CC(Cl)=NN=C1Cl 017102 [0,2,0,0,0,0|2,0,0]=4 1068 B9R1.69 CC1=CC(F)=C(Br)C=C1 002344 [0,2,0,0,0,0|2,0,0]=4 1069 B9R1.69 CC1=CC(F)=C(I)C=C1 013321 [0,2,0,0,0,0|2,0,0]=4 1070 B9R1.69 CC1=CC(F)=C(N)C=C1 001686 [0,2,0,0,0,0|1,0,0]=3 1071 B9R1.69 CC1=CC(F)=NC=C1N 036178 [0,2,0,0,0,0|1,0,0]=3 1072 B9R1.69 CC1=CC(I)=C(C)C=C1 003509 [0,2,0,0,0,0|2,0,0]=4 1073 B9R1.69 CC1=CC(I)=C(F)C=C1 009207 [0,2,0,0,0,0|2,0,0]=4 1074 B9R1.69 CC1=CC(I)=C(I)C=C1 024614 [0,2,0,0,0,0|2,0,0]=4 1075 B9R1.69 CC1=CC(I)=CC=C1Cl 077705 [0,2,0,0,0,0|2,0,0]=4 1076 B9R1.69 CC1=CC(I)=CC=C1F 005313 [0,2,0,0,0,0|2,0,0]=4 1077 B9R1.69 CC1=CC(I)=CN=C1N 033294 [0,2,0,0,0,0|2,0,0]=4 1078 B9R1.69 CC1=CC(N)=C(Br)C=C1 032729 [0,2,0,0,0,0|1,0,0]=3 1079 B9R1.69 CC1=CC(N)=C(C)C=C1 094616 [0,2,0,0,0,0|1,0,0]=3 1080 B9R1.69 CC1=CC(N)=C(Cl)C=C1 033717 [0,2,0,0,0,0|1,0,0]=3 1081 B9R1.69 CC1=CC(N)=C(Cl)N=C1 033670 [0,2,0,0,0,0|2,0,0]=4 1082 B9R1.69 CC1=CC(N)=C(F)C=C1 021823 [0,2,0,0,0,0|1,0,0]=3 1083 B9R1.69 CC1=CC(N)=C(N)C=C1 037872 [0,2,0,0,0,0|1,0,0]=3 1084 B9R1.69 CC1=CC(N)=NC=C1I 217491 [0,2,0,0,0,0|1,0,0]=3 1085 B9R1.69 CC1=CC(O)=C(Br)C=C1 044749 [0,2,0,0,0,0|2,0,0]=4 1086 B9R1.69 CC1=CC(O)=C(Cl)C=C1 044834 [0,2,0,0,0,0|2,0,0]=4 1087 B9R1.69 CC1=CC(O)=C(F)C=C1 007901 [0,2,0,0,0,0|2,0,0]=4 1088 B9R1.69 CC1=CC(O)=C(N)C=C1 043441 [0,2,0,0,0,0|1,0,0]=3 1089 B9R1.69 CC1=CC(O)=C(O)C=C1 424851 [0,2,0,0,0,0|2,0,0]=4 1090 B9R1.69 CC1=CC(O)=CC=C1Br 018300 [0,2,0,0,0,0|2,0,0]=4 1091 B9R1.69 CC1=CC(O)=CC=C1I 078711 [0,2,0,0,0,0|2,0,0]=4 1092 B9R1.69 CC1=CC(O)=CC=C1N 078902 [0,2,0,0,0,0|1,0,0]=3 1093 B9R1.69 CC1=CC(O)=CC=C1O 223171 [0,2,0,0,0,0|2,0,0]=4 1094 B9R1.69 CC1=CC(S)=C(C)C=C1 001345 [0,2,0,0,0,0|2,0,0]=4 1095 B9R1.69 CC1=CC(S)=CC=C1F 023080 [0,2,0,0,0,0|2,0,0]=4 1096 B9R1.69 CC1=CC=C(Br)C(C)=C1 018327 [0,2,0,0,0,0|2,0,0]=4 1097 B9R1.69 CC1=CC=C(Br)C(Cl)=C1 018263 [0,2,0,0,0,0|2,0,0]=4 1098 B9R1.69 CC1=CC=C(Br)C=C1Br 037608 [0,2,0,0,0,0|2,0,0]=4 1099 B9R1.69 CC1=CC=C(Br)C=C1C 018328 [0,2,0,0,0,0|2,0,0]=4 1100 B9R1.69 CC1=CC=C(Br)C=C1Cl 018262 [0,2,0,0,0,0|2,0,0]=4 1101 B9R1.69 CC1=CC=C(Br)C=C1O 043842 [0,2,0,0,0,0|2,0,0]=4 1102 B9R1.69 CC1=CC=C(C)C(Cl)=C1 094429 [0,2,0,0,0,0|2,0,0]=4 1103 B9R1.69 CC1=CC=C(Cl)C(Br)=C1 018261 [0,2,0,0,0,0|2,0,0]=4 1104 B9R1.69 CC1=CC=C(Cl)C(Cl)=C1 092496 [0,2,0,0,0,0|2,0,0]=4 1105 B9R1.69 CC1=CC=C(Cl)C(F)=C1 013287 [0,2,0,0,0,0|2,0,0]=4 1106 B9R1.69 CC1=CC=C(Cl)C=C1I 018385 [0,2,0,0,0,0|2,0,0]=4 1107 B9R1.69 CC1=CC=C(Cl)C=C1O 018407 [0,2,0,0,0,0|2,0,0]=4 1108 B9R1.69 CC1=CC=C(I)C(Cl)=C1 018384 [0,2,0,0,0,0|2,0,0]=4 1109 B9R1.69 CC1=CC=C(I)C(N)=C1 064692 [0,2,0,0,0,0|1,0,0]=3 1110 B9R1.69 CC1=CC=C(N)C(C)=C1 098336 [0,2,0,0,0,0|1,0,0]=3 1111 B9R1.69 CC1=CC=C(N)C(C)=N1 079681 [0,2,0,0,0,0|2,0,0]=4 1112 B9R1.69 CC1=CC=C(N)C=C1Br 013745 [0,2,0,0,0,0|1,0,0]=3 1113 B9R1.69 CC1=CC=C(N)C=C1I 216625 [0,2,0,0,0,0|1,0,0]=3 1114 B9R1.69 CC1=CC=C(N)C=C1O 078747 [0,2,0,0,0,0|1,0,0]=3 1115 B9R1.69 CC1=CC=C(O)C(Br)=C1 092949 [0,2,0,0,0,0|2,0,0]=4 1116 B9R1.69 CC1=CC=C(O)C(C)=C1 208699 [0,2,0,0,0,0|2,0,0]=4 1117 B9R1.69 CC1=CC=C(O)C(Cl)=C1 018404 [0,2,0,0,0,0|2,0,0]=4 1118 B9R1.69 CC1=CC=C(O)C(N)=C1 064689 [0,2,0,0,0,0|1,0,0]=3 1119 B9R1.69 CC1=CC=C(O)C=C1Br 077987 [0,2,0,0,0,0|2,0,0]=4 1120 B9R1.69 CC1=CC=C(O)C=C1Cl 018012 [0,2,0,0,0,0|2,0,0]=4 1121 B9R1.69 CC1=CN=C(C)N=C1O 189283 [0,2,0,0,0,0|2,0,0]=4 1122 B9R1.69 CC1=CN=C(Cl)N=C1Cl 033156 [0,2,0,0,0,0|2,0,0]=4 1123 B9R1.69 CC1=CN=C(F)C=C1I 036281 [0,2,0,0,0,0|1,0,0]=3 1124 B9R1.69 CC1=CN=C(N)C(Br)=C1 002493 [0,2,0,0,0,0|2,0,0]=4 1125 B9R1.69 CC1=CN=C(N)C(Cl)=C1 219357 [0,2,0,0,0,0|2,0,0]=4 1126 B9R1.69 CC1=CNC(=O)N=C1N 222199 [0,2,0,0,0,0|1,0,1]=4 1127 B9R1.69 CC1=NC(Br)=CC=C1N 040412 [0,2,0,0,0,0|2,0,0]=4 1128 B9R1.69 CC1=NC(Cl)=CC=C1N 040121 [0,2,0,0,0,0|2,0,0]=4 1129 B9R1.69 CC1=NC(N)=CC=C1Br 002495 [0,2,0,0,0,0|2,0,0]=4 1130 B9R1.69 CC1=NC=C(N)C=C1Br 064785 [0,2,0,0,0,0|2,0,0]=4 1131 B9R1.69 C[N+]1=CC(Cl)=CC=C1N 184679 [0,2,0,0,0,0|2,0,0]=4 1132 B9R1.69 ClC1=C(Br)C=CC(I)=C1 021409 [0,2,0,0,0,0|2,0,0]=4 1133 B9R1.69 ClC1=C(Cl)C=C(Br)C=C1 001114 [0,2,0,0,0,0|2,0,0]=4 1134 B9R1.69 ClC1=C(Cl)C=C(I)C=C1 001166 [0,2,0,0,0,0|2,0,0]=4 1135 B9R1.69 ClC1=C(I)C=C(Br)C=C1 062556 [0,2,0,0,0,0|2,0,0]=4 1136 B9R1.69 ClC1=C(I)C=CC(Br)=C1 018257 [0,2,0,0,0,0|2,0,0]=4 1137 B9R1.69 ClC1=CC(Br)=C(Br)C=C1 035610 [0,2,0,0,0,0|2,0,0]=4 1138 B9R1.69 ClC1=CC(Br)=C(I)C=C1 061710 [0,2,0,0,0,0|2,0,0]=4 1139 B9R1.69 ClC1=CC(Cl)=C(I)C=C1 001167 [0,2,0,0,0,0|2,0,0]=4 1140 B9R1.69 ClC1=CC(Cl)=NC=C1Br 079526 [0,2,0,0,0,0|1,0,0]=3 1141 B9R1.69 ClC1=CC(Cl)=NN=C1Cl 077593 [0,2,0,0,0,0|2,0,0]=4 1142 B9R1.69 ClC1=CC(I)=C(Br)C=C1 062557 [0,2,0,0,0,0|2,0,0]=4 1143 B9R1.69 ClC1=CC(I)=C(Cl)C=C1 001168 [0,2,0,0,0,0|2,0,0]=4 1144 B9R1.69 ClC1=CC=C(Br)C(Cl)=C1 018266 [0,2,0,0,0,0|2,0,0]=4 1145 B9R1.69 ClC1=CC=C(Cl)C(Br)=C1 111100 [0,2,0,0,0,0|2,0,0]=4 1146 B9R1.69 ClC1=CC=C(Cl)C(Cl)=C1 098910 [0,2,0,0,0,0|2,0,0]=4 1147 B9R1.69 ClC1=CC=C(I)C=C1Br 061641 [0,2,0,0,0,0|2,0,0]=4 1148 B9R1.69 ClC1=CN=C(Cl)C=C1Br 069667 [0,2,0,0,0,0|1,0,0]=3 1149 B9R1.69 ClC1=CN=C(Cl)C=C1I 069668 [0,2,0,0,0,0|1,0,0]=3 1150 B9R1.69 ClC1=NC(Cl)=C(Cl)C=N1 040380 [0,2,0,0,0,0|2,0,0]=4 1151 B9R1.69 ClC1=NC=C(Br)C(Cl)=N1 011581 [0,2,0,0,0,0|2,0,0]=4 1152 B9R1.69 ClC1=NC=C(I)C(Cl)=N1 049479 [0,2,0,0,0,0|2,0,0]=4 1153 B9R1.69 ClC1=NN=C(Cl)C(Br)=C1 227735 [0,2,0,0,0,0|2,0,0]=4 1154 B9R1.69 FC1=C(Br)C=C(Br)C=C1 004653 [0,2,0,0,0,0|2,0,0]=4 1155 B9R1.69 FC1=C(Br)C=C(Cl)C=C1 013192 [0,2,0,0,0,0|2,0,0]=4 1156 B9R1.69 FC1=C(Br)C=C(I)C=C1 013233 [0,2,0,0,0,0|2,0,0]=4 1157 B9R1.69 FC1=C(Br)C=CC(Br)=C1 004652 [0,2,0,0,0,0|2,0,0]=4 1158 B9R1.69 FC1=C(Br)C=CC(Cl)=C1 004151 [0,2,0,0,0,0|2,0,0]=4 1159 B9R1.69 FC1=C(Br)C=CC(I)=C1 008674 [0,2,0,0,0,0|2,0,0]=4 1160 B9R1.69 FC1=C(Cl)C=C(Br)C=C1 002876 [0,2,0,0,0,0|2,0,0]=4 1161 B9R1.69 FC1=C(Cl)C=C(Cl)C=C1 004707 [0,2,0,0,0,0|2,0,0]=4 1162 B9R1.69 FC1=C(Cl)C=C(I)C=C1 004453 [0,2,0,0,0,0|2,0,0]=4 1163 B9R1.69 FC1=C(Cl)C=C(S)C=C1 004469 [0,2,0,0,0,0|2,0,0]=4 1164 B9R1.69 FC1=C(Cl)C=CC(Br)=C1 004152 [0,2,0,0,0,0|2,0,0]=4 1165 B9R1.69 FC1=C(Cl)C=CC(Cl)=C1 009129 [0,2,0,0,0,0|2,0,0]=4 1166 B9R1.69 FC1=C(Cl)C=CC(I)=C1 018374 [0,2,0,0,0,0|2,0,0]=4 1167 B9R1.69 FC1=C(F)C=C(Br)C=C1 001118 [0,2,0,0,0,0|2,0,0]=4 1168 B9R1.69 FC1=C(F)C=C(Cl)C=C1 002875 [0,2,0,0,0,0|2,0,0]=4 1169 B9R1.69 FC1=C(F)C=C(I)C=C1 004819 [0,2,0,0,0,0|2,0,0]=4 1170 B9R1.69 FC1=C(I)C=C(Br)C=C1 024627 [0,2,0,0,0,0|2,0,0]=4 1171 B9R1.69 FC1=C(I)C=C(Cl)C=C1 013274 [0,2,0,0,0,0|2,0,0]=4 1172 B9R1.69 FC1=C(I)C=CC(Br)=C1 001802 [0,2,0,0,0,0|2,0,0]=4 1173 B9R1.69 FC1=C(I)C=CC(Cl)=C1 008158 [0,2,0,0,0,0|2,0,0]=4 1174 B9R1.69 FC1=C(I)C=CC(I)=C1 009150 [0,2,0,0,0,0|2,0,0]=4 1175 B9R1.69 FC1=CC(Br)=C(Br)C=C1 008673 [0,2,0,0,0,0|2,0,0]=4 1176 B9R1.69 FC1=CC(Br)=C(Cl)C=C1 013191 [0,2,0,0,0,0|2,0,0]=4 1177 B9R1.69 FC1=CC(Br)=C(F)C=C1 001800 [0,2,0,0,0,0|2,0,0]=4 1178 B9R1.69 FC1=CC(Br)=C(I)C=C1 013234 [0,2,0,0,0,0|2,0,0]=4 1179 B9R1.69 FC1=CC(Br)=CC=C1S 033394 [0,2,0,0,0,0|2,0,0]=4 1180 B9R1.69 FC1=CC(Cl)=C(Br)C=C1 005539 [0,2,0,0,0,0|2,0,0]=4 1181 B9R1.69 FC1=CC(Cl)=C(Cl)C=C1 002690 [0,2,0,0,0,0|2,0,0]=4 1182 B9R1.69 FC1=CC(Cl)=C(F)C=C1 001596 [0,2,0,0,0,0|2,0,0]=4 1183 B9R1.69 FC1=CC(Cl)=C(I)C=C1 004452 [0,2,0,0,0,0|2,0,0]=4 1184 B9R1.69 FC1=CC(Cl)=C(S)C=C1 008695 [0,2,0,0,0,0|2,0,0]=4 1185 B9R1.69 FC1=CC(F)=C(Br)C=C1 001462 [0,2,0,0,0,0|2,0,0]=4 1186 B9R1.69 FC1=CC(F)=C(Cl)C=C1 004394 [0,2,0,0,0,0|2,0,0]=4 1187 B9R1.69 FC1=CC(F)=C(F)C=C1 001792 [0,2,0,0,0,0|2,0,0]=4 1188 B9R1.69 FC1=CC(F)=C(I)C=C1 004818 [0,2,0,0,0,0|2,0,0]=4 1189 B9R1.69 FC1=CC(F)=C(S)C=C1 004878 [0,2,0,0,0,0|2,0,0]=4 1190 B9R1.69 FC1=CC(I)=C(Br)C=C1 013232 [0,2,0,0,0,0|2,0,0]=4 1191 B9R1.69 FC1=CC(I)=C(Cl)C=C1 013273 [0,2,0,0,0,0|2,0,0]=4 1192 B9R1.69 FC1=CC(I)=C(Cl)C=N1 046507 [0,2,0,0,0,0|1,0,0]=3 1193 B9R1.69 FC1=CC(I)=C(F)C=C1 035737 [0,2,0,0,0,0|2,0,0]=4 1194 B9R1.69 FC1=CC(I)=C(I)C=C1 013307 [0,2,0,0,0,0|2,0,0]=4 1195 B9R1.69 FC1=CC(S)=C(F)C=C1 037938 [0,2,0,0,0,0|2,0,0]=4 1196 B9R1.69 FC1=CC(S)=CC=C1Br 033395 [0,2,0,0,0,0|2,0,0]=4 1197 B9R1.69 FC1=CC(S)=CC=C1Cl 037931 [0,2,0,0,0,0|2,0,0]=4 1198 B9R1.69 FC1=CC=C(S)C(Br)=C1 033391 [0,2,0,0,0,0|2,0,0]=4 1199 B9R1.69 FC1=CC=C(S)C=C1Br 033393 [0,2,0,0,0,0|2,0,0]=4 1200 B9R1.69 FC1=CN=C(Cl)C=C1Br 069657 [0,2,0,0,0,0|1,0,0]=3 1201 B9R1.69 FC1=CN=C(Cl)C=C1I 069656 [0,2,0,0,0,0|1,0,0]=3 1202 B9R1.69 FC1=CN=C(Cl)N=C1Cl 010972 [0,2,0,0,0,0|2,0,0]=4 1203 B9R1.69 FC1=CN=C(F)C=C1I 069649 [0,2,0,0,0,0|1,0,0]=3 1204 B9R1.69 FC1=NC(F)=C(F)C=N1 043808 [0,2,0,0,0,0|2,0,0]=4 1205 B9R1.69 NC1=C(Br)C=C(Br)C=C1 003660 [0,2,0,0,0,0|1,0,0]=3 1206 B9R1.69 NC1=C(Br)C=C(Br)C=N1 018180 [0,2,0,0,0,0|2,0,0]=4 1207 B9R1.69 NC1=C(Br)C=C(Cl)C=C1 061709 [0,2,0,0,0,0|1,0,0]=3 1208 B9R1.69 NC1=C(Br)C=C(Cl)C=N1 033564 [0,2,0,0,0,0|2,0,0]=4 1209 B9R1.69 NC1=C(Br)C=C(F)C=C1 003144 [0,2,0,0,0,0|1,0,0]=3 1210 B9R1.69 NC1=C(Br)C=C(F)C=N1 033566 [0,2,0,0,0,0|2,0,0]=4 1211 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 062558 [0,2,0,0,0,0|1,0,0]=3 1212 B9R1.69 NC1=C(Br)C=CC(F)=C1 008853 [0,2,0,0,0,0|1,0,0]=3 1213 B9R1.69 NC1=C(Br)N=CC(F)=C1 033567 [0,2,0,0,0,0|2,0,0]=4 1214 B9R1.69 NC1=C(Cl)C=C(Br)C=C1 003692 [0,2,0,0,0,0|1,0,0]=3 1215 B9R1.69 NC1=C(Cl)C=C(Cl)C=C1 022088 [0,2,0,0,0,0|1,0,0]=3 1216 B9R1.69 NC1=C(Cl)C=C(F)C=C1 001691 [0,2,0,0,0,0|1,0,0]=3 1217 B9R1.69 NC1=C(Cl)C=C(I)C=C1 005436 [0,2,0,0,0,0|1,0,0]=3 1218 B9R1.69 NC1=C(Cl)C=CC(Br)=C1 024803 [0,2,0,0,0,0|1,0,0]=3 1219 B9R1.69 NC1=C(Cl)C=CC(Cl)=C1 037357 [0,2,0,0,0,0|1,0,0]=3 1220 B9R1.69 NC1=C(Cl)C=CC(F)=C1 004416 [0,2,0,0,0,0|1,0,0]=3 1221 B9R1.69 NC1=C(Cl)N=CC(Br)=C1 033563 [0,2,0,0,0,0|2,0,0]=4 1222 B9R1.69 NC1=C(F)C=C(Br)C=C1 001713 [0,2,0,0,0,0|1,0,0]=3 1223 B9R1.69 NC1=C(F)C=C(Br)C=C1 002190 [0,2,0,0,0,0|1,0,0]=3 1224 B9R1.69 NC1=C(F)C=C(Cl)C=C1 002196 [0,2,0,0,0,0|1,0,0]=3 1225 B9R1.69 NC1=C(F)C=C(F)C=C1 001428 [0,2,0,0,0,0|1,0,0]=3 1226 B9R1.69 NC1=C(F)C=C(F)C=N1 043633 [0,2,0,0,0,0|2,0,0]=4 1227 B9R1.69 NC1=C(F)C=C(I)C=C1 010682 [0,2,0,0,0,0|1,0,0]=3 1228 B9R1.69 NC1=C(F)C=C(O)C=C1 003988 [0,2,0,0,0,0|1,0,0]=3 1229 B9R1.69 NC1=C(F)C=CC(Br)=C1 013203 [0,2,0,0,0,0|1,0,0]=3 1230 B9R1.69 NC1=C(F)C=CC(Cl)=C1 008151 [0,2,0,0,0,0|1,0,0]=3 1231 B9R1.69 NC1=C(F)C=CC(F)=C1 001931 [0,2,0,0,0,0|1,0,0]=3 1232 B9R1.69 NC1=C(I)C=C(Cl)C=C1 005435 [0,2,0,0,0,0|1,0,0]=3 1233 B9R1.69 NC1=C(I)C=C(F)C=C1 019309 [0,2,0,0,0,0|1,0,0]=3 1234 B9R1.69 NC1=C(I)C=C(I)C=C1 005459 [0,2,0,0,0,0|1,0,0]=3 1235 B9R1.69 NC1=C(I)C=CC(Cl)=C1 062562 [0,2,0,0,0,0|1,0,0]=3 1236 B9R1.69 NC1=C(N)C=C(Br)C=C1 041919 [0,2,0,0,0,0|1,0,0]=3 1237 B9R1.69 NC1=C(N)C=C(F)C=C1 004630 [0,2,0,0,0,0|1,0,0]=3 1238 B9R1.69 NC1=C(N)N=C(Cl)C=C1 049431 [0,2,0,0,0,0|2,0,0]=4 1239 B9R1.69 NC1=C(N)N=CC(Br)=C1 043711 [0,2,0,0,0,0|2,0,0]=4 1240 B9R1.69 NC1=C(N)N=CC(Cl)=C1 049470 [0,2,0,0,0,0|2,0,0]=4 1241 B9R1.69 NC1=C(O)C=C(F)C=C1 013054 [0,2,0,0,0,0|1,0,0]=3 1242 B9R1.69 NC1=C(O)C=CC(F)=C1 013048 [0,2,0,0,0,0|1,0,0]=3 1243 B9R1.69 NC1=CC(Br)=C(Br)C=C1 035608 [0,2,0,0,0,0|1,0,0]=3 1244 B9R1.69 NC1=CC(Br)=C(Cl)N=C1 033565 [0,2,0,0,0,0|2,0,0]=4 1245 B9R1.69 NC1=CC(Br)=C(F)C=C1 013091 [0,2,0,0,0,0|1,0,0]=3 1246 B9R1.69 NC1=CC(Br)=CC=C1Br 092047 [0,2,0,0,0,0|1,0,0]=3 1247 B9R1.69 NC1=CC(Br)=CC=C1I 213068 [0,2,0,0,0,0|1,0,0]=3 1248 B9R1.69 NC1=CC(Br)=CC=C1O 036709 [0,2,0,0,0,0|1,0,0]=3 1249 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 003693 [0,2,0,0,0,0|1,0,0]=3 1250 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 022132 [0,2,0,0,0,0|1,0,0]=3 