0 B9R1.15 BrCC1=C(Br)C=CC=C1 DY20808 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.15 BrCC1=C(Br)C=NC=C1 DY656944 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.15 BrCC1=C(I)C=CC=C1 DY40561 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.15 C#CC1=C(Cl)C=CC=C1 NO20629 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.15 C#CC1=C(N)C=CC=C1 NO21537 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.15 C#CC1=C(O)C=CC=C1 NO21538 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.15 C=CC1=C(Br)C=CC=C1 NO18853 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.15 C=CC1=C(Cl)C=CC=C1 NO19873 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.15 CC1=C(CBr)C=CC=C1 NO14791 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.15 CC1=C(CBr)C=NC=C1 DY656650 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.15 CC1=C(CBr)C=NC=C1 NO17496 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.15 CC1=C(CN)C=NC=C1 NO20204 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.15 CC1=C(NN)C=CC=C1 DY788973 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.15 CC1=C(NN)C=CC=C1 NO19575 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.15 CC1=CC=CC=C1C=O NO19114 [0,0,0,0,0,0|2,0,0]=2 15 B9R1.15 CC1=CC=CN=C1C#N NO20234 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.15 CC1=CC=CN=C1C=O NO14987 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.15 CC1=CC=CN=C1CCl NO15725 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.15 CC1=CC=CN=C1CO NO19225 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.15 CC1=CC=NC=C1C#N NO22253 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.15 CC1=NC=CC=C1CBr DY520989 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.15 CC1=NC=CC=C1CO NO20145 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.15 CCC1=C(Br)C=CC=C1 NO20980 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.15 CCC1=C(C)C=CC=C1 NO21536 [0,0,0,0,0,0|1,0,0]=1 24 B9R1.15 CCC1=C(I)C=CC=C1 DY534201 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.15 CCC1=C(N)C=NC=C1 DY658535 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.15 CCC1=CC=CN=C1C DY522489 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.15 CCC1=CN=CN=C1Cl DY559413 