0 B7R1.3 BrC1=CC=CN=C1 NO19218 [0,0,0,0,0,0|3,0,0]=3 1 B7R1.3 BrC1=CC=NC=C1 NO13376 [0,0,0,0,0,0|1,0,0]=1 2 B7R1.3 BrC1=CN=CN=C1 NO22560 [0,0,0,0,0,0|4,0,0]=4 3 B7R1.3 BrC1=NC=CC=C1 NO17815 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.3 BrC1=NC=CC=N1 NO13369 [0,0,0,0,0,0|4,0,0]=4 5 B7R1.3 BrC1=NC=CN=C1 NO15000 [0,0,0,0,0,0|4,0,0]=4 6 B7R1.3 CC1=CC=CN=N1 NO22374 [0,0,0,0,0,0|4,0,0]=4 7 B7R1.3 CC1=CN=CN=C1 NO18851 [0,0,0,0,0,0|4,0,0]=4 8 B7R1.3 CC1=CN=NC=C1 NO22983 [0,0,0,0,0,0|2,0,0]=2 9 B7R1.3 CC1=NC=NC=C1 NO19795 [0,0,0,0,0,0|2,0,0]=2 10 B7R1.3 C[N+]1=CC=CC=C1 NO17683 [0,0,0,0,0,0|3,0,0]=3 11 B7R1.3 ClC1=CC=NC=C1 DY715154 [0,0,0,0,0,0|1,0,0]=1 12 B7R1.3 ClC1=CC=NC=C1 NO13378 [0,0,0,0,0,0|1,0,0]=1 13 B7R1.3 ClC1=CN=CN=C1 NO15471 [0,0,0,0,0,0|4,0,0]=4 14 B7R1.3 ClC1=CN=NC=C1 DY427202 [0,0,0,0,0,0|2,0,0]=2 15 B7R1.3 ClC1=NC=CC=C1 DY20672 [0,0,0,0,0,0|3,0,0]=3 16 B7R1.3 ClC1=NC=CC=N1 DY10446 [0,0,0,0,0,0|4,0,0]=4 17 B7R1.3 ClC1=NC=CC=N1 DY693436 [0,0,0,0,0,0|4,0,0]=4 18 B7R1.3 ClC1=NC=CN=C1 NO15454 [0,0,0,0,0,0|4,0,0]=4 19 B7R1.3 FC1=CC=CC=C1 DY41489 [0,0,0,0,0,0|2,0,0]=2 20 B7R1.3 FC1=CC=CN=C1 DY20006 [0,0,0,0,0,0|3,0,0]=3 21 B7R1.3 FC1=CC=CN=N1 DY736850 [0,0,0,0,0,0|4,0,0]=4 22 B7R1.3 FC1=NC=CC=C1 DY20005 [0,0,0,0,0,0|3,0,0]=3 23 B7R1.3 FC1=NC=CC=N1 DY429402 [0,0,0,0,0,0|4,0,0]=4 24 B7R1.3 IC1=CC=CC=C1 NO19958 [0,0,0,0,0,0|2,0,0]=2 25 B7R1.3 IC1=CN=CN=C1 NO12325 [0,0,0,0,0,0|4,0,0]=4 26 B7R1.3 IC1=NC=CC=C1 NO14565 [0,0,0,0,0,0|3,0,0]=3 27 B7R1.3 IC1=NC=CC=N1 NO14968 [0,0,0,0,0,0|4,0,0]=4 28 B7R1.3 IC1=NC=CN=C1 DY425096 [0,0,0,0,0,0|4,0,0]=4 29 B7R1.3 NC1=CC=CN=C1 NO19073 [0,0,0,0,0,0|2,0,0]=2 30 B7R1.3 NC1=CC=CN=N1 NO18539 [0,0,0,0,0,0|3,0,0]=3 31 B7R1.3 NC1=CC=CN=N1 NO19775 [0,0,0,0,0,0|3,0,0]=3 32 B7R1.3 NC1=CC=NC=C1 DY20017 [0,0,0,0,0,0|0,0,0]=0 33 B7R1.3 NC1=CN=CN=C1 NO18383 [0,0,0,0,0,0|3,0,0]=3 34 B7R1.3 NC1=CN=NC=C1 NO18154 [0,0,0,0,0,0|1,0,0]=1 35 B7R1.3 NC1=NC=CC=N1 NO13370 [0,0,0,0,0,0|3,0,0]=3 36 B7R1.3 NC1=NC=CN=C1 NO16102 [0,0,0,0,0,0|3,0,0]=3 37 B7R1.3 NC1=NC=CN=N1 DY459438 [0,0,0,0,0,0|4,0,0]=4 38 B7R1.3 NC1=NC=NC=C1 DY696160 [0,0,0,0,0,0|1,0,0]=1 39 B7R1.3 NC1=NC=NC=C1 NO19707 [0,0,0,0,0,0|1,0,0]=1 40 B7R1.3 NC1C=CCCC1 DY608404 [0,0,0,0,0,0|1,0,3]=4 41 B7R1.3 O=C1C=CC=CN1 NO18724 [0,0,0,0,0,0|3,0,0]=3 42 B7R1.3 O=C1C=CC=NN1 NO19793 [0,0,0,0,0,0|4,0,0]=4 43 B7R1.3 O=C1C=CCCN1 NO15771 [0,0,0,0,0,0|3,0,1]=4 44 B7R1.3 O=C1C=CCOC1 NO17023 [0,0,0,0,0,0|3,0,1]=4 45 B7R1.3 O=C1C=CN=CN1 NO19105 [0,0,0,0,0,0|2,0,0]=2 46 B7R1.3 O=c1ccocc1 DY460890 [0,0,0,0,0,0|2,0,0]=2 47 B7R1.3 OC1=CC=CN=C1 NO17813 [0,0,0,0,0,0|3,0,0]=3 48 B7R1.3 OC1=CC=NC=C1 NO19216 [0,0,0,0,0,0|1,0,0]=1 49 B7R1.3 OC1=CN=CN=C1 NO10407 [0,0,0,0,0,0|4,0,0]=4 50 B7R1.3 OC1=CN=NC=C1 DY538881 [0,0,0,0,0,0|2,0,0]=2 51 B7R1.3 OC1=CN=NC=C1 NO17666 [0,0,0,0,0,0|2,0,0]=2 52 B7R1.3 OC1=NC=CC=C1 NO21602 [0,0,0,0,0,0|3,0,0]=3 53 B7R1.3 OC1=NC=CC=N1 NO14246 [0,0,0,0,0,0|4,0,0]=4 54 B7R1.3 OC1=NC=CC=N1 NO16090 [0,0,0,0,0,0|4,0,0]=4 55 B7R1.3 OC1=NC=CN=C1 NO21601 [0,0,0,0,0,0|4,0,0]=4 56 B7R1.3 OC1=NC=NC=C1 DY737960 [0,0,0,0,0,0|2,0,0]=2 57 B7R1.3 OC1=NC=NC=C1 NO15728 [0,0,0,0,0,0|2,0,0]=2 58 B7R1.3 SC1=CC=CN=N1 DY546327 [0,0,0,0,0,0|4,0,0]=4 59 B7R1.3 [15NH2]C1=CC=CC=C1 DY454761 [0,0,0,0,0,0|1,0,0]=1 60 B7R1.3 [Hg+]C1=CC=CC=C1 DY822438 [0,0,0,0,0,0|2,0,0]=2 61 B6R1.1 C1=CC=CC=C1 DY534327 [1,0,0,0,0,0|1,0,0]=2 62 B6R1.1 C1=CC=NC=C1 DY21088 [1,0,0,0,0,0|0,0,0]=1 63 B6R1.1 C1=CC=NC=C1 DY663929 [1,0,0,0,0,0|0,0,0]=1 64 B6R1.1 C1=CC=[NH+]C=C1 DY20763 [1,0,0,0,0,0|0,0,1]=2 65 B6R1.1 C1=CN=CC=N1 DY20792 [1,0,0,0,0,0|1,0,0]=2 66 B6R1.1 C1=CN=NC=C1 NO11905 [1,0,0,0,0,0|1,0,0]=2 67 B6R1.1 C1=NC=NC=N1 NO20497 [1,0,0,0,0,0|2,0,0]=3 68 B8R1.2 BrCC1=CC=NC=C1 NO22459 [0,1,0,0,0,0|1,0,0]=2 69 B8R1.2 C#CC1=CC=CC=C1 NO19127 [0,1,0,0,0,0|2,0,0]=3 70 B8R1.2 C#CC1=CC=NC=C1 DY544323 [0,1,0,0,0,0|1,0,0]=2 71 B8R1.2 C#CC1=NC=CC=C1 NO21539 [0,1,0,0,0,0|3,0,0]=4 72 B8R1.2 C=CC1=CC=CN=C1 DY507011 [0,1,0,0,0,0|3,0,0]=4 73 B8R1.2 CCC1=CC=CN=C1 NO22277 [0,1,0,0,0,0|3,0,0]=4 74 B8R1.2 CNC1=CC=CC=C1 NO11792 [0,1,0,0,0,0|1,0,0]=2 75 B8R1.2 CNC1=CC=CN=C1 NO13856 [0,1,0,0,0,0|2,0,0]=3 76 B8R1.2 CNC1=CN=CN=C1 DY553401 [0,1,0,0,0,0|3,0,0]=4 77 B8R1.2 COC1=CC=CN=C1 NO22348 [0,1,0,0,0,0|3,0,0]=4 78 B8R1.2 COC1=CC=NC=C1 NO19206 [0,1,0,0,0,0|1,0,0]=2 79 B8R1.2 COC1=CC=[C-]C=C1 DY747109 [0,1,0,0,0,0|2,0,0]=3 80 B8R1.2 COC1=NC=CC=C1 NO18780 [0,1,0,0,0,0|3,0,0]=4 81 B8R1.2 ClCC1=CC=CN=C1 NO19291 [0,1,0,0,0,0|3,0,0]=4 82 B8R1.2 ClCC1=NC=CC=C1 NO19289 [0,1,0,0,0,0|3,0,0]=4 83 B8R1.2 ClSC1=CC=CC=C1 DY799077 [0,1,0,0,0,0|2,0,0]=3 84 B8R1.2 ICC1=CC=CC=C1 NO11000 [0,1,0,0,0,0|2,0,0]=3 85 B8R1.2 N#CC1=CN=CC=C1 NO22263 [0,1,0,0,0,0|2,0,1]=4 86 B8R1.2 N#CC1=NC=CC=C1 NO19642 [0,1,0,0,0,0|2,0,1]=4 87 B8R1.2 N#CC1=NC=NC=C1 NO12430 [0,1,0,0,0,0|1,0,1]=3 88 B8R1.2 N#Cc1ccccc1 NO13696 [0,1,0,0,0,0|1,0,1]=3 89 B8R1.2 NCC1=CC=CN=C1 NO14226 [0,1,0,0,0,0|2,0,0]=3 90 B8R1.2 NCC1=CC=NC=C1 NO11906 [0,1,0,0,0,0|0,0,0]=1 91 B8R1.2 NCC1=CC=NC=C1 NO19023 [0,1,0,0,0,0|0,0,0]=1 92 B8R1.2 NCC1=CN=NC=C1 NO15014 [0,1,0,0,0,0|1,0,0]=2 93 B8R1.2 NCC1=CN=NC=C1 NO15515 [0,1,0,0,0,0|1,0,0]=2 94 B8R1.2 NCC1=NC=CC=C1 DY663911 [0,1,0,0,0,0|2,0,0]=3 95 B8R1.2 NCC1=NC=CC=N1 NO21304 [0,1,0,0,0,0|3,0,0]=4 96 B8R1.2 NCC1=NC=CN=C1 DY710323 [0,1,0,0,0,0|3,0,0]=4 97 B8R1.2 NCC1=NC=CN=C1 NO19691 [0,1,0,0,0,0|3,0,0]=4 98 B8R1.2 NCC1=NC=CN=C1 NO20245 [0,1,0,0,0,0|3,0,0]=4 99 B8R1.2 NNC1=CC=CC=C1 NO15210 [0,1,0,0,0,0|1,0,0]=2 100 B8R1.2 NNC1=CC=CN=C1 NO15491 [0,1,0,0,0,0|2,0,0]=3 101 B8R1.2 NNC1=CC=CN=C1 NO22308 [0,1,0,0,0,0|2,0,0]=3 102 B8R1.2 NNC1=CC=NC=C1 DY20777 [0,1,0,0,0,0|0,0,0]=1 103 B8R1.2 NNC1=NC=CC=C1 NO15589 [0,1,0,0,0,0|2,0,0]=3 104 B8R1.2 NNC1=NC=CC=C1 NO21573 [0,1,0,0,0,0|2,0,0]=3 105 B8R1.2 O=CC1=CC=NC=C1 DY458075 [0,1,0,0,0,0|1,0,0]=2 106 B8R1.2 O=CC1=CN=CC=C1 NO19090 [0,1,0,0,0,0|3,0,0]=4 107 B8R1.2 O=CC1=NC=CC=C1 NO18610 [0,1,0,0,0,0|3,0,0]=4 108 B8R1.2 OCC1=CC=CN=C1 NO22409 [0,1,0,0,0,0|3,0,0]=4 109 B8R1.2 OCC1=CC=NC=C1 NO19163 [0,1,0,0,0,0|1,0,0]=2 110 B8R1.2 OCC1=NC=CC=C1 NO19164 [0,1,0,0,0,0|3,0,0]=4 111 B8R1.2 OCC1=NC=NC=C1 NO11915 [0,1,0,0,0,0|2,0,0]=3 112 B8R1.3 BrC1=CC=C(Br)C=C1 DY41477 [0,1,0,0,0,0|2,0,0]=3 113 B8R1.3 BrC1=CC=C(I)C=C1 NO22911 [0,1,0,0,0,0|2,0,0]=3 114 B8R1.3 BrC1=CN=C(Br)C=C1 NO21792 [0,1,0,0,0,0|3,0,0]=4 115 B8R1.3 BrC1=CN=C(I)C=C1 NO22029 [0,1,0,0,0,0|3,0,0]=4 116 B8R1.3 BrC1=NC=C(I)C=C1 NO15803 [0,1,0,0,0,0|3,0,0]=4 117 B8R1.3 CC1=CC=C(Br)C=C1 DY20922 [0,1,0,0,0,0|2,0,0]=3 118 B8R1.3 CC1=CC=C(N)C=C1 NO11898 [0,1,0,0,0,0|1,0,0]=2 119 B8R1.3 CC1=CC=C(N)C=N1 NO19519 [0,1,0,0,0,0|2,0,0]=3 120 B8R1.3 CC1=CN=C(Br)C=C1 NO21837 [0,1,0,0,0,0|3,0,0]=4 121 B8R1.3 CC1=CN=C(C)C=C1 NO21154 [0,1,0,0,0,0|3,0,0]=4 122 B8R1.3 CC1=CN=C(Cl)C=C1 NO19287 [0,1,0,0,0,0|3,0,0]=4 123 B8R1.3 CC1=CN=C(F)C=C1 NO21872 [0,1,0,0,0,0|3,0,0]=4 124 B8R1.3 CC1=CN=C(N)C=C1 NO21820 [0,1,0,0,0,0|2,0,0]=3 125 B8R1.3 CC1=CN=C(N)C=N1 NO18361 [0,1,0,0,0,0|3,0,0]=4 126 B8R1.3 CC1=CN=C(N)N=C1 NO21761 [0,1,0,0,0,0|3,0,0]=4 127 B8R1.3 CC1=CN=C(O)C=C1 NO16275 [0,1,0,0,0,0|3,0,0]=4 128 B8R1.3 CC1=CNC(=O)C=C1 NO21591 [0,1,0,0,0,0|3,0,0]=4 129 B8R1.3 CC1=NC=C(Br)C=C1 NO22031 [0,1,0,0,0,0|3,0,0]=4 130 B8R1.3 CC1=NC=C(Cl)C=C1 DY568875 [0,1,0,0,0,0|3,0,0]=4 131 B8R1.3 CC1=NC=C(N)C=N1 NO14284 [0,1,0,0,0,0|3,0,0]=4 132 B8R1.3 ClC1=CC=C(Br)C=C1 NO22677 [0,1,0,0,0,0|2,0,0]=3 133 B8R1.3 ClC1=CC=C(I)C=C1 NO19235 [0,1,0,0,0,0|2,0,0]=3 134 B8R1.3 ClC1=CN=C(Br)C=C1 NO17275 [0,1,0,0,0,0|3,0,0]=4 135 B8R1.3 ClC1=CN=C(Cl)C=C1 NO13779 [0,1,0,0,0,0|3,0,0]=4 136 B8R1.3 ClC1=CN=C(I)C=C1 NO18901 [0,1,0,0,0,0|3,0,0]=4 137 B8R1.3 ClC1=NC=C(Br)C=C1 NO14919 [0,1,0,0,0,0|3,0,0]=4 138 B8R1.3 ClC1=NC=C(I)C=C1 NO17315 [0,1,0,0,0,0|3,0,0]=4 139 B8R1.3 FC1=CC=C(Cl)C=C1 NO20666 [0,1,0,0,0,0|2,0,0]=3 140 B8R1.3 FC1=CC=C(I)C=C1 NO22840 [0,1,0,0,0,0|2,0,0]=3 141 B8R1.3 FC1=CC=C(S)C=C1 DY20299 [0,1,0,0,0,0|2,0,0]=3 142 B8R1.3 FC1=CN=C(Br)C=C1 NO21836 [0,1,0,0,0,0|3,0,0]=4 143 B8R1.3 FC1=CN=C(Cl)C=C1 NO21851 [0,1,0,0,0,0|3,0,0]=4 144 B8R1.3 FC1=CN=C(I)C=C1 NO10383 [0,1,0,0,0,0|3,0,0]=4 145 B8R1.3 FC1=NC=C(Br)C=C1 NO22028 [0,1,0,0,0,0|3,0,0]=4 146 B8R1.3 FC1=NC=C(Cl)C=C1 NO17313 [0,1,0,0,0,0|3,0,0]=4 147 B8R1.3 FC1=NC=C(I)C=C1 NO17371 [0,1,0,0,0,0|3,0,0]=4 148 B8R1.3 IC1=CC=C(I)C=C1 NO19213 [0,1,0,0,0,0|2,0,0]=3 149 B8R1.3 NC1=CC=C(Br)N=C1 NO21910 [0,1,0,0,0,0|2,0,0]=3 150 B8R1.3 NC1=CC=C(Br)N=N1 NO10641 [0,1,0,0,0,0|3,0,0]=4 151 B8R1.3 NC1=CC=C(Cl)C=C1 NO18588 [0,1,0,0,0,0|1,0,0]=2 152 B8R1.3 NC1=CC=C(Cl)N=C1 NO21849 [0,1,0,0,0,0|2,0,0]=3 153 B8R1.3 NC1=CC=C(Cl)N=N1 NO15607 [0,1,0,0,0,0|3,0,0]=4 154 B8R1.3 NC1=CC=C(F)N=C1 NO22740 [0,1,0,0,0,0|2,0,0]=3 155 B8R1.3 NC1=CC=C(F)N=N1 NO17801 [0,1,0,0,0,0|3,0,0]=4 156 B8R1.3 NC1=CC=C(I)C=C1 DY452056 [0,1,0,0,0,0|1,0,0]=2 157 B8R1.3 NC1=CC=C(N)C=C1 DY822026 [0,1,0,0,0,0|1,0,0]=2 158 B8R1.3 NC1=CC=C(N)C=C1 NO18589 [0,1,0,0,0,0|1,0,0]=2 159 B8R1.3 NC1=CC=C(O)C=N1 NO13087 [0,1,0,0,0,0|2,0,0]=3 160 B8R1.3 NC1=CC=C(O)C=N1 NO18367 [0,1,0,0,0,0|2,0,0]=3 161 B8R1.3 NC1=CN=C(Br)N=C1 NO21412 [0,1,0,0,0,0|3,0,0]=4 162 B8R1.3 NC1=CN=C(N)C=C1 NO15186 [0,1,0,0,0,0|2,0,0]=3 163 B8R1.3 NC1=CN=C(N)C=N1 DY528117 [0,1,0,0,0,0|3,0,0]=4 164 B8R1.3 NC1=CN=C(N)C=N1 DY710881 [0,1,0,0,0,0|3,0,0]=4 165 B8R1.3 NC1=CN=C(N)N=C1 NO19880 [0,1,0,0,0,0|3,0,0]=4 166 B8R1.3 NC1=CN=C(O)C=C1 NO10211 [0,1,0,0,0,0|2,0,0]=3 167 B8R1.3 NC1=CN=C(O)C=C1 NO18129 [0,1,0,0,0,0|2,0,0]=3 168 B8R1.3 NC1=CNC(=O)C=C1 NO15177 [0,1,0,0,0,0|2,0,0]=3 169 B8R1.3 NC1=NC=C(Br)N=C1 NO15187 [0,1,0,0,0,0|3,0,0]=4 170 B8R1.3 NC1=NC=C(Cl)C=C1 NO21816 [0,1,0,0,0,0|2,0,0]=3 171 B8R1.3 NC1=NC=C(Cl)C=N1 NO15629 [0,1,0,0,0,0|3,0,0]=4 172 B8R1.3 NC1=NC=C(Cl)N=C1 NO18243 [0,1,0,0,0,0|3,0,0]=4 173 B8R1.3 NC1=NC=C(F)C=C1 NO21818 [0,1,0,0,0,0|2,0,0]=3 174 B8R1.3 NC1=NC=C(F)C=N1 NO21760 [0,1,0,0,0,0|3,0,0]=4 175 B8R1.3 NC1=NC=C(I)C=C1 NO17736 [0,1,0,0,0,0|2,0,0]=3 176 B8R1.3 NC1=NC=C(O)C=N1 NO17222 [0,1,0,0,0,0|3,0,0]=4 177 B8R1.3 O=C1C=CC(O)=CN1 NO15928 [0,1,0,0,0,0|3,0,0]=4 178 B8R1.3 OC1=CC=C(Br)N=C1 NO14988 [0,1,0,0,0,0|3,0,0]=4 179 B8R1.3 OC1=CC=C(Cl)C=C1 NO22792 [0,1,0,0,0,0|2,0,0]=3 180 B8R1.3 OC1=CC=C(Cl)N=C1 NO21853 [0,1,0,0,0,0|3,0,0]=4 181 B8R1.3 OC1=CC=C(F)N=C1 NO14991 [0,1,0,0,0,0|3,0,0]=4 182 B8R1.3 OC1=CC=C(I)C=C1 DY20152 [0,1,0,0,0,0|2,0,0]=3 183 B8R1.3 OC1=CN=C(O)C=C1 NO21147 [0,1,0,0,0,0|3,0,0]=4 184 B8R1.3 OC1=NC=C(Br)C=C1 NO22706 [0,1,0,0,0,0|3,0,0]=4 185 B8R1.3 OC1=NC=C(I)C=C1 NO13623 [0,1,0,0,0,0|3,0,0]=4 186 B8R1.3 SC1=CC=C(Br)C=C1 DY20198 [0,1,0,0,0,0|2,0,0]=3 187 B8R1.3 SC1=CC=C(Cl)C=C1 DY822118 [0,1,0,0,0,0|2,0,0]=3 188 B8R1.3 SC1=CC=C(S)C=C1 DY563991 [0,1,0,0,0,0|2,0,0]=3 189 B8R1.3 SC1=NC=C(Cl)C=C1 DY659984 [0,1,0,0,0,0|3,0,0]=4 190 B8R1.3 [O-][N+]1=CC=C(Br)C=C1 NO22699 [0,1,0,0,0,0|1,0,1]=3 191 B8R1.4 BrC1=CC(Br)=NC=C1 NO15110 [0,1,0,0,0,0|1,0,0]=2 192 B8R1.4 BrC1=CC(Br)=NC=N1 NO22500 [0,1,0,0,0,0|2,0,0]=3 193 B8R1.4 BrC1=CC(I)=CC=C1 DY433479 [0,1,0,0,0,0|2,0,0]=3 194 B8R1.4 BrC1=CC(I)=CN=C1 NO13981 [0,1,0,0,0,0|3,0,0]=4 195 B8R1.4 BrC1=CC=CC(Br)=C1 NO19814 [0,1,0,0,0,0|2,0,0]=3 196 B8R1.4 BrC1=CC=CC(Br)=N1 NO21793 [0,1,0,0,0,0|3,0,0]=4 197 B8R1.4 BrC1=CN=CC(Br)=C1 NO21896 [0,1,0,0,0,0|3,0,0]=4 198 B8R1.4 BrC1=NC(Br)=NC=C1 NO10554 [0,1,0,0,0,0|2,0,0]=3 199 B8R1.4 BrC1=NC=CC(I)=C1 NO17279 [0,1,0,0,0,0|1,0,0]=2 200 B8R1.4 CC1=CC(=O)NN=C1 NO10446 [0,1,0,0,0,0|2,0,1]=4 201 B8R1.4 CC1=CC(Br)=NC=N1 NO13070 [0,1,0,0,0,0|2,0,0]=3 202 B8R1.4 CC1=CC(C)=NC=N1 NO19849 [0,1,0,0,0,0|2,0,0]=3 203 B8R1.4 CC1=CC(Cl)=NC=C1 NO23009 [0,1,0,0,0,0|1,0,0]=2 204 B8R1.4 CC1=CC(Cl)=NC=N1 NO22963 [0,1,0,0,0,0|2,0,0]=3 205 B8R1.4 CC1=CC(F)=NC=C1 NO21868 [0,1,0,0,0,0|1,0,0]=2 206 B8R1.4 CC1=CC(N)=NC=C1 NO15630 [0,1,0,0,0,0|1,0,0]=2 207 B8R1.4 CC1=CC(N)=NC=N1 NO12473 [0,1,0,0,0,0|1,0,0]=2 208 B8R1.4 CC1=CC(O)=NC=C1 NO23034 [0,1,0,0,0,0|1,0,0]=2 209 B8R1.4 CC1=CC(O)=NC=N1 NO19796 [0,1,0,0,0,0|2,0,0]=3 210 B8R1.4 CC1=CC=CC(Br)=C1 NO19957 [0,1,0,0,0,0|2,0,0]=3 211 B8R1.4 CC1=CC=CC(Br)=N1 NO21841 [0,1,0,0,0,0|3,0,0]=4 212 B8R1.4 CC1=CC=CC(C)=N1 NO18597 [0,1,0,0,0,0|3,0,0]=4 213 B8R1.4 CC1=CC=CC(Cl)=N1 NO23010 [0,1,0,0,0,0|3,0,0]=4 214 B8R1.4 CC1=CC=CC(F)=C1 NO19910 [0,1,0,0,0,0|2,0,0]=3 215 B8R1.4 CC1=CC=CC(F)=N1 NO19330 [0,1,0,0,0,0|3,0,0]=4 216 B8R1.4 CC1=CC=CC(I)=C1 NO19968 [0,1,0,0,0,0|2,0,0]=3 217 B8R1.4 CC1=CC=CC(N)=C1 NO11698 [0,1,0,0,0,0|1,0,0]=2 218 B8R1.4 CC1=CC=CC(N)=N1 NO18078 [0,1,0,0,0,0|2,0,0]=3 219 B8R1.4 CC1=CN=CC(C)=C1 DY714404 [0,1,0,0,0,0|3,0,0]=4 220 B8R1.4 CC1=CN=CC(Cl)=C1 NO13884 [0,1,0,0,0,0|3,0,0]=4 221 B8R1.4 CC1=CN=CC(F)=C1 NO19335 [0,1,0,0,0,0|3,0,0]=4 222 B8R1.4 CC1=CN=CC(N)=C1 NO14172 [0,1,0,0,0,0|2,0,0]=3 223 B8R1.4 CC1=CN=CC(O)=C1 NO14332 [0,1,0,0,0,0|3,0,0]=4 224 B8R1.4 CC1=NC(Br)=NC=C1 NO17649 [0,1,0,0,0,0|2,0,0]=3 225 B8R1.4 CC1=NC(Cl)=NC=C1 NO13591 [0,1,0,0,0,0|2,0,0]=3 226 