1251 B9R1.69 NC1=CC(Cl)=C(F)C=C1 001682 [0,2,0,0,0,0|1,0,0]=3 1252 B9R1.69 NC1=CC(Cl)=CC=C1O 208929 [0,2,0,0,0,0|1,0,0]=3 1253 B9R1.69 NC1=CC(Cl)=CN=C1Br 024340 [0,2,0,0,0,0|2,0,0]=4 1254 B9R1.69 NC1=CC(Cl)=CN=C1Cl 017241 [0,2,0,0,0,0|2,0,0]=4 1255 B9R1.69 NC1=CC(F)=C(Br)C=C1 005219 [0,2,0,0,0,0|1,0,0]=3 1256 B9R1.69 NC1=CC(F)=C(Cl)C=C1 009745 [0,2,0,0,0,0|1,0,0]=3 1257 B9R1.69 NC1=CC(F)=C(F)C=C1 001459 [0,2,0,0,0,0|1,0,0]=3 1258 B9R1.69 NC1=CC(F)=C(O)C=C1 013049 [0,2,0,0,0,0|1,0,0]=3 1259 B9R1.69 NC1=CC(O)=CC=C1Cl 219343 [0,2,0,0,0,0|1,0,0]=3 1260 B9R1.69 NC1=CC=C(Br)C=C1I 239872 [0,2,0,0,0,0|1,0,0]=3 1261 B9R1.69 NC1=CC=C(Br)C=C1O 064750 [0,2,0,0,0,0|1,0,0]=3 1262 B9R1.69 NC1=CC=C(Br)N=C1N 210038 [0,2,0,0,0,0|2,0,0]=4 1263 B9R1.69 NC1=CC=C(Cl)C(Br)=C1 061640 [0,2,0,0,0,0|1,0,0]=3 1264 B9R1.69 NC1=CC=C(Cl)C=C1N 078681 [0,2,0,0,0,0|1,0,0]=3 1265 B9R1.69 NC1=CC=C(Cl)C=C1O 077868 [0,2,0,0,0,0|1,0,0]=3 1266 B9R1.69 NC1=CC=C(Cl)N=C1Cl 017208 [0,2,0,0,0,0|2,0,0]=4 1267 B9R1.69 NC1=CC=C(O)C(Br)=C1 210030 [0,2,0,0,0,0|1,0,0]=3 1268 B9R1.69 NC1=CC=C(O)C(Cl)=C1 078384 [0,2,0,0,0,0|1,0,0]=3 1269 B9R1.69 NC1=CC=C(O)C(F)=C1 467247 [0,2,0,0,0,0|1,0,0]=3 1270 B9R1.69 NC1=CC=C(O)C=C1Cl 064719 [0,2,0,0,0,0|1,0,0]=3 1271 B9R1.69 NC1=CC=C(O)C=C1O 224619 [0,2,0,0,0,0|1,0,0]=3 1272 B9R1.69 NC1=CN=C(Cl)N=C1Cl 033477 [0,2,0,0,0,0|2,0,0]=4 1273 B9R1.69 NC1=CN=C(Cl)N=C1N 092335 [0,2,0,0,0,0|1,0,0]=3 1274 B9R1.69 NC1=NC(=O)NC=C1Br 210091 [0,2,0,0,0,0|1,0,1]=4 1275 B9R1.69 NC1=NC(=O)NC=C1F 006215 [0,2,0,0,0,0|1,0,1]=4 1276 B9R1.69 NC1=NC(Br)=CC=C1O 222257 [0,2,0,0,0,0|2,0,0]=4 1277 B9R1.69 NC1=NC(Cl)=NC=C1Br 016248 [0,2,0,0,0,0|1,0,0]=3 1278 B9R1.69 NC1=NC=C(Br)C(Cl)=C1 079650 [0,2,0,0,0,0|1,0,0]=3 1279 B9R1.69 NC1=NC=C(Br)C=C1I 036677 [0,2,0,0,0,0|2,0,0]=4 1280 B9R1.69 NC1=NC=C(Cl)C=C1Cl 064838 [0,2,0,0,0,0|2,0,0]=4 1281 B9R1.69 NC1=NN=C(Cl)C=C1Br 076814 [0,2,0,0,0,0|2,0,0]=4 1282 B9R1.69 OC1=C(Br)C=C(Br)C=C1 237133 [0,2,0,0,0,0|2,0,0]=4 1283 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 047730 [0,2,0,0,0,0|2,0,0]=4 1284 B9R1.69 OC1=C(Br)C=C(F)C=C1 004231 [0,2,0,0,0,0|2,0,0]=4 1285 B9R1.69 OC1=C(Br)C=CC(F)=C1 004232 [0,2,0,0,0,0|2,0,0]=4 1286 B9R1.69 OC1=C(Cl)C=C(F)C=C1 001427 [0,2,0,0,0,0|2,0,0]=4 1287 B9R1.69 OC1=C(Cl)C=CC(F)=C1 004457 [0,2,0,0,0,0|2,0,0]=4 1288 B9R1.69 OC1=C(F)C=C(Br)C=C1 004233 [0,2,0,0,0,0|2,0,0]=4 1289 B9R1.69 OC1=C(F)C=C(Cl)C=C1 013284 [0,2,0,0,0,0|2,0,0]=4 1290 B9R1.69 OC1=C(F)C=C(F)C=C1 001926 [0,2,0,0,0,0|2,0,0]=4 1291 B9R1.69 OC1=C(F)C=CC(Br)=C1 036161 [0,2,0,0,0,0|2,0,0]=4 1292 B9R1.69 OC1=C(F)C=CC(Cl)=C1 013285 [0,2,0,0,0,0|2,0,0]=4 1293 B9R1.69 OC1=C(F)C=CC(F)=C1 001943 [0,2,0,0,0,0|2,0,0]=4 1294 B9R1.69 OC1=C(O)C=C(F)C=C1 013093 [0,2,0,0,0,0|2,0,0]=4 1295 B9R1.69 OC1=CC(Br)=C(Cl)C=C1 044958 [0,2,0,0,0,0|2,0,0]=4 1296 B9R1.69 OC1=CC(Cl)=C(Cl)C=C1 013050 [0,2,0,0,0,0|2,0,0]=4 1297 B9R1.69 OC1=CC(Cl)=C(F)C=C1 004458 [0,2,0,0,0,0|2,0,0]=4 1298 B9R1.69 OC1=CC(F)=C(Cl)C=C1 004459 [0,2,0,0,0,0|2,0,0]=4 1299 B9R1.69 OC1=CC(F)=C(F)C=C1 002091 [0,2,0,0,0,0|2,0,0]=4 1300 B9R1.69 OC1=CC=C(Br)C(F)=C1 019215 [0,2,0,0,0,0|2,0,0]=4 1301 B9R1.69 OC1=CC=C(Br)C(O)=C1 091463 [0,2,0,0,0,0|2,0,0]=4 1302 B9R1.69 OC1=CC=C(Br)C=C1Cl 079102 [0,2,0,0,0,0|2,0,0]=4 1303 B9R1.69 OC1=CC=C(Br)C=C1O 210057 [0,2,0,0,0,0|2,0,0]=4 1304 B9R1.69 OC1=CC=C(Cl)C(O)=C1 208944 [0,2,0,0,0,0|2,0,0]=4 1305 B9R1.69 OC1=CC=C(Cl)C=C1Cl 214815 [0,2,0,0,0,0|2,0,0]=4 1306 B9R1.69 OC1=CC=C(Cl)C=C1I 067204 [0,2,0,0,0,0|2,0,0]=4 1307 B9R1.69 OC1=CC=C(F)C(Br)=C1 076795 [0,2,0,0,0,0|2,0,0]=4 1308 B9R1.69 SC1=C(C)C=CC(Cl)=C1 024837 [0,2,0,0,0,0|2,0,0]=4 1309 B9R1.69 SC1=C(Cl)C=C(Cl)C=C1 003353 [0,2,0,0,0,0|2,0,0]=4 1310 B9R1.69 SC1=CC(Cl)=C(Cl)C=C1 003356 [0,2,0,0,0,0|2,0,0]=4 1311 B9R1.3 BrC1=CC=CC(Br)=C1I 043141 [0,2,0,0,0,0|2,0,0]=4 1312 B9R1.3 CC1=C(Br)C(Cl)=CC=C1 