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.15 CCC1=NC=CN=C1Cl NO21430 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.15 CCC1=NC=NC=C1F NO19573 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.15 CN1C=CC=C\C1=N\N DY586632 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.15 CNC1=C(Br)C=CC=C1 DY584260 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.15 CNC1=C(F)C=CC=C1 NO13895 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.15 CNC1=C(N)C=NC=C1 DY10330 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.15 CNC1=CC=CC=C1N NO22302 [0,0,0,0,0,0|2,0,0]=2 35 B9R1.15 CNC1=NC=CC=C1Br NO17281 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.15 COC1=C(Br)C=CC=C1 NO19150 [0,0,0,0,0,0|1,0,0]=1 37 B9R1.15 COC1=C(Br)C=CN=C1 NO14715 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.15 COC1=C(Br)C=NC=C1 NO18491 [0,0,0,0,0,0|2,0,0]=2 39 B9R1.15 COC1=C(C)C=CC=C1 DY561483 [0,0,0,0,0,0|0,0,0]=0 40 B9R1.15 COC1=C(Cl)C=CN=C1 DY442708 [0,0,0,0,0,0|2,0,0]=2 41 B9R1.15 COC1=C(F)C=CC=C1 NO19904 [0,0,0,0,0,0|1,0,0]=1 42 B9R1.15 COC1=C(F)C=NC=C1 NO16194 [0,0,0,0,0,0|2,0,0]=2 43 B9R1.15 COC1=C(I)C=NC=C1 NO18542 [0,0,0,0,0,0|2,0,0]=2 44 B9R1.15 COC1=C(N)C=CC=C1 NO11812 [0,0,0,0,0,0|1,0,0]=1 45 B9R1.15 COC1=C(N)C=CN=C1 NO22564 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.15 COC1=C(N)C=NC=C1 NO18248 [0,0,0,0,0,0|2,0,0]=2 47 B9R1.15 COC1=C(O)C=NC=C1 DY586059 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.15 COC1=CC=CN=C1Br NO19255 [0,0,0,0,0,0|2,0,0]=2 49 B9R1.15 COC1=CC=CN=C1Cl NO19305 [0,0,0,0,0,0|2,0,0]=2 50 B9R1.15 COC1=CC=CN=C1F NO13044 [0,0,0,0,0,0|2,0,0]=2 51 B9R1.15 COC1=CC=CN=C1N NO17216 [0,0,0,0,0,0|2,0,0]=2 52 B9R1.15 COC1=CN=CN=C1Br NO17880 [0,0,0,0,0,0|3,0,0]=3 53 B9R1.15 COC1=CN=CN=C1N NO13116 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.15 COC1=NC=CC=C1Br DY715700 [0,0,0,0,0,0|2,0,0]=2 55 B9R1.15 COC1=NC=CC=C1Br NO19258 [0,0,0,0,0,0|2,0,0]=2 56 B9R1.15 COC1=NC=CC=C1Cl NO18705 [0,0,0,0,0,0|2,0,0]=2 57 B9R1.15 COC1=NC=CC=C1F NO19564 [0,0,0,0,0,0|2,0,0]=2 58 B9R1.15 COC1=NC=CC=C1I NO13512 [0,0,0,0,0,0|2,0,0]=2 59 B9R1.15 COC1=NC=CC=C1N NO19526 [0,0,0,0,0,0|2,0,0]=2 60 B9R1.15 COC1=NC=CN=C1Br NO12288 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.15 