B8R1.4 CC1=NC(O)=NC=C1 NO21586 [0,1,0,0,0,0|2,0,0]=3 227 B8R1.4 CC1=NC=CC(=O)N1 NO22425 [0,1,0,0,0,0|2,0,0]=3 228 B8R1.4 CC1=NC=CC(Br)=C1 DY658195 [0,1,0,0,0,0|1,0,0]=2 229 B8R1.4 CC1=NC=CC(Br)=C1 NO13967 [0,1,0,0,0,0|1,0,0]=2 230 B8R1.4 CC1=NC=CC(Cl)=C1 NO14214 [0,1,0,0,0,0|1,0,0]=2 231 B8R1.4 CC1=NC=CC(Cl)=N1 DY694223 [0,1,0,0,0,0|2,0,0]=3 232 B8R1.4 CC1=NC=CC(Cl)=N1 NO22751 [0,1,0,0,0,0|2,0,0]=3 233 B8R1.4 CC1=NC=CC(F)=C1 NO15882 [0,1,0,0,0,0|1,0,0]=2 234 B8R1.4 CC1=NC=CC(I)=C1 NO22899 [0,1,0,0,0,0|1,0,0]=2 235 B8R1.4 CC1=NC=CC(N)=C1 NO19520 [0,1,0,0,0,0|0,0,0]=1 236 B8R1.4 CC1=NC=CC(N)=N1 DY693586 [0,1,0,0,0,0|1,0,0]=2 237 B8R1.4 CC1=NC=CC(N)=N1 NO13322 [0,1,0,0,0,0|1,0,0]=2 238 B8R1.4 CC1=NC=CC(O)=C1 NO22867 [0,1,0,0,0,0|1,0,0]=2 239 B8R1.4 CC1=NC=CC(O)=N1 NO15583 [0,1,0,0,0,0|2,0,0]=3 240 B8R1.4 ClC1=CC(Br)=NC=C1 NO13973 [0,1,0,0,0,0|1,0,0]=2 241 B8R1.4 ClC1=CC(Cl)=NC=C1 NO17291 [0,1,0,0,0,0|1,0,0]=2 242 B8R1.4 ClC1=CC(Cl)=NC=N1 NO21954 [0,1,0,0,0,0|2,0,0]=3 243 B8R1.4 ClC1=CC(I)=CC=C1 NO20663 [0,1,0,0,0,0|2,0,0]=3 244 B8R1.4 ClC1=CC=CC(Br)=C1 NO22170 [0,1,0,0,0,0|2,0,0]=3 245 B8R1.4 ClC1=CC=CC(Br)=N1 NO14668 [0,1,0,0,0,0|3,0,0]=4 246 B8R1.4 ClC1=CC=CC(Cl)=N1 NO18899 [0,1,0,0,0,0|3,0,0]=4 247 B8R1.4 ClC1=CN=CC(Br)=C1 NO15808 [0,1,0,0,0,0|3,0,0]=4 248 B8R1.4 ClC1=CN=CC(Cl)=C1 NO14008 [0,1,0,0,0,0|3,0,0]=4 249 B8R1.4 ClC1=CN=NC(Cl)=C1 NO21984 [0,1,0,0,0,0|2,0,0]=3 250 B8R1.4 ClC1=NC(Cl)=NC=C1 NO22557 [0,1,0,0,0,0|2,0,0]=3 251 B8R1.4 ClC1=NC(I)=NC=C1 DY694211 [0,1,0,0,0,0|2,0,0]=3 252 B8R1.4 ClC1=NC=CC(Br)=C1 NO21986 [0,1,0,0,0,0|1,0,0]=2 253 B8R1.4 ClC1=NC=CC(Br)=N1 DY21047 [0,1,0,0,0,0|2,0,0]=3 254 B8R1.4 ClC1=NC=CC(I)=C1 NO22695 [0,1,0,0,0,0|1,0,0]=2 255 B8R1.4 ClC1=NC=NC(Cl)=N1 NO18930 [0,1,0,0,0,0|3,0,0]=4 256 B8R1.4 FC1=CC(Br)=CN=C1 NO22034 [0,1,0,0,0,0|3,0,0]=4 257 B8R1.4 FC1=CC(Br)=NC=C1 NO14190 [0,1,0,0,0,0|1,0,0]=2 258 B8R1.4 FC1=CC(Cl)=NC=C1 NO17300 [0,1,0,0,0,0|1,0,0]=2 259 B8R1.4 FC1=CC(F)=NC=C1 NO19909 [0,1,0,0,0,0|1,0,0]=2 260 B8R1.4 FC1=CC(I)=CC=C1 NO18882 [0,1,0,0,0,0|2,0,0]=3 261 B8R1.4 FC1=CC(I)=CN=C1 NO18467 [0,1,0,0,0,0|3,0,0]=4 262 B8R1.4 FC1=CC=CC(Br)=N1 NO13708 [0,1,0,0,0,0|3,0,0]=4 263 B8R1.4 FC1=CC=CC(Cl)=N1 NO18859 [0,1,0,0,0,0|3,0,0]=4 264 B8R1.4 FC1=CC=CC(F)=N1 NO18752 [0,1,0,0,0,0|3,0,0]=4 265 B8R1.4 FC1=CC=CC(S)=C1 DY20298 [0,1,0,0,0,0|2,0,0]=3 266 B8R1.4 FC1=CN=CC(Cl)=C1 NO19936 [0,1,0,0,0,0|3,0,0]=4 267 B8R1.4 FC1=CN=CC(F)=C1 NO13374 [0,1,0,0,0,0|3,0,0]=4 268 B8R1.4 FC1=NC(Cl)=NC=C1 DY429933 [0,1,0,0,0,0|2,0,0]=3 269 B8R1.4 FC1=NC=CC(Br)=C1 NO17277 [0,1,0,0,0,0|1,0,0]=2 270 B8R1.4 FC1=NC=CC(Cl)=C1 NO14178 [0,1,0,0,0,0|1,0,0]=2 271 B8R1.4 FC1=NC=CC(I)=C1 NO13375 [0,1,0,0,0,0|1,0,0]=2 272 B8R1.4 IC1=CC(I)=NC=C1 DY451054 [0,1,0,0,0,0|1,0,0]=2 273 B8R1.4 IC1=CC=CC(I)=C1 DY433521 [0,1,0,0,0,0|2,0,0]=3 274 B8R1.4 IC1=CC=CC(I)=N1 NO18354 [0,1,0,0,0,0|3,0,0]=4 275 B8R1.4 NC1=CC(=O)COC1 DY777652 [0,1,0,0,0,0|2,0,1]=4 276 B8R1.4 NC1=CC(Br)=CC=C1 NO19169 [0,1,0,0,0,0|1,0,0]=2 277 B8R1.4 NC1=CC(Br)=CN=C1 NO22730 [0,1,0,0,0,0|2,0,0]=3 278 B8R1.4 NC1=CC(Br)=NC=C1 NO21962 [0,1,0,0,0,0|0,0,0]=1 279 B8R1.4 NC1=CC(Cl)=CC=C1 NO22234 [0,1,0,0,0,0|1,0,0]=2 280 B8R1.4 NC1=CC(Cl)=CN=C1 DY31090 [0,1,0,0,0,0|2,0,0]=3 281 B8R1.4 NC1=CC(Cl)=NC=C1 NO21964 [0,1,0,0,0,0|0,0,0]=1 282 B8R1.4 NC1=CC(F)=CC=C1 NO19913 [0,1,0,0,0,0|1,0,0]=2 283 B8R1.4 NC1=CC(F)=CN=C1 NO13934 [0,1,0,0,0,0|2,0,0]=3 284 B8R1.4 NC1=CC(I)=CC=C1 NO19215 [0,1,0,0,0,0|1,0,0]=2 285 B8R1.4 NC1=CC(N)=NC=C1 NO11909 [0,1,0,0,0,0|0,0,0]=1 286 B8R1.4 NC1=CC(O)=NC=C1 NO18280 [0,1,0,0,0,0|0,0,0]=1 287 B8R1.4 NC1=CC=CC(=O)N1 NO22760 [0,1,0,0,0,0|2,0,0]=3 288 B8R1.4 NC1=CC=CC(N)=N1 NO13686 [0,1,0,0,0,0|2,0,0]=3 289 B8R1.4 NC1=CN=CC(N)=C1 NO21958 [0,1,0,0,0,0|2,0,0]=3 290 B8R1.4 NC1=CN=CC(N)=N1 NO15121 [0,1,0,0,0,0|3,0,0]=4 291 B8R1.4 NC1=CN=CC(O)=C1 NO12372 [0,1,0,0,0,0|2,0,0]=3 292 B8R1.4 NC1=CN=CC(O)=C1 NO22080 [0,1,0,0,0,0|2,0,0]=3 293 B8R1.4 NC1=CN=NC(Cl)=C1 NO13017 [0,1,0,0,0,0|1,0,0]=2 294 B8R1.4 NC1=NC(=O)NC=C1 NO22211 [0,1,0,0,0,0|1,0,1]=3 295 B8R1.4 NC1=NC(=O)NC=N1 NO22023 [0,1,0,0,0,0|2,0,1]=4 296 B8R1.4 NC1=NC(Br)=CC=C1 NO17641 [0,1,0,0,0,0|2,0,0]=3 297 B8R1.4 NC1=NC(Cl)=CC=C1 NO17675 [0,1,0,0,0,0|2,0,0]=3 298 B8R1.4 NC1=NC(Cl)=CN=C1 DY20457 [0,1,0,0,0,0|3,0,0]=4 299 B8R1.4 NC1=NC(F)=CC=C1 NO17727 [0,1,0,0,0,0|2,0,0]=3 300 B8R1.4 NC1=NC(N)=NC=C1 NO22603 [0,1,0,0,0,0|1,0,0]=2 301 B8R1.4 NC1=NC=CC(Br)=C1 NO16114 [0,1,0,0,0,0|1,0,0]=2 302 B8R1.4 NC1=NC=CC(Cl)=C1 NO17669 [0,1,0,0,0,0|1,0,0]=2 303 B8R1.4 NC1=NC=CC(Cl)=N1 NO15619 [0,1,0,0,0,0|2,0,0]=3 304 B8R1.4 NC1=NC=CC(F)=C1 NO21251 [0,1,0,0,0,0|1,0,0]=2 305 B8R1.4 NC1=NC=CC(I)=N1 NO12109 [0,1,0,0,0,0|2,0,0]=3 306 B8R1.4 NC1=NC=CC(O)=C1 NO14161 [0,1,0,0,0,0|1,0,0]=2 307 B8R1.4 NC1=NC=NC(Br)=C1 NO12354 [0,1,0,0,0,0|1,0,0]=2 308 B8R1.4 NC1=NC=NC(Cl)=C1 NO15652 [0,1,0,0,0,0|1,0,0]=2 309 B8R1.4 NC1=NC=NC(I)=C1 NO12484 [0,1,0,0,0,0|1,0,0]=2 310 B8R1.4 NC1=NC=NC(O)=C1 NO22588 [0,1,0,0,0,0|1,0,0]=2 311 B8R1.4 O=C1C=C(Cl)C=NN1 NO12688 [0,1,0,0,0,0|2,0,1]=4 312 B8R1.4 O=C1C=C(I)C=CN1 NO22900 [0,1,0,0,0,0|1,0,1]=3 313 B8R1.4 O=C1C=C(I)C=NN1 NO12955 [0,1,0,0,0,0|2,0,1]=4 314 B8R1.4 O=C1C=C(O)C=CN1 NO19356 [0,1,0,0,0,0|1,0,1]=3 315 B8R1.4 O=C1C=CC=C(Cl)N1 NO10672 [0,1,0,0,0,0|3,0,0]=4 316 B8R1.4 OC1=CC(Br)=CC=C1 NO15169 [0,1,0,0,0,0|2,0,0]=3 317 B8R1.4 OC1=CC(Br)=NC=C1 NO14221 [0,1,0,0,0,0|1,0,0]=2 318 B8R1.4 OC1=CC(Cl)=NC=C1 NO22712 [0,1,0,0,0,0|1,0,0]=2 319 B8R1.4 OC1=CC(F)=CC=C1 NO19021 [0,1,0,0,0,0|2,0,0]=3 320 B8R1.4 OC1=CC(F)=CN=C1 NO13932 [0,1,0,0,0,0|3,0,0]=4 321 B8R1.4 OC1=CC(F)=NC=C1 DY452176 [0,1,0,0,0,0|1,0,0]=2 322 B8R1.4 OC1=CC(I)=CC=C1 NO19969 [0,1,0,0,0,0|2,0,0]=3 323 B8R1.4 OC1=CC(O)=NC=N1 NO15744 [0,1,0,0,0,0|2,0,0]=3 324 B8R1.4 OC1=CN=CC(O)=C1 NO21992 [0,1,0,0,0,0|3,0,0]=4 325 B8R1.4 OC1=NC(Br)=CC=C1 NO14076 [0,1,0,0,0,0|3,0,0]=4 326 B8R1.4 OC1=NC=CC(Br)=C1 NO14220 [0,1,0,0,0,0|1,0,0]=2 327 B8R1.4 OC1=NC=CC(Cl)=C1 NO18294 [0,1,0,0,0,0|1,0,0]=2 328 B8R1.4 OC1=NC=CC(F)=C1 NO21583 [0,1,0,0,0,0|1,0,0]=2 329 B8R1.4 OC1=NC=NC(Br)=C1 NO14406 [0,1,0,0,0,0|2,0,0]=3 330 B8R1.4 SC1=CC(Br)=CC=C1 DY564537 [0,1,0,0,0,0|2,0,0]=3 331 B8R1.4 SC1=CC(Cl)=NC=C1 DY712051 [0,1,0,0,0,0|1,0,0]=2 332 B8R1.4 [O-][N+]1=CC(Cl)=CC=C1 DY442468 [0,1,0,0,0,0|3,0,0]=4 333 B8R1.5 BrC1=C(Br)C=NC=C1 NO13628 [0,1,0,0,0,0|1,0,0]=2 334 B8R1.5 BrC1=C(I)C=CC=C1 NO19157 [0,1,0,0,0,0|2,0,0]=3 335 B8R1.5 BrC1=CC=CN=C1Br NO22670 [0,1,0,0,0,0|3,0,0]=4 336 B8R1.5 BrC1=NC=CC=C1I DY110926 [0,1,0,0,0,0|3,0,0]=4 337 B8R1.5 CC1=C(Br)C=CC=C1 DY20187 [0,1,0,0,0,0|2,0,0]=3 338 B8R1.5 CC1=C(Br)C=CN=C1 NO13416 [0,1,0,0,0,0|1,0,0]=2 339 B8R1.5 CC1=C(Br)C=NC=C1 NO21916 [0,1,0,0,0,0|1,0,0]=2 340 B8R1.5 CC1=C(Cl)C=CN=C1 DY460902 [0,1,0,0,0,0|1,0,0]=2 341 B8R1.5 CC1=C(Cl)C=CN=C1 NO18038 [0,1,0,0,0,0|1,0,0]=2 342 B8R1.5 CC1=C(Cl)C=NC=C1 NO15751 [0,1,0,0,0,0|1,0,0]=2 343 B8R1.5 CC1=C(F)C=CC=C1 DY41519 [0,1,0,0,0,0|2,0,0]=3 344 B8R1.5 CC1=C(F)C=NC=C1 NO19332 [0,1,0,0,0,0|1,0,0]=2 345 B8R1.5 CC1=C(I)C=CC=C1 NO19198 [0,1,0,0,0,0|2,0,0]=3 346 B8R1.5 CC1=C(N)C=CN=C1 NO19521 [0,1,0,0,0,0|0,0,0]=1 347 B8R1.5 CC1=C(N)C=NC=C1 NO21907 [0,1,0,0,0,0|1,0,0]=2 348 B8R1.5 CC1=C(O)C=CN=C1 NO13965 [0,1,0,0,0,0|1,0,0]=2 349 B8R1.5 CC1=CC=CC=C1C DY41549 [0,1,0,0,0,0|2,0,0]=3 350 B8R1.5 CC1=CC=CC=C1N NO20592 [0,1,0,0,0,0|1,0,0]=2 351 B8R1.5 CC1=CC=CC=C1O NO11813 [0,1,0,0,0,0|2,0,0]=3 352 B8R1.5 CC1=CC=CN=C1Br NO23002 [0,1,0,0,0,0|3,0,0]=4 353 B8R1.5 CC1=CC=CN=C1C NO21050 [0,1,0,0,0,0|3,0,0]=4 354 B8R1.5 CC1=CC=CN=C1Cl NO13857 [0,1,0,0,0,0|3,0,0]=4 355 B8R1.5 CC1=CC=CN=C1F NO19328 [0,1,0,0,0,0|3,0,0]=4 356 B8R1.5 CC1=CC=CN=C1N NO13775 [0,1,0,0,0,0|2,0,0]=3 357 B8R1.5 CC1=CN=CN=C1Br NO12572 [0,1,0,0,0,0|2,0,0]=3 358 B8R1.5 CC1=CN=CN=C1Cl NO19938 [0,1,0,0,0,0|2,0,0]=3 359 B8R1.5 CC1=CN=CN=C1N NO12501 [0,1,0,0,0,0|1,0,0]=2 360 B8R1.5 CC1=CN=CN=C1O NO10459 [0,1,0,0,0,0|2,0,0]=3 361 B8R1.5 CC1=CNC=CC1=O DY502725 [0,1,0,0,0,0|1,0,1]=3 362 B8R1.5 CC1=NC=CC=C1Br DY20012 [0,1,0,0,0,0|3,0,0]=4 363 B8R1.5 CC1=NC=CC=C1F NO19850 [0,1,0,0,0,0|3,0,0]=4 364 B8R1.5 CC1=NC=CC=C1N NO19518 [0,1,0,0,0,0|2,0,0]=3 365 B8R1.5 CC1=NC=CN=C1N NO21232 [0,1,0,0,0,0|3,0,0]=4 366 B8R1.5 CC1=NC=NC=C1Br NO11920 [0,1,0,0,0,0|2,0,0]=3 367 B8R1.5 CC1=NC=NC=C1I NO12766 [0,1,0,0,0,0|2,0,0]=3 368 B8R1.5 CC1=NC=NC=C1N NO19908 [0,1,0,0,0,0|2,0,0]=3 369 B8R1.5 C[N+]1=C(Cl)C=CC=C1 NO19467 [0,1,0,0,0,0|3,0,0]=4 370 B8R1.5 ClC1=C(Br)C=CC=C1 NO21391 [0,1,0,0,0,0|2,0,0]=3 371 B8R1.5 ClC1=C(Br)C=CN=C1 NO15809 [0,1,0,0,0,0|1,0,0]=2 372 B8R1.5 ClC1=C(Cl)C=NC=C1 NO14992 [0,1,0,0,0,0|1,0,0]=2 373 B8R1.5 ClC1=C(Cl)N=NC=C1 DY102217 [0,1,0,0,0,0|2,0,0]=3 374 B8R1.5 ClC1=C(I)C=CN=C1 NO17639 [0,1,0,0,0,0|1,0,0]=2 375 B8R1.5 ClC1=C(I)C=CN=C1 NO19993 [0,1,0,0,0,0|1,0,0]=2 376 B8R1.5 ClC1=C(I)C=NC=C1 NO17640 [0,1,0,0,0,0|1,0,0]=2 377 B8R1.5 ClC1=CC=CN=C1Br NO17272 [0,1,0,0,0,0|3,0,0]=4 378 B8R1.5 ClC1=CC=CN=C1Cl NO13373 [0,1,0,0,0,0|3,0,0]=4 379 B8R1.5 ClC1=CN=CN=C1Cl DY565761 [0,1,0,0,0,0|2,0,0]=3 380 B8R1.5 ClC1=NC=CC=C1Br NO22671 [0,1,0,0,0,0|3,0,0]=4 381 B8R1.5 ClC1=NC=CC=C1I NO22694 [0,1,0,0,0,0|3,0,0]=4 382 B8R1.5 ClC1=NC=NC=C1Br NO22769 [0,1,0,0,0,0|2,0,0]=3 383 B8R1.5 ClC1=NC=NC=C1I NO19722 [0,1,0,0,0,0|2,0,0]=3 384 B8R1.5 Clc1ncncc1Br DY512511 [0,1,0,0,0,0|2,0,0]=3 385 B8R1.5 FC1=C(Br)C=CC=C1 NO19658 [0,1,0,0,0,0|2,0,0]=3 386 B8R1.5 FC1=C(Br)C=NC=C1 NO13534 [0,1,0,0,0,0|1,0,0]=2 387 B8R1.5 FC1=C(Cl)C=CN=C1 DY658401 [0,1,0,0,0,0|1,0,0]=2 388 B8R1.5 FC1=C(F)C=CC=C1 NO20490 [0,1,0,0,0,0|2,0,0]=3 389 B8R1.5 FC1=C(I)C=CN=C1 NO18172 [0,1,0,0,0,0|1,0,0]=2 390 B8R1.5 FC1=CC=CN=C1Br NO14296 [0,1,0,0,0,0|3,0,0]=4 391 B8R1.5 FC1=CC=CN=C1Cl NO17308 [0,1,0,0,0,0|3,0,0]=4 392 B8R1.5 FC1=CC=CN=C1F NO18753 [0,1,0,0,0,0|3,0,0]=4 393 B8R1.5 FC1=CN=CN=C1Cl NO11918 [0,1,0,0,0,0|2,0,0]=3 394 B8R1.5 FC1=NC=CC=C1Br NO14198 [0,1,0,0,0,0|3,0,0]=4 395 B8R1.5 FC1=NC=CC=C1Cl NO18743 [0,1,0,0,0,0|3,0,0]=4 396 B8R1.5 FC1=NC=CC=C1I NO21866 [0,1,0,0,0,0|3,0,0]=4 397 B8R1.5 NC1=C(Br)C=CC=C1 NO19197 [0,1,0,0,0,0|1,0,0]=2 398 B8R1.5 NC1=C(Br)C=CN=C1 NO13987 [0,1,0,0,0,0|1,0,0]=2 399 B8R1.5 NC1=C(Br)C=NC=C1 NO21968 [0,1,0,0,0,0|0,0,0]=1 400 B8R1.5 NC1=C(Cl)C=CN=C1 NO22737 [0,1,0,0,0,0|1,0,0]=2 401 B8R1.5 NC1=C(Cl)C=NC=C1 NO13897 [0,1,0,0,0,0|0,0,0]=1 402 B8R1.5 NC1=C(F)C=NC=C1 NO13971 [0,1,0,0,0,0|0,0,0]=1 403 B8R1.5 NC1=C(I)C=CC=C1 NO23020 [0,1,0,0,0,0|1,0,0]=2 404 B8R1.5 NC1=C(I)C=CN=C1 NO17808 [0,1,0,0,0,0|1,0,0]=2 405 B8R1.5 NC1=C(I)C=NC=C1 NO18532 [0,1,0,0,0,0|0,0,0]=1 406 B8R1.5 NC1=C(N)C=NC=C1 NO22778 [0,1,0,0,0,0|0,0,0]=1 407 B8R1.5 NC1=C(O)C=CC=C1 NO21309 [0,1,0,0,0,0|1,0,0]=2 408 B8R1.5 NC1=C(O)C=NC=C1 NO14741 [0,1,0,0,0,0|0,0,0]=1 409 B8R1.5 NC1=CC=CN=C1Br NO22729 [0,1,0,0,0,0|2,0,0]=3 410 B8R1.5 NC1=CC=CN=C1Cl NO17686 [0,1,0,0,0,0|2,0,0]=3 411 B8R1.5 NC1=CC=CN=C1F NO22742 [0,1,0,0,0,0|2,0,0]=3 412 B8R1.5 NC1=CC=CN=C1I NO18159 [0,1,0,0,0,0|2,0,0]=3 413 B8R1.5 NC1=CC=CN=C1N NO21785 [0,1,0,0,0,0|2,0,0]=3 414 B8R1.5 NC1=CC=CNC1=O NO15503 [0,1,0,0,0,0|2,0,0]=3 415 B8R1.5 NC1=CC=CNC1=S NO20821 [0,1,0,0,0,0|2,0,0]=3 416 B8R1.5 NC1=CC=NNC1=O NO15772 [0,1,0,0,0,0|1,0,0]=2 417 B8R1.5 NC1=CN=CN=C1Br NO12371 [0,1,0,0,0,0|2,0,0]=3 418 B8R1.5 NC1=CN=CN=C1Cl NO10217 [0,1,0,0,0,0|2,0,0]=3 419 B8R1.5 NC1=CN=CN=C1N DY10418 [0,1,0,0,0,0|1,0,0]=2 420 B8R1.5 NC1=NC=CC=C1Br NO17634 [0,1,0,0,0,0|2,0,0]=3 421 B8R1.5 NC1=NC=CC=C1Cl NO17664 [0,1,0,0,0,0|2,0,0]=3 422 B8R1.5 NC1=NC=CC=C1F NO13951 [0,1,0,0,0,0|2,0,0]=3 423 B8R1.5 NC1=NC=CC=C1I NO13464 [0,1,0,0,0,0|2,0,0]=3 424 B8R1.5 NC1=NC=CC=C1O NO22765 [0,1,0,0,0,0|2,0,0]=3 425 B8R1.5 NC1=NC=CN=C1Br NO21229 [0,1,0,0,0,0|3,0,0]=4 426 B8R1.5 NC1=NC=CN=C1Cl NO18423 [0,1,0,0,0,0|3,0,0]=4 427 B8R1.5 NC1=NC=CN=C1F DY710113 [0,1,0,0,0,0|3,0,0]=4 428 B8R1.5 NC1=NC=CN=C1I NO12456 [0,1,0,0,0,0|3,0,0]=4 429 B8R1.5 NC1=NC=CN=C1N DY517323 [0,1,0,0,0,0|3,0,0]=4 430 B8R1.5 NC1=NC=CN=C1O NO21231 [0,1,0,0,0,0|3,0,0]=4 431 B8R1.5 NC1=NC=NC=C1Br NO18005 [0,1,0,0,0,0|1,0,0]=2 432 B8R1.5 NC1=NC=NC=C1Cl NO12255 [0,1,0,0,0,0|1,0,0]=2 433 B8R1.5 NC1=NC=NC=C1F NO12828 [0,1,0,0,0,0|1,0,0]=2 434 B8R1.5 NC1=NC=NC=C1O NO16658 [0,1,0,0,0,0|1,0,0]=2 435 B8R1.5 O=C1C=COC=C1O NO16007 [0,1,0,0,0,0|2,0,0]=3 436 B8R1.5 O=C1N=CNC=C1Br NO10567 [0,1,0,0,0,0|2,0,1]=4 437 B8R1.5 O=C1N=CNC=C1Br NO12515 [0,1,0,0,0,0|2,0,1]=4 438 B8R1.5 O=C1NC=CC=C1F NO13754 [0,1,0,0,0,0|3,0,0]=4 439 B8R1.5 O=C1NC=CC=C1I NO16075 [0,1,0,0,0,0|3,0,0]=4 440 B8R1.5 O=C1NC=CC=C1O NO22752 [0,1,0,0,0,0|3,0,0]=4 441 B8R1.5 O=C1NC=NC=C1O NO15721 [0,1,0,0,0,0|2,0,0]=3 442 B8R1.5 O=C1NN=CC=C1Cl NO15942 [0,1,0,0,0,0|2,0,0]=3 443 B8R1.5 OC1=C(Br)C=CC=C1 NO19429 [0,1,0,0,0,0|2,0,0]=3 444 B8R1.5 OC1=C(Br)C=CN=C1 NO13781 [0,1,0,0,0,0|1,0,0]=2 445 B8R1.5 OC1=C(Br)C=NC=C1 NO14222 [0,1,0,0,0,0|1,0,0]=2 446 B8R1.5 OC1=C(Cl)C=CN=C1 NO16383 [0,1,0,0,0,0|1,0,0]=2 447 B8R1.5 OC1=C(Cl)C=NC=C1 