018258 [0,2,0,0,0,0|2,0,0]=4 1313 B9R1.3 CC1=C(Br)C=CC=C1F 005235 [0,2,0,0,0,0|2,0,0]=4 1314 B9R1.3 CC1=C(C)C(F)=CC=C1 002577 [0,2,0,0,0,0|2,0,0]=4 1315 B9R1.3 CC1=C(C)C(I)=CC=C1 001050 [0,2,0,0,0,0|2,0,0]=4 1316 B9R1.3 CC1=C(C)C(O)=CC=C1 358211 [0,2,0,0,0,0|2,0,0]=4 1317 B9R1.3 CC1=C(Cl)C(Br)=CC=C1 024558 [0,2,0,0,0,0|2,0,0]=4 1318 B9R1.3 CC1=C(Cl)C(F)=CC=C1 036297 [0,2,0,0,0,0|2,0,0]=4 1319 B9R1.3 CC1=C(Cl)C(I)=CC=C1 219773 [0,2,0,0,0,0|2,0,0]=4 1320 B9R1.3 CC1=C(Cl)C(N)=CC=C1 076000 [0,2,0,0,0,0|1,0,0]=3 1321 B9R1.3 CC1=C(Cl)C=CC=C1Br 018260 [0,2,0,0,0,0|2,0,0]=4 1322 B9R1.3 CC1=C(Cl)C=CC=C1F 001599 [0,2,0,0,0,0|2,0,0]=4 1323 B9R1.3 CC1=C(Cl)C=CC=C1O 018406 [0,2,0,0,0,0|2,0,0]=4 1324 B9R1.3 CC1=C(Cl)N=CN=C1Cl 040227 [0,2,0,0,0,0|2,0,0]=4 1325 B9R1.3 CC1=C(F)C(Br)=CC=C1 032928 [0,2,0,0,0,0|2,0,0]=4 1326 B9R1.3 CC1=C(F)C(F)=CC=C1 005238 [0,2,0,0,0,0|2,0,0]=4 1327 B9R1.3 CC1=C(F)C(I)=CC=C1 211591 [0,2,0,0,0,0|2,0,0]=4 1328 B9R1.3 CC1=C(F)C(O)=CC=C1 036232 [0,2,0,0,0,0|2,0,0]=4 1329 B9R1.3 CC1=C(F)C=CC=C1F 003205 [0,2,0,0,0,0|2,0,0]=4 1330 B9R1.3 CC1=C(F)C=CC=C1S 037943 [0,2,0,0,0,0|2,0,0]=4 1331 B9R1.3 CC1=C(I)C(F)=CC=C1 092268 [0,2,0,0,0,0|2,0,0]=4 1332 B9R1.3 CC1=C(I)C=CC=C1Br 037475 [0,2,0,0,0,0|2,0,0]=4 1333 B9R1.3 CC1=C(I)C=CC=C1Cl 018382 [0,2,0,0,0,0|2,0,0]=4 1334 B9R1.3 CC1=C(I)C=CC=C1F 013320 [0,2,0,0,0,0|2,0,0]=4 1335 B9R1.3 CC1=C(I)C=CC=C1N 077814 [0,2,0,0,0,0|1,0,0]=3 1336 B9R1.3 CC1=C(I)C=CN=C1Cl 036263 [0,2,0,0,0,0|1,0,0]=3 1337 B9R1.3 CC1=C(N)C(Br)=CC=C1 013450 [0,2,0,0,0,0|1,0,0]=3 1338 B9R1.3 CC1=C(N)C(Cl)=NC=C1 021733 [0,2,0,0,0,0|1,0,0]=3 1339 B9R1.3 CC1=C(N)C(N)=CC=C1 064679 [0,2,0,0,0,0|1,0,0]=3 1340 B9R1.3 CC1=C(N)C=CC=C1Br 037201 [0,2,0,0,0,0|1,0,0]=3 1341 B9R1.3 CC1=C(N)C=CC=C1Cl 021716 [0,2,0,0,0,0|1,0,0]=3 1342 B9R1.3 CC1=C(N)C=CC=C1F 001693 [0,2,0,0,0,0|1,0,0]=3 1343 B9R1.3 CC1=C(N)C=CC=C1N 462876 [0,2,0,0,0,0|1,0,0]=3 1344 B9R1.3 CC1=C(O)C(=O)C=CO1 068773 [0,2,0,0,0,0|2,0,0]=4 1345 B9R1.3 CC1=C(O)C(Cl)=CC=C1 018405 [0,2,0,0,0,0|2,0,0]=4 1346 B9R1.3 CC1=C(O)C=CC=C1O 208710 [0,2,0,0,0,0|2,0,0]=4 1347 B9R1.3 CC1=CC=CC(Br)=C1C 018326 [0,2,0,0,0,0|2,0,0]=4 1348 B9R1.3 CC1=CC=CC(C)=C1Br 018325 [0,2,0,0,0,0|2,0,0]=4 1349 B9R1.3 CC1=CC=CC(C)=C1Cl 018459 [0,2,0,0,0,0|2,0,0]=4 1350 B9R1.3 CC1=CC=CC(C)=C1F 003242 [0,2,0,0,0,0|2,0,0]=4 1351 B9R1.3 CC1=CC=CC(C)=C1I 002976 [0,2,0,0,0,0|2,0,0]=4 1352 B9R1.3 CC1=CC=CC(C)=C1N 033243 [0,2,0,0,0,0|1,0,0]=3 1353 B9R1.3 CC1=CC=CC(C)=C1O 078941 [0,2,0,0,0,0|2,0,0]=4 1354 B9R1.3 CC1=CC=CC(C)=C1S 001346 [0,2,0,0,0,0|2,0,0]=4 1355 B9R1.3 CC1=CC=CC(Cl)=C1I 018383 [0,2,0,0,0,0|2,0,0]=4 1356 B9R1.3 CC1=CC=CC(Cl)=C1N 005545 [0,2,0,0,0,0|1,0,0]=3 1357 B9R1.3 CC1=CC=CC(F)=C1N 012747 [0,2,0,0,0,0|1,0,0]=3 1358 B9R1.3 CC1=CC=CC(I)=C1Br 038627 [0,2,0,0,0,0|2,0,0]=4 1359 B9R1.3 CC1=CC=CC(N)=C1Br 038626 [0,2,0,0,0,0|1,0,0]=3 1360 B9R1.3 CC1=CC=CC(N)=C1C 098346 [0,2,0,0,0,0|1,0,0]=3 1361 B9R1.3 CC1=CC=CC(N)=C1F 033667 [0,2,0,0,0,0|1,0,0]=3 1362 B9R1.3 CC1=CC=CC(N)=C1I 038629 [0,2,0,0,0,0|1,0,0]=3 1363 B9R1.3 CC1=CC=CC(N)=C1O 076522 [0,2,0,0,0,0|1,0,0]=3 1364 B9R1.3 CC1=NC=CC(Br)=C1N 210002 [0,2,0,0,0,0|1,0,0]=3 1365 B9R1.3 CC1=NC=CC(N)=C1C 024705 [0,2,0,0,0,0|0,0,0]=2 1366 B9R1.3 ClC1=C(Br)C(Br)=CC=C1 043419 [0,2,0,0,0,0|2,0,0]=4 1367 B9R1.3 ClC1=C(Br)C=CC=C1Br 043139 [0,2,0,0,0,0|2,0,0]=4 1368 B9R1.3 ClC1=C(Cl)C(Br)=CC=C1 211245 [0,2,0,0,0,0|2,0,0]=4 1369 B9R1.3 ClC1=C(Cl)C(I)=CC=C1 001165 [0,2,0,0,0,0|2,0,0]=4 1370 B9R1.3 ClC1=CC=CC(Br)=C1I 043369 [0,2,0,0,0,0|2,0,0]=4 1371 B9R1.3 ClC1=CC=CC(Cl)=C1Br 001113 [0,2,0,0,0,0|2,0,0]=4 1372 B9R1.3 ClC1=CC=CC(Cl)=C1Cl 241235 [0,2,0,0,0,0|2,0,0]=4 1373 B9R1.3 ClC1=CC=CC(Cl)=C1I 018526 [0,2,0,0,0,0|2,0,0]=4 1374 B9R1.3 ClC1=CN=CC(Cl)=C1Br 075167 [0,2,0,0,0,0|1,0,0]=3 1375 B9R1.3 ClC1=CN=CC(Cl)=C1Cl 075168 [0,2,0,0,0,0|1,0,0]=3 1376 B9R1.3 