COC1=NC=CN=C1Cl NO14291 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.15 COC1=NC=CN=C1N DY441119 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.15 CSC1=CC=CN=C1Cl DY452032 [0,0,0,0,0,0|2,1,0]=3 64 B9R1.15 ClC1=C(CBr)C=CC=C1 NO19190 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.15 ClC1=CC=CN=C1CBr DY116292 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.15 ClCC1=C(Br)C=CC=C1 DY584533 [0,0,0,0,0,0|3,0,0]=3 67 B9R1.15 ClCC1=C(Cl)C=CC=C1 NO19964 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.15 ClCC1=NC=CC=C1Br DY656902 [0,0,0,0,0,0|4,0,0]=4 69 B9R1.15 FC1=C(CBr)C=CC=C1 NO21562 [0,0,0,0,0,0|3,0,0]=3 70 B9R1.15 N#CC1=C(Br)C=CC=C1 DY20182 [0,0,0,0,0,0|3,0,0]=3 71 B9R1.15 N#CC1=C(Br)C=NC=C1 NO13671 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.15 N#CC1=C(Cl)C=NC=C1 NO15593 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.15 N#CC1=C(Cl)N=CC=C1 NO18689 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.15 N#CC1=C(F)C=CC=C1 NO18285 [0,0,0,0,0,0|3,0,0]=3 75 B9R1.15 N#CC1=C(I)C=CC=C1 NO21883 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.15 N#CC1=C(N)C=CC=C1 NO13393 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.15 N#CC1=C(N)C=NC=C1 NO15948 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.15 N#CC1=C(O)C=CC=C1 NO19191 [0,0,0,0,0,0|3,0,0]=3 79 B9R1.15 N#CC1=CC=CN=C1Br NO14990 [0,0,0,0,0,0|4,0,0]=4 80 B9R1.15 N#CC1=CC=CN=C1N NO22990 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.15 N#CC1=CC=CN=C1O NO13920 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.15 N#CC1=CN=CC=C1Br NO13752 [0,0,0,0,0,0|4,0,0]=4 83 B9R1.15 N#CC1=CN=CC=C1Cl NO16226 [0,0,0,0,0,0|4,0,0]=4 84 B9R1.15 N#CC1=NC=CC=C1Br NO14847 [0,0,0,0,0,0|4,0,0]=4 85 B9R1.15 N#CC1=NC=CC=C1Cl NO18276 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.15 N#CC1=NC=CC=C1I NO12161 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.15 N#CC1=NC=CC=C1O NO21861 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.15 NC1=C(C=O)C=CC=C1 DY20756 [0,0,0,0,0,0|3,0,0]=3 89 B9R1.15 NC1=C(C=O)C=CC=N1 NO19340 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.15 NC1=C(C=O)C=CN=C1 NO14976 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.15 NC1=C(CO)C=CC=C1 NO19122 [0,0,0,0,0,0|3,0,0]=3 92 B9R1.15 NC1=CC=NC=C1C=O DY509936 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.15 NC1=CC=NC=C1C=O NO19349 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.15 NC1=NC=CC=C1CO NO13983 [0,0,0,0,0,0|4,0,0]=4 95 B9R1.15 NCC1=C(Br)C=CC=C1 NO19534 [0,0,0,0,0,0|3,0,0]=3 96 B9R1.15 NCC1=C(Br)C=CN=C1 DY651253 [0,0,0,0,0,0|4,0,0]=4 97 B9R1.15 NCC1=C(Br)C=NC=C1 NO17629 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.15 NCC1=C(F)C=CC=C1 DY40826 [0,0,0,0,0,0|3,0,0]=3 99 B9R1.15 NCC1=C(N)C=CC=C1 DY40796 [0,0,0,0,0,0|3,0,0]=3 100 B9R1.15 NCC1=C(N)C=NC=C1 DY574167 [0,0,0,0,0,0|4,0,0]=4 101 B9R1.15 NCC1=C(O)C=CC=C1 NO20889 [0,0,0,0,0,0|3,0,0]=3 102 B9R1.15 NCC1=C(O)C=CN=C1 DY656620 [0,0,0,0,0,0|4,0,0]=4 103 B9R1.15 NCC1=CC=CN=C1F DY538641 [0,0,0,0,0,0|4,0,0]=4 104 B9R1.15 NCC1=NC=CC=C1Br DY713191 [0,0,0,0,0,0|4,0,0]=4 105 B9R1.15 NCC1=NC=CC=C1N DY654384 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.15 NNC1=C(Br)C=CC=C1 NO19466 [0,0,0,0,0,0|3,0,0]=3 107 B9R1.15 NNC1=C(Cl)C=CC=C1 NO19478 [0,0,0,0,0,0|3,0,0]=3 108 B9R1.15 NNC1=C(F)C=CC=C1 NO23033 [0,0,0,0,0,0|3,0,0]=3 109 B9R1.15 NNC1=CC=CN=C1Br DY715022 [0,0,0,0,0,0|4,0,0]=4 110 B9R1.15 NNC1=NC=CC=C1Cl NO20171 [0,0,0,0,0,0|4,0,0]=4 111 B9R1.15 O=CC1=C(Br)N=CC=C1 NO17915 [0,0,0,0,0,0|4,0,0]=4 112 B9R1.15 O=CC1=C(Cl)C=NC=C1 DY657198 [0,0,0,0,0,0|4,0,0]=4 113 B9R1.15 O=CC1=C(Cl)C=NC=C1 NO15780 [0,0,0,0,0,0|4,0,0]=4 114 B9R1.15 O=CC1=C(Cl)N=CC=C1 NO14208 [0,0,0,0,0,0|4,0,0]=4 115 B9R1.15 O=CC1=C(F)C=CC=C1 DY794301 [0,0,0,0,0,0|3,0,0]=3 116 B9R1.15 O=CC1=C(F)C=CC=C1 NO21560 [0,0,0,0,0,0|3,0,0]=3 117 B9R1.15 O=CC1=C(F)C=CN=C1 DY577299 [0,0,0,0,0,0|4,0,0]=4 118 B9R1.15 O=CC1=C(F)N=CC=C1 NO18263 [0,0,0,0,0,0|4,0,0]=4 119 B9R1.15 O=CC1=C(I)C=CC=C1 NO20131 [0,0,0,0,0,0|3,0,0]=3 120 B9R1.15 O=CC1=C(O)C=CC=C1 DY41121 [0,0,0,0,0,0|3,0,0]=3 121 B9R1.15 O=CC1=C(O)C=NC=C1 NO13859 [0,0,0,0,0,0|4,0,0]=4 122 B9R1.15 O=CC1=C(O)N=CC=C1 NO19011 [0,0,0,0,0,0|4,0,0]=4 123 B9R1.15 O=CC1=CNC=CC1=O NO17898 [0,0,0,0,0,0|4,0,0]=4 124 B9R1.15 OCC1=C(Br)C=CC=C1 NO18828 [0,0,0,0,0,0|3,0,0]=3 125 B9R1.15 OCC1=C(Br)C=NC=C1 NO12881 [0,0,0,0,0,0|4,0,0]=4 126 B9R1.15 OCC1=C(Cl)C=CC=C1 NO21494 [0,0,0,0,0,0|3,0,0]=3 127 B9R1.15 OCC1=C(Cl)C=CN=C1 NO17105 [0,0,0,0,0,0|4,0,0]=4 128 B9R1.15 OCC1=C(F)C=NC=C1 DY452008 [0,0,0,0,0,0|4,0,0]=4 129 B9R1.15 OCC1=C(I)C=CC=C1 NO19102 [0,0,0,0,0,0|3,0,0]=3 130 B9R1.15 OCC1=C(O)C=CC=C1 NO16243 [0,0,0,0,0,0|3,0,0]=3 131 B9R1.15 OCC1=CC=CN=C1Cl NO14328 [0,0,0,0,0,0|4,0,0]=4 132 B9R1.15 OCC1=CC=CN=C1F NO18697 [0,0,0,0,0,0|4,0,0]=4 133 B9R1.15 OCC1=NC=CC=C1Cl NO17318 [0,0,0,0,0,0|4,0,0]=4 134 B9R1.15 OCC1=NC=CC=C1O DY20200 [0,0,0,0,0,0|4,0,0]=4 135 B8R1.2 BrCC1=CC=NC=C1 NO22459 [1,0,0,0,0,0|3,0,0]=4 136 B8R1.2 C#CC1=CC=CC=C1 NO19127 [1,0,0,0,0,0|1,0,1]=3 137 B8R1.2 C#CC1=CC=NC=C1 DY544323 [1,0,0,0,0,0|2,0,1]=4 138 B8R1.2 C#CC1=NC=CC=C1 NO21539 [1,0,0,0,0,0|2,0,1]=4 139 B8R1.2 C=CC1=CC=CN=C1 DY507011 [1,0,0,0,0,0|2,0,1]=4 140 B8R1.2 CCC1=CC=CN=C1 NO22277 [1,0,0,0,0,0|2,0,0]=3 141 B8R1.2 CCC1=NC=CN=C1 NO21534 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.2 CNC1=CC=CC=C1 NO11792 [1,0,0,0,0,0|1,0,0]=2 143 B8R1.2 CNC1=CC=CN=C1 NO13856 [1,0,0,0,0,0|2,0,0]=3 144 B8R1.2 CNC1=CN=CN=C1 DY553401 [1,0,0,0,0,0|3,0,0]=4 145 B8R1.2 COC1=CC=CN=C1 NO22348 [1,0,0,0,0,0|1,0,0]=2 146 B8R1.2 COC1=CC=CN=N1 NO22347 [1,0,0,0,0,0|2,0,0]=3 147 B8R1.2 COC1=CC=NC=C1 NO19206 [1,0,0,0,0,0|1,0,0]=2 148 B8R1.2 COC1=CC=[C-]C=C1 DY747109 [1,0,0,0,0,0|0,0,1]=2 149 B8R1.2 COC1=NC=CC=C1 NO18780 [1,0,0,0,0,0|1,0,0]=2 150 B8R1.2 COC1=NC=CN=C1 NO17887 [1,0,0,0,0,0|2,0,0]=3 151 B8R1.2 CSC1=NC=CC=N1 DY573207 [1,0,0,0,0,0|2,1,0]=4 152 B8R1.2 CSC1=NC=CN=C1 DY541389 [1,0,0,0,0,0|2,1,0]=4 153 B8R1.2 ClCC1=CC=CN=C1 NO19291 [1,0,0,0,0,0|3,0,0]=4 154 B8R1.2 ClCC1=NC=CC=C1 NO19289 [1,0,0,0,0,0|3,0,0]=4 155 B8R1.2 ClSC1=CC=CC=C1 DY799077 [1,0,0,0,0,0|1,1,0]=3 156 B8R1.2 ICC1=CC=CC=C1 NO11000 [1,0,0,0,0,0|2,0,0]=3 157 B8R1.2 N#CC1=CN=CC=C1 NO22263 [1,0,0,0,0,0|3,0,0]=4 158 B8R1.2 N#CC1=NC=CC=C1 NO19642 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.2 N#Cc1ccccc1 NO13696 [1,0,0,0,0,0|2,0,0]=3 160 B8R1.2 NCC1=CC=CN=C1 NO14226 [1,0,0,0,0,0|3,0,0]=4 161 B8R1.2 NCC1=CC=NC=C1 NO11906 [1,0,0,0,0,0|3,0,0]=4 162 B8R1.2 NCC1=CC=NC=C1 NO19023 [1,0,0,0,0,0|3,0,0]=4 163 B8R1.2 NCC1=NC=CC=C1 DY663911 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.2 NNC1=CC=CC=C1 NO15210 [1,0,0,0,0,0|2,0,0]=3 165 B8R1.2 NNC1=CC=CN=C1 NO15491 [1,0,0,0,0,0|3,0,0]=4 166 B8R1.2 