NO16225 [0,1,0,0,0,0|1,0,0]=2 448 B8R1.5 OC1=C(Cl)N=NC=C1 DY737048 [0,1,0,0,0,0|2,0,0]=3 449 B8R1.5 OC1=C(F)C=NC=C1 NO22284 [0,1,0,0,0,0|1,0,0]=2 450 B8R1.5 OC1=C(I)C=CC=C1 DY20193 [0,1,0,0,0,0|2,0,0]=3 451 B8R1.5 OC1=C(I)C=CN=C1 NO12130 [0,1,0,0,0,0|1,0,0]=2 452 B8R1.5 OC1=CC=CC=C1O NO11109 [0,1,0,0,0,0|2,0,0]=3 453 B8R1.5 OC1=CC=CN=C1Cl NO17508 [0,1,0,0,0,0|3,0,0]=4 454 B8R1.5 OC1=CC=CN=C1F NO13836 [0,1,0,0,0,0|3,0,0]=4 455 B8R1.5 OC1=CC=CN=C1I NO14294 [0,1,0,0,0,0|3,0,0]=4 456 B8R1.5 OC1=NC=CC=C1Br NO18703 [0,1,0,0,0,0|3,0,0]=4 457 B8R1.5 OC1=NC=NC=C1I NO12263 [0,1,0,0,0,0|2,0,0]=3 458 B8R1.5 SC1=C(I)C=CC=C1 DY41410 [0,1,0,0,0,0|2,0,0]=3 459 B8R1.5 [O-][N+]1=C(O)C=CC=C1 NO21603 [0,1,0,0,0,0|3,0,0]=4 460 B6R0.4 C=C\C=C\C(=O)O NO12033 [0,0,1,0,0,0|3,0,0]=4 461 B6R1.2 BrC1=CC=CS1 NO21414 [0,0,0,0,1,0|2,0,0]=3 462 B6R1.2 BrC1=CC=C[Se]1 DY114898 [0,0,0,0,1,0|2,0,0]=3 463 B6R1.2 BrC1=CC=NN1 NO17757 [0,0,0,0,1,0|2,0,0]=3 464 B6R1.2 BrC1=CN=CS1 NO14114 [0,0,0,0,1,0|2,0,0]=3 465 B6R1.2 BrC1=CNC=N1 NO14270 [0,0,0,0,1,0|2,0,1]=4 466 B6R1.2 BrC1=CNN=C1 NO13922 [0,0,0,0,1,0|2,0,0]=3 467 B6R1.2 BrC1=COC=C1 NO19877 [0,0,0,0,1,0|2,0,0]=3 468 B6R1.2 BrC1=CSC=C1 NO21415 [0,0,0,0,1,0|2,0,0]=3 469 B6R1.2 BrC1=CSC=N1 DY20197 [0,0,0,0,1,0|3,0,0]=4 470 B6R1.2 BrC1=NC=CN1 NO19858 [0,0,0,0,1,0|3,0,0]=4 471 B6R1.2 BrC1=NC=CS1 NO14242 [0,0,0,0,1,0|3,0,0]=4 472 B6R1.2 BrC1=NC=NS1 NO14599 [0,0,0,0,1,0|3,0,0]=4 473 B6R1.2 BrC1=NN=CN1 NO18124 [0,0,0,0,1,0|3,0,0]=4 474 B6R1.2 BrC1=NN=CS1 NO21329 [0,0,0,0,1,0|3,0,0]=4 475 B6R1.2 BrC1=NNC=C1 NO19717 [0,0,0,0,1,0|2,0,1]=4 476 B6R1.2 BrC1=NOC=C1 DY113742 [0,0,0,0,1,0|3,0,0]=4 477 B6R1.2 BrC1=NSC=C1 NO11529 [0,0,0,0,1,0|3,0,0]=4 478 B6R1.2 CC1=CC=CN1 NO21660 [0,0,0,0,1,0|2,0,0]=3 479 B6R1.2 CC1=CC=CS1 NO21701 [0,0,0,0,1,0|2,0,0]=3 480 B6R1.2 CC1=CC=NN1 DY21108 [0,0,0,0,1,0|2,0,0]=3 481 B6R1.2 CC1=CN=CS1 NO10460 [0,0,0,0,1,0|2,0,0]=3 482 B6R1.2 CC1=CNC=C1 DY20689 [0,0,0,0,1,0|1,0,1]=3 483 B6R1.2 CC1=CNC=N1 DY20397 [0,0,0,0,1,0|2,0,1]=4 484 B6R1.2 CC1=CNN=C1 NO22982 [0,0,0,0,1,0|2,0,0]=3 485 B6R1.2 CC1=CNN=N1 NO12910 [0,0,0,0,1,0|3,0,0]=4 486 B6R1.2 CC1=CON=C1 DY822175 [0,0,0,0,1,0|2,0,0]=3 487 B6R1.2 CC1=CSC=N1 NO15621 [0,0,0,0,1,0|3,0,0]=4 488 B6R1.2 CC1=NC=CN1 DY562149 [0,0,0,0,1,0|3,0,0]=4 489 B6R1.2 CC1=NC=CN1 DY567567 [0,0,0,0,1,0|3,0,0]=4 490 B6R1.2 CC1=NC=CS1 NO22598 [0,0,0,0,1,0|3,0,0]=4 491 B6R1.2 CC1=NN=CO1 NO12863 [0,0,0,0,1,0|3,0,0]=4 492 B6R1.2 CC1=NNC=C1 NO13720 [0,0,0,0,1,0|2,0,1]=4 493 B6R1.2 CC1=NOC=C1 NO11533 [0,0,0,0,1,0|3,0,0]=4 494 B6R1.2 CN1C=CC=C1 NO20770 [0,0,0,0,1,0|2,0,0]=3 495 B6R1.2 CN1C=CC=N1 NO19419 [0,0,0,0,1,0|3,0,0]=4 496 B6R1.2 CN1C=CN=N1 NO20743 [0,0,0,0,1,0|3,0,0]=4 497 B6R1.2 CN1C=NC=N1 NO20744 [0,0,0,0,1,0|3,0,0]=4 498 B6R1.2 CN1C=NN=C1 DY20987 [0,0,0,0,1,0|3,0,0]=4 499 B6R1.2 ClC1=CN=CN1 NO10347 [0,0,0,0,1,0|2,0,0]=3 500 B6R1.2 ClC1=CN=CS1 DY460404 [0,0,0,0,1,0|2,0,0]=3 501 B6R1.2 ClC1=CNN=C1 NO18764 [0,0,0,0,1,0|2,0,0]=3 502 B6R1.2 ClC1=CSC=N1 NO14317 [0,0,0,0,1,0|3,0,0]=4 503 B6R1.2 ClC1=NC=NS1 NO13994 [0,0,0,0,1,0|3,0,0]=4 504 B6R1.2 ClC1=NN=CN1 NO18465 [0,0,0,0,1,0|3,0,0]=4 505 B6R1.2 ClC1=NN=CS1 DY558585 [0,0,0,0,1,0|3,0,0]=4 506 B6R1.2 FC1=CNN=C1 DY550557 [0,0,0,0,1,0|2,0,0]=3 507 B6R1.2 IC1=CC=CS1 NO21616 [0,0,0,0,1,0|2,0,0]=3 508 B6R1.2 IC1=CNC=N1 NO14306 [0,0,0,0,1,0|2,0,1]=4 509 B6R1.2 IC1=CNN=C1 NO14308 [0,0,0,0,1,0|2,0,0]=3 510 B6R1.2 IC1=CSC=C1 NO22332 [0,0,0,0,1,0|2,0,0]=3 511 B6R1.2 IC1=NC=CN1 NO21881 [0,0,0,0,1,0|3,0,0]=4 512 B6R1.2 IC1=NNC=C1 NO13669 [0,0,0,0,1,0|2,0,1]=4 513 B6R1.2 NC1=CC=NO1 DY459948 [0,0,0,0,1,0|1,0,0]=2 514 B6R1.2 NC1=CC=NS1 DY20989 [0,0,0,0,1,0|1,0,0]=2 515 B6R1.2 NC1=CN=NS1 NO13955 [0,0,0,0,1,0|2,0,0]=3 516 B6R1.2 NC1=CNC=N1 DY506688 [0,0,0,0,1,0|1,0,1]=3 517 B6R1.2 NC1=CNC=N1 NO16117 [0,0,0,0,1,0|1,0,1]=3 518 B6R1.2 NC1=CNN=C1 NO18307 [0,0,0,0,1,0|1,0,0]=2 519 B6R1.2 NC1=COC=N1 DY121309 [0,0,0,0,1,0|2,0,0]=3 520 B6R1.2 NC1=CON=C1 NO15739 [0,0,0,0,1,0|1,0,0]=2 521 B6R1.2 NC1=CSC=C1 NO12280 [0,0,0,0,1,0|1,0,0]=2 522 B6R1.2 NC1=NC=CN1 NO13716 [0,0,0,0,1,0|2,0,0]=3 523 B6R1.2 NC1=NC=CO1 NO19070 [0,0,0,0,1,0|2,0,0]=3 524 B6R1.2 NC1=NC=CS1 NO16381 [0,0,0,0,1,0|2,0,0]=3 525 B6R1.2 NC1=NC=NN1 NO15608 [0,0,0,0,1,0|2,0,0]=3 526 B6R1.2 NC1=NC=NS1 NO13953 [0,0,0,0,1,0|2,0,0]=3 527 B6R1.2 NC1=NC=NS1 NO15183 [0,0,0,0,1,0|2,0,0]=3 528 B6R1.2 NC1=NN=CS1 NO22505 [0,0,0,0,1,0|2,0,0]=3 529 B6R1.2 NC1=NNC=C1 DY645486 [0,0,0,0,1,0|1,0,1]=3 530 B6R1.2 NC1=NNC=C1 NO22527 [0,0,0,0,1,0|1,0,1]=3 531 B6R1.2 NC1=NNC=N1 NO22032 [0,0,0,0,1,0|2,0,1]=4 532 B6R1.2 NC1=NOC=C1 NO14368 [0,0,0,0,1,0|2,0,0]=3 533 B6R1.2 NC1CC=CC1 NO19415 [0,0,0,0,1,0|0,0,3]=4 534 B6R1.2 NN1C=CC=C1 DY10332 [0,0,0,0,1,0|1,0,0]=2 535 B6R1.2 NN1C=CN=C1 DY725995 [0,0,0,0,1,0|1,0,0]=2 536 B6R1.2 NN1C=NN=C1 NO22509 [0,0,0,0,1,0|2,0,0]=3 537 B6R1.2 O=C1CC=NN1 NO20496 [0,0,0,0,1,0|2,0,1]=4 538 B6R1.2 OC1=NC=CS1 NO12100 [0,0,0,0,1,0|3,0,0]=4 539 B6R1.2 OC1=NN=CS1 DY607647 [0,0,0,0,1,0|3,0,0]=4 540 B6R1.2 ON1C=CC=N1 NO12818 [0,0,0,0,1,0|3,0,0]=4 541 B6R1.2 SC1=NC=CS1 DY573237 [0,0,0,0,1,0|3,0,0]=4 542 B6R1.2 SC1=NN=CS1 DY20533 [0,0,0,0,1,0|3,0,0]=4 543 B5R0.1 N\C=C\C(N)=O DY741355 [1,0,1,0,0,0|1,0,1]=4 544 B7R1.1 C=CN1C=CN=C1 DY20497 [0,1,0,0,1,0|2,0,0]=4 545 B7R1.1 CNC1=CC=CS1 DY786838 [0,1,0,0,1,0|1,0,0]=3 546 B7R1.1 CNC1=NNC=C1 DY555147 [0,1,0,0,1,0|1,0,1]=4 547 B7R1.1 COC1=CC=CO1 DY759896 [0,1,0,0,1,0|2,0,0]=4 548 B7R1.1 COC1=CSC=C1 NO22351 [0,1,0,0,1,0|2,0,0]=4 549 B7R1.1 ClCC1=CC=CO1 NO13429 [0,1,0,0,1,0|2,0,0]=4 550 B7R1.1 ClCC1=CN=CO1 DY114644 [0,1,0,0,1,0|2,0,0]=4 551 B7R1.1 ClCC1=CN=CS1 NO16156 [0,1,0,0,1,0|2,0,0]=4 552 B7R1.1 N#CC1=CC=CS1 NO22701 [0,1,0,0,1,0|1,0,1]=4 553 B7R1.1 N#CC1=CC=NO1 NO17495 [0,1,0,0,1,0|1,0,1]=4 554 B7R1.1 N#CC1=CN=CS1 NO12489 [0,1,0,0,1,0|1,0,1]=4 555 B7R1.1 N#CC1=CNC=C1 DY568533 [0,1,0,0,1,0|0,0,2]=4 556 B7R1.1 N#CC1=CNN=C1 NO17637 [0,1,0,0,1,0|1,0,1]=4 557 B7R1.1 N#CC1=CNN=C1 NO22809 [0,1,0,0,1,0|1,0,1]=4 558 B7R1.1 N#CC1=CSC=C1 NO17418 [0,1,0,0,1,0|1,0,1]=4 559 B7R1.1 NCC1=CC=CN1 NO14874 [0,1,0,0,1,0|1,0,0]=3 560 B7R1.1 NCC1=CC=CS1 NO22783 [0,1,0,0,1,0|1,0,0]=3 561 B7R1.1 NCC1=CN=CO1 NO17502 [0,1,0,0,1,0|1,0,0]=3 562 B7R1.1 NCC1=CN=CO1 NO18508 [0,1,0,0,1,0|1,0,0]=3 563 B7R1.1 NCC1=CN=CS1 DY517137 [0,1,0,0,1,0|1,0,0]=3 564 B7R1.1 NCC1=CN=NN1 DY501302 [0,1,0,0,1,0|2,0,0]=4 565 B7R1.1 NCC1=CNC=N1 NO15263 [0,1,0,0,1,0|1,0,1]=4 566 B7R1.1 NCC1=CNC=N1 NO16828 [0,1,0,0,1,0|1,0,1]=4 567 B7R1.1 NCC1=CON=C1 DY531627 [0,1,0,0,1,0|1,0,0]=3 568 B7R1.1 NCC1=CSC=C1 NO22417 [0,1,0,0,1,0|1,0,0]=3 569 B7R1.1 NCC1=CSC=N1 DY116268 [0,1,0,0,1,0|2,0,0]=4 570 B7R1.1 NCC1=NC=CO1 DY773829 [0,1,0,0,1,0|2,0,0]=4 571 B7R1.1 NCC1=NC=CS1 DY560307 [0,1,0,0,1,0|2,0,0]=4 572 B7R1.1 NCC1=NN=CO1 DY103312 [0,1,0,0,1,0|2,0,0]=4 573 B7R1.1 NCC1=NNC=C1 NO15493 [0,1,0,0,1,0|1,0,1]=4 574 B7R1.1 NNC1=NC=CS1 DY785464 [0,1,0,0,1,0|2,0,0]=4 575 B7R1.1 O=CC1=CC=CN1 NO17764 [0,1,0,0,1,0|2,0,0]=4 576 B7R1.1 O=CC1=CC=CS1 NO16400 [0,1,0,0,1,0|2,0,0]=4 577 B7R1.1 O=CC1=CN=CS1 NO15582 [0,1,0,0,1,0|2,0,0]=4 578 B7R1.1 O=CC1=CNC=C1 NO20728 [0,1,0,0,1,0|1,0,1]=4 579 B7R1.1 O=CC1=CNN=C1 NO17644 [0,1,0,0,1,0|2,0,0]=4 580 B7R1.1 O=CC1=CNN=C1 NO18258 [0,1,0,0,1,0|2,0,0]=4 581 B7R1.1 O=CC1=CSC=C1 NO14553 [0,1,0,0,1,0|2,0,0]=4 582 B7R1.1 OCC1=CC=NO1 NO15343 [0,1,0,0,1,0|2,0,0]=4 583 B7R1.1 OCC1=CN=CS1 NO16191 [0,1,0,0,1,0|2,0,0]=4 584 B7R1.1 OCC1=CNN=C1 NO20094 [0,1,0,0,1,0|2,0,0]=4 585 B7R1.1 OCC1=COC=C1 NO22303 [0,1,0,0,1,0|2,0,0]=4 586 B7R1.1 OCC1=CSC=C1 NO18039 [0,1,0,0,1,0|2,0,0]=4 587 B7R1.1 OCN1C=CN=C1 DY726289 [0,1,0,0,1,0|2,0,0]=4 588 B7R1.2 BrC1=CC=C(Br)S1 NO22553 [0,1,0,0,1,0|2,0,0]=4 589 B7R1.2 BrC1=CN=C(Br)S1 NO19923 [0,1,0,0,1,0|2,0,0]=4 590 B7R1.2 BrC1=NC=C(I)S1 DY452794 [0,1,0,0,1,0|2,0,0]=4 591 B7R1.2 CC1=CC(Br)=CS1 NO22736 [0,1,0,0,1,0|2,0,0]=4 592 B7R1.2 CC1=CC(Br)=NN1 NO12832 [0,1,0,0,1,0|2,0,0]=4 593 B7R1.2 CC1=CC(Br)=NO1 DY113406 [0,1,0,0,1,0|2,0,0]=4 594 B7R1.2 CC1=CC(C)=NN1 NO19982 [0,1,0,0,1,0|2,0,0]=4 595 B7R1.2 CC1=CC(C)=NO1 NO14107 [0,1,0,0,1,0|2,0,0]=4 596 B7R1.2 CC1=CC(I)=NN1 NO16887 [0,1,0,0,1,0|2,0,0]=4 597 B7R1.2 CC1=CC(N)=CS1 DY786994 [0,1,0,0,1,0|1,0,0]=3 598 B7R1.2 CC1=CC=C(Br)O1 DY513585 [0,1,0,0,1,0|2,0,0]=4 599 B7R1.2 CC1=CC=C(Br)S1 NO22735 [0,1,0,0,1,0|2,0,0]=4 600 B7R1.2 CC1=CC=C(C)N1 NO21153 [0,1,0,0,1,0|2,0,0]=4 601 B7R1.2 CC1=CC=C(Cl)S1 DY451354 [0,1,0,0,1,0|2,0,0]=4 602 B7R1.2 CC1=CC=C(I)S1 DY530097 [0,1,0,0,1,0|2,0,0]=4 603 B7R1.2 CC1=CC=C(N)S1 DY787300 [0,1,0,0,1,0|1,0,0]=3 604 B7R1.2 CC1=CC=C(N)S1 DY787384 [0,1,0,0,1,0|1,0,0]=3 605 B7R1.2 CC1=CN(C)N=C1 NO20542 [0,1,0,0,1,0|2,0,0]=4 606 B7R1.2 CC1=CN=C(Br)S1 NO12301 [0,1,0,0,1,0|2,0,0]=4 607 B7R1.2 CC1=CN=C(C)S1 NO22782 [0,1,0,0,1,0|2,0,0]=4 608 B7R1.2 CC1=CN=C(N)S1 NO21821 [0,1,0,0,1,0|2,0,0]=4 609 B7R1.2 CC1=CSC(N)=N1 DY785716 [0,1,0,0,1,0|2,0,0]=4 610 B7R1.2 CC1=NC(N)=CO1 DY773883 [0,1,0,0,1,0|2,0,0]=4 611 B7R1.2 CC1=NC=C(I)N1 NO19295 [0,1,0,0,1,0|2,0,0]=4 612 B7R1.2 CC1=NC=C(N)N1 DY445566 [0,1,0,0,1,0|1,0,0]=3 613 B7R1.2 CC1=NC=C(N)S1 NO15937 [0,1,0,0,1,0|1,0,0]=3 614 B7R1.2 CC1=NN=C(N)N1 NO22083 [0,1,0,0,1,0|2,0,0]=4 615 B7R1.2 CC1=NN=C(N)S1 DY460812 [0,1,0,0,1,0|2,0,0]=4 616 B7R1.2 CC1=NOC(Br)=C1 DY773601 [0,1,0,0,1,0|2,0,0]=4 617 B7R1.2 CC1=NOC(N)=C1 NO16239 [0,1,0,0,1,0|1,0,0]=3 618 B7R1.2 CC1=NSC(N)=C1 DY459756 [0,1,0,0,1,0|1,0,0]=3 619 B7R1.2 CC1=NSC(N)=C1 NO16387 [0,1,0,0,1,0|1,0,0]=3 620 B7R1.2 CN1C=C(Br)C=N1 NO19794 [0,1,0,0,1,0|2,0,0]=4 621 B7R1.2 CN1C=C(Cl)C=N1 NO12276 [0,1,0,0,1,0|2,0,0]=4 622 B7R1.2 CN1C=C(I)C=N1 NO20765 [0,1,0,0,1,0|2,0,0]=4 623 B7R1.2 CN1C=C(N)C=N1 NO12134 [0,1,0,0,1,0|1,0,0]=3 624 B7R1.2 CN1C=C(N)C=N1 NO15973 [0,1,0,0,1,0|1,0,0]=3 625 B7R1.2 CN1C=CC(N)=C1 NO17699 [0,1,0,0,1,0|0,0,1]=3 626 B7R1.2 CN1C=NC(Br)=C1 DY544755 [0,1,0,0,1,0|2,0,0]=4 627 B7R1.2 CN1C=NC(I)=C1 NO16068 [0,1,0,0,1,0|2,0,0]=4 628 B7R1.2 CN1C=NC(N)=C1 NO15605 [0,1,0,0,1,0|1,0,1]=4 629 B7R1.2 C[N+]1=CN(N)C=N1 DY822854 [0,1,0,0,1,0|2,0,0]=4 630 B7R1.2 ClC1=CC=C(Cl)S1 DY548247 [0,1,0,0,1,0|2,0,0]=4 631 B7R1.2 NC1=CC(=O)CS1 DY786970 [0,1,0,0,1,0|1,0,1]=4 632 B7R1.2 NC1=CC(=O)NN1 NO13152 [0,1,0,0,1,0|1,0,1]=4 633 B7R1.2 NC1=CC(Br)=CN1 DY717897 [0,1,0,0,1,0|1,0,0]=3 634 B7R1.2 NC1=CC(N)=NN1 DY645492 [0,1,0,0,1,0|1,0,0]=3 635 B7R1.2 NC1=CN=C(Br)S1 DY786196 [0,1,0,0,1,0|1,0,0]=3 636 B7R1.2 NC1=CSC(Cl)=C1 DY104600 [0,1,0,0,1,0|1,0,0]=3 637 B7R1.2 NC1=CSC(N)=N1 NO14359 [0,1,0,0,1,0|2,0,0]=4 638 B7R1.2 NC1=NC(Br)=CS1 NO18333 [0,1,0,0,1,0|2,0,0]=4 639 B7R1.2 NC1=NC=C(Br)O1 DY522675 [0,1,0,0,1,0|2,0,0]=4 640 B7R1.2 NC1=NC=C(Cl)S1 NO21276 [0,1,0,0,1,0|2,0,0]=4 641 B7R1.2 NC1=NC=C(F)S1 NO10393 [0,1,0,0,1,0|2,0,0]=4 642 B7R1.2 NC1=NN=C(Br)S1 NO13944 [0,1,0,0,1,0|2,0,0]=4 643 B7R1.2 NC1=NN=C(Cl)S1 NO12574 [0,1,0,0,1,0|2,0,0]=4 644 B7R1.2 NC1=NN=C(S)S1 DY20709 [0,1,0,0,1,0|2,0,0]=4 645 B7R1.2 NC1=NNC(Br)=C1 NO15854 [0,1,0,0,1,0|1,0,1]=4 646 B7R1.2 O=C1C=CC(=O)O1 DY743137 [0,1,0,0,1,0|2,0,0]=4 647 B7R1.4 BrC1=C(Br)SC=C1 NO22551 [0,1,0,0,1,0|2,0,0]=4 648 B7R1.4 BrC1=CSC=C1Br NO22554 [0,1,0,0,1,0|2,0,0]=4 649 B7R1.4 CC1=C(Br)C=NN1 NO16927 [0,1,0,0,1,0|2,0,0]=4 650 B7R1.4 CC1=C(Br)SC=C1 NO13700 [0,1,0,0,1,0|2,0,0]=4 651 B7R1.4 CC1=C(C)NC=N1 DY20435 [0,1,0,0,1,0|2,0,0]=4 652 B7R1.4 CC1=C(C)NC=N1 DY575295 [0,1,0,0,1,0|2,0,0]=4 653 B7R1.4 CC1=C(C)SC=N1 NO22784 [0,1,0,0,1,0|2,0,0]=4 654 B7R1.4 CC1=C(N)C=NN1 DY605875 [0,1,0,0,1,0|1,0,0]=3 655 B7R1.4 CC1=C(N)C=NN1 DY609385 [0,1,0,0,1,0|1,0,0]=3 656 B7R1.4 CC1=CC=NN1C NO19266 [0,1,0,0,1,0|2,0,0]=4 657 B7R1.4 CC1=CNN=C1C NO13346 [0,1,0,0,1,0|2,0,0]=4 658 B7R1.4 CC1=NNC=C1Br NO15947 [0,1,0,0,1,0|2,0,0]=4 659 B7R1.4 CC1=NNC=C1I NO22358 [0,1,0,0,1,0|2,0,0]=4 660 B7R1.4 CC1=NOC=C1N NO17073 [0,1,0,0,1,0|1,0,0]=3 661 B7R1.4 CN1C=CN=C1I NO21609 [0,1,0,0,1,0|2,0,0]=4 662 B7R1.4 CN1C=NC=C1Br NO17783 [0,1,0,0,1,0|2,0,0]=4 663 B7R1.4 CN1C=NC=C1I NO16077 [0,1,0,0,1,0|2,0,0]=4 664 B7R1.4 CN1C=NC=C1N NO17122 [0,1,0,0,1,0|1,0,0]=3 665 B7R1.4 CN1C=NN=C1N NO16957 [0,1,0,0,1,0|2,0,0]=4 666 B7R1.4 CN1N=CC=C1Br NO12124 [0,1,0,0,1,0|2,0,0]=4 667 B7R1.4 CN1N=CC=C1N NO22609 [0,1,0,0,1,0|1,0,0]=3 668 B7R1.4 CN1N=CC=C1O NO10399 [0,1,0,0,1,0|2,0,0]=4 669 B7R1.4 ClC1=C(Br)C=CS1 NO22555 [0,1,0,0,1,0|2,0,0]=4 670 B7R1.4 NC1=C(Br)C=NN1 NO14320 [0,1,0,0,1,0|1,0,0]=3 671 B7R1.4 NC1=CC=NN1Br DY645088 [0,1,0,0,1,0|1,0,0]=3 672 B7R1.4 NC1=CNN=C1N DY529047 [0,1,0,0,1,0|1,0,0]=3 673 B7R1.4 NC1=NNC=C1Cl DY648163 [0,1,0,0,1,0|1,0,1]=4 674 B7R1.4 NC1=NON=C1N NO21924 [0,1,0,0,1,0|2,0,0]=4 675 B9R1.1 BrCC1=CC=C(Br)C=C1 NO19166 [0,2,0,0,0,0|2,0,0]=4 676 B9R1.1 BrCC1=CC=C(I)C=C1 NO20172 [0,2,0,0,0,0|2,0,0]=4 677 B9R1.1 CC1=CC=C(C#N)C=C1 NO19807 [0,2,0,0,0,0|1,0,1]=4 678 B9R1.1 CC1=CC=C(CBr)C=C1 NO22969 [0,2,0,0,0,0|2,0,0]=4 679 B9R1.1 CC1=CC=C(CCl)C=C1 DY40603 [0,2,0,0,0,0|2,0,0]=4 680 B9R1.1 CC1=CC=C(CN)C=C1 NO22970 [0,2,0,0,0,0|1,0,0]=3 681 B9R1.1 CC1=CC=C(CO)C=C1 NO19704 [0,2,0,0,0,0|2,0,0]=4 682 B9R1.1 CC1=CC=C(NN)C=C1 NO19576 [0,2,0,0,0,0|1,0,0]=3 683 B9R1.1 CC1=CN=C(CN)C=C1 DY711847 [0,2,0,0,0,0|2,0,0]=4 684 B9R1.1 CC1=CN=C(CN)C=C1 NO18319 [0,2,0,0,0,0|2,0,0]=4 685 B9R1.1 CCC1=CC=C(Br)C=C1 NO10865 [0,2,0,0,0,0|2,0,0]=4 686 B9R1.1 CCC1=CC=C(Cl)C=C1 DY584444 [0,2,0,0,0,0|2,0,0]=4 687 B9R1.1 CCC1=CC=C(F)C=C1 DY20965 [0,2,0,0,0,0|2,0,0]=4 688 B9R1.1 CCC1=CC=C(I)C=C1 DY20189 [0,2,0,0,0,0|2,0,0]=4 689 B9R1.1 CCC1=CC=C(N)C=N1 DY515529 [0,2,0,0,0,0|2,0,0]=4 690 B9R1.1 CCC1=CC=C(O)C=C1 DY20188 [0,2,0,0,0,0|2,0,0]=4 691 B9R1.1 CCC1=CN=C(N)C=C1 DY585943 [0,2,0,0,0,0|2,0,0]=4 692 B9R1.1 CNC1=CC=C(I)C=C1 NO22906 [0,2,0,0,0,0|1,0,0]=3 693 B9R1.1 CNC1=NC=C(Br)C=C1 NO10304 [0,2,0,0,0,0|2,0,0]=4 694 B9R1.1 CNC1=NC=C(F)C=C1 DY711535 [0,2,0,0,0,0|2,0,0]=4 695 B9R1.1 COC1=CC=C(N)C=C1 DY584663 [0,2,0,0,0,0|1,0,0]=3 696 B9R1.1 COC1=CC=C(N)C=C1 NO18580 [0,2,0,0,0,0|1,0,0]=3 697 B9R1.1 COC1=CC=C(N)C=N1 NO19527 [0,2,0,0,0,0|2,0,0]=4 698 B9R1.1 COC1=CC=C(O)C=C1 NO22939 [0,2,0,0,0,0|2,0,0]=4 699 B9R1.1 COC1=CC=[N+]([O-])C=C1 NO18613 [0,2,0,0,0,0|1,0,1]=4 700 B9R1.1 COC1=CN=C(N)C=C1 NO17791 [0,2,0,0,0,0|2,0,0]=4 701 B9R1.1 CSC1=CC=C(I)C=C1 DY585121 [0,2,0,0,0,0|2,0,0]=4 702 B9R1.1 CSC1=CC=C(N)C=N1 DY547125 [0,2,0,0,0,0|2,0,0]=4 703 B9R1.1 CSC1=CC=C(O)C=C1 DY20743 [0,2,0,0,0,0|2,0,0]=4 704 B9R1.1 ClCC1=CC=C(Br)C=C1 NO19167 [0,2,0,0,0,0|2,0,0]=4 705 B9R1.1 ClCC1=CC=C(Cl)C=C1 NO19806 [0,2,0,0,0,0|2,0,0]=4 706 B9R1.1 FC1=CC=C(CBr)C=C1 NO19071 [0,2,0,0,0,0|2,0,0]=4 707 B9R1.1 FCC1=CC=C(Br)C=C1 DY555441 [0,2,0,0,0,0|2,0,0]=4 708 B9R1.1 N#CC1=CC=C(Br)C=C1 NO19210 [0,2,0,0,0,0|1,0,1]=4 709 B9R1.1 N#CC1=CC=C(Cl)C=C1 NO19211 [0,2,0,0,0,0|1,0,1]=4 710 B9R1.1 N#CC1=CC=C(F)C=C1 NO18637 [0,2,0,0,0,0|1,0,1]=4 711 B9R1.1 N#CC1=CC=C(I)C=C1 NO22010 [0,2,0,0,0,0|1,0,1]=4 712 B9R1.1 N#CC1=CC=C(N)C=C1 NO13395 [0,2,0,0,0,0|1,0,0]=3 713 B9R1.1 N#CC1=CC=C(N)C=N1 NO19137 [0,2,0,0,0,0|2,0,0]=4 714 B9R1.1 N#CC1=CC=C(O)C=C1 NO15887 [0,2,0,0,0,0|1,0,1]=4 715 B9R1.1 N#CC1=CC=C(S)C=C1 DY551463 [0,2,0,0,0,0|1,0,1]=4 716 B9R1.1 N#CC1=CN=C(N)C=C1 NO22991 [0,2,0,0,0,0|2,0,0]=4 717 B9R1.1 NC1=CC=C(C=O)C=C1 DY20423 [0,2,0,0,0,0|1,0,0]=3 718 B9R1.1 NCC1=CC=C(Br)C=C1 NO19587 [0,2,0,0,0,0|1,0,0]=3 719 B9R1.1 NCC1=CC=C(Br)N=C1 NO11090 [0,2,0,0,0,0|2,0,0]=4 720 B9R1.1 NCC1=CC=C(Cl)N=C1 NO16390 [0,2,0,0,0,0|2,0,0]=4 721 B9R1.1 NCC1=CC=C(F)C=C1 NO18721 [0,2,0,0,0,0|1,0,0]=3 722 B9R1.1 NCC1=CC=C(N)C=N1 NO10590 [0,2,0,0,0,0|2,0,0]=4 723 B9R1.1 NCC1=CC=C(O)C=C1 NO22886 [0,2,0,0,0,0|1,0,0]=3 724 B9R1.1 NCC1=CNC(=O)C=C1 DY585975 [0,2,0,0,0,0|2,0,0]=4 725 B9R1.1 NCC1=NC=C(F)C=C1 DY430169 [0,2,0,0,0,0|2,0,0]=4 726 B9R1.1 NCC1=NC=C(F)C=C1 NO16554 [0,2,0,0,0,0|2,0,0]=4 727 B9R1.1 NNC1=CC=C(Br)C=C1 NO15342 [0,2,0,0,0,0|1,0,0]=3 728 B9R1.1 NNC1=CC=C(Cl)C=C1 NO13495 [0,2,0,0,0,0|1,0,0]=3 729 B9R1.1 NNC1=CC=C(F)C=C1 NO22006 [0,2,0,0,0,0|1,0,0]=3 730 B9R1.1 NNC1=CC=C(N)C=N1 DY713641 [0,2,0,0,0,0|2,0,0]=4 731 B9R1.1 NNC1=CN=C(Cl)C=C1 DY524685 [0,2,0,0,0,0|2,0,0]=4 732 B9R1.1 NNC1=NC=C(Br)C=C1 NO19995 [0,2,0,0,0,0|2,0,0]=4 733 B9R1.1 NNC1=NC=C(Cl)C=C1 NO20219 [0,2,0,0,0,0|2,0,0]=4 734 B9R1.1 NNC1=NC=C(F)C=C1 NO17301 [0,2,0,0,0,0|2,0,0]=4 735 B9R1.1 O=CC1=CC=C(Br)C=C1 NO18612 [0,2,0,0,0,0|2,0,0]=4 736 B9R1.1 O=CC1=CC=C(Cl)C=C1 NO14843 [0,2,0,0,0,0|2,0,0]=4 737 B9R1.1 O=CC1=CC=C(F)C=C1 NO19072 [0,2,0,0,0,0|2,0,0]=4 738 B9R1.1 O=CC1=CC=C(I)C=C1 NO20133 [0,2,0,0,0,0|2,0,0]=4 739 B9R1.1 O=CC1=CC=C(O)C=C1 NO18686 [0,2,0,0,0,0|2,0,0]=4 740 B9R1.1 OCC1=CC=C(Br)C=C1 NO19378 [0,2,0,0,0,0|2,0,0]=4 741 B9R1.1 OCC1=CC=C(Cl)C=C1 NO19353 [0,2,0,0,0,0|2,0,0]=4 742 B9R1.1 OCC1=CC=C(O)C=C1 NO19212 [0,2,0,0,0,0|2,0,0]=4 743 B9R1.2 BrCC1=CC=CC(Br)=C1 NO19344 [0,2,0,0,0,0|2,0,0]=4 744 B9R1.2 C#CC1=CC(F)=CC=C1 NO20642 [0,2,0,0,0,0|2,0,0]=4 745 B9R1.2 C#CC1=CC=CC(N)=C1 NO10819 [0,2,0,0,0,0|1,0,0]=3 746 B9R1.2 CC1=CC(C#N)=NC=C1 NO20235 [0,2,0,0,0,0|1,0,0]=3 747 B9R1.2 CC1=CC(C=O)=NC=C1 NO19123 [0,2,0,0,0,0|1,0,0]=3 748 B9R1.2 CC1=CC(CCl)=NC=C1 NO15442 [0,2,0,0,0,0|1,0,0]=3 749 B9R1.2 CC1=CC(CCl)=NC=N1 DY694001 [0,2,0,0,0,0|2,0,0]=4 750 B9R1.2 CC1=CC(CN)=CC=C1 NO19644 [0,2,0,0,0,0|1,0,0]=3 751 B9R1.2 CC1=CC(CO)=NC=C1 NO11126 [0,2,0,0,0,0|1,0,0]=3 752 B9R1.2 CC1=CC(NN)=CC=C1 NO19574 [0,2,0,0,0,0|1,0,0]=3 753 B9R1.2 CC1=CC(NN)=NC=C1 NO13399 [0,2,0,0,0,0|1,0,0]=3 754 B9R1.2 CC1=CC=CC(C#N)=C1 NO19778 [0,2,0,0,0,0|1,0,1]=4 755 B9R1.2 CC1=CC=CC(C=O)=C1 DY41127 [0,2,0,0,0,0|2,0,0]=4 756 B9R1.2 CC1=CC=CC(CN)=N1 NO18414 [0,2,0,0,0,0|2,0,0]=4 757 B9R1.2 CC1=NC(CN)=NC=C1 DY580845 [0,2,0,0,0,0|2,0,0]=4 758 B9R1.2 CC1=NC(CN)=NC=C1 DY611424 [0,2,0,0,0,0|2,0,0]=4 759 B9R1.2 CC1=NC=CC(C=O)=C1 NO15441 [0,2,0,0,0,0|1,0,0]=3 760 B9R1.2 CC1=NC=CC(C=O)=N1 NO19715 [0,2,0,0,0,0|2,0,0]=4 761 B9R1.2 CCC1=CC=CC(Cl)=C1 DY584271 [0,2,0,0,0,0|2,0,0]=4 762 B9R1.2 CCC1=NC=CC(Br)=C1 DY658183 [0,2,0,0,0,0|1,0,0]=3 763 B9R1.2 CNC1=CC(Br)=CC=C1 NO22185 [0,2,0,0,0,0|1,0,0]=3 764 B9R1.2 CNC1=CC(Cl)=CC=C1 DY20486 [0,2,0,0,0,0|1,0,0]=3 765 B9R1.2 CNC1=CC(I)=CC=C1 DY563655 [0,2,0,0,0,0|1,0,0]=3 766 B9R1.2 CNC1=CC(N)=CC=C1 NO16640 [0,2,0,0,0,0|1,0,0]=3 767 B9R1.2 CNC1=CC=CC(O)=C1 DY442233 [0,2,0,0,0,0|1,0,0]=3 768 B9R1.2 CNC1=NC=CC(Br)=N1 NO14470 [0,2,0,0,0,0|2,0,0]=4 769 B9R1.2 CNC1=NC=CC(F)=C1 DY714974 [0,2,0,0,0,0|1,0,0]=3 770 B9R1.2 CNC1=NC=CC(I)=C1 DY452194 [0,2,0,0,0,0|1,0,0]=3 771 B9R1.2 CNC1=NC=CC(N)=C1 NO16967 [0,2,0,0,0,0|0,0,0]=2 772 B9R1.2 CNC1=NC=NC(C)=C1 DY695897 [0,2,0,0,0,0|1,0,0]=3 773 B9R1.2 COC1=CC(Br)=NC=C1 NO16230 [0,2,0,0,0,0|1,0,0]=3 774 B9R1.2 COC1=CC(Cl)=NC=C1 NO19311 [0,2,0,0,0,0|1,0,0]=3 775 B9R1.2 COC1=CC(Cl)=NC=N1 NO17690 [0,2,0,0,0,0|2,0,0]=4 776 B9R1.2 COC1=CC(F)=NC=C1 NO14826 [0,2,0,0,0,0|1,0,0]=3 777 B9R1.2 COC1=CC(I)=NC=N1 NO17505 [0,2,0,0,0,0|2,0,0]=4 778 B9R1.2 COC1=CC(N)=NC=C1 NO19522 [0,2,0,0,0,0|1,0,0]=3 779 B9R1.2 COC1=CC(N)=NC=N1 NO18114 [0,2,0,0,0,0|1,0,0]=3 780 B9R1.2 COC1=CC=CC(Cl)=C1 NO19894 [0,2,0,0,0,0|2,0,0]=4 781 B9R1.2 COC1=CC=CC(F)=C1 NO19929 [0,2,0,0,0,0|2,0,0]=4 782 B9R1.2 COC1=CC=CC(N)=C1 NO19943 [0,2,0,0,0,0|1,0,0]=3 783 B9R1.2 COC1=CC=CC(N)=N1 NO13845 [0,2,0,0,0,0|2,0,0]=4 784 B9R1.2 COC1=CC=CC(O)=C1 NO18747 [0,2,0,0,0,0|2,0,0]=4 785 B9R1.2 COC1=CN=CC(N)=C1 NO19973 [0,2,0,0,0,0|2,0,0]=4 786 B9R1.2 COC1=CN=NC(Cl)=C1 NO22227 [0,2,0,0,0,0|2,0,0]=4 787 B9R1.2 COC1=NC(Br)=NC=C1 NO12506 [0,2,0,0,0,0|2,0,0]=4 788 B9R1.2 COC1=NC(C)=NC=C1 NO11919 [0,2,0,0,0,0|2,0,0]=4 789 B9R1.2 COC1=NC(Cl)=NC=C1 NO21447 [0,2,0,0,0,0|2,0,0]=4 790 B9R1.2 COC1=NC(I)=NC=C1 NO11917 [0,2,0,0,0,0|2,0,0]=4 791 B9R1.2 COC1=NC=CC(Br)=C1 NO22650 [0,2,0,0,0,0|1,0,0]=3 792 B9R1.2 COC1=NC=CC(C)=C1 NO21637 [0,2,0,0,0,0|1,0,0]=3 793 B9R1.2 COC1=NC=CC(Cl)=C1 NO19313 [0,2,0,0,0,0|1,0,0]=3 794 B9R1.2 COC1=NC=CC(F)=C1 NO11908 [0,2,0,0,0,0|1,0,0]=3 795 B9R1.2 COC1=NC=CC(I)=C1 NO19594 [0,2,0,0,0,0|1,0,0]=3 796 B9R1.2 COC1=NC=CC(N)=C1 NO19525 [0,2,0,0,0,0|0,0,0]=2 797 B9R1.2 COC1=NC=CC(N)=N1 NO10114 [0,2,0,0,0,0|1,0,0]=3 798 B9R1.2 CSC1=CC(Cl)=NC=N1 NO12488 [0,2,0,0,0,0|2,0,0]=4 799 B9R1.2 CSC1=CC(N)=CC=C1 DY20570 [0,2,0,0,0,0|1,0,0]=3 800 B9R1.2 CSC1=CC(N)=NC=C1 DY657949 [0,2,0,0,0,0|1,0,0]=3 801 B9R1.2 CSC1=NC(Cl)=NC=C1 NO19934 [0,2,0,0,0,0|2,0,0]=4 802 B9R1.2 CSC1=NC=CC(=O)N1 NO22771 [0,2,0,0,0,0|2,0,0]=4 803 B9R1.2 CSC1=NC=CC(Br)=N1 DY425588 [0,2,0,0,0,0|2,0,0]=4 804 B9R1.2 CSC1=NC=CC(Cl)=C1 NO12493 [0,2,0,0,0,0|1,0,0]=3 805 B9R1.2 CSC1=NC=CC(Cl)=N1 NO18332 [0,2,0,0,0,0|2,0,0]=4 806 B9R1.2 CSC1=NC=CC(N)=N1 NO20913 [0,2,0,0,0,0|1,0,0]=3 807 B9R1.2 CSC1=NC=CC(O)=N1 NO12612 [0,2,0,0,0,0|2,0,0]=4 808 B9R1.2 ClC1=CC=CC(CBr)=C1 NO22235 [0,2,0,0,0,0|2,0,0]=4 809 B9R1.2 ClC1=NC=CC(CBr)=C1 DY657889 [0,2,0,0,0,0|1,0,0]=3 810 B9R1.2 ClCC1=CC(Br)=CC=C1 DY40579 [0,2,0,0,0,0|2,0,0]=4 811 B9R1.2 ClCc1cccc(I)c1 DY585080 [0,2,0,0,0,0|2,0,0]=4 812 B9R1.2 FC1=CC=CC(CCl)=C1 NO19068 [0,2,0,0,0,0|2,0,0]=4 813 B9R1.2 FCC1=CC(Br)=NC=C1 DY512247 [0,2,0,0,0,0|1,0,0]=3 814 B9R1.2 N#CC1=CC(=O)NC=C1 DY582177 [0,2,0,0,0,0|0,0,2]=4 815 B9R1.2 N#CC1=CC(Br)=CC=C1 NO19865 [0,2,0,0,0,0|1,0,1]=4 816 B9R1.2 N#CC1=CC(Cl)=CC=C1 NO19319 [0,2,0,0,0,0|1,0,1]=4 817 B9R1.2 N#CC1=CC(Cl)=NC=C1 NO18691 [0,2,0,0,0,0|0,0,1]=3 818 B9R1.2 N#CC1=CC(F)=CC=C1 DY20044 [0,2,0,0,0,0|1,0,1]=4 819 B9R1.2 N#CC1=CC(F)=NC=C1 NO21565 [0,2,0,0,0,0|0,0,1]=3 820 B9R1.2 N#CC1=CC(N)=CC=C1 NO13394 [0,2,0,0,0,0|1,0,0]=3 821 B9R1.2 N#CC1=CC(O)=CC=C1 NO19377 [0,2,0,0,0,0|1,0,1]=4 822 B9R1.2 N#CC1=NC(Cl)=NC=C1 NO10116 [0,2,0,0,0,0|1,0,1]=4 823 B9R1.2 N#CC1=NC=CC(Br)=C1 NO18399 [0,2,0,0,0,0|1,0,0]=3 824 B9R1.2 N#CC1=NC=CC(Cl)=C1 NO18109 [0,2,0,0,0,0|1,0,0]=3 825 B9R1.2 N#CC1=NC=CC(N)=N1 DY121176 [0,2,0,0,0,0|1,0,0]=3 826 B9R1.2 NC1=CC(C=O)=CN=C1 DY659426 [0,2,0,0,0,0|2,0,0]=4 827 B9R1.2 NC1=CC(CBr)=CN=C1 DY659222 [0,2,0,0,0,0|2,0,0]=4 828 B9R1.2 NC1=CC(CO)=NC=C1 DY33483 [0,2,0,0,0,0|0,0,0]=2 829 B9R1.2 NC1=CC(CO)=NC=N1 DY121194 [0,2,0,0,0,0|1,0,0]=3 830 B9R1.2 NC1=CC=CC(CO)=C1 NO18821 [0,2,0,0,0,0|1,0,0]=3 831 B9R1.2 NC1=CC=CC(CO)=N1 NO16612 [0,2,0,0,0,0|2,0,0]=4 832 B9R1.2 NC1=CN=CC(CO)=C1 NO22079 [0,2,0,0,0,0|2,0,0]=4 833 B9R1.2 NC1=NC=CC(C=O)=C1 NO18505 [0,2,0,0,0,0|1,0,0]=3 834 B9R1.2 NC1=NC=CC(CF)=N1 DY430731 [0,2,0,0,0,0|2,0,0]=4 835 B9R1.2 NC1=NC=CC(CO)=C1 NO17807 [0,2,0,0,0,0|1,0,0]=3 836 B9R1.2 NCC1=CC(=O)N=CN1 DY112983 [0,2,0,0,0,0|1,0,0]=3 837 B9R1.2 NCC1=CC(Br)=CC=C1 NO19652 [0,2,0,0,0,0|1,0,0]=3 838 B9R1.2 NCC1=CC(Br)=NC=C1 NO17247 [0,2,0,0,0,0|0,0,0]=2 839 B9R1.2 NCC1=CC(Cl)=CC=C1 DY33134 [0,2,0,0,0,0|1,0,0]=3 840 B9R1.2 NCC1=CC(Cl)=NC=C1 NO16037 [0,2,0,0,0,0|0,0,0]=2 841 B9R1.2 NCC1=CC(I)=CC=C1 DY584527 [0,2,0,0,0,0|1,0,0]=3 842 B9R1.2 NCC1=CC(I)=CC=C1 NO22330 [0,2,0,0,0,0|1,0,0]=3 843 B9R1.2 NCC1=CC=CC(=O)N1 DY582837 [0,2,0,0,0,0|2,0,0]=4 844 B9R1.2 NCC1=CC=CC(O)=C1 DY745447 [0,2,0,0,0,0|1,0,0]=3 845 B9R1.2 NCC1=NC(Br)=CC=C1 NO10635 [0,2,0,0,0,0|2,0,0]=4 846 B9R1.2 NCC1=NC(Cl)=CC=C1 DY527445 [0,2,0,0,0,0|2,0,0]=4 847 B9R1.2 NCC1=NC(F)=CC=C1 NO13193 [0,2,0,0,0,0|2,0,0]=4 848 B9R1.2 NCC1=NC=CC(Br)=C1 NO12824 [0,2,0,0,0,0|1,0,0]=3 849 B9R1.2 NCC1=NC=CC(Br)=C1 NO15559 [0,2,0,0,0,0|1,0,0]=3 850 B9R1.2 NNC1=CC(Br)=CC=C1 NO19465 [0,2,0,0,0,0|1,0,0]=3 851 B9R1.2 NNC1=CC(Cl)=CC=C1 NO19479 [0,2,0,0,0,0|1,0,0]=3 852 B9R1.2 NNC1=CC(Cl)=NC=N1 NO17425 [0,2,0,0,0,0|1,0,0]=3 853 B9R1.2 NNC1=CC(F)=CC=C1 NO19485 [0,2,0,0,0,0|1,0,0]=3 854 B9R1.2 NNC1=CC(O)=NC=N1 NO12366 [0,2,0,0,0,0|1,0,0]=3 855 B9R1.2 NNC1=CC=CC(Br)=N1 DY545589 [0,2,0,0,0,0|2,0,0]=4 856 B9R1.2 NNC1=CC=CC(Cl)=N1 NO21479 [0,2,0,0,0,0|2,0,0]=4 857 B9R1.2 NNC1=NC(Cl)=NC=C1 NO16010 [0,2,0,0,0,0|1,0,0]=3 858 B9R1.2 NNC1=NC(O)=NC=C1 DY461070 [0,2,0,0,0,0|1,0,0]=3 859 B9R1.2 O=C1C=CNC(CO)=C1 DY654576 [0,2,0,0,0,0|1,0,1]=4 860 B9R1.2 O=CC1=CC(Br)=CC=C1 NO18958 [0,2,0,0,0,0|2,0,0]=4 861 B9R1.2 O=CC1=CC(Br)=NC=C1 NO18783 [0,2,0,0,0,0|1,0,0]=3 862 B9R1.2 O=CC1=CC(Cl)=CC=C1 DY20579 [0,2,0,0,0,0|2,0,0]=4 863 B9R1.2 O=CC1=CC(F)=CC=C1 NO22298 [0,2,0,0,0,0|2,0,0]=4 864 B9R1.2 O=CC1=CC(I)=CC=C1 NO20132 [0,2,0,0,0,0|2,0,0]=4 865 B9R1.2 O=CC1=CC(O)=CC=C1 DY20422 [0,2,0,0,0,0|2,0,0]=4 866 B9R1.2 O=CC1=NC=CC(Br)=C1 NO12092 [0,2,0,0,0,0|1,0,0]=3 867 B9R1.2 O=CC1=NC=CC(Cl)=C1 NO22794 [0,2,0,0,0,0|1,0,0]=3 868 B9R1.2 OCC1=CC(Br)=NC=C1 NO19256 [0,2,0,0,0,0|1,0,0]=3 869 B9R1.2 OCC1=CC(F)=CC=C1 NO19069 [0,2,0,0,0,0|2,0,0]=4 870 B9R1.2 OCC1=NC(Cl)=NC=C1 DY550299 [0,2,0,0,0,0|2,0,0]=4 871 B9R1.2 OCC1=NC=CC(Br)=C1 NO18696 [0,2,0,0,0,0|1,0,0]=3 872 B9R1.2 OCC1=NC=CC(Cl)=C1 DY20517 [0,2,0,0,0,0|1,0,0]=3 873 B9R1.2 OCC1=NC=CC(O)=C1 NO17612 [0,2,0,0,0,0|1,0,0]=3 874 B9R1.6 CC(=O)C1=CC=NC=C1 NO22535 [0,2,0,0,0,0|1,0,0]=3 875 B9R1.6 CC(N)C1=CC=CC=C1 DY457042 [0,2,0,0,0,0|1,0,0]=3 876 B9R1.6 CN(C)C1=CC=NC=C1 NO13386 [0,2,0,0,0,0|0,0,0]=2 877 B9R1.6 CS(=O)C1=CC=CC=C1 DY510356 [0,2,0,0,0,0|2,0,0]=4 878 B9R1.6 C[C@@H](N)C1=CC=CN=C1 DY553203 [0,2,0,0,0,0|2,0,0]=4 879 B9R1.6 C[C@@H](N)C1=CC=CN=C1 DY621669 [0,2,0,0,0,0|2,0,0]=4 880 B9R1.6 C[C@H](N)C1=CC=CN=C1 DY546027 [0,2,0,0,0,0|2,0,0]=4 881 B9R1.6 C[C@H](N)C1=NC=CC=C1 NO15370 [0,2,0,0,0,0|2,0,0]=4 882 B9R1.6 C[PH](=O)C1=CC=CC=C1 NO16386 [0,2,0,0,0,0|1,1,0]=4 883 B9R1.6 C[S@@](=O)C1=CC=CC=C1 DY621380 [0,2,0,0,0,0|2,0,0]=4 884 B9R1.6 ClP(Cl)C1=CC=CC=C1 DY822051 [0,2,0,0,0,0|1,1,0]=4 885 B9R1.6 N=C(N)C1=CC=CC=C1 NO14830 [0,2,0,0,0,0|1,0,0]=3 886 B9R1.6 N=C(N)C1=CN=CC=C1 NO19487 [0,2,0,0,0,0|2,0,0]=4 887 B9R1.6 N=C(N)C1=NC=CC=C1 NO19100 [0,2,0,0,0,0|2,0,0]=4 888 B9R1.6 NC(=O)C1=CC=NC=C1 NO13721 [0,2,0,0,0,0|0,0,0]=2 889 B9R1.6 NC(=O)C1=CN=CC=C1 DY583359 [0,2,0,0,0,0|2,0,0]=4 890 B9R1.6 NC(=O)C1=NC=CC=C1 NO11910 [0,2,0,0,0,0|2,0,0]=4 891 B9R1.6 NC(=S)C1=CC=NC=C1 DY541407 [0,2,0,0,0,0|0,0,0]=2 892 B9R1.6 O=C(Br)C1=CC=CC=C1 DY585100 [0,2,0,0,0,0|2,0,0]=4 893 B9R1.6 O=C(Cl)C1=CC=CC=C1 DY40435 [0,2,0,0,0,0|2,0,0]=4 894 B9R1.6 O=C([O-])C1=CC=CC=C1 DY558819 [0,2,0,0,0,0|2,0,0]=4 895 B9R1.6 O=[N+]([O-])C1=CC=NC=C1 DY715232 [0,2,0,0,0,0|0,0,1]=3 896 B9R1.6 O=[PH](O)C1=CC=CC=C1 DY532299 [0,2,0,0,0,0|1,1,0]=4 897 B9R1.6 OB(O)C1=CC=CC=C1 NO19450 [0,2,0,0,0,0|2,0,0]=4 898 B9R1.6 OB(O)C1=CC=NC=C1 NO22018 [0,2,0,0,0,0|1,0,0]=3 899 B9R1.6 OB(O)C1=NC=NC=C1 DY20899 [0,2,0,0,0,0|2,0,0]=4 900 B9R1.8 C#CCC1=CC=CC=C1 DY501873 [0,2,0,0,0,0|2,0,0]=4 901 B9R1.8 CNCC1=CC=CC=C1 DY10559 [0,2,0,0,0,0|1,0,0]=3 902 B9R1.8 CNCC1=CC=CC=C1 DY20323 [0,2,0,0,0,0|1,0,0]=3 903 B9R1.8 CNCC1=CC=CC=C1 DY21006 [0,2,0,0,0,0|1,0,0]=3 904 B9R1.8 CNCC1=CC=CN=C1 NO18846 [0,2,0,0,0,0|2,0,0]=4 905 B9R1.8 CNCC1=CC=NC=C1 DY712153 [0,2,0,0,0,0|0,0,0]=2 906 B9R1.8 CNCC1=NC=CC=C1 DY501242 [0,2,0,0,0,0|2,0,0]=4 907 B9R1.8 CNCC1=NC=CC=C1 DY663671 [0,2,0,0,0,0|2,0,0]=4 908 B9R1.8 ClCCC1=CC=NC=C1 NO17913 [0,2,0,0,0,0|1,0,0]=3 909 B9R1.8 ClCSC1=CC=CC=C1 DY797799 [0,2,0,0,0,0|2,0,0]=4 910 B9R1.8 N#CCC1=CC=NC=C1 NO20239 [0,2,0,0,0,0|0,0,1]=3 911 B9R1.8 N#C[Se]C1=CC=CC=C1 DY822031 [0,2,0,0,0,0|1,0,1]=4 912 B9R1.8 NCCC1=CC=CN=C1 NO21892 [0,2,0,0,0,0|2,0,0]=4 913 B9R1.8 NCCC1=NC=CC=C1 NO14064 [0,2,0,0,0,0|2,0,0]=4 914 B9R1.8 NNCC1=CC=CC=C1 NO11006 [0,2,0,0,0,0|1,0,0]=3 915 B9R1.8 NNCC1=CC=CC=C1 NO12127 [0,2,0,0,0,0|1,0,0]=3 916 B9R1.8 NNCC1=CC=NC=C1 DY518961 [0,2,0,0,0,0|0,0,0]=2 917 B9R1.8 NNCC1=NC=CC=C1 DY578445 [0,2,0,0,0,0|2,0,0]=4 918 B9R1.8 NOCC1=CC=CC=C1 NO14063 [0,2,0,0,0,0|1,0,0]=3 919 B9R1.8 ONCC1=CC=CC=C1 DY563853 [0,2,0,0,0,0|1,0,0]=3 920 B9R1.8 ONCC1=CC=CC=C1 NO11753 [0,2,0,0,0,0|1,0,0]=3 921 B9R1.15 BrCC1=C(Br)C=CC=C1 DY20808 [0,2,0,0,0,0|2,0,0]=4 922 B9R1.15 BrCC1=C(Br)C=NC=C1 DY656944 [0,2,0,0,0,0|1,0,0]=3 923 B9R1.15 BrCC1=C(I)C=CC=C1 DY40561 [0,2,0,0,0,0|2,0,0]=4 924 B9R1.15 C#CC1=C(Cl)C=CC=C1 NO20629 [0,2,0,0,0,0|2,0,0]=4 925 B9R1.15 C#CC1=C(N)C=CC=C1 NO21537 [0,2,0,0,0,0|1,0,0]=3 926 B9R1.15 C#CC1=C(O)C=CC=C1 NO21538 [0,2,0,0,0,0|2,0,0]=4 927 B9R1.15 C=CC1=C(Br)C=CC=C1 NO18853 [0,2,0,0,0,0|2,0,0]=4 928 B9R1.15 C=CC1=C(Cl)C=CC=C1 NO19873 [0,2,0,0,0,0|2,0,0]=4 929 B9R1.15 CC1=C(CBr)C=CC=C1 NO14791 [0,2,0,0,0,0|2,0,0]=4 930 B9R1.15 CC1=C(CBr)C=NC=C1 DY656650 [0,2,0,0,0,0|1,0,0]=3 931 B9R1.15 CC1=C(CBr)C=NC=C1 NO17496 [0,2,0,0,0,0|1,0,0]=3 932 B9R1.15 CC1=C(CN)C=NC=C1 NO20204 [0,2,0,0,0,0|1,0,0]=3 933 B9R1.15 CC1=C(NN)C=CC=C1 DY788973 [0,2,0,0,0,0|1,0,0]=3 934 B9R1.15 CC1=C(NN)C=CC=C1 NO19575 [0,2,0,0,0,0|1,0,0]=3 935 B9R1.15 CC1=CC=CC=C1C=O NO19114 [0,2,0,0,0,0|2,0,0]=4 936 B9R1.15 CC1=CC=NC=C1C#N NO22253 [0,2,0,0,0,0|1,0,0]=3 937 B9R1.15 CCC1=C(Br)C=CC=C1 NO20980 [0,2,0,0,0,0|2,0,0]=4 938 B9R1.15 CCC1=C(C)C=CC=C1 NO21536 [0,2,0,0,0,0|2,0,0]=4 939 B9R1.15 CCC1=C(I)C=CC=C1 DY534201 [0,2,0,0,0,0|2,0,0]=4 940 B9R1.15 CCC1=C(N)C=NC=C1 DY658535 [0,2,0,0,0,0|1,0,0]=3 941 B9R1.15 CCC1=CN=CN=C1Cl DY559413 [0,2,0,0,0,0|2,0,0]=4 942 B9R1.15 CCC1=NC=NC=C1F NO19573 [0,2,0,0,0,0|2,0,0]=4 943 B9R1.15 CN1C=CC=C\C1=N\N DY586632 [0,2,0,0,0,0|2,0,0]=4 944 B9R1.15 CNC1=C(Br)C=CC=C1 DY584260 [0,2,0,0,0,0|1,0,0]=3 945 B9R1.15 CNC1=C(F)C=CC=C1 NO13895 [0,2,0,0,0,0|1,0,0]=3 946 B9R1.15 CNC1=C(N)C=NC=C1 DY10330 [0,2,0,0,0,0|0,0,0]=2 947 B9R1.15 CNC1=CC=CC=C1N NO22302 [0,2,0,0,0,0|1,0,0]=3 948 B9R1.15 CNC1=NC=CC=C1Br NO17281 [0,2,0,0,0,0|2,0,0]=4 949 B9R1.15 COC1=C(Br)C=CC=C1 NO19150 [0,2,0,0,0,0|2,0,0]=4 950 B9R1.15 COC1=C(Br)C=CN=C1 NO14715 [0,2,0,0,0,0|1,0,0]=3 951 B9R1.15 COC1=C(Br)C=NC=C1 NO18491 [0,2,0,0,0,0|1,0,0]=3 952 B9R1.15 COC1=C(C)C=CC=C1 DY561483 [0,2,0,0,0,0|2,0,0]=4 953 B9R1.15 COC1=C(Cl)C=CN=C1 DY442708 [0,2,0,0,0,0|1,0,0]=3 954 B9R1.15 COC1=C(F)C=CC=C1 NO19904 [0,2,0,0,0,0|2,0,0]=4 955 B9R1.15 COC1=C(F)C=NC=C1 NO16194 [0,2,0,0,0,0|1,0,0]=3 956 B9R1.15 COC1=C(I)C=NC=C1 NO18542 [0,2,0,0,0,0|1,0,0]=3 957 B9R1.15 COC1=C(N)C=CC=C1 NO11812 [0,2,0,0,0,0|1,0,0]=3 958 B9R1.15 COC1=C(N)C=CN=C1 NO22564 [0,2,0,0,0,0|0,0,0]=2 959 B9R1.15 COC1=C(N)C=NC=C1 NO18248 [0,2,0,0,0,0|1,0,0]=3 960 B9R1.15 COC1=C(O)C=NC=C1 DY586059 [0,2,0,0,0,0|1,0,0]=3 961 B9R1.15 COC1=CC=CN=C1N NO17216 [0,2,0,0,0,0|2,0,0]=4 962 B9R1.15 COC1=CN=CN=C1Br NO17880 [0,2,0,0,0,0|2,0,0]=4 963 B9R1.15 COC1=CN=CN=C1N NO13116 [0,2,0,0,0,0|1,0,0]=3 964 B9R1.15 COC1=NC=CC=C1N NO19526 [0,2,0,0,0,0|2,0,0]=4 965 B9R1.15 ClC1=C(CBr)C=CC=C1 NO19190 [0,2,0,0,0,0|2,0,0]=4 966 B9R1.15 ClCC1=C(Br)C=CC=C1 DY584533 [0,2,0,0,0,0|2,0,0]=4 967 B9R1.15 ClCC1=C(Cl)C=CC=C1 NO19964 [0,2,0,0,0,0|2,0,0]=4 968 B9R1.15 FC1=C(CBr)C=CC=C1 NO21562 [0,2,0,0,0,0|2,0,0]=4 969 B9R1.15 N#CC1=C(Br)C=CC=C1 DY20182 [0,2,0,0,0,0|1,0,1]=4 970 B9R1.15 N#CC1=C(Br)C=NC=C1 NO13671 [0,2,0,0,0,0|0,0,1]=3 971 B9R1.15 N#CC1=C(Cl)C=NC=C1 NO15593 [0,2,0,0,0,0|0,0,1]=3 972 B9R1.15 N#CC1=C(F)C=CC=C1 NO18285 [0,2,0,0,0,0|1,0,1]=4 973 B9R1.15 N#CC1=C(I)C=CC=C1 NO21883 [0,2,0,0,0,0|1,0,1]=4 974 B9R1.15 N#CC1=C(N)C=CC=C1 NO13393 [0,2,0,0,0,0|1,0,0]=3 975 B9R1.15 N#CC1=C(N)C=NC=C1 NO15948 [0,2,0,0,0,0|0,0,1]=3 976 B9R1.15 N#CC1=C(N)N=NC=C1 DY736460 [0,2,0,0,0,0|1,0,1]=4 977 B9R1.15 N#CC1=C(O)C=CC=C1 NO19191 [0,2,0,0,0,0|1,0,1]=4 978 B9R1.15 N#CC1=CC=CN=C1N NO22990 [0,2,0,0,0,0|2,0,0]=4 979 B9R1.15 N#CC1=CN=CC=C1Br NO13752 [0,2,0,0,0,0|1,0,0]=3 980 B9R1.15 N#CC1=CN=CC=C1Cl NO16226 [0,2,0,0,0,0|1,0,0]=3 981 B9R1.15 N#CC1=CN=CN=C1Cl NO14002 [0,2,0,0,0,0|2,0,0]=4 982 B9R1.15 N#CC1=CN=CN=C1O NO17392 [0,2,0,0,0,0|2,0,0]=4 983 B9R1.15 NC1=C(C=O)C=CC=C1 DY20756 [0,2,0,0,0,0|1,0,0]=3 984 B9R1.15 NC1=C(C=O)C=CC=N1 NO19340 [0,2,0,0,0,0|2,0,0]=4 985 B9R1.15 NC1=C(C=O)C=CN=C1 NO14976 [0,2,0,0,0,0|1,0,0]=3 986 B9R1.15 NC1=C(CO)C=CC=C1 NO19122 [0,2,0,0,0,0|1,0,0]=3 987 B9R1.15 NC1=CC=NC=C1C=O DY509936 [0,2,0,0,0,0|0,0,0]=2 988 B9R1.15 NC1=CC=NC=C1C=O NO19349 [0,2,0,0,0,0|0,0,0]=2 989 B9R1.15 NC1=NC=CC=C1CO NO13983 [0,2,0,0,0,0|2,0,0]=4 990 B9R1.15 NCC1=C(Br)C=CC=C1 NO19534 [0,2,0,0,0,0|1,0,0]=3 991 B9R1.15 NCC1=C(Br)C=CN=C1 DY651253 [0,2,0,0,0,0|1,0,0]=3 992 B9R1.15 NCC1=C(Br)C=NC=C1 NO17629 [0,2,0,0,0,0|0,0,0]=2 993 B9R1.15 NCC1=C(F)C=CC=C1 DY40826 [0,2,0,0,0,0|1,0,0]=3 994 B9R1.15 NCC1=C(N)C=CC=C1 DY40796 [0,2,0,0,0,0|1,0,0]=3 995 B9R1.15 NCC1=C(N)C=NC=C1 DY574167 [0,2,0,0,0,0|0,0,0]=2 996 B9R1.15 NCC1=C(O)C=CC=C1 NO20889 [0,2,0,0,0,0|1,0,0]=3 997 B9R1.15 NCC1=C(O)C=CN=C1 DY656620 [0,2,0,0,0,0|1,0,0]=3 998 B9R1.15 NCC1=CC=CN=C1F DY538641 [0,2,0,0,0,0|2,0,0]=4 999 B9R1.15 NCC1=NC=CC=C1Br DY713191 [0,2,0,0,0,0|2,0,0]=4 1000 B9R1.15 NCC1=NC=CC=C1N DY654384 [0,2,0,0,0,0|2,0,0]=4 1001 B9R1.15 NNC1=C(Br)C=CC=C1 NO19466 [0,2,0,0,0,0|1,0,0]=3 1002 B9R1.15 NNC1=C(Cl)C=CC=C1 NO19478 [0,2,0,0,0,0|1,0,0]=3 1003 B9R1.15 NNC1=C(F)C=CC=C1 NO23033 [0,2,0,0,0,0|1,0,0]=3 1004 B9R1.15 NNC1=CC=CN=C1Br DY715022 [0,2,0,0,0,0|2,0,0]=4 1005 B9R1.15 NNC1=NC=CC=C1Cl NO20171 [0,2,0,0,0,0|2,0,0]=4 1006 B9R1.15 N\N=C1/NC=NC=C1Br DY737672 [0,2,0,0,0,0|1,0,0]=3 1007 B9R1.15 O=CC1=C(Cl)C=NC=C1 DY657198 [0,2,0,0,0,0|1,0,0]=3 1008 B9R1.15 O=CC1=C(Cl)C=NC=C1 NO15780 [0,2,0,0,0,0|1,0,0]=3 1009 B9R1.15 O=CC1=C(F)C=CC=C1 DY794301 [0,2,0,0,0,0|2,0,0]=4 1010 B9R1.15 O=CC1=C(F)C=CC=C1 NO21560 [0,2,0,0,0,0|2,0,0]=4 1011 B9R1.15 O=CC1=C(F)C=CN=C1 DY577299 [0,2,0,0,0,0|1,0,0]=3 1012 B9R1.15 O=CC1=C(I)C=CC=C1 NO20131 [0,2,0,0,0,0|2,0,0]=4 1013 B9R1.15 O=CC1=C(O)C=CC=C1 DY41121 [0,2,0,0,0,0|2,0,0]=4 1014 B9R1.15 O=CC1=C(O)C=NC=C1 NO13859 [0,2,0,0,0,0|1,0,0]=3 1015 B9R1.15 O=CC1=CNC=CC1=O NO17898 [0,2,0,0,0,0|1,0,1]=4 1016 B9R1.15 OCC1=C(Br)C=CC=C1 NO18828 [0,2,0,0,0,0|2,0,0]=4 1017 B9R1.15 OCC1=C(Br)C=NC=C1 NO12881 [0,2,0,0,0,0|1,0,0]=3 1018 B9R1.15 OCC1=C(Cl)C=CC=C1 NO21494 [0,2,0,0,0,0|2,0,0]=4 1019 B9R1.15 OCC1=C(Cl)C=CN=C1 NO17105 [0,2,0,0,0,0|1,0,0]=3 1020 B9R1.15 OCC1=C(F)C=NC=C1 DY452008 [0,2,0,0,0,0|1,0,0]=3 1021 B9R1.15 OCC1=C(I)C=CC=C1 NO19102 [0,2,0,0,0,0|2,0,0]=4 1022 B9R1.15 OCC1=C(O)C=CC=C1 NO16243 [0,2,0,0,0,0|2,0,0]=4 1023 B9R1.69 BrC1=C(I)C=C(I)C=C1 DY584301 [0,2,0,0,0,0|2,0,0]=4 1024 B9R1.69 BrC1=CC(Br)=C(Br)N=N1 NO15864 [0,2,0,0,0,0|2,0,0]=4 1025 B9R1.69 CC1=C(Br)C=C(Br)C=C1 DY33103 [0,2,0,0,0,0|2,0,0]=4 1026 B9R1.69 CC1=C(Br)C=C(F)C=C1 DY20047 [0,2,0,0,0,0|2,0,0]=4 1027 B9R1.69 CC1=C(Br)C=C(I)C=C1 NO21358 [0,2,0,0,0,0|2,0,0]=4 1028 B9R1.69 CC1=C(Br)C=C(N)C=C1 NO10506 [0,2,0,0,0,0|1,0,0]=3 1029 B9R1.69 CC1=C(Br)C=C(N)C=N1 NO18819 [0,2,0,0,0,0|2,0,0]=4 1030 B9R1.69 CC1=C(Br)C=C(O)C=C1 NO12184 [0,2,0,0,0,0|2,0,0]=4 1031 B9R1.69 CC1=C(Br)C=CC(Br)=C1 NO21137 [0,2,0,0,0,0|2,0,0]=4 1032 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 NO20166 [0,2,0,0,0,0|2,0,0]=4 1033 B9R1.69 CC1=C(Br)C=CC(F)=C1 NO10390 [0,2,0,0,0,0|2,0,0]=4 1034 B9R1.69 CC1=C(Br)C=CC(N)=C1 NO15448 [0,2,0,0,0,0|1,0,0]=3 1035 B9R1.69 CC1=C(Br)C=CC(N)=N1 NO23028 [0,2,0,0,0,0|2,0,0]=4 1036 B9R1.69 CC1=C(Br)C=CC(O)=C1 NO20279 [0,2,0,0,0,0|2,0,0]=4 1037 B9R1.69 CC1=C(Br)C=NC(=O)N1 NO15560 [0,2,0,0,0,0|2,0,0]=4 1038 B9R1.69 CC1=C(Br)N=CC(N)=C1 NO19464 [0,2,0,0,0,0|2,0,0]=4 1039 B9R1.69 CC1=C(Br)N=NC(Cl)=C1 DY737042 [0,2,0,0,0,0|2,0,0]=4 1040 B9R1.69 CC1=C(C)C=C(S)C=C1 DY535125 [0,2,0,0,0,0|2,0,0]=4 1041 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 NO22639 [0,2,0,0,0,0|2,0,0]=4 1042 B9R1.69 CC1=C(Cl)C=C(Cl)C=C1 NO21102 [0,2,0,0,0,0|2,0,0]=4 1043 B9R1.69 CC1=C(Cl)C=C(F)C=C1 NO10409 [0,2,0,0,0,0|2,0,0]=4 1044 B9R1.69 CC1=C(Cl)C=C(I)C=C1 DY451264 [0,2,0,0,0,0|2,0,0]=4 1045 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 NO19135 [0,2,0,0,0,0|2,0,0]=4 1046 B9R1.69 CC1=C(Cl)C=CC(I)=C1 NO20194 [0,2,0,0,0,0|2,0,0]=4 1047 B9R1.69 CC1=C(Cl)N=C(N)C=C1 NO21753 [0,2,0,0,0,0|2,0,0]=4 1048 B9R1.69 CC1=C(Cl)N=CC(N)=C1 NO14239 [0,2,0,0,0,0|2,0,0]=4 1049 B9R1.69 CC1=C(Cl)N=NC(Cl)=C1 NO18830 [0,2,0,0,0,0|2,0,0]=4 1050 B9R1.69 CC1=C(F)C=C(Br)C=C1 NO14669 [0,2,0,0,0,0|2,0,0]=4 1051 B9R1.69 CC1=C(F)C=C(Cl)C=C1 DY41507 [0,2,0,0,0,0|2,0,0]=4 1052 B9R1.69 CC1=C(F)C=C(F)C=C1 NO19066 [0,2,0,0,0,0|2,0,0]=4 1053 B9R1.69 CC1=C(F)C=C(N)C=C1 DY20039 [0,2,0,0,0,0|1,0,0]=3 1054 B9R1.69 CC1=C(F)C=C(O)C=C1 NO10481 [0,2,0,0,0,0|2,0,0]=4 1055 B9R1.69 CC1=C(F)C=CC(Cl)=C1 NO14434 [0,2,0,0,0,0|2,0,0]=4 1056 B9R1.69 CC1=C(F)C=CC(F)=C1 NO19928 [0,2,0,0,0,0|2,0,0]=4 1057 B9R1.69 CC1=C(F)C=CC(I)=C1 NO10424 [0,2,0,0,0,0|2,0,0]=4 1058 B9R1.69 CC1=C(F)C=CC(N)=C1 NO10514 [0,2,0,0,0,0|1,0,0]=3 1059 B9R1.69 CC1=C(F)C=CC(O)=C1 NO10483 [0,2,0,0,0,0|2,0,0]=4 1060 B9R1.69 CC1=C(I)C=C(Br)C=C1 DY41501 [0,2,0,0,0,0|2,0,0]=4 1061 B9R1.69 CC1=C(I)C=CC(Br)=C1 NO10398 [0,2,0,0,0,0|2,0,0]=4 1062 B9R1.69 CC1=C(I)C=CC(O)=C1 NO22901 [0,2,0,0,0,0|2,0,0]=4 1063 B9R1.69 CC1=C(I)N=CC(N)=C1 DY661206 [0,2,0,0,0,0|2,0,0]=4 1064 B9R1.69 CC1=C(N)C=C(Br)C=C1 NO14257 [0,2,0,0,0,0|1,0,0]=3 1065 B9R1.69 CC1=C(N)C=C(I)C=C1 NO20374 [0,2,0,0,0,0|1,0,0]=3 1066 B9R1.69 CC1=C(N)C=CC(=O)N1 DY425072 [0,2,0,0,0,0|2,0,0]=4 1067 B9R1.69 CC1=C(N)C=CC(Br)=C1 NO15106 [0,2,0,0,0,0|1,0,0]=3 1068 B9R1.69 CC1=C(N)C=CC(Cl)=C1 NO16371 [0,2,0,0,0,0|1,0,0]=3 1069 B9R1.69 CC1=C(N)C=CC(F)=C1 NO10513 [0,2,0,0,0,0|1,0,0]=3 1070 B9R1.69 CC1=C(N)C=CC(I)=C1 NO20371 [0,2,0,0,0,0|1,0,0]=3 1071 B9R1.69 CC1=C(N)C=CC(N)=C1 NO18566 [0,2,0,0,0,0|1,0,0]=3 1072 B9R1.69 CC1=C(N)C=CC(O)=C1 NO14087 [0,2,0,0,0,0|1,0,0]=3 1073 B9R1.69 CC1=C(N)C=NC(Br)=C1 NO19458 [0,2,0,0,0,0|1,0,0]=3 1074 B9R1.69 CC1=C(N)C=NC(Cl)=C1 NO19473 [0,2,0,0,0,0|1,0,0]=3 1075 B9R1.69 CC1=C(N)C=NC(F)=C1 DY20830 [0,2,0,0,0,0|1,0,0]=3 1076 B9R1.69 CC1=C(N)N=NC(Cl)=C1 NO17524 [0,2,0,0,0,0|2,0,0]=4 1077 B9R1.69 CC1=C(O)C=C(Br)C=C1 NO10275 [0,2,0,0,0,0|2,0,0]=4 1078 B9R1.69 CC1=C(O)C=C(F)C=C1 NO10484 [0,2,0,0,0,0|2,0,0]=4 1079 B9R1.69 CC1=C(O)C=C(I)C=C1 DY451996 [0,2,0,0,0,0|2,0,0]=4 1080 B9R1.69 CC1=C(O)C=C(O)C=C1 NO20391 [0,2,0,0,0,0|2,0,0]=4 1081 B9R1.69 CC1=C(O)C=CC(Br)=C1 DY20395 [0,2,0,0,0,0|2,0,0]=4 1082 B9R1.69 CC1=C(O)C=CC(Cl)=C1 NO20290 [0,2,0,0,0,0|2,0,0]=4 1083 B9R1.69 CC1=C(O)C=CC(F)=C1 NO10482 [0,2,0,0,0,0|2,0,0]=4 1084 B9R1.69 CC1=C(S)C=CC(F)=C1 DY584410 [0,2,0,0,0,0|2,0,0]=4 1085 B9R1.69 CC1=CC(Br)=C(Br)C=C1 DY41513 [0,2,0,0,0,0|2,0,0]=4 1086 B9R1.69 CC1=CC(Br)=C(C)C=C1 NO21410 [0,2,0,0,0,0|2,0,0]=4 1087 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 NO20167 [0,2,0,0,0,0|2,0,0]=4 1088 B9R1.69 CC1=CC(Br)=C(F)C=C1 DY20046 [0,2,0,0,0,0|2,0,0]=4 1089 B9R1.69 CC1=CC(Br)=C(N)C=C1 NO19777 [0,2,0,0,0,0|1,0,0]=3 1090 B9R1.69 CC1=CC(Br)=CN=C1N DY20013 [0,2,0,0,0,0|2,0,0]=4 1091 B9R1.69 CC1=CC(Br)=NC=C1Br NO14171 [0,2,0,0,0,0|1,0,0]=3 1092 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 NO19979 [0,2,0,0,0,0|2,0,0]=4 1093 B9R1.69 CC1=CC(Cl)=C(Cl)C=C1 NO21935 [0,2,0,0,0,0|2,0,0]=4 1094 B9R1.69 CC1=CC(Cl)=C(O)C=C1 NO20292 [0,2,0,0,0,0|2,0,0]=4 1095 B9R1.69 CC1=CC(Cl)=CN=C1N NO13921 [0,2,0,0,0,0|2,0,0]=4 1096 B9R1.69 CC1=CC(Cl)=NC=C1Cl DY20731 [0,2,0,0,0,0|1,0,0]=3 1097 B9R1.69 CC1=CC(Cl)=NC=C1F NO19390 [0,2,0,0,0,0|1,0,0]=3 1098 B9R1.69 CC1=CC(Cl)=[N+]([O-])C=C1 DY655422 [0,2,0,0,0,0|1,0,1]=4 1099 B9R1.69 CC1=CC(F)=C(Br)C=C1 NO10392 [0,2,0,0,0,0|2,0,0]=4 1100 B9R1.69 CC1=CC(F)=C(C)C=C1 DY433527 [0,2,0,0,0,0|2,0,0]=4 1101 