ClC1=NC=CC(Cl)=C1Br 044661 [0,2,0,0,0,0|1,0,0]=3 1377 B9R1.3 ClC1=NC=CC(Cl)=C1I 043013 [0,2,0,0,0,0|1,0,0]=3 1378 B9R1.3 ClC1=NC=CC(I)=C1Cl 075173 [0,2,0,0,0,0|1,0,0]=3 1379 B9R1.3 FC1=C(Br)C(Br)=CC=C1 061589 [0,2,0,0,0,0|2,0,0]=4 1380 B9R1.3 FC1=C(Br)C=CC=C1Br 070572 [0,2,0,0,0,0|2,0,0]=4 1381 B9R1.3 FC1=C(Br)C=CC=C1Cl 024515 [0,2,0,0,0,0|2,0,0]=4 1382 B9R1.3 FC1=C(Br)C=CC=C1I 070561 [0,2,0,0,0,0|2,0,0]=4 1383 B9R1.3 FC1=C(Cl)C(Cl)=CC=C1 004706 [0,2,0,0,0,0|2,0,0]=4 1384 B9R1.3 FC1=C(Cl)C=CC=C1Cl 003714 [0,2,0,0,0,0|2,0,0]=4 1385 B9R1.3 FC1=C(Cl)N=CN=C1Cl 076464 [0,2,0,0,0,0|2,0,0]=4 1386 B9R1.3 FC1=C(I)C(Br)=CC=C1 061590 [0,2,0,0,0,0|2,0,0]=4 1387 B9R1.3 FC1=C(I)C=CC=C1Cl 021395 [0,2,0,0,0,0|2,0,0]=4 1388 B9R1.3 FC1=C(I)C=CN=C1Cl 069651 [0,2,0,0,0,0|1,0,0]=3 1389 B9R1.3 FC1=CC=CC(Br)=C1Cl 043103 [0,2,0,0,0,0|2,0,0]=4 1390 B9R1.3 FC1=CC=CC(Br)=C1F 001797 [0,2,0,0,0,0|2,0,0]=4 1391 B9R1.3 FC1=CC=CC(Cl)=C1Br 035684 [0,2,0,0,0,0|2,0,0]=4 1392 B9R1.3 FC1=CC=CC(Cl)=C1I 035683 [0,2,0,0,0,0|2,0,0]=4 1393 B9R1.3 FC1=CC=CC(F)=C1Br 001117 [0,2,0,0,0,0|2,0,0]=4 1394 B9R1.3 FC1=CC=CC(F)=C1F 001791 [0,2,0,0,0,0|2,0,0]=4 1395 B9R1.3 FC1=CC=CC(F)=C1I 032511 [0,2,0,0,0,0|2,0,0]=4 1396 B9R1.3 FC1=CC=CC(I)=C1Cl 036326 [0,2,0,0,0,0|2,0,0]=4 1397 B9R1.3 FC1=CC=CC(I)=C1F 035730 [0,2,0,0,0,0|2,0,0]=4 1398 B9R1.3 FC1=CN=CC(F)=C1I 080085 [0,2,0,0,0,0|1,0,0]=3 1399 B9R1.3 FC1=NC=CC(Br)=C1Cl 044855 [0,2,0,0,0,0|1,0,0]=3 1400 B9R1.3 FC1=NC=CC(I)=C1Cl 069662 [0,2,0,0,0,0|1,0,0]=3 1401 B9R1.3 FC1=NC=CC(I)=C1F 069643 [0,2,0,0,0,0|1,0,0]=3 1402 B9R1.3 NC1=C(Br)C=CC=C1Br 093486 [0,2,0,0,0,0|1,0,0]=3 1403 B9R1.3 NC1=C(Cl)C(Br)=CC=C1 062571 [0,2,0,0,0,0|1,0,0]=3 1404 B9R1.3 NC1=C(Cl)C(Cl)=CC=C1 021881 [0,2,0,0,0,0|1,0,0]=3 1405 B9R1.3 NC1=C(Cl)C(F)=CC=C1 036325 [0,2,0,0,0,0|1,0,0]=3 1406 B9R1.3 NC1=C(Cl)C=CC=C1Cl 005424 [0,2,0,0,0,0|1,0,0]=3 1407 B9R1.3 NC1=C(Cl)C=CC=C1F 004417 [0,2,0,0,0,0|1,0,0]=3 1408 B9R1.3 NC1=C(Cl)C=NC=C1Cl 024644 [0,2,0,0,0,0|0,0,0]=2 1409 B9R1.3 NC1=C(Cl)N=CN=C1Cl 024634 [0,2,0,0,0,0|2,0,0]=4 1410 B9R1.3 NC1=C(F)C(Cl)=CC=C1 004418 [0,2,0,0,0,0|1,0,0]=3 1411 B9R1.3 NC1=C(F)C(F)=CC=C1 001855 [0,2,0,0,0,0|1,0,0]=3 1412 B9R1.3 NC1=C(F)C=CC=C1Br 043663 [0,2,0,0,0,0|1,0,0]=3 1413 B9R1.3 NC1=C(F)C=CC=C1F 001458 [0,2,0,0,0,0|1,0,0]=3 1414 B9R1.3 NC1=C(I)C=CC=C1Cl 216382 [0,2,0,0,0,0|1,0,0]=3 1415 B9R1.3 NC1=C(I)C=CC=C1O 040830 [0,2,0,0,0,0|1,0,0]=3 1416 B9R1.3 NC1=C(N)C(=O)NC=N1 363441 [0,2,0,0,0,0|1,0,1]=4 1417 B9R1.3 NC1=C(N)C(Br)=CN=C1 077033 [0,2,0,0,0,0|0,0,0]=2 1418 B9R1.3 NC1=C(N)C(O)=CC=C1 208713 [0,2,0,0,0,0|1,0,0]=3 1419 B9R1.3 NC1=C(O)C=CC=C1O 091453 [0,2,0,0,0,0|1,0,0]=3 1420 B9R1.3 NC1=CC=CC(Br)=C1F 077980 [0,2,0,0,0,0|1,0,0]=3 1421 B9R1.3 NC1=CC=CC(Br)=C1N 078855 [0,2,0,0,0,0|1,0,0]=3 1422 B9R1.3 NC1=CC=CC(Br)=C1O 210031 [0,2,0,0,0,0|1,0,0]=3 1423 B9R1.3 NC1=CC=CC(Cl)=C1Br 078926 [0,2,0,0,0,0|1,0,0]=3 1424 B9R1.3 NC1=CC=CC(Cl)=C1N 079799 [0,2,0,0,0,0|1,0,0]=3 1425 B9R1.3 NC1=CC=CC(F)=C1Br 040426 [0,2,0,0,0,0|1,0,0]=3 1426 B9R1.3 NC1=NC=CC(Cl)=C1I 091919 [0,2,0,0,0,0|1,0,0]=3 1427 B9R1.3 NC1=NC=NC(Cl)=C1Cl 076890 [0,2,0,0,0,0|1,0,0]=3 1428 B9R1.3 NC1=NC=NC(Cl)=C1F 092861 [0,2,0,0,0,0|1,0,0]=3 1429 B9R1.3 NC1=NC=NC(O)=C1N 077221 [0,2,0,0,0,0|1,0,0]=3 1430 B9R1.3 O=C1NN=CC(Cl)=C1Cl 049500 [0,2,0,0,0,0|2,0,0]=4 1431 B9R1.3 OC1=C(Br)C=CC=C1Br 077432 [0,2,0,0,0,0|2,0,0]=4 1432 B9R1.3 OC1=C(Cl)C(Cl)=CC=C1 008840 [0,2,0,0,0,0|2,0,0]=4 1433 B9R1.3 OC1=C(Cl)C=CC=C1Cl 008837 [0,2,0,0,0,0|2,0,0]=4 1434 B9R1.3 OC1=C(Cl)C=CC=C1F 005664 [0,2,0,0,0,0|2,0,0]=4 1435 B9R1.3 OC1=C(F)C(Br)=CC=C1 046496 [0,2,0,0,0,0|2,0,0]=4 1436 B9R1.3 OC1=C(F)C(Cl)=CC=C1 005665 [0,2,0,0,0,0|2,0,0]=4 1437 B9R1.3 OC1=C(F)C(F)=CC=C1 001865 [0,2,0,0,0,0|2,0,0]=4 1438 B9R1.3 OC1=C(F)C=CC=C1F 001418 [0,2,0,0,0,0|2,0,0]=4 1439 B9R1.3 OC1=C(O)C(F)=CC=C1 006210 [0,2,0,0,0,0|2,0,0]=4 