NNC1=CC=CN=C1 NO22308 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.2 NNC1=CC=NC=C1 DY20777 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.2 NNC1=NC=CC=C1 NO15589 [1,0,0,0,0,0|3,0,0]=4 169 B8R1.2 NNC1=NC=CC=C1 NO21573 [1,0,0,0,0,0|3,0,0]=4 170 B8R1.2 O=CC1=CC=NC=C1 DY458075 [1,0,0,0,0,0|3,0,0]=4 171 B8R1.2 O=CC1=CN=CC=C1 NO19090 [1,0,0,0,0,0|3,0,0]=4 172 B8R1.2 O=CC1=NC=CC=C1 NO18610 [1,0,0,0,0,0|3,0,0]=4 173 B8R1.2 OCC1=CC=CN=C1 NO22409 [1,0,0,0,0,0|3,0,0]=4 174 B8R1.2 OCC1=CC=NC=C1 NO19163 [1,0,0,0,0,0|3,0,0]=4 175 B8R1.2 OCC1=NC=CC=C1 NO19164 [1,0,0,0,0,0|3,0,0]=4 176 B8R1.5 BrC1=C(Br)C=NC=C1 NO13628 [1,0,0,0,0,0|3,0,0]=4 177 B8R1.5 BrC1=C(I)C=CC=C1 NO19157 [1,0,0,0,0,0|2,0,0]=3 178 B8R1.5 BrC1=CC=CN=C1Br NO22670 [1,0,0,0,0,0|3,0,0]=4 179 B8R1.5 BrC1=NC=CC=C1I DY110926 [1,0,0,0,0,0|3,0,0]=4 180 B8R1.5 CC1=C(Br)C=CC=C1 DY20187 [1,0,0,0,0,0|1,0,0]=2 181 B8R1.5 CC1=C(Br)C=CN=C1 NO13416 [1,0,0,0,0,0|2,0,0]=3 182 B8R1.5 CC1=C(Br)C=NC=C1 NO21916 [1,0,0,0,0,0|2,0,0]=3 183 B8R1.5 CC1=C(Cl)C=CN=C1 DY460902 [1,0,0,0,0,0|2,0,0]=3 184 B8R1.5 CC1=C(Cl)C=CN=C1 NO18038 [1,0,0,0,0,0|2,0,0]=3 185 B8R1.5 CC1=C(Cl)C=NC=C1 NO15751 [1,0,0,0,0,0|2,0,0]=3 186 B8R1.5 CC1=C(F)C=CC=C1 DY41519 [1,0,0,0,0,0|1,0,0]=2 187 B8R1.5 CC1=C(F)C=NC=C1 NO19332 [1,0,0,0,0,0|2,0,0]=3 188 B8R1.5 CC1=C(I)C=CC=C1 NO19198 [1,0,0,0,0,0|1,0,0]=2 189 B8R1.5 CC1=C(N)C=CN=C1 NO19521 [1,0,0,0,0,0|2,0,0]=3 190 B8R1.5 CC1=C(N)C=NC=C1 NO21907 [1,0,0,0,0,0|2,0,0]=3 191 B8R1.5 CC1=C(O)C=CN=C1 NO13965 [1,0,0,0,0,0|1,0,0]=2 192 B8R1.5 CC1=CC=CC=C1C DY41549 [1,0,0,0,0,0|0,0,0]=1 193 B8R1.5 CC1=CC=CC=C1N NO20592 [1,0,0,0,0,0|1,0,0]=2 194 B8R1.5 CC1=CC=CC=C1O NO11813 [1,0,0,0,0,0|0,0,0]=1 195 B8R1.5 CC1=CC=CN=C1Br NO23002 [1,0,0,0,0,0|2,0,0]=3 196 B8R1.5 CC1=CC=CN=C1C NO21050 [1,0,0,0,0,0|1,0,0]=2 197 B8R1.5 CC1=CC=CN=C1Cl NO13857 [1,0,0,0,0,0|2,0,0]=3 198 B8R1.5 CC1=CC=CN=C1F NO19328 [1,0,0,0,0,0|2,0,0]=3 199 B8R1.5 CC1=CC=CN=C1N NO13775 [1,0,0,0,0,0|2,0,0]=3 200 B8R1.5 CC1=CN=CN=C1Br NO12572 [1,0,0,0,0,0|3,0,0]=4 201 B8R1.5 CC1=CN=CN=C1Cl NO19938 [1,0,0,0,0,0|3,0,0]=4 202 B8R1.5 CC1=CN=CN=C1N NO12501 [1,0,0,0,0,0|3,0,0]=4 203 B8R1.5 CC1=CN=CN=C1O NO10459 [1,0,0,0,0,0|2,0,0]=3 204 B8R1.5 CC1=CNC=CC1=O DY502725 [1,0,0,0,0,0|1,0,1]=3 