B9R1.69 CC1=CC(F)=C(C)C=C1 NO13237 [0,2,0,0,0,0|2,0,0]=4 1102 B9R1.69 CC1=CC(F)=C(Cl)C=C1 NO22757 [0,2,0,0,0,0|2,0,0]=4 1103 B9R1.69 CC1=CC(F)=C(F)C=C1 NO19897 [0,2,0,0,0,0|2,0,0]=4 1104 B9R1.69 CC1=CC(F)=CN=C1N NO17590 [0,2,0,0,0,0|2,0,0]=4 1105 B9R1.69 CC1=CC(F)=NC=C1Br NO10262 [0,2,0,0,0,0|1,0,0]=3 1106 B9R1.69 CC1=CC(I)=C(F)C=C1 DY555255 [0,2,0,0,0,0|2,0,0]=4 1107 B9R1.69 CC1=CC(I)=C(N)C=C1 NO10517 [0,2,0,0,0,0|1,0,0]=3 1108 B9R1.69 CC1=CC(I)=CN=C1N NO13801 [0,2,0,0,0,0|2,0,0]=4 1109 B9R1.69 CC1=CC(N)=C(Br)C=C1 NO18349 [0,2,0,0,0,0|1,0,0]=3 1110 B9R1.69 CC1=CC(N)=C(Cl)C=C1 NO20365 [0,2,0,0,0,0|1,0,0]=3 1111 B9R1.69 CC1=CC(N)=C(F)C=C1 NO10510 [0,2,0,0,0,0|1,0,0]=3 1112 B9R1.69 CC1=CC(N)=C(I)C=C1 NO20372 [0,2,0,0,0,0|1,0,0]=3 1113 B9R1.69 CC1=CC(N)=NC=C1Br NO19457 [0,2,0,0,0,0|1,0,0]=3 1114 B9R1.69 CC1=CC(N)=NC=C1Cl NO19468 [0,2,0,0,0,0|1,0,0]=3 1115 B9R1.69 CC1=CC(O)=C(Br)C=C1 NO16357 [0,2,0,0,0,0|2,0,0]=4 1116 B9R1.69 CC1=CC(O)=C(C)C=C1 NO19431 [0,2,0,0,0,0|2,0,0]=4 1117 B9R1.69 CC1=CC(O)=C(N)C=C1 NO14086 [0,2,0,0,0,0|1,0,0]=3 1118 B9R1.69 CC1=CC(O)=NC=C1Br NO13793 [0,2,0,0,0,0|1,0,0]=3 1119 B9R1.69 CC1=CC(S)=C(N)C=C1 DY793311 [0,2,0,0,0,0|1,0,0]=3 1120 B9R1.69 CC1=CC=C(Br)C(N)=N1 NO19460 [0,2,0,0,0,0|2,0,0]=4 1121 B9R1.69 CC1=CC=C(Br)N=C1N DY443537 [0,2,0,0,0,0|2,0,0]=4 1122 B9R1.69 CC1=CC=C(C)C(N)=N1 NO16045 [0,2,0,0,0,0|2,0,0]=4 1123 B9R1.69 CC1=CC=C(F)C=C1N NO20370 [0,2,0,0,0,0|1,0,0]=3 1124 B9R1.69 CC1=CC=C(I)C(N)=N1 NO13037 [0,2,0,0,0,0|2,0,0]=4 1125 B9R1.69 CC1=CC=C(N)C(Br)=N1 NO19459 [0,2,0,0,0,0|2,0,0]=4 1126 B9R1.69 CC1=CC=C(N)C(C)=N1 NO19572 [0,2,0,0,0,0|2,0,0]=4 1127 B9R1.69 CC1=CC=C(N)C(Cl)=N1 NO19471 [0,2,0,0,0,0|2,0,0]=4 1128 B9R1.69 CC1=CC=C(N)C(F)=N1 DY551829 [0,2,0,0,0,0|2,0,0]=4 1129 B9R1.69 CC1=CC=C(N)C(N)=C1 NO21925 [0,2,0,0,0,0|1,0,0]=3 1130 B9R1.69 CC1=CC=C(O)C(N)=N1 DY431086 [0,2,0,0,0,0|2,0,0]=4 1131 B9R1.69 CC1=CC=C(O)C(O)=C1 NO14435 [0,2,0,0,0,0|2,0,0]=4 1132 B9R1.69 CC1=CN=C(Br)C(N)=C1 DY20317 [0,2,0,0,0,0|2,0,0]=4 1133 B9R1.69 CC1=CN=C(Br)C=C1N NO16645 [0,2,0,0,0,0|0,0,0]=2 1134 B9R1.69 CC1=CN=C(C)C(N)=C1 DY578583 [0,2,0,0,0,0|2,0,0]=4 1135 B9R1.69 CC1=CN=C(C)C=C1Cl NO15163 [0,2,0,0,0,0|1,0,0]=3 1136 B9R1.69 CC1=CN=C(C)N=C1N NO17171 [0,2,0,0,0,0|1,0,0]=3 1137 B9R1.69 CC1=CN=C(Cl)C(N)=C1 NO19472 [0,2,0,0,0,0|2,0,0]=4 1138 B9R1.69 CC1=CN=C(Cl)C=C1Cl DY20301 [0,2,0,0,0,0|1,0,0]=3 1139 B9R1.69 CC1=CN=C(Cl)C=C1N NO14350 [0,2,0,0,0,0|0,0,0]=2 1140 B9R1.69 CC1=CN=C(Cl)N=C1Cl NO17479 [0,2,0,0,0,0|2,0,0]=4 1141 B9R1.69 CC1=CN=C(Cl)N=C1N NO22545 [0,2,0,0,0,0|1,0,0]=3 1142 B9R1.69 CC1=CN=C(F)C=C1I NO18758 [0,2,0,0,0,0|1,0,0]=3 1143 B9R1.69 CC1=CN=C(N)C(Br)=C1 NO19456 [0,2,0,0,0,0|2,0,0]=4 1144 B9R1.69 CC1=CN=C(N)C(C)=C1 DY427372 [0,2,0,0,0,0|2,0,0]=4 1145 B9R1.69 CC1=CN=C(N)C(I)=C1 DY715448 [0,2,0,0,0,0|2,0,0]=4 1146 B9R1.69 CC1=CN=C(N)C(N)=C1 NO12089 [0,2,0,0,0,0|2,0,0]=4 1147 B9R1.69 CC1=CN=C(N)C=C1Br DY712393 [0,2,0,0,0,0|1,0,0]=3 1148 B9R1.69 CC1=CN=C(N)N=C1Br DY585670 [0,2,0,0,0,0|2,0,0]=4 1149 B9R1.69 CC1=CN=C(N)N=C1Cl NO13071 [0,2,0,0,0,0|2,0,0]=4 1150 B9R1.69 CC1=CN=C(O)C=C1N DY582459 [0,2,0,0,0,0|0,0,0]=2 1151 B9R1.69 CC1=CNC(=O)C(N)=C1 NO21574 [0,2,0,0,0,0|2,0,0]=4 1152 B9R1.69 CC1=CNC(=O)C=C1Br DY658226 [0,2,0,0,0,0|1,0,1]=4 1153 B9R1.69 CC1=CNC(=O)N=C1N NO18115 [0,2,0,0,0,0|1,0,1]=4 1154 B9R1.69 CC1=NC(Br)=CC=C1N NO13574 [0,2,0,0,0,0|2,0,0]=4 1155 B9R1.69 CC1=NC(Cl)=CC=C1N NO13794 [0,2,0,0,0,0|2,0,0]=4 1156 B9R1.69 CC1=NC(Cl)=NC=C1Br NO12644 [0,2,0,0,0,0|2,0,0]=4 1157 B9R1.69 CC1=NC(Cl)=NC=C1F NO14202 [0,2,0,0,0,0|2,0,0]=4 1158 B9R1.69 CC1=NC(Cl)=NC=C1N DY537747 [0,2,0,0,0,0|2,0,0]=4 1159 B9R1.69 CC1=NC(N)=NC=C1Br NO19861 [0,2,0,0,0,0|2,0,0]=4 1160 B9R1.69 CC1=NC=C(Br)C(=O)N1 NO17891 [0,2,0,0,0,0|2,0,0]=4 1161 B9R1.69 CC1=NC=C(Br)C(Cl)=N1 NO14459 [0,2,0,0,0,0|2,0,0]=4 1162 B9R1.69 CC1=NC=C(Br)C(N)=N1 DY694715 [0,2,0,0,0,0|1,0,0]=3 1163 B9R1.69 CC1=NC=C(Br)C(O)=N1 NO10273 [0,2,0,0,0,0|2,0,0]=4 1164 B9R1.69 CC1=NC=C(Br)C=C1N NO10276 [0,2,0,0,0,0|2,0,0]=4 1165 B9R1.69 CC1=NC=C(Cl)C(Cl)=C1 DY711085 [0,2,0,0,0,0|1,0,0]=3 1166 B9R1.69 CC1=NC=C(F)C(=O)N1 NO14592 [0,2,0,0,0,0|2,0,0]=4 1167 B9R1.69 CC1=NC=C(F)C(Br)=C1 NO16271 [0,2,0,0,0,0|1,0,0]=3 1168 B9R1.69 CC1=NC=C(F)C(Cl)=N1 NO12957 [0,2,0,0,0,0|2,0,0]=4 1169 B9R1.69 CC1=NC=C(N)C(=O)N1 NO14824 [0,2,0,0,0,0|2,0,0]=4 1170 B9R1.69 CC1=NC=C(N)C(C)=N1 NO14188 [0,2,0,0,0,0|2,0,0]=4 1171 B9R1.69 CC1=NC=C(N)C(Cl)=N1 NO13251 [0,2,0,0,0,0|2,0,0]=4 1172 B9R1.69 CC1=NC=C(O)C(C)=N1 NO16008 [0,2,0,0,0,0|2,0,0]=4 1173 B9R1.69 CC1=[N+]([O-])C=CC(N)=C1 DY715184 [0,2,0,0,0,0|0,0,1]=3 1174 B9R1.69 CN1C=C(Br)N=CC1=O NO12933 [0,2,0,0,0,0|2,0,0]=4 1175 B9R1.69 CN1C=CC(=O)C(O)=C1 NO17435 [0,2,0,0,0,0|1,0,1]=4 1176 B9R1.69 CN1C=CC(Br)=CC1=O NO12571 [0,2,0,0,0,0|1,0,1]=4 1177 B9R1.69 CN1C=CC(I)=CC1=O DY442287 [0,2,0,0,0,0|1,0,1]=4 1178 B9R1.69 CN1C=CC(N)=NC1=O DY425150 [0,2,0,0,0,0|1,0,1]=4 1179 B9R1.69 CN1C=NC(Cl)=CC1=O NO14349 [0,2,0,0,0,0|2,0,0]=4 1180 B9R1.69 CN1N=CC(N)=CC1=O DY104084 [0,2,0,0,0,0|1,0,1]=4 1181 B9R1.69 ClC1=C(Br)C=C(Br)C=C1 DY584370 [0,2,0,0,0,0|2,0,0]=4 1182 B9R1.69 ClC1=C(Br)C=CC(I)=C1 NO12748 [0,2,0,0,0,0|2,0,0]=4 1183 B9R1.69 ClC1=C(Cl)C=C(Br)C=C1 NO18812 [0,2,0,0,0,0|2,0,0]=4 1184 B9R1.69 ClC1=CC(Br)=C(Cl)N=N1 NO15693 [0,2,0,0,0,0|2,0,0]=4 1185 B9R1.69 ClC1=CC(Br)=C(I)C=C1 NO21351 [0,2,0,0,0,0|2,0,0]=4 1186 B9R1.69 ClC1=CC(Br)=NC=C1Br DY432382 [0,2,0,0,0,0|1,0,0]=3 1187 B9R1.69 ClC1=CC(Cl)=C(Br)C=C1 NO18636 [0,2,0,0,0,0|2,0,0]=4 1188 B9R1.69 ClC1=CC(Cl)=C(Cl)N=N1 NO21922 [0,2,0,0,0,0|2,0,0]=4 1189 B9R1.69 ClC1=CC(Cl)=NC=C1Br NO10253 [0,2,0,0,0,0|1,0,0]=3 1190 B9R1.69 ClC1=CC(I)=C(Br)C=C1 NO20652 [0,2,0,0,0,0|2,0,0]=4 1191 B9R1.69 ClC1=CC(I)=C(Cl)C=C1 DY546969 [0,2,0,0,0,0|2,0,0]=4 1192 B9R1.69 ClC1=CN=C(Cl)C=C1Br NO12673 [0,2,0,0,0,0|1,0,0]=3 1193 B9R1.69 ClC1=CN=C(Cl)N=C1Cl NO16824 [0,2,0,0,0,0|2,0,0]=4 1194 B9R1.69 ClC1=NC=C(Br)C(Cl)=N1 NO16790 [0,2,0,0,0,0|2,0,0]=4 1195 B9R1.69 ClC1=NC=C(I)C(Cl)=N1 NO16795 [0,2,0,0,0,0|2,0,0]=4 1196 B9R1.69 FC1=C(Br)C=C(Br)C=C1 DY20168 [0,2,0,0,0,0|2,0,0]=4 1197 B9R1.69 FC1=C(Br)C=C(Cl)C=C1 NO18841 [0,2,0,0,0,0|2,0,0]=4 1198 B9R1.69 FC1=C(Br)C=CC(Br)=C1 NO18653 [0,2,0,0,0,0|2,0,0]=4 1199 B9R1.69 FC1=C(Br)C=CC(I)=C1 NO18663 [0,2,0,0,0,0|2,0,0]=4 1200 B9R1.69 FC1=C(Cl)C=C(Br)C=C1 NO19184 [0,2,0,0,0,0|2,0,0]=4 1201 B9R1.69 FC1=C(Cl)C=CC(Br)=C1 NO19182 [0,2,0,0,0,0|2,0,0]=4 1202 B9R1.69 FC1=C(Cl)C=CC(I)=C1 NO18849 [0,2,0,0,0,0|2,0,0]=4 1203 B9R1.69 FC1=C(I)C=C(Br)C=C1 NO22852 [0,2,0,0,0,0|2,0,0]=4 1204 B9R1.69 FC1=C(I)C=C(Cl)C=C1 DY508694 [0,2,0,0,0,0|2,0,0]=4 1205 B9R1.69 FC1=C(I)C=CC(Br)=C1 NO22850 [0,2,0,0,0,0|2,0,0]=4 1206 B9R1.69 FC1=CC(Br)=C(Cl)C=C1 NO18847 [0,2,0,0,0,0|2,0,0]=4 1207 B9R1.69 FC1=CC(Br)=C(F)C=C1 NO19044 [0,2,0,0,0,0|2,0,0]=4 1208 B9R1.69 FC1=CC(Br)=C(I)C=C1 NO18665 [0,2,0,0,0,0|2,0,0]=4 1209 B9R1.69 FC1=CC(Br)=NC=C1I DY655120 [0,2,0,0,0,0|1,0,0]=3 1210 B9R1.69 FC1=CC(Cl)=C(Cl)C=C1 DY33048 [0,2,0,0,0,0|2,0,0]=4 1211 B9R1.69 FC1=CC(Cl)=C(F)C=C1 DY41471 [0,2,0,0,0,0|2,0,0]=4 1212 B9R1.69 FC1=CC(F)=C(F)C=C1 DY41495 [0,2,0,0,0,0|2,0,0]=4 1213 B9R1.69 FC1=CC(F)=C(S)C=C1 DY41404 [0,2,0,0,0,0|2,0,0]=4 1214 B9R1.69 FC1=CC(I)=C(Cl)C=C1 DY433497 [0,2,0,0,0,0|2,0,0]=4 1215 B9R1.69 FC1=CC=C(Br)C=C1F DY452314 [0,2,0,0,0,0|2,0,0]=4 1216 B9R1.69 FC1=CN=C(Br)C=C1Cl NO15366 [0,2,0,0,0,0|1,0,0]=3 1217 B9R1.69 FC1=CN=C(Cl)C=C1Br NO19582 [0,2,0,0,0,0|1,0,0]=3 1218 B9R1.69 FC1=CN=C(Cl)C=C1Cl DY427226 [0,2,0,0,0,0|1,0,0]=3 1219 B9R1.69 FC1=CN=C(Cl)C=C1I NO21461 [0,2,0,0,0,0|1,0,0]=3 1220 B9R1.69 FC1=CN=C(Cl)N=C1Cl NO14094 [0,2,0,0,0,0|2,0,0]=4 1221 B9R1.69 FC1=NC=C(Br)C(F)=N1 NO14029 [0,2,0,0,0,0|2,0,0]=4 1222 B9R1.69 Fc1ccc(I)c(Cl)c1 NO19647 [0,2,0,0,0,0|2,0,0]=4 1223 B9R1.69 IC1=CC(I)=C(I)C=C1 DY822105 [0,2,0,0,0,0|2,0,0]=4 1224 B9R1.69 NC1=C(Br)C=C(Br)N=N1 DY460146 [0,2,0,0,0,0|2,0,0]=4 1225 B9R1.69 NC1=C(Br)C=C(Cl)N=N1 NO12417 [0,2,0,0,0,0|2,0,0]=4 1226 B9R1.69 NC1=C(Br)C=C(F)C=C1 DY40868 [0,2,0,0,0,0|1,0,0]=3 1227 B9R1.69 NC1=C(Br)C=C(I)C=C1 NO21357 [0,2,0,0,0,0|1,0,0]=3 1228 B9R1.69 NC1=C(Br)C=C(O)C=C1 DY41139 [0,2,0,0,0,0|1,0,0]=3 1229 B9R1.69 NC1=C(Br)C=CC(Br)=C1 NO18980 [0,2,0,0,0,0|1,0,0]=3 1230 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 NO18496 [0,2,0,0,0,0|1,0,0]=3 1231 B9R1.69 NC1=C(Br)C=CC(F)=C1 NO22951 [0,2,0,0,0,0|1,0,0]=3 1232 B9R1.69 NC1=C(Br)C=CC(I)=C1 DY822107 [0,2,0,0,0,0|1,0,0]=3 1233 B9R1.69 NC1=C(Br)C=CC(O)=C1 NO14504 [0,2,0,0,0,0|1,0,0]=3 1234 B9R1.69 NC1=C(Cl)C=C(Cl)C=C1 NO21094 [0,2,0,0,0,0|1,0,0]=3 1235 B9R1.69 NC1=C(Cl)C=C(Cl)N=C1 NO18446 [0,2,0,0,0,0|1,0,0]=3 1236 B9R1.69 NC1=C(Cl)C=C(O)C=C1 DY10180 [0,2,0,0,0,0|1,0,0]=3 1237 B9R1.69 NC1=C(Cl)C=C(O)C=C1 NO18805 [0,2,0,0,0,0|1,0,0]=3 1238 B9R1.69 NC1=C(Cl)C=C(O)C=N1 DY660825 [0,2,0,0,0,0|2,0,0]=4 1239 B9R1.69 NC1=C(Cl)C=CC(Br)=C1 NO15250 [0,2,0,0,0,0|1,0,0]=3 1240 B9R1.69 NC1=C(Cl)C=CC(Cl)=C1 NO21140 [0,2,0,0,0,0|1,0,0]=3 1241 B9R1.69 NC1=C(Cl)C=CC(F)=C1 NO22962 [0,2,0,0,0,0|1,0,0]=3 1242 B9R1.69 NC1=C(Cl)C=CC(I)=C1 DY822106 [0,2,0,0,0,0|1,0,0]=3 1243 B9R1.69 NC1=C(Cl)N=NC(Cl)=C1 NO15012 [0,2,0,0,0,0|1,0,0]=3 1244 B9R1.69 NC1=C(F)C=C(Br)C=C1 NO22953 [0,2,0,0,0,0|1,0,0]=3 1245 B9R1.69 NC1=C(F)C=C(Cl)C=C1 NO22965 [0,2,0,0,0,0|1,0,0]=3 1246 B9R1.69 NC1=C(F)C=C(Cl)N=C1 DY514725 [0,2,0,0,0,0|1,0,0]=3 1247 B9R1.69 NC1=C(F)C=C(F)C=C1 NO19091 [0,2,0,0,0,0|1,0,0]=3 1248 B9R1.69 NC1=C(F)C=C(F)N=C1 DY712981 [0,2,0,0,0,0|1,0,0]=3 1249 B9R1.69 NC1=C(F)C=C(I)C=C1 NO19120 [0,2,0,0,0,0|1,0,0]=3 1250 B9R1.69 NC1=C(F)C=C(O)C=C1 NO23017 [0,2,0,0,0,0|1,0,0]=3 1251 B9R1.69 NC1=C(F)C=CC(Br)=C1 NO22955 [0,2,0,0,0,0|1,0,0]=3 1252 B9R1.69 NC1=C(F)C=CC(Cl)=C1 DY30003 [0,2,0,0,0,0|1,0,0]=3 1253 B9R1.69 NC1=C(F)C=CC(F)=C1 NO22979 [0,2,0,0,0,0|1,0,0]=3 1254 B9R1.69 NC1=C(F)C=CC(I)=C1 NO19543 [0,2,0,0,0,0|1,0,0]=3 1255 B9R1.69 NC1=C(F)C=CC(O)=C1 NO19712 [0,2,0,0,0,0|1,0,0]=3 1256 B9R1.69 NC1=C(I)C=C(Br)C=C1 NO22647 [0,2,0,0,0,0|1,0,0]=3 1257 B9R1.69 NC1=C(I)C=C(Cl)C=C1 NO15394 [0,2,0,0,0,0|1,0,0]=3 1258 B9R1.69 NC1=C(I)C=C(Cl)N=C1 DY550419 [0,2,0,0,0,0|1,0,0]=3 1259 B9R1.69 NC1=C(I)C=C(Cl)N=C1 DY661025 [0,2,0,0,0,0|1,0,0]=3 1260 B9R1.69 NC1=C(I)C=C(F)C=C1 NO19121 [0,2,0,0,0,0|1,0,0]=3 1261 B9R1.69 NC1=C(I)C=C(I)C=C1 DY796137 [0,2,0,0,0,0|1,0,0]=3 1262 B9R1.69 NC1=C(I)C=CC(Cl)=C1 NO18421 [0,2,0,0,0,0|1,0,0]=3 1263 B9R1.69 NC1=C(I)C=CC(F)=C1 NO22986 [0,2,0,0,0,0|1,0,0]=3 1264 B9R1.69 NC1=C(I)C=CC(I)=C1 DY822103 [0,2,0,0,0,0|1,0,0]=3 1265 B9R1.69 NC1=C(N)C=C(S)C=C1 DY565749 [0,2,0,0,0,0|1,0,0]=3 1266 B9R1.69 NC1=C(O)C=C(Br)C=C1 NO21272 [0,2,0,0,0,0|1,0,0]=3 1267 B9R1.69 NC1=C(O)C=C(Cl)C=C1 NO19300 [0,2,0,0,0,0|1,0,0]=3 1268 B9R1.69 NC1=C(O)C=C(F)C=C1 NO23016 [0,2,0,0,0,0|1,0,0]=3 1269 B9R1.69 NC1=C(O)C=C(O)C=C1 NO22592 [0,2,0,0,0,0|1,0,0]=3 1270 B9R1.69 NC1=C(O)C=CC(Br)=C1 NO14311 [0,2,0,0,0,0|1,0,0]=3 1271 B9R1.69 NC1=C(O)C=CC(Cl)=C1 NO16374 [0,2,0,0,0,0|1,0,0]=3 1272 B9R1.69 NC1=C(O)C=NC(Cl)=C1 DY432273 [0,2,0,0,0,0|0,0,0]=2 1273 B9R1.69 NC1=C(S)C=CC(Cl)=C1 DY500643 [0,2,0,0,0,0|1,0,0]=3 1274 B9R1.69 NC1=CC(Br)=C(Br)N=C1 NO20036 [0,2,0,0,0,0|2,0,0]=4 1275 B9R1.69 NC1=CC(Br)=C(Cl)C=C1 NO22147 [0,2,0,0,0,0|1,0,0]=3 1276 B9R1.69 NC1=CC(Br)=C(Cl)N=C1 NO13590 [0,2,0,0,0,0|2,0,0]=4 1277 B9R1.69 NC1=CC(Br)=C(F)C=C1 NO15522 [0,2,0,0,0,0|1,0,0]=3 1278 B9R1.69 NC1=CC(Br)=C(I)C=C1 DY575307 [0,2,0,0,0,0|1,0,0]=3 1279 B9R1.69 NC1=CC(Br)=CN=C1F NO17338 [0,2,0,0,0,0|2,0,0]=4 1280 B9R1.69 NC1=CC(Br)=CN=C1N DY508982 [0,2,0,0,0,0|2,0,0]=4 1281 B9R1.69 NC1=CC(Br)=CN=C1N NO14253 [0,2,0,0,0,0|2,0,0]=4 1282 B9R1.69 NC1=CC(Br)=CN=C1O NO14285 [0,2,0,0,0,0|2,0,0]=4 1283 B9R1.69 NC1=CC(Br)=NC=C1Br DY715796 [0,2,0,0,0,0|0,0,0]=2 1284 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 NO18864 [0,2,0,0,0,0|1,0,0]=3 1285 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 NO21929 [0,2,0,0,0,0|1,0,0]=3 1286 B9R1.69 NC1=CC(Cl)=C(Cl)N=C1 NO19436 [0,2,0,0,0,0|2,0,0]=4 1287 B9R1.69 NC1=CC(Cl)=C(F)C=C1 NO19039 [0,2,0,0,0,0|1,0,0]=3 1288 B9R1.69 NC1=CC(Cl)=C(O)C=C1 NO19309 [0,2,0,0,0,0|1,0,0]=3 1289 B9R1.69 NC1=CC(Cl)=CN=C1Br NO16256 [0,2,0,0,0,0|2,0,0]=4 1290 B9R1.69 NC1=CC(F)=C(Br)C=C1 NO22954 [0,2,0,0,0,0|1,0,0]=3 1291 B9R1.69 NC1=CC(F)=C(Cl)C=C1 NO22968 [0,2,0,0,0,0|1,0,0]=3 1292 B9R1.69 NC1=CC(F)=C(Cl)N=C1 DY514713 [0,2,0,0,0,0|2,0,0]=4 1293 B9R1.69 NC1=CC(F)=C(I)C=C1 NO22985 [0,2,0,0,0,0|1,0,0]=3 1294 B9R1.69 NC1=CC(F)=C(O)C=N1 DY660813 [0,2,0,0,0,0|1,0,0]=3 1295 B9R1.69 NC1=CC(F)=CN=C1Br DY20009 [0,2,0,0,0,0|2,0,0]=4 1296 B9R1.69 NC1=CC(F)=CN=C1N DY585170 [0,2,0,0,0,0|2,0,0]=4 1297 B9R1.69 NC1=CC(F)=CNC1=O DY656836 [0,2,0,0,0,0|2,0,0]=4 1298 B9R1.69 NC1=CC(N)=C(Cl)C=C1 NO14655 [0,2,0,0,0,0|1,0,0]=3 1299 B9R1.69 NC1=CC(N)=C(F)C=C1 NO23032 [0,2,0,0,0,0|1,0,0]=3 1300 B9R1.69 NC1=CC(N)=C(O)C=C1 NO16325 [0,2,0,0,0,0|1,0,0]=3 1301 B9R1.69 NC1=CC(O)=C(F)C=C1 NO13999 [0,2,0,0,0,0|1,0,0]=3 1302 B9R1.69 NC1=CC(O)=CN=C1O DY656872 [0,2,0,0,0,0|2,0,0]=4 1303 B9R1.69 NC1=CC=C(Br)C(Br)=N1 DY20982 [0,2,0,0,0,0|2,0,0]=4 1304 B9R1.69 NC1=CC=C(Br)C=C1N NO19462 [0,2,0,0,0,0|1,0,0]=3 1305 B9R1.69 NC1=CC=C(Br)N=C1Br NO22704 [0,2,0,0,0,0|2,0,0]=4 1306 B9R1.69 NC1=CC=C(Br)N=C1Cl NO12982 [0,2,0,0,0,0|2,0,0]=4 1307 B9R1.69 NC1=CC=C(Br)N=C1N NO13154 [0,2,0,0,0,0|2,0,0]=4 1308 B9R1.69 NC1=CC=C(Cl)C=C1N NO23029 [0,2,0,0,0,0|1,0,0]=3 1309 B9R1.69 NC1=CC=C(Cl)N=C1Cl NO17483 [0,2,0,0,0,0|2,0,0]=4 1310 B9R1.69 NC1=CC=C(Cl)N=C1N NO21009 [0,2,0,0,0,0|2,0,0]=4 1311 B9R1.69 NC1=CC=C(F)C=C1N NO19484 [0,2,0,0,0,0|1,0,0]=3 1312 B9R1.69 NC1=CC=C(F)N=C1Br NO15317 [0,2,0,0,0,0|2,0,0]=4 1313 B9R1.69 NC1=CC=C(I)C(N)=N1 DY33465 [0,2,0,0,0,0|2,0,0]=4 1314 B9R1.69 NC1=CN=C(Cl)N=C1Cl NO18066 [0,2,0,0,0,0|2,0,0]=4 1315 B9R1.69 NC1=CN=C(Cl)N=C1Cl NO18344 [0,2,0,0,0,0|2,0,0]=4 1316 B9R1.69 NC1=CN=C(Cl)N=C1N NO18008 [0,2,0,0,0,0|1,0,0]=3 1317 B9R1.69 NC1=CN=C(N)C(Cl)=C1 DY713227 [0,2,0,0,0,0|2,0,0]=4 1318 B9R1.69 NC1=CN=C(N)C(N)=C1 DY585668 [0,2,0,0,0,0|2,0,0]=4 1319 B9R1.69 NC1=CN=C(O)C(I)=C1 DY715736 [0,2,0,0,0,0|2,0,0]=4 1320 B9R1.69 NC1=CNC(=O)C=C1Cl DY659408 [0,2,0,0,0,0|1,0,1]=4 1321 B9R1.69 NC1=NC(Br)=CC=C1O NO15126 [0,2,0,0,0,0|2,0,0]=4 1322 B9R1.69 NC1=NC(Cl)=CC=C1I NO13134 [0,2,0,0,0,0|2,0,0]=4 1323 B9R1.69 NC1=NC(Cl)=CC=C1O DY528201 [0,2,0,0,0,0|2,0,0]=4 1324 B9R1.69 NC1=NC(Cl)=NC=C1Br NO18145 [0,2,0,0,0,0|1,0,0]=3 1325 B9R1.69 NC1=NC(Cl)=NC=C1Cl NO13487 [0,2,0,0,0,0|1,0,0]=3 1326 B9R1.69 NC1=NC(Cl)=NC=C1I NO14422 [0,2,0,0,0,0|1,0,0]=3 1327 B9R1.69 NC1=NC(F)=C(I)C=C1 NO15172 [0,2,0,0,0,0|2,0,0]=4 1328 B9R1.69 NC1=NC(I)=C(Br)C=C1 DY512709 [0,2,0,0,0,0|2,0,0]=4 1329 B9R1.69 NC1=NC=C(Br)C(Br)=C1 NO16866 [0,2,0,0,0,0|1,0,0]=3 1330 B9R1.69 NC1=NC=C(Br)C(Cl)=C1 NO12672 [0,2,0,0,0,0|1,0,0]=3 1331 B9R1.69 NC1=NC=C(Br)C(F)=C1 NO16865 [0,2,0,0,0,0|1,0,0]=3 1332 B9R1.69 NC1=NC=C(Br)C(O)=N1 NO12513 [0,2,0,0,0,0|2,0,0]=4 1333 B9R1.69 NC1=NC=C(Br)C(O)=N1 NO21270 [0,2,0,0,0,0|2,0,0]=4 1334 B9R1.69 NC1=NC=C(Br)C=C1Br NO17443 [0,2,0,0,0,0|2,0,0]=4 1335 B9R1.69 NC1=NC=C(Br)C=C1F NO12629 [0,2,0,0,0,0|2,0,0]=4 1336 B9R1.69 NC1=NC=C(Br)C=C1I NO14238 [0,2,0,0,0,0|2,0,0]=4 1337 B9R1.69 NC1=NC=C(Cl)C(Br)=C1 DY443681 [0,2,0,0,0,0|1,0,0]=3 1338 B9R1.69 NC1=NC=C(Cl)C(Cl)=N1 NO12575 [0,2,0,0,0,0|2,0,0]=4 1339 B9R1.69 NC1=NC=C(Cl)C=C1Br NO14049 [0,2,0,0,0,0|2,0,0]=4 1340 B9R1.69 NC1=NC=C(Cl)C=C1Cl DY41597 [0,2,0,0,0,0|2,0,0]=4 1341 B9R1.69 NC1=NC=C(Cl)C=C1F NO18904 [0,2,0,0,0,0|2,0,0]=4 1342 B9R1.69 NC1=NC=C(Cl)C=C1I NO18161 [0,2,0,0,0,0|2,0,0]=4 1343 B9R1.69 NC1=NC=C(F)C(Cl)=N1 NO11916 [0,2,0,0,0,0|2,0,0]=4 1344 B9R1.69 NC1=NC=C(F)C=C1Br NO16185 [0,2,0,0,0,0|2,0,0]=4 1345 B9R1.69 NC1=NC=C(F)C=C1Cl NO17132 [0,2,0,0,0,0|2,0,0]=4 1346 B9R1.69 NC1=NC=C(F)C=C1O NO14876 [0,2,0,0,0,0|2,0,0]=4 1347 B9R1.69 NC1=NC=C(I)C(Br)=C1 NO16717 [0,2,0,0,0,0|1,0,0]=3 1348 B9R1.69 NC1=NC=C(I)C(Cl)=C1 DY20729 [0,2,0,0,0,0|1,0,0]=3 1349 B9R1.69 NC1=NC=C(I)C=C1Br NO22160 [0,2,0,0,0,0|2,0,0]=4 1350 B9R1.69 O=C1NC(Cl)=NC=C1F NO19848 [0,2,0,0,0,0|2,0,0]=4 1351 B9R1.69 O=C1NN=C(Cl)C=C1Br NO15689 [0,2,0,0,0,0|2,0,0]=4 1352 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 NO15632 [0,2,0,0,0,0|2,0,0]=4 1353 B9R1.69 OC1=C(Br)C=C(F)C=C1 DY10138 [0,2,0,0,0,0|2,0,0]=4 1354 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 NO21372 [0,2,0,0,0,0|2,0,0]=4 1355 B9R1.69 OC1=C(Br)C=CC(F)=C1 DY20075 [0,2,0,0,0,0|2,0,0]=4 1356 B9R1.69 OC1=C(Br)C=CC(I)=C1 NO13046 [0,2,0,0,0,0|2,0,0]=4 1357 B9R1.69 OC1=C(Cl)C=C(F)C=C1 NO13904 [0,2,0,0,0,0|2,0,0]=4 1358 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 DY20037 [0,2,0,0,0,0|2,0,0]=4 1359 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 NO21143 [0,2,0,0,0,0|2,0,0]=4 1360 B9R1.69 OC1=C(Cl)C=CC(F)=C1 NO22918 [0,2,0,0,0,0|2,0,0]=4 1361 B9R1.69 OC1=C(Cl)N=NC(Cl)=C1 NO17048 [0,2,0,0,0,0|2,0,0]=4 1362 B9R1.69 OC1=C(F)C=C(Br)C=C1 NO22908 [0,2,0,0,0,0|2,0,0]=4 1363 B9R1.69 OC1=C(F)C=C(F)C=C1 NO19015 [0,2,0,0,0,0|2,0,0]=4 1364 B9R1.69 OC1=C(F)C=CC(Br)=C1 NO22910 [0,2,0,0,0,0|2,0,0]=4 1365 B9R1.69 OC1=C(F)C=CC(Cl)=C1 NO22920 [0,2,0,0,0,0|2,0,0]=4 1366 B9R1.69 OC1=C(F)C=CC(I)=C1 NO12536 [0,2,0,0,0,0|2,0,0]=4 1367 B9R1.69 OC1=C(I)C=C(Cl)C=C1 NO22744 [0,2,0,0,0,0|2,0,0]=4 1368 B9R1.69 OC1=C(I)C=C(F)C=C1 NO13176 [0,2,0,0,0,0|2,0,0]=4 1369 B9R1.69 OC1=C(I)C=C(I)C=C1 DY584396 [0,2,0,0,0,0|2,0,0]=4 1370 B9R1.69 OC1=C(I)C=CC(Br)=C1 DY442822 [0,2,0,0,0,0|2,0,0]=4 1371 B9R1.69 OC1=C(I)C=CC(Cl)=C1 NO10328 [0,2,0,0,0,0|2,0,0]=4 1372 B9R1.69 OC1=CC(Br)=C(Cl)C=C1 NO22149 [0,2,0,0,0,0|2,0,0]=4 1373 B9R1.69 OC1=CC(Br)=C(F)C=C1 NO22905 [0,2,0,0,0,0|2,0,0]=4 1374 B9R1.69 OC1=CC(Br)=NC=C1F DY655168 [0,2,0,0,0,0|1,0,0]=3 1375 B9R1.69 OC1=CC(Cl)=C(Br)C=C1 DY20176 [0,2,0,0,0,0|2,0,0]=4 1376 B9R1.69 OC1=CC(Cl)=NC=C1Cl DY454126 [0,2,0,0,0,0|1,0,0]=3 1377 B9R1.69 OC1=CC(F)=C(Br)C=C1 NO22909 [0,2,0,0,0,0|2,0,0]=4 1378 B9R1.69 OC1=CC(F)=C(Cl)C=C1 NO22919 [0,2,0,0,0,0|2,0,0]=4 1379 B9R1.69 OC1=CC(F)=C(F)C=C1 NO22926 [0,2,0,0,0,0|2,0,0]=4 1380 B9R1.69 OC1=CC(F)=C(I)C=C1 NO15852 [0,2,0,0,0,0|2,0,0]=4 1381 B9R1.69 OC1=CC(F)=C(O)C=C1 DY20784 [0,2,0,0,0,0|2,0,0]=4 1382 B9R1.69 OC1=CC(F)=NC=C1Br DY659534 [0,2,0,0,0,0|1,0,0]=3 1383 B9R1.69 OC1=CC(I)=C(F)C=C1 DY442383 [0,2,0,0,0,0|2,0,0]=4 1384 B9R1.69 OC1=CC(O)=C(Br)C=C1 NO22703 [0,2,0,0,0,0|2,0,0]=4 1385 B9R1.69 OC1=CC(O)=C(F)C=C1 NO22989 [0,2,0,0,0,0|2,0,0]=4 1386 B9R1.69 OC1=CC=C(Br)C=C1O NO22676 [0,2,0,0,0,0|2,0,0]=4 1387 B9R1.69 OC1=CC=C(Cl)C=C1O DY584662 [0,2,0,0,0,0|2,0,0]=4 1388 B9R1.69 OC1=CN=C(Cl)N=C1Cl DY521493 [0,2,0,0,0,0|2,0,0]=4 1389 B9R1.69 OC1=NC=C(Cl)C(I)=C1 DY21156 [0,2,0,0,0,0|1,0,0]=3 1390 B9R1.69 SC1=C(Cl)C=CC(Cl)=C1 DY561891 [0,2,0,0,0,0|2,0,0]=4 1391 B9R1.69 SC1=CC(Cl)=C(Cl)C=C1 DY585101 [0,2,0,0,0,0|2,0,0]=4 1392 B9R1.3 CC1=C(Br)C(Cl)=NC=C1 NO14983 [0,2,0,0,0,0|1,0,0]=3 1393 B9R1.3 CC1=C(Br)C(Cl)=NC=N1 NO12379 [0,2,0,0,0,0|2,0,0]=4 1394 B9R1.3 CC1=C(Br)C(F)=NC=C1 NO20037 [0,2,0,0,0,0|1,0,0]=3 1395 B9R1.3 CC1=C(Br)C(N)=NC=N1 NO12474 [0,2,0,0,0,0|1,0,0]=3 1396 B9R1.3 CC1=C(Br)C(O)=NC=C1 NO21575 [0,2,0,0,0,0|1,0,0]=3 1397 B9R1.3 CC1=C(Br)C(O)=NC=N1 DY106954 [0,2,0,0,0,0|2,0,0]=4 1398 B9R1.3 CC1=C(Br)C=CC=C1Br NO20164 [0,2,0,0,0,0|2,0,0]=4 1399 B9R1.3 CC1=C(Br)C=CC=C1F NO19838 [0,2,0,0,0,0|2,0,0]=4 1400 B9R1.3 CC1=C(Br)C=CC=C1I NO16145 [0,2,0,0,0,0|2,0,0]=4 1401 B9R1.3 CC1=C(Br)C=CN=C1Cl NO21442 [0,2,0,0,0,0|1,0,0]=3 1402 B9R1.3 CC1=C(Br)C=NC=C1Cl DY452524 [0,2,0,0,0,0|1,0,0]=3 1403 B9R1.3 CC1=C(C)C(Br)=CC=C1 NO19738 [0,2,0,0,0,0|2,0,0]=4 1404 B9R1.3 CC1=C(C)C(N)=NC=C1 NO14451 [0,2,0,0,0,0|1,0,0]=3 1405 B9R1.3 CC1=C(C)C(O)=NC=C1 DY431552 [0,2,0,0,0,0|1,0,0]=3 1406 B9R1.3 CC1=C(Cl)C=CC=C1Cl NO21173 [0,2,0,0,0,0|2,0,0]=4 1407 B9R1.3 CC1=C(Cl)N=CN=C1Cl NO22507 [0,2,0,0,0,0|2,0,0]=4 1408 B9R1.3 CC1=C(Cl)N=CN=C1N NO10115 [0,2,0,0,0,0|1,0,0]=3 1409 B9R1.3 CC1=C(F)C(Br)=CC=C1 DY30221 [0,2,0,0,0,0|2,0,0]=4 1410 B9R1.3 CC1=C(F)C(Br)=NC=C1 NO19394 [0,2,0,0,0,0|1,0,0]=3 1411 B9R1.3 CC1=C(F)C(Cl)=NC=C1 NO19389 [0,2,0,0,0,0|1,0,0]=3 1412 B9R1.3 CC1=C(F)C(Cl)=NC=N1 DY578493 [0,2,0,0,0,0|2,0,0]=4 1413 B9R1.3 CC1=C(F)C(N)=NC=C1 DY433034 [0,2,0,0,0,0|1,0,0]=3 1414 B9R1.3 CC1=C(F)C=CC=C1F NO19669 [0,2,0,0,0,0|2,0,0]=4 1415 B9R1.3 CC1=C(F)C=CN=C1Cl DY450904 [0,2,0,0,0,0|1,0,0]=3 1416 B9R1.3 CC1=C(I)C(Cl)=CC=C1 NO20195 [0,2,0,0,0,0|2,0,0]=4 1417 B9R1.3 CC1=C(I)C(Cl)=NC=C1 DY448288 [0,2,0,0,0,0|1,0,0]=3 1418 B9R1.3 CC1=C(I)C(Cl)=NC=N1 NO22770 [0,2,0,0,0,0|2,0,0]=4 1419 B9R1.3 CC1=C(I)C(F)=CC=C1 NO20026 [0,2,0,0,0,0|2,0,0]=4 1420 B9R1.3 CC1=C(I)C(N)=NC=N1 NO10411 [0,2,0,0,0,0|1,0,0]=3 1421 B9R1.3 CC1=C(I)C=CN=C1Cl DY425783 [0,2,0,0,0,0|1,0,0]=3 1422 B9R1.3 CC1=C(I)C=CN=C1F NO18757 [0,2,0,0,0,0|1,0,0]=3 1423 B9R1.3 CC1=C(N)C(=O)N=CN1 DY694631 [0,2,0,0,0,0|2,0,0]=4 1424 B9R1.3 CC1=C(N)C(Br)=NC=C1 NO13575 [0,2,0,0,0,0|1,0,0]=3 1425 B9R1.3 CC1=C(N)C(Cl)=NC=C1 NO19470 [0,2,0,0,0,0|1,0,0]=3 1426 B9R1.3 CC1=C(N)C(N)=CC=C1 DY790251 [0,2,0,0,0,0|1,0,0]=3 1427 B9R1.3 CC1=C(N)C=CC=C1Br DY20171 [0,2,0,0,0,0|1,0,0]=3 1428 B9R1.3 CC1=C(N)C=CC=C1Cl NO16197 [0,2,0,0,0,0|1,0,0]=3 1429 B9R1.3 CC1=C(N)C=CC=C1F DY585178 [0,2,0,0,0,0|1,0,0]=3 1430 B9R1.3 CC1=C(N)C=CC=C1F NO10512 [0,2,0,0,0,0|1,0,0]=3 1431 B9R1.3 CC1=C(N)C=NC=C1Br NO14627 [0,2,0,0,0,0|1,0,0]=3 1432 B9R1.3 CC1=C(O)C(=O)C=CO1 DY21095 [0,2,0,0,0,0|2,0,0]=4 1433 B9R1.3 CC1=C(O)C(Cl)=NC=C1 NO16152 [0,2,0,0,0,0|1,0,0]=3 1434 B9R1.3 CC1=C(O)C=CC=C1Br NO14415 [0,2,0,0,0,0|2,0,0]=4 1435 B9R1.3 CC1=C(O)C=CC=C1Cl NO22210 [0,2,0,0,0,0|2,0,0]=4 1436 B9R1.3 CC1=C(O)C=CC=C1F DY433104 [0,2,0,0,0,0|2,0,0]=4 1437 B9R1.3 CC1=C(O)C=CC=C1O DY20744 [0,2,0,0,0,0|2,0,0]=4 1438 B9R1.3 CC1=C(O)N=CN=C1O DY461148 [0,2,0,0,0,0|2,0,0]=4 1439 B9R1.3 CC1=CC=CC(Br)=C1Br DY585024 [0,2,0,0,0,0|2,0,0]=4 1440 B9R1.3 CC1=CC=CC(Br)=C1N NO10505 [0,2,0,0,0,0|1,0,0]=3 1441 B9R1.3 CC1=CC=CC(C)=C1Br NO19952 [0,2,0,0,0,0|2,0,0]=4 1442 B9R1.3 CC1=CC=CC(C)=C1O NO21185 [0,2,0,0,0,0|2,0,0]=4 1443 B9R1.3 CC1=CC=CC(C)=C1S DY789459 [0,2,0,0,0,0|2,0,0]=4 1444 B9R1.3 CC1=CC=CC(Cl)=C1F NO22205 [0,2,0,0,0,0|2,0,0]=4 1445 B9R1.3 CC1=CC=CC(Cl)=C1N NO13397 [0,2,0,0,0,0|1,0,0]=3 1446 B9R1.3 CC1=CC=CC(F)=C1F NO19914 [0,2,0,0,0,0|2,0,0]=4 1447 B9R1.3 CC1=CC=CC(F)=C1N NO10511 [0,2,0,0,0,0|1,0,0]=3 1448 B9R1.3 CC1=CC=CC(N)=C1Br NO12669 [0,2,0,0,0,0|1,0,0]=3 1449 B9R1.3 CC1=CC=CC(N)=C1O NO13842 [0,2,0,0,0,0|1,0,0]=3 1450 B9R1.3 CC1=CC=CC(O)=C1F DY20207 [0,2,0,0,0,0|2,0,0]=4 1451 B9R1.3 CC1=CC=CC(O)=C1I DY442299 [0,2,0,0,0,0|2,0,0]=4 1452 B9R1.3 CC1=CC=CC(O)=C1N NO14085 [0,2,0,0,0,0|1,0,0]=3 1453 B9R1.3 CC1=CN=CC(Br)=C1C DY453100 [0,2,0,0,0,0|1,0,0]=3 1454 B9R1.3 CC1=CN=CC(Br)=C1N NO19435 [0,2,0,0,0,0|0,0,0]=2 1455 B9R1.3 CC1=NC=CC(Br)=C1C NO15313 [0,2,0,0,0,0|1,0,0]=3 1456 B9R1.3 CC1=NC=CC(Br)=C1Cl DY658207 [0,2,0,0,0,0|1,0,0]=3 1457 B9R1.3 CC1=NC=CC(Br)=C1F NO17321 [0,2,0,0,0,0|1,0,0]=3 1458 B9R1.3 CC1=NC=CC(Br)=C1N DY713107 [0,2,0,0,0,0|1,0,0]=3 1459 B9R1.3 CC1=NC=CC(C)=C1O DY430625 [0,2,0,0,0,0|1,0,0]=3 1460 B9R1.3 CC1=NC=CC(Cl)=C1F DY711385 [0,2,0,0,0,0|1,0,0]=3 1461 B9R1.3 CC1=NC=CC(Cl)=C1I DY658407 [0,2,0,0,0,0|1,0,0]=3 1462 B9R1.3 CC1=NC=CC(Cl)=C1N NO15139 [0,2,0,0,0,0|1,0,0]=3 1463 B9R1.3 CC1=NC=CC(I)=C1Cl DY586507 [0,2,0,0,0,0|1,0,0]=3 1464 B9R1.3 CC1=NC=CC(N)=C1C NO14420 [0,2,0,0,0,0|0,0,0]=2 1465 B9R1.3 CC1=NC=CC(N)=C1N NO21697 [0,2,0,0,0,0|0,0,0]=2 1466 B9R1.3 CC1=NC=CC(O)=C1N DY512937 [0,2,0,0,0,0|1,0,0]=3 1467 B9R1.3 CC1=NC=CC(O)=C1O DY656055 [0,2,0,0,0,0|1,0,0]=3 1468 B9R1.3 CN1C(=O)C=NC=C1Br DY709609 [0,2,0,0,0,0|2,0,0]=4 1469 B9R1.3 CN1C=CC=C(N)C1=O DY425210 [0,2,0,0,0,0|2,0,0]=4 1470 B9R1.3 CN1C=CN=C(Cl)C1=O DY537531 [0,2,0,0,0,0|2,0,0]=4 1471 B9R1.3 CN1C=CN=C(N)C1=O DY709633 [0,2,0,0,0,0|2,0,0]=4 1472 B9R1.3 CN1C=NC=C(Br)C1=O DY694721 [0,2,0,0,0,0|2,0,0]=4 1473 B9R1.3 ClC1=C(Br)C=CC=C1Br NO15022 [0,2,0,0,0,0|2,0,0]=4 1474 B9R1.3 ClC1=CC=CC(Br)=C1I DY452860 [0,2,0,0,0,0|2,0,0]=4 1475 B9R1.3 ClC1=CC=CC(Cl)=C1Br NO13889 [0,2,0,0,0,0|2,0,0]=4 1476 B9R1.3 ClC1=CN=CC(Br)=C1Br NO17477 [0,2,0,0,0,0|1,0,0]=3 1477 B9R1.3 ClC1=CN=CC(Br)=C1Cl NO14690 [0,2,0,0,0,0|1,0,0]=3 1478 B9R1.3 ClC1=CN=CC(Cl)=C1Br DY20934 [0,2,0,0,0,0|1,0,0]=3 1479 B9R1.3 ClC1=CN=NC(Cl)=C1Cl NO21915 [0,2,0,0,0,0|2,0,0]=4 1480 B9R1.3 ClC1=NC=CC(Br)=C1Br DY656157 [0,2,0,0,0,0|1,0,0]=3 1481 B9R1.3 ClC1=NC=CC(Br)=C1I DY453904 [0,2,0,0,0,0|1,0,0]=3 1482 B9R1.3 ClC1=NC=CC(Cl)=C1Cl NO17151 [0,2,0,0,0,0|1,0,0]=3 1483 B9R1.3 ClC1=NC=CC(I)=C1Cl NO14028 [0,2,0,0,0,0|1,0,0]=3 1484 B9R1.3 ClC1=NC=NC(Cl)=C1Cl NO13844 [0,2,0,0,0,0|2,0,0]=4 1485 B9R1.3 ClC1=NC=NC(Cl)=C1I NO12896 [0,2,0,0,0,0|2,0,0]=4 1486 B9R1.3 FC1=C(Br)C=CC=C1Br NO16311 [0,2,0,0,0,0|2,0,0]=4 1487 B9R1.3 FC1=C(Br)C=CC=C1Cl DY31054 [0,2,0,0,0,0|2,0,0]=4 1488 B9R1.3 FC1=C(Cl)C(Cl)=NC=C1 DY431926 [0,2,0,0,0,0|1,0,0]=3 1489 B9R1.3 FC1=C(Cl)C(I)=CC=C1 DY686533 [0,2,0,0,0,0|2,0,0]=4 1490 B9R1.3 FC1=C(Cl)C=CC=C1Cl NO21170 [0,2,0,0,0,0|2,0,0]=4 1491 B9R1.3 FC1=C(Cl)C=NC=C1Cl DY579813 [0,2,0,0,0,0|1,0,0]=3 1492 B9R1.3 FC1=C(Cl)N=CN=C1Cl NO18862 [0,2,0,0,0,0|2,0,0]=4 1493 B9R1.3 FC1=C(F)C(Cl)=NC=C1 DY655292 [0,2,0,0,0,0|1,0,0]=3 1494 B9R1.3 FC1=C(I)C=CN=C1Cl NO13734 [0,2,0,0,0,0|1,0,0]=3 1495 B9R1.3 FC1=CC=CC(Br)=C1I DY452848 [0,2,0,0,0,0|2,0,0]=4 1496 B9R1.3 FC1=CC=CC(Cl)=C1Br NO12182 [0,2,0,0,0,0|2,0,0]=4 1497 B9R1.3 FC1=CC=CC(F)=C1Cl DY30191 [0,2,0,0,0,0|2,0,0]=4 1498 B9R1.3 FC1=CN=CC(Br)=C1Br NO14477 [0,2,0,0,0,0|1,0,0]=3 1499 B9R1.3 FC1=CN=CC(Cl)=C1Br NO17228 [0,2,0,0,0,0|1,0,0]=3 1500 B9R1.3 FC1=CN=CC(Cl)=C1Cl DY656163 [0,2,0,0,0,0|1,0,0]=3 1501 B9R1.3 FC1=CN=CC(F)=C1I DY441029 [0,2,0,0,0,0|1,0,0]=3 1502 B9R1.3 FC1=NC=CC(F)=C1I NO13086 [0,2,0,0,0,0|1,0,0]=3 1503 B9R1.3 FC1=NC=CC(I)=C1F NO21026 [0,2,0,0,0,0|1,0,0]=3 1504 B9R1.3 NC1=C(Br)C(Br)=CC=C1 DY584419 [0,2,0,0,0,0|1,0,0]=3 1505 B9R1.3 