1440 B9R1.3 OC1=CC=CC(Br)=C1O 079386 [0,2,0,0,0,0|2,0,0]=4 1441 B9R1.3 OC1=CC=CC(F)=C1Br 036234 [0,2,0,0,0,0|2,0,0]=4 1442 B9R1.3 OC1=CC=CC(O)=C1Br 047531 [0,2,0,0,0,0|2,0,0]=4 1443 B9R1.3 OC1=CC=CC(O)=C1Cl 078307 [0,2,0,0,0,0|2,0,0]=4 1444 B9R1.3 OC1=CC=CC(O)=C1O 079472 [0,2,0,0,0,0|2,0,0]=4 1445 B9R1.3 SC1=C(Cl)C(Cl)=CC=C1 003351 [0,2,0,0,0,0|2,0,0]=4 1446 B9R1.34 BrC1=CC(Br)=CC(Br)=C1 079486 [0,2,0,0,0,0|2,0,0]=4 1447 B9R1.34 CC1=CC(=O)C=C(C)O1 069041 [0,2,0,0,0,0|2,0,0]=4 1448 B9R1.34 CC1=CC(=O)OC(C)=C1 045789 [0,2,0,0,0,0|2,0,0]=4 1449 B9R1.34 CC1=CC(=S)OC(C)=C1 180125 [0,2,0,0,0,0|2,0,0]=4 1450 B9R1.34 CC1=CC(Br)=CC(Br)=C1 037721 [0,2,0,0,0,0|2,0,0]=4 1451 B9R1.34 CC1=CC(Br)=CC(C)=N1 077942 [0,2,0,0,0,0|1,0,0]=3 1452 B9R1.34 CC1=CC(Br)=CC(F)=C1 021361 [0,2,0,0,0,0|2,0,0]=4 1453 B9R1.34 CC1=CC(Br)=NC(Br)=C1 078035 [0,2,0,0,0,0|1,0,0]=3 1454 B9R1.34 CC1=CC(C)=CC(Br)=C1 008025 [0,2,0,0,0,0|2,0,0]=4 1455 B9R1.34 CC1=CC(C)=CC(C)=C1 095021 [0,2,0,0,0,0|2,0,0]=4 1456 B9R1.34 CC1=CC(C)=CC(Cl)=C1 018463 [0,2,0,0,0,0|2,0,0]=4 1457 B9R1.34 CC1=CC(C)=CC(F)=C1 002576 [0,2,0,0,0,0|2,0,0]=4 1458 B9R1.34 CC1=CC(C)=CC(I)=C1 002953 [0,2,0,0,0,0|2,0,0]=4 1459 B9R1.34 CC1=CC(C)=CC(I)=C1 106112 [0,2,0,0,0,0|2,0,0]=4 1460 B9R1.34 CC1=CC(C)=CC(N)=C1 095075 [0,2,0,0,0,0|1,0,0]=3 1461 B9R1.34 CC1=CC(C)=CC(O)=C1 214771 [0,2,0,0,0,0|2,0,0]=4 1462 B9R1.34 CC1=CC(C)=CC(S)=C1 001348 [0,2,0,0,0,0|2,0,0]=4 1463 B9R1.34 CC1=CC(C)=NC(C)=C1 005102 [0,2,0,0,0,0|1,0,0]=3 1464 B9R1.34 CC1=CC(C)=NC(C)=C1 102991 [0,2,0,0,0,0|1,0,0]=3 1465 B9R1.34 CC1=CC(C)=NC(Cl)=N1 023423 [0,2,0,0,0,0|2,0,0]=4 1466 B9R1.34 CC1=CC(C)=NC(N)=N1 036339 [0,2,0,0,0,0|2,0,0]=4 1467 B9R1.34 CC1=CC(C)=NC(S)=N1 036395 [0,2,0,0,0,0|2,0,0]=4 1468 B9R1.34 CC1=CC(C)=[O+]C(C)=C1 005450 [0,2,0,0,0,0|2,0,0]=4 1469 B9R1.34 CC1=CC(Cl)=CC(Br)=C1 032723 [0,2,0,0,0,0|2,0,0]=4 1470 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 047109 [0,2,0,0,0,0|1,0,0]=3 1471 B9R1.34 CC1=CC(Cl)=CC(N)=C1 079788 [0,2,0,0,0,0|1,0,0]=3 1472 B9R1.34 CC1=CC(Cl)=CC(N)=N1 079721 [0,2,0,0,0,0|1,0,0]=3 1473 B9R1.34 CC1=CC(Cl)=NC(C)=C1 037141 [0,2,0,0,0,0|1,0,0]=3 1474 B9R1.34 CC1=CC(Cl)=NC(C)=N1 058303 [0,2,0,0,0,0|2,0,0]=4 1475 B9R1.34 CC1=CC(Cl)=NC(Cl)=C1 075736 [0,2,0,0,0,0|1,0,0]=3 1476 B9R1.34 CC1=CC(Cl)=NC(Cl)=N1 036406 [0,2,0,0,0,0|2,0,0]=4 1477 B9R1.34 CC1=CC(Cl)=NC(N)=N1 036342 [0,2,0,0,0,0|2,0,0]=4 1478 B9R1.34 CC1=CC(F)=CC(Cl)=C1 044238 [0,2,0,0,0,0|2,0,0]=4 1479 B9R1.34 CC1=CC(F)=CC(N)=C1 044821 [0,2,0,0,0,0|1,0,0]=3 1480 B9R1.34 CC1=CC(I)=CC(F)=C1 069625 [0,2,0,0,0,0|2,0,0]=4 1481 B9R1.34 CC1=CC(N)=CC(Br)=C1 038770 [0,2,0,0,0,0|1,0,0]=3 1482 B9R1.34 CC1=CC(N)=CC(O)=C1 092274 [0,2,0,0,0,0|1,0,0]=3 1483 B9R1.34 CC1=CC(N)=NC(Br)=C1 093618 [0,2,0,0,0,0|1,0,0]=3 1484 B9R1.34 CC1=CC(N)=NC(C)=C1 046704 [0,2,0,0,0,0|1,0,0]=3 1485 B9R1.34 CC1=CC(N)=NC(C)=N1 233210 [0,2,0,0,0,0|1,0,0]=3 1486 B9R1.34 CC1=CC(N)=NC(Cl)=C1 093619 [0,2,0,0,0,0|1,0,0]=3 1487 B9R1.34 CC1=CC(O)=CC(=O)O1 003638 [0,2,0,0,0,0|2,0,0]=4 1488 B9R1.34 CC1=CC(O)=CC(C)=N1 011702 [0,2,0,0,0,0|1,0,0]=3 1489 B9R1.34 CC1=CC(O)=CC(O)=C1 005921 [0,2,0,0,0,0|2,0,0]=4 1490 B9R1.34 CC1=CC(O)=CC(O)=N1 068449 [0,2,0,0,0,0|1,0,0]=3 1491 B9R1.34 CC1=CC(O)=NC(C)=N1 222325 [0,2,0,0,0,0|2,0,0]=4 1492 B9R1.34 CC1=CC(O)=NC(O)=N1 077360 [0,2,0,0,0,0|2,0,0]=4 1493 B9R1.34 CC1=NC(Cl)=CC(Cl)=N1 036431 [0,2,0,0,0,0|2,0,0]=4 1494 B9R1.34 CC1=NC(Cl)=CC(N)=N1 078280 [0,2,0,0,0,0|1,0,0]=3 1495 B9R1.34 CC1=NC(N)=NC(N)=N1 238997 [0,2,0,0,0,0|2,0,0]=4 1496 B9R1.34 CC1=NC(N)=NC(O)=C1 076960 [0,2,0,0,0,0|2,0,0]=4 1497 B9R1.34 CC1=NC(O)=CC(O)=N1 036424 [0,2,0,0,0,0|2,0,0]=4 1498 B9R1.34 ClC1=CC(Br)=CC(Br)=C1 078588 [0,2,0,0,0,0|2,0,0]=4 1499 B9R1.34 ClC1=CC(Br)=CC(I)=C1 078356 [0,2,0,0,0,0|2,0,0]=4 1500 B9R1.34 ClC1=CC(Cl)=CC(Br)=C1 023277 [0,2,0,0,0,0|2,0,0]=4 1501 B9R1.34 