205 B8R1.5 CC1=NC=CC=C1Br DY20012 [1,0,0,0,0,0|2,0,0]=3 206 B8R1.5 CC1=NC=CC=C1F NO19850 [1,0,0,0,0,0|2,0,0]=3 207 B8R1.5 CC1=NC=CC=C1N NO19518 [1,0,0,0,0,0|2,0,0]=3 208 B8R1.5 CC1=NC=CN=C1Br NO12416 [1,0,0,0,0,0|3,0,0]=4 209 B8R1.5 CC1=NC=CN=C1C NO10108 [1,0,0,0,0,0|2,0,0]=3 210 B8R1.5 CC1=NC=CN=C1Cl NO17680 [1,0,0,0,0,0|3,0,0]=4 211 B8R1.5 CC1=NC=CN=C1N NO21232 [1,0,0,0,0,0|3,0,0]=4 212 B8R1.5 CC1=NC=CN=C1O NO21577 [1,0,0,0,0,0|2,0,0]=3 213 B8R1.5 CC1=NC=NC=C1Br NO11920 [1,0,0,0,0,0|3,0,0]=4 214 B8R1.5 CC1=NC=NC=C1I NO12766 [1,0,0,0,0,0|3,0,0]=4 215 B8R1.5 CC1=NC=NC=C1N NO19908 [1,0,0,0,0,0|3,0,0]=4 216 B8R1.5 CN1N=CC=CC1=O DY736910 [1,0,0,0,0,0|2,0,1]=4 217 B8R1.5 C[N+]1=C(Cl)C=CC=C1 NO19467 [1,0,0,0,0,0|2,0,0]=3 218 B8R1.5 ClC1=C(Br)C=CC=C1 NO21391 [1,0,0,0,0,0|2,0,0]=3 219 B8R1.5 ClC1=C(Br)C=CN=C1 NO15809 [1,0,0,0,0,0|3,0,0]=4 220 B8R1.5 ClC1=C(Cl)C=NC=C1 NO14992 [1,0,0,0,0,0|3,0,0]=4 221 B8R1.5 ClC1=C(I)C=CN=C1 NO17639 [1,0,0,0,0,0|3,0,0]=4 222 B8R1.5 ClC1=C(I)C=CN=C1 NO19993 [1,0,0,0,0,0|3,0,0]=4 223 B8R1.5 ClC1=C(I)C=NC=C1 NO17640 [1,0,0,0,0,0|3,0,0]=4 224 B8R1.5 ClC1=CC=CN=C1Br NO17272 [1,0,0,0,0,0|3,0,0]=4 225 B8R1.5 ClC1=CC=CN=C1Cl NO13373 [1,0,0,0,0,0|3,0,0]=4 226 B8R1.5 ClC1=NC=CC=C1Br NO22671 [1,0,0,0,0,0|3,0,0]=4 227 B8R1.5 ClC1=NC=CC=C1I NO22694 [1,0,0,0,0,0|3,0,0]=4 228 B8R1.5 FC1=C(Br)C=CC=C1 NO19658 [1,0,0,0,0,0|2,0,0]=3 229 B8R1.5 FC1=C(Br)C=NC=C1 NO13534 [1,0,0,0,0,0|3,0,0]=4 230 B8R1.5 FC1=C(Cl)C=CN=C1 DY658401 [1,0,0,0,0,0|3,0,0]=4 231 B8R1.5 FC1=C(F)C=CC=C1 NO20490 [1,0,0,0,0,0|2,0,0]=3 232 B8R1.5 FC1=C(I)C=CN=C1 NO18172 [1,0,0,0,0,0|3,0,0]=4 233 B8R1.5 FC1=CC=CN=C1Br NO14296 [1,0,0,0,0,0|3,0,0]=4 234 B8R1.5 FC1=CC=CN=C1Cl NO17308 [1,0,0,0,0,0|3,0,0]=4 235 B8R1.5 FC1=CC=CN=C1F NO18753 [1,0,0,0,0,0|3,0,0]=4 236 B8R1.5 FC1=NC=CC=C1Br NO14198 [1,0,0,0,0,0|3,0,0]=4 237 B8R1.5 FC1=NC=CC=C1Cl NO18743 [1,0,0,0,0,0|3,0,0]=4 238 B8R1.5 FC1=NC=CC=C1I NO21866 [1,0,0,0,0,0|3,0,0]=4 239 B8R1.5 NC1=C(Br)C=CC=C1 NO19197 [1,0,0,0,0,0|2,0,0]=3 240 B8R1.5 NC1=C(Br)C=CN=C1 NO13987 [1,0,0,0,0,0|3,0,0]=4 241 B8R1.5 NC1=C(Br)C=NC=C1 NO21968 [1,0,0,0,0,0|3,0,0]=4 242 B8R1.5 NC1=C(Cl)C=CN=C1 NO22737 [1,0,0,0,0,0|3,0,0]=4 243 B8R1.5 NC1=C(Cl)C=NC=C1 NO13897 [1,0,0,0,0,0|3,0,0]=4 244 