NC1=C(Br)C(Cl)=CC=C1 NO12729 [0,2,0,0,0,0|1,0,0]=3 1506 B9R1.3 NC1=C(Br)C(F)=CC=C1 NO22950 [0,2,0,0,0,0|1,0,0]=3 1507 B9R1.3 NC1=C(Br)C=CC=C1Br NO19185 [0,2,0,0,0,0|1,0,0]=3 1508 B9R1.3 NC1=C(Br)C=CC=C1Cl NO17061 [0,2,0,0,0,0|1,0,0]=3 1509 B9R1.3 NC1=C(Br)C=NC=C1Cl NO15062 [0,2,0,0,0,0|0,0,0]=2 1510 B9R1.3 NC1=C(Br)C=NC=C1F NO13180 [0,2,0,0,0,0|0,0,0]=2 1511 B9R1.3 NC1=C(Cl)C(Br)=CN=C1 NO16352 [0,2,0,0,0,0|1,0,0]=3 1512 B9R1.3 NC1=C(Cl)C(Br)=NC=C1 DY563145 [0,2,0,0,0,0|0,0,0]=2 1513 B9R1.3 NC1=C(Cl)C(Cl)=CC=C1 NO15257 [0,2,0,0,0,0|1,0,0]=3 1514 B9R1.3 NC1=C(Cl)C(Cl)=NC=C1 DY534411 [0,2,0,0,0,0|0,0,0]=2 1515 B9R1.3 NC1=C(Cl)C(F)=CC=C1 NO22961 [0,2,0,0,0,0|1,0,0]=3 1516 B9R1.3 NC1=C(Cl)C=CC=C1Cl NO19030 [0,2,0,0,0,0|1,0,0]=3 1517 B9R1.3 NC1=C(Cl)C=CC=C1F NO14207 [0,2,0,0,0,0|1,0,0]=3 1518 B9R1.3 NC1=C(Cl)C=CC=C1I NO21480 [0,2,0,0,0,0|1,0,0]=3 1519 B9R1.3 NC1=C(Cl)C=CN=C1Cl NO21077 [0,2,0,0,0,0|1,0,0]=3 1520 B9R1.3 NC1=C(Cl)C=NC=C1Cl NO17493 [0,2,0,0,0,0|0,0,0]=2 1521 B9R1.3 NC1=C(Cl)N=CN=C1S DY737312 [0,2,0,0,0,0|2,0,0]=4 1522 B9R1.3 NC1=C(F)C(Cl)=CC=C1 NO22203 [0,2,0,0,0,0|1,0,0]=3 1523 B9R1.3 NC1=C(F)C=CC=C1F NO22980 [0,2,0,0,0,0|1,0,0]=3 1524 B9R1.3 NC1=C(F)C=CC=C1I DY577713 [0,2,0,0,0,0|1,0,0]=3 1525 B9R1.3 NC1=C(F)C=NC=C1F NO13656 [0,2,0,0,0,0|0,0,0]=2 1526 B9R1.3 NC1=C(F)C=NC=C1I DY432540 [0,2,0,0,0,0|0,0,0]=2 1527 B9R1.3 NC1=C(I)C(Cl)=CC=C1 NO17354 [0,2,0,0,0,0|1,0,0]=3 1528 B9R1.3 NC1=C(I)C(Cl)=NC=C1 DY20957 [0,2,0,0,0,0|0,0,0]=2 1529 B9R1.3 NC1=C(I)C(F)=CC=C1 DY20040 [0,2,0,0,0,0|1,0,0]=3 1530 B9R1.3 NC1=C(I)C=CN=C1Cl DY655404 [0,2,0,0,0,0|1,0,0]=3 1531 B9R1.3 NC1=C(N)C(=O)NC=N1 NO19859 [0,2,0,0,0,0|1,0,1]=4 1532 B9R1.3 NC1=C(N)C(Br)=CN=C1 NO12576 [0,2,0,0,0,0|0,0,0]=2 1533 B9R1.3 NC1=C(N)C(Cl)=CN=C1 NO12293 [0,2,0,0,0,0|0,0,0]=2 1534 B9R1.3 NC1=C(N)C(Cl)=NC=C1 NO14254 [0,2,0,0,0,0|0,0,0]=2 1535 B9R1.3 NC1=C(N)C(S)=NC=N1 DY584492 [0,2,0,0,0,0|1,0,0]=3 1536 B9R1.3 NC1=C(O)C(Br)=CC=C1 NO14079 [0,2,0,0,0,0|1,0,0]=3 1537 B9R1.3 NC1=C(O)C(Br)=CN=C1 DY113808 [0,2,0,0,0,0|1,0,0]=3 1538 B9R1.3 NC1=C(O)C(Br)=CN=C1 NO14319 [0,2,0,0,0,0|1,0,0]=3 1539 B9R1.3 NC1=C(O)C(Cl)=CC=C1 NO13388 [0,2,0,0,0,0|1,0,0]=3 1540 B9R1.3 NC1=C(O)C(Cl)=NC=C1 DY512913 [0,2,0,0,0,0|0,0,0]=2 1541 B9R1.3 NC1=C(O)C(Cl)=NC=C1 DY608152 [0,2,0,0,0,0|0,0,0]=2 1542 B9R1.3 NC1=C(O)C(F)=CC=C1 NO10703 [0,2,0,0,0,0|1,0,0]=3 1543 B9R1.3 NC1=C(O)C=CC=C1Br NO12191 [0,2,0,0,0,0|1,0,0]=3 1544 B9R1.3 NC1=C(O)C=CC=C1F NO13672 [0,2,0,0,0,0|1,0,0]=3 1545 B9R1.3 NC1=C(O)C=CC=C1I DY584579 [0,2,0,0,0,0|1,0,0]=3 1546 B9R1.3 NC1=C(O)C=CC=C1O NO21312 [0,2,0,0,0,0|1,0,0]=3 1547 B9R1.3 NC1=CC=CC(Br)=C1N NO13189 [0,2,0,0,0,0|1,0,0]=3 1548 B9R1.3 NC1=CC=CC(F)=C1N NO21010 [0,2,0,0,0,0|1,0,0]=3 1549 B9R1.3 NC1=CC=CC(N)=C1O DY793185 [0,2,0,0,0,0|1,0,0]=3 1550 B9R1.3 NC1=CC=CC(O)=C1Br NO15538 [0,2,0,0,0,0|1,0,0]=3 1551 B9R1.3 NC1=CC=CC(O)=C1Cl DY584534 [0,2,0,0,0,0|1,0,0]=3 1552 B9R1.3 NC1=CNC=C(Br)C1=O NO17302 [0,2,0,0,0,0|1,0,1]=4 1553 B9R1.3 NC1=NC=CC(Cl)=C1Br NO15162 [0,2,0,0,0,0|1,0,0]=3 1554 B9R1.3 NC1=NC=CC(Cl)=C1I NO17492 [0,2,0,0,0,0|1,0,0]=3 1555 B9R1.3 NC1=NC=CC(Cl)=C1N DY543909 [0,2,0,0,0,0|1,0,0]=3 1556 B9R1.3 NC1=NC=CC(F)=C1Br NO17383 [0,2,0,0,0,0|1,0,0]=3 1557 B9R1.3 NC1=NC=NC(Cl)=C1Br NO12254 [0,2,0,0,0,0|1,0,0]=3 1558 B9R1.3 NC1=NC=NC(Cl)=C1Cl NO10170 [0,2,0,0,0,0|1,0,0]=3 1559 B9R1.3 NC1=NC=NC(Cl)=C1F NO14511 [0,2,0,0,0,0|1,0,0]=3 1560 B9R1.3 NC1=NC=NC(Cl)=C1N NO19732 [0,2,0,0,0,0|1,0,0]=3 1561 B9R1.3 NC1=NC=NC(Cl)=C1O NO13114 [0,2,0,0,0,0|1,0,0]=3 1562 B9R1.3 O=C1C(Cl)=CNC=C1Cl NO21979 [0,2,0,0,0,0|1,0,1]=4 1563 B9R1.3 O=C1NC=CC(O)=C1Br DY427594 [0,2,0,0,0,0|1,0,1]=4 1564 B9R1.3 O=C1NC=NC(Cl)=C1Br NO12757 [0,2,0,0,0,0|2,0,0]=4 1565 B9R1.3 O=C1NC=NC(O)=C1I NO16916 [0,2,0,0,0,0|2,0,0]=4 1566 B9R1.3 O=C1NN=CC(Br)=C1Br NO19953 [0,2,0,0,0,0|2,0,0]=4 1567 B9R1.3 O=C1NN=CC(Cl)=C1Cl NO22494 [0,2,0,0,0,0|2,0,0]=4 1568 B9R1.3 O=C1NN=CC(O)=C1Cl DY736412 [0,2,0,0,0,0|2,0,0]=4 1569 B9R1.3 OC1=C(Br)C(Cl)=CC=C1 NO21337 [0,2,0,0,0,0|2,0,0]=4 1570 B9R1.3 OC1=C(Br)C=CC=C1Br NO15261 [0,2,0,0,0,0|2,0,0]=4 1571 B9R1.3 OC1=C(Br)C=CC=C1Cl NO15849 [0,2,0,0,0,0|2,0,0]=4 1572 B9R1.3 OC1=C(Br)C=CC=C1F NO22904 [0,2,0,0,0,0|2,0,0]=4 1573 B9R1.3 OC1=C(Br)C=CC=C1I DY441065 [0,2,0,0,0,0|2,0,0]=4 1574 B9R1.3 OC1=C(Cl)C(Br)=CC=C1 NO19373 [0,2,0,0,0,0|2,0,0]=4 1575 B9R1.3 OC1=C(Cl)C(Cl)=CC=C1 NO21020 [0,2,0,0,0,0|2,0,0]=4 1576 B9R1.3 OC1=C(Cl)C(F)=CC=C1 NO21431 [0,2,0,0,0,0|2,0,0]=4 1577 B9R1.3 OC1=C(Cl)C=CC=C1Cl NO21171 [0,2,0,0,0,0|2,0,0]=4 1578 B9R1.3 OC1=C(Cl)C=CC=C1F NO18835 [0,2,0,0,0,0|2,0,0]=4 1579 B9R1.3 OC1=C(Cl)C=CC=C1I DY441025 [0,2,0,0,0,0|2,0,0]=4 1580 B9R1.3 OC1=C(Cl)C=NC=C1Cl NO22692 [0,2,0,0,0,0|1,0,0]=3 1581 B9R1.3 OC1=C(Cl)N=CN=C1Cl NO17140 [0,2,0,0,0,0|2,0,0]=4 1582 B9R1.3 OC1=C(F)C(Cl)=CC=C1 NO22204 [0,2,0,0,0,0|2,0,0]=4 1583 B9R1.3 OC1=C(F)C(F)=CC=C1 NO18870 [0,2,0,0,0,0|2,0,0]=4 1584 B9R1.3 OC1=C(F)C=CC=C1F NO18872 [0,2,0,0,0,0|2,0,0]=4 1585 B9R1.3 OC1=CC=CC(F)=C1O DY20210 [0,2,0,0,0,0|2,0,0]=4 1586 B9R1.3 OC1=CC=CC(O)=C1Br DY443180 [0,2,0,0,0,0|2,0,0]=4 1587 B9R1.3 OC1=CC=CC(O)=C1Cl NO19075 [0,2,0,0,0,0|2,0,0]=4 1588 B9R1.3 OC1=CC=CC(O)=C1F DY433390 [0,2,0,0,0,0|2,0,0]=4 1589 B9R1.3 OC1=CC=CC(O)=C1I DY443433 [0,2,0,0,0,0|2,0,0]=4 1590 B9R1.3 OC1=NC=CC(Br)=C1F DY658213 [0,2,0,0,0,0|1,0,0]=3 1591 B9R1.34 BrC1=CC(Br)=CC(Br)=C1 NO19217 [0,2,0,0,0,0|2,0,0]=4 1592 B9R1.34 BrC1=CC(Br)=NC(Br)=C1 NO21057 [0,2,0,0,0,0|1,0,0]=3 1593 B9R1.34 BrC1=CC(Br)=NC(I)=C1 DY653028 [0,2,0,0,0,0|1,0,0]=3 1594 B9R1.34 CC1=CC(=O)C=C(O)O1 NO16601 [0,2,0,0,0,0|2,0,0]=4 1595 B9R1.34 CC1=CC(=O)NC(N)=N1 NO14276 [0,2,0,0,0,0|2,0,0]=4 1596 B9R1.34 CC1=CC(Br)=CC(C)=N1 NO17464 [0,2,0,0,0,0|1,0,0]=3 1597 B9R1.34 CC1=CC(Br)=CC(Cl)=C1 NO15189 [0,2,0,0,0,0|2,0,0]=4 1598 B9R1.34 CC1=CC(Br)=CC(F)=C1 NO10391 [0,2,0,0,0,0|2,0,0]=4 1599 B9R1.34 CC1=CC(Br)=CC(F)=N1 DY431200 [0,2,0,0,0,0|1,0,0]=3 1600 B9R1.34 CC1=CC(Br)=CC(I)=C1 DY584704 [0,2,0,0,0,0|2,0,0]=4 1601 B9R1.34 CC1=CC(Br)=CC(O)=N1 NO15180 [0,2,0,0,0,0|1,0,0]=3 1602 B9R1.34 CC1=CC(Br)=NC(Br)=C1 NO12414 [0,2,0,0,0,0|1,0,0]=3 1603 B9R1.34 CC1=CC(Br)=NC(C)=C1 NO14545 [0,2,0,0,0,0|1,0,0]=3 1604 B9R1.34 CC1=CC(Br)=NC(N)=N1 NO12756 [0,2,0,0,0,0|2,0,0]=4 1605 B9R1.34 CC1=CC(C)=CC(Br)=C1 NO19140 [0,2,0,0,0,0|2,0,0]=4 1606 B9R1.34 CC1=CC(C)=CC(I)=C1 NO19879 [0,2,0,0,0,0|2,0,0]=4 1607 B9R1.34 CC1=CC(C)=CC(N)=C1 NO19815 [0,2,0,0,0,0|1,0,0]=3 1608 B9R1.34 CC1=CC(C)=NC(Cl)=N1 NO19469 [0,2,0,0,0,0|2,0,0]=4 1609 B9R1.34 CC1=CC(C)=NC(N)=N1 NO19549 [0,2,0,0,0,0|2,0,0]=4 1610 B9R1.34 CC1=CC(C)=NC(O)=N1 NO19523 [0,2,0,0,0,0|2,0,0]=4 1611 B9R1.34 CC1=CC(C)=NC(S)=N1 NO19545 [0,2,0,0,0,0|2,0,0]=4 1612 B9R1.34 CC1=CC(Cl)=CC(C)=N1 NO17490 [0,2,0,0,0,0|1,0,0]=3 1613 B9R1.34 CC1=CC(Cl)=CC(Cl)=C1 NO21779 [0,2,0,0,0,0|2,0,0]=4 1614 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 NO21090 [0,2,0,0,0,0|1,0,0]=3 1615 B9R1.34 CC1=CC(Cl)=CC(F)=C1 DY584320 [0,2,0,0,0,0|2,0,0]=4 1616 B9R1.34 CC1=CC(Cl)=CC(I)=C1 DY584823 [0,2,0,0,0,0|2,0,0]=4 1617 B9R1.34 CC1=CC(Cl)=CC(N)=N1 NO21244 [0,2,0,0,0,0|1,0,0]=3 1618 B9R1.34 CC1=CC(Cl)=NC(C)=C1 NO18953 [0,2,0,0,0,0|1,0,0]=3 1619 B9R1.34 CC1=CC(Cl)=NC(C)=N1 NO19474 [0,2,0,0,0,0|2,0,0]=4 1620 B9R1.34 CC1=CC(Cl)=NC(Cl)=C1 NO21169 [0,2,0,0,0,0|1,0,0]=3 1621 B9R1.34 CC1=CC(Cl)=NC(Cl)=N1 NO21790 [0,2,0,0,0,0|2,0,0]=4 1622 B9R1.34 CC1=CC(Cl)=NC(I)=C1 DY713653 [0,2,0,0,0,0|1,0,0]=3 1623 B9R1.34 CC1=CC(Cl)=NC(N)=N1 NO14995 [0,2,0,0,0,0|2,0,0]=4 1624 B9R1.34 CC1=CC(F)=CC(I)=C1 DY556569 [0,2,0,0,0,0|2,0,0]=4 1625 B9R1.34 CC1=CC(I)=CC(C)=N1 NO15577 [0,2,0,0,0,0|1,0,0]=3 1626 B9R1.34 CC1=CC(N)=CC(Br)=C1 NO12564 [0,2,0,0,0,0|1,0,0]=3 1627 B9R1.34 CC1=CC(N)=CC(F)=C1 NO20369 [0,2,0,0,0,0|1,0,0]=3 1628 B9R1.34 CC1=CC(N)=NC(=O)N1 DY585834 [0,2,0,0,0,0|1,0,1]=4 1629 B9R1.34 CC1=CC(N)=NC(Br)=C1 NO12540 [0,2,0,0,0,0|1,0,0]=3 1630 B9R1.34 CC1=CC(N)=NC(C)=C1 NO19570 [0,2,0,0,0,0|1,0,0]=3 1631 B9R1.34 CC1=CC(N)=NC(C)=N1 NO14489 [0,2,0,0,0,0|1,0,0]=3 1632 B9R1.34 CC1=CC(N)=NC(N)=N1 NO13657 [0,2,0,0,0,0|1,0,0]=3 1633 B9R1.34 CC1=CC(O)=CC(=O)N1 NO15737 [0,2,0,0,0,0|1,0,1]=4 1634 B9R1.34 CC1=CC(O)=CC(=O)O1 NO15586 [0,2,0,0,0,0|2,0,0]=4 1635 B9R1.34 CC1=CC(O)=CC(Br)=C1 NO17351 [0,2,0,0,0,0|2,0,0]=4 1636 B9R1.34 CC1=CC(O)=CC(Cl)=C1 NO22228 [0,2,0,0,0,0|2,0,0]=4 1637 B9R1.34 CC1=CC(O)=CC(I)=N1 DY716678 [0,2,0,0,0,0|1,0,0]=3 1638 B9R1.34 CC1=CC(O)=CC(N)=C1 NO22082 [0,2,0,0,0,0|1,0,0]=3 1639 B9R1.34 CC1=CC(O)=CC(O)=C1 NO19696 [0,2,0,0,0,0|2,0,0]=4 1640 B9R1.34 CC1=CC(O)=CC(O)=N1 NO21109 [0,2,0,0,0,0|1,0,0]=3 1641 B9R1.34 CC1=CC(O)=NC(C)=C1 NO18772 [0,2,0,0,0,0|1,0,0]=3 1642 B9R1.34 CC1=NC(Cl)=CC(Cl)=N1 DY10399 [0,2,0,0,0,0|2,0,0]=4 1643 B9R1.34 CC1=NC(Cl)=CC(O)=N1 DY431944 [0,2,0,0,0,0|2,0,0]=4 1644 B9R1.34 CC1=NC(I)=CC(I)=N1 NO19730 [0,2,0,0,0,0|2,0,0]=4 1645 B9R1.34 CC1=NC(I)=CC(N)=N1 NO15438 [0,2,0,0,0,0|1,0,0]=3 1646 B9R1.34 CC1=NC(N)=NC(O)=N1 NO16289 [0,2,0,0,0,0|2,0,0]=4 1647 B9R1.34 CC1=NC(O)=CC(O)=N1 NO17927 [0,2,0,0,0,0|2,0,0]=4 1648 B9R1.34 Cc1cc(C)cc(F)c1 NO10870 [0,2,0,0,0,0|2,0,0]=4 1649 B9R1.34 ClC1=CC(Br)=CC(Br)=C1 NO18744 [0,2,0,0,0,0|2,0,0]=4 1650 B9R1.34 ClC1=CC(Br)=NC(Br)=C1 NO16235 [0,2,0,0,0,0|1,0,0]=3 1651 B9R1.34 ClC1=CC(Br)=NC(Cl)=N1 DY585278 [0,2,0,0,0,0|2,0,0]=4 1652 B9R1.34 ClC1=CC(Cl)=CC(Br)=C1 DY20178 [0,2,0,0,0,0|2,0,0]=4 1653 B9R1.34 ClC1=CC(Cl)=NC(Br)=N1 DY585277 [0,2,0,0,0,0|2,0,0]=4 1654 B9R1.34 ClC1=CC(Cl)=NC(Cl)=C1 NO20815 [0,2,0,0,0,0|1,0,0]=3 1655 B9R1.34 ClC1=CC(I)=CC(Br)=C1 NO20648 [0,2,0,0,0,0|2,0,0]=4 1656 B9R1.34 ClC1=CC(I)=CC(Cl)=N1 NO20816 [0,2,0,0,0,0|1,0,0]=3 1657 B9R1.34 FC1=CC(Br)=NC(Br)=C1 NO17986 [0,2,0,0,0,0|1,0,0]=3 1658 B9R1.34 FC1=CC(Cl)=NC(F)=C1 DY655356 [0,2,0,0,0,0|1,0,0]=3 1659 B9R1.34 FC1=CC(F)=CC(F)=C1 DY20002 [0,2,0,0,0,0|2,0,0]=4 1660 B9R1.34 FC1=CC(F)=NC(F)=N1 NO19268 [0,2,0,0,0,0|2,0,0]=4 1661 B9R1.34 FC1=CC(I)=CC(Br)=C1 NO22851 [0,2,0,0,0,0|2,0,0]=4 1662 B9R1.34 FC1=NC(Cl)=CC(Cl)=N1 NO17865 [0,2,0,0,0,0|2,0,0]=4 1663 B9R1.34 NC1=CC(=O)N=C(N)N1 NO16285 [0,2,0,0,0,0|1,0,0]=3 1664 B9R1.34 NC1=CC(=O)NC(=O)N1 NO22590 [0,2,0,0,0,0|1,0,1]=4 1665 B9R1.34 NC1=CC(=O)NC(=S)N1 NO15528 [0,2,0,0,0,0|1,0,1]=4 1666 B9R1.34 NC1=CC(=O)NC(Cl)=N1 DY558339 [0,2,0,0,0,0|1,0,1]=4 1667 B9R1.34 NC1=CC(Br)=CC(Cl)=C1 NO22156 [0,2,0,0,0,0|1,0,0]=3 1668 B9R1.34 NC1=CC(Br)=CC(F)=C1 NO10197 [0,2,0,0,0,0|1,0,0]=3 1669 B9R1.34 NC1=CC(Br)=NC(Br)=C1 NO12790 [0,2,0,0,0,0|0,0,0]=2 1670 B9R1.34 NC1=CC(Cl)=CC(Cl)=C1 NO21981 [0,2,0,0,0,0|1,0,0]=3 1671 B9R1.34 NC1=CC(Cl)=CC(F)=C1 NO22964 [0,2,0,0,0,0|1,0,0]=3 1672 B9R1.34 NC1=CC(Cl)=NC(Cl)=C1 NO17484 [0,2,0,0,0,0|0,0,0]=2 1673 B9R1.34 NC1=CC(F)=CC(F)=C1 NO22981 [0,2,0,0,0,0|1,0,0]=3 1674 B9R1.34 NC1=CC(F)=CC(I)=C1 NO22290 [0,2,0,0,0,0|1,0,0]=3 1675 B9R1.34 NC1=CC(N)=CC(N)=C1 DY433335 [0,2,0,0,0,0|1,0,0]=3 1676 B9R1.34 NC1=CC(N)=NC(N)=N1 NO22611 [0,2,0,0,0,0|1,0,0]=3 1677 B9R1.34 NC1=CC(N)=NC(S)=N1 DY20388 [0,2,0,0,0,0|1,0,0]=3 1678 B9R1.34 NC1=CC(O)=NC(Br)=C1 DY658117 [0,2,0,0,0,0|0,0,0]=2 1679 B9R1.34 NC1=CC(O)=NC(O)=C1 DY658147 [0,2,0,0,0,0|0,0,0]=2 1680 B9R1.34 NC1=CC(O)=NC(S)=N1 NO16153 [0,2,0,0,0,0|1,0,0]=3 1681 B9R1.34 NC1=NC(Br)=CC(Br)=N1 NO21236 [0,2,0,0,0,0|2,0,0]=4 1682 B9R1.34 NC1=NC(Cl)=CC(=O)N1 NO12189 [0,2,0,0,0,0|2,0,0]=4 1683 B9R1.34 NC1=NC(Cl)=CC(Cl)=C1 NO17487 [0,2,0,0,0,0|1,0,0]=3 1684 B9R1.34 NC1=NC(Cl)=CC(F)=C1 DY661019 [0,2,0,0,0,0|1,0,0]=3 1685 B9R1.34 NC1=NC(Cl)=NC(Cl)=C1 NO15446 [0,2,0,0,0,0|1,0,0]=3 1686 B9R1.34 NC1=NC(N)=NC(Cl)=C1 NO21994 [0,2,0,0,0,0|1,0,0]=3 1687 B9R1.34 NC1=NC(O)=CC(O)=N1 NO22589 [0,2,0,0,0,0|2,0,0]=4 1688 B9R1.34 OC1=CC(Br)=CC(Br)=C1 NO15360 [0,2,0,0,0,0|2,0,0]=4 1689 B9R1.34 OC1=CC(Br)=CC(Cl)=C1 NO22155 [0,2,0,0,0,0|2,0,0]=4 1690 B9R1.34 OC1=CC(Br)=CC(F)=C1 NO19926 [0,2,0,0,0,0|2,0,0]=4 1691 B9R1.34 OC1=CC(Cl)=CC(Cl)=C1 NO19171 [0,2,0,0,0,0|2,0,0]=4 1692 B9R1.34 OC1=CC(Cl)=CC(O)=N1 DY658493 [0,2,0,0,0,0|1,0,0]=3 1693 B9R1.34 OC1=CC(F)=CC(F)=C1 NO22928 [0,2,0,0,0,0|2,0,0]=4 1694 B9R1.34 OC1=CC(O)=CC(O)=C1 DY34268 [0,2,0,0,0,0|2,0,0]=4 1695 B9R1.34 OC1=CC(O)=CC(O)=C1 NO19697 [0,2,0,0,0,0|2,0,0]=4 1696 B9R1.34 OC1=CC(O)=NC(O)=N1 NO16734 [0,2,0,0,0,0|2,0,0]=4 1697 B9R1.34 OC1=CC(O)=NC(S)=N1 NO14575 [0,2,0,0,0,0|2,0,0]=4 1698 B9R1.34 SC1=CC(Cl)=CC(Cl)=C1 DY584547 [0,2,0,0,0,0|2,0,0]=4 1699 B9R2.50 C1=CC=C2CCC2=C1 NO19267 [0,1,0,1,0,0|2,0,0]=4 1700 B5R1.1 C1=CNC=C1 DY20798 [1,0,0,0,1,0|0,0,1]=3 1701 B5R1.1 C1=CNC=N1 DY725677 [1,0,0,0,1,0|1,0,0]=3 1702 B5R1.1 C1=CNC=N1 NO19767 [1,0,0,0,1,0|1,0,0]=3 1703 B5R1.1 C1=CNN=C1 NO18933 [1,0,0,0,1,0|1,0,0]=3 1704 B5R1.1 C1=CNN=N1 DY793779 [1,0,0,0,1,0|2,0,0]=4 1705 B5R1.1 C1=COC=N1 DY546507 [1,0,0,0,1,0|1,0,0]=3 1706 B5R1.1 C1=CON=C1 DY20462 [1,0,0,0,1,0|1,0,0]=3 1707 B5R1.1 C1=CSN=C1 DY20995 [1,0,0,0,1,0|1,0,0]=3 1708 B5R1.1 C1=C[CH-]C=C1 DY21078 [1,0,0,0,1,0|0,0,1]=3 1709 B5R1.1 C1=NC=NN1 NO19896 [1,0,0,0,1,0|2,0,0]=4