ClC1=CC(Cl)=CC(I)=C1 018527 [0,2,0,0,0,0|2,0,0]=4 1502 B9R1.34 ClC1=CC(Cl)=NC(Cl)=C1 047532 [0,2,0,0,0,0|1,0,0]=3 1503 B9R1.34 ClC1=CC(Cl)=NC(Cl)=N1 036437 [0,2,0,0,0,0|2,0,0]=4 1504 B9R1.34 ClC1=CC(I)=CC(Cl)=N1 045180 [0,2,0,0,0,0|1,0,0]=3 1505 B9R1.34 FC1=CC(Br)=CC(Br)=C1 004651 [0,2,0,0,0,0|2,0,0]=4 1506 B9R1.34 FC1=CC(Br)=CC(Cl)=C1 004150 [0,2,0,0,0,0|2,0,0]=4 1507 B9R1.34 FC1=CC(Cl)=CC(Cl)=C1 004709 [0,2,0,0,0,0|2,0,0]=4 1508 B9R1.34 FC1=CC(F)=CC(Br)=C1 001416 [0,2,0,0,0,0|2,0,0]=4 1509 B9R1.34 FC1=CC(F)=CC(Cl)=C1 001484 [0,2,0,0,0,0|2,0,0]=4 1510 B9R1.34 FC1=CC(F)=CC(F)=C1 001585 [0,2,0,0,0,0|2,0,0]=4 1511 B9R1.34 FC1=CC(F)=CC(I)=C1 024566 [0,2,0,0,0,0|2,0,0]=4 1512 B9R1.34 FC1=CC(F)=CC(S)=C1 023121 [0,2,0,0,0,0|2,0,0]=4 1513 B9R1.34 FC1=CC(F)=NC(F)=N1 007722 [0,2,0,0,0,0|2,0,0]=4 1514 B9R1.34 FC1=CC(I)=CC(Br)=C1 023889 [0,2,0,0,0,0|2,0,0]=4 1515 B9R1.34 FC1=CC(I)=CC(Cl)=C1 094952 [0,2,0,0,0,0|2,0,0]=4 1516 B9R1.34 FC1=CC(I)=CC(F)=N1 446274 [0,2,0,0,0,0|1,0,0]=3 1517 B9R1.34 FC1=CC(S)=CC(Cl)=C1 023127 [0,2,0,0,0,0|2,0,0]=4 1518 B9R1.34 NC1=CC(=O)NC(=S)N1 036345 [0,2,0,0,0,0|1,0,1]=4 1519 B9R1.34 NC1=CC(=O)NC(=S)N1 064918 [0,2,0,0,0,0|1,0,1]=4 1520 B9R1.34 NC1=CC(Br)=CC(F)=C1 032713 [0,2,0,0,0,0|1,0,0]=3 1521 B9R1.34 NC1=CC(Cl)=CC(Br)=C1 038769 [0,2,0,0,0,0|1,0,0]=3 1522 B9R1.34 NC1=CC(Cl)=CC(Cl)=C1 022133 [0,2,0,0,0,0|1,0,0]=3 1523 B9R1.34 NC1=CC(Cl)=CC(F)=C1 035862 [0,2,0,0,0,0|1,0,0]=3 1524 B9R1.34 NC1=CC(Cl)=NC(Cl)=N1 036785 [0,2,0,0,0,0|1,0,0]=3 1525 B9R1.34 NC1=CC(Cl)=NC(N)=N1 011624 [0,2,0,0,0,0|1,0,0]=3 1526 B9R1.34 NC1=CC(F)=CC(F)=C1 001690 [0,2,0,0,0,0|1,0,0]=3 1527 B9R1.34 NC1=CC(N)=CC(Cl)=C1 239383 [0,2,0,0,0,0|1,0,0]=3 1528 B9R1.34 NC1=CC(N)=NC(N)=N1 036440 [0,2,0,0,0,0|1,0,0]=3 1529 B9R1.34 NC1=CC(O)=NC(N)=N1 036405 [0,2,0,0,0,0|1,0,0]=3 1530 B9R1.34 NC1=CC(O)=NC(O)=N1 036336 [0,2,0,0,0,0|1,0,0]=3 1531 B9R1.34 NC1=NC(Cl)=CC(Cl)=C1 036799 [0,2,0,0,0,0|1,0,0]=3 1532 B9R1.34 NC1=NC(Cl)=CC(Cl)=N1 011355 [0,2,0,0,0,0|2,0,0]=4 1533 B9R1.34 NC1=NC(Cl)=CC(O)=N1 036763 [0,2,0,0,0,0|2,0,0]=4 1534 B9R1.34 NC1=NC(N)=NC(Cl)=N1 024242 [0,2,0,0,0,0|2,0,0]=4 1535 B9R1.34 NC1=NC(N)=NC(N)=N1 358411 [0,2,0,0,0,0|2,0,0]=4 1536 B9R1.34 NC1=NC(O)=CC(O)=N1 036340 [0,2,0,0,0,0|2,0,0]=4 1537 B9R1.34 NC1=NC(S)=NC(O)=C1 077387 [0,2,0,0,0,0|1,0,0]=3 1538 B9R1.34 OC1=CC(Br)=CC(Br)=C1 091923 [0,2,0,0,0,0|2,0,0]=4 1539 B9R1.34 OC1=CC(Cl)=CC(Br)=C1 077970 [0,2,0,0,0,0|2,0,0]=4 1540 B9R1.34 OC1=CC(Cl)=CC(Cl)=C1 013051 [0,2,0,0,0,0|2,0,0]=4 1541 B9R1.34 OC1=CC(Cl)=CC(F)=C1 013283 [0,2,0,0,0,0|2,0,0]=4 1542 B9R1.34 OC1=CC(F)=CC(Br)=C1 036239 [0,2,0,0,0,0|2,0,0]=4 1543 B9R1.34 OC1=CC(F)=CC(F)=C1 001659 [0,2,0,0,0,0|2,0,0]=4 1544 B9R1.34 OC1=CC(O)=CC(O)=C1 045197 [0,2,0,0,0,0|2,0,0]=4 1545 B9R1.34 OC1=CC(O)=CC(O)=C1 095065 [0,2,0,0,0,0|2,0,0]=4 1546 B9R1.34 OC1=CC(O)=NC(S)=N1 078755 [0,2,0,0,0,0|2,0,0]=4 1547 B9R1.34 SC1=CC(Cl)=CC(Cl)=C1 003357 [0,2,0,0,0,0|2,0,0]=4 1548 B9R1.34 SC1=CC(S)=CC(Br)=C1 104056 [0,2,0,0,0,0|2,0,0]=4 1549 B7R1.24 C1=CC=CCC=C1 242090 [0,0,1,1,0,0|2,0,0]=4 1550 B7R1.24 C1=CC=C[CH+]C=C1 009408 [0,0,1,1,0,0|2,0,0]=4 1551 B5R1.1 C1=CNC=C1 034290 [1,0,0,0,1,0|0,0,1]=3 1552 B5R1.1 C1=CNC=N1 021690 [1,0,0,0,1,0|1,0,0]=3 1553 B5R1.1 C1=CNC=N1 104823 [1,0,0,0,1,0|1,0,0]=3 1554 B5R1.1 C1=CNC=N1 222516 [1,0,0,0,1,0|1,0,0]=3 1555 B5R1.1 C1=CNN=C1 032730 [1,0,0,0,1,0|1,0,0]=3 1556 B5R1.1 C1=CNN=N1 094533 [1,0,0,0,1,0|2,0,0]=4 1557 B5R1.1 C1=COC=C1 098439 [1,0,0,0,1,0|1,0,0]=3 1558 B5R1.1 C1=COC=N1 091888 [1,0,0,0,1,0|1,0,0]=3 1559 B5R1.1 C1=CON=C1 076552 [1,0,0,0,1,0|1,0,0]=3 1560 B5R1.1 C1=CSC=C1 032744 [1,0,0,0,1,0|1,0,0]=3 1561 B5R1.1 C1=CSC=N1 002766 [1,0,0,0,1,0|1,0,0]=3 1562 B5R1.1 C1=CSN=C1 046382 [1,0,0,0,1,0|1,0,0]=3 1563 B5R1.1 C1=NC=NN1 043890 [1,0,0,0,1,0|2,0,0]=4 1564 B5R1.1 C1=NC=N[N-]1 386742 [1,0,0,0,1,0|2,0,0]=4