B8R1.5 NC1=C(F)C=NC=C1 NO13971 [1,0,0,0,0,0|3,0,0]=4 245 B8R1.5 NC1=C(I)C=CC=C1 NO23020 [1,0,0,0,0,0|2,0,0]=3 246 B8R1.5 NC1=C(I)C=CN=C1 NO17808 [1,0,0,0,0,0|3,0,0]=4 247 B8R1.5 NC1=C(I)C=NC=C1 NO18532 [1,0,0,0,0,0|3,0,0]=4 248 B8R1.5 NC1=C(N)C=NC=C1 NO22778 [1,0,0,0,0,0|3,0,0]=4 249 B8R1.5 NC1=C(O)C=CC=C1 NO21309 [1,0,0,0,0,0|1,0,0]=2 250 B8R1.5 NC1=C(O)C=NC=C1 NO14741 [1,0,0,0,0,0|2,0,0]=3 251 B8R1.5 NC1=CC=CN=C1Br NO22729 [1,0,0,0,0,0|3,0,0]=4 252 B8R1.5 NC1=CC=CN=C1Cl NO17686 [1,0,0,0,0,0|3,0,0]=4 253 B8R1.5 NC1=CC=CN=C1F NO22742 [1,0,0,0,0,0|3,0,0]=4 254 B8R1.5 NC1=CC=CN=C1I NO18159 [1,0,0,0,0,0|3,0,0]=4 255 B8R1.5 NC1=CC=CN=C1N NO21785 [1,0,0,0,0,0|3,0,0]=4 256 B8R1.5 NC1=CC=CNC1=O NO15503 [1,0,0,0,0,0|2,0,1]=4 257 B8R1.5 NC1=CC=CNC1=S NO20821 [1,0,0,0,0,0|2,1,0]=4 258 B8R1.5 NC1=NC=CC=C1Br NO17634 [1,0,0,0,0,0|3,0,0]=4 259 B8R1.5 NC1=NC=CC=C1Cl NO17664 [1,0,0,0,0,0|3,0,0]=4 260 B8R1.5 NC1=NC=CC=C1F NO13951 [1,0,0,0,0,0|3,0,0]=4 261 B8R1.5 NC1=NC=CC=C1I NO13464 [1,0,0,0,0,0|3,0,0]=4 262 B8R1.5 NC1=NC=CC=C1O NO22765 [1,0,0,0,0,0|2,0,0]=3 263 B8R1.5 NC1=NC=CN=C1O NO21231 [1,0,0,0,0,0|3,0,0]=4 264 B8R1.5 NC1=NC=NC=C1O NO16658 [1,0,0,0,0,0|3,0,0]=4 265 B8R1.5 O=C1C=COC=C1O NO16007 [1,0,0,0,0,0|2,0,0]=3 266 B8R1.5 O=C1NC=CC=C1F NO13754 [1,0,0,0,0,0|2,0,1]=4 267 B8R1.5 O=C1NC=CC=C1I NO16075 [1,0,0,0,0,0|2,0,1]=4 268 B8R1.5 O=C1NC=CC=C1O NO22752 [1,0,0,0,0,0|2,0,0]=3 269 B8R1.5 O=C1NC=NC=C1O NO15721 [1,0,0,0,0,0|3,0,0]=4 270 B8R1.5 OC1=C(Br)C=CC=C1 NO19429 [1,0,0,0,0,0|1,0,0]=2 271 B8R1.5 OC1=C(Br)C=CN=C1 NO13781 [1,0,0,0,0,0|2,0,0]=3 272 B8R1.5 OC1=C(Br)C=NC=C1 NO14222 [1,0,0,0,0,0|2,0,0]=3 273 B8R1.5 OC1=C(Cl)C=CN=C1 NO16383 [1,0,0,0,0,0|2,0,0]=3 274 B8R1.5 OC1=C(Cl)C=NC=C1 NO16225 [1,0,0,0,0,0|2,0,0]=3 275 B8R1.5 OC1=C(Cl)N=NC=C1 DY737048 [1,0,0,0,0,0|3,0,0]=4 276 B8R1.5 OC1=C(F)C=NC=C1 NO22284 [1,0,0,0,0,0|2,0,0]=3 277 B8R1.5 OC1=C(I)C=CC=C1 DY20193 [1,0,0,0,0,0|1,0,0]=2 278 B8R1.5 OC1=C(I)C=CN=C1 NO12130 [1,0,0,0,0,0|2,0,0]=3 279 B8R1.5 OC1=CC=CC=C1O NO11109 [1,0,0,0,0,0|1,0,0]=2 280 B8R1.5 OC1=CC=CN=C1Cl NO17508 [1,0,0,0,0,0|2,0,0]=3 281 B8R1.5 OC1=CC=CN=C1F NO13836 [1,0,0,0,0,0|2,0,0]=3 282 B8R1.5 OC1=CC=CN=C1I NO14294 [1,0,0,0,0,0|2,0,0]=3 283 B8R1.5 OC1=NC=CC=C1Br NO18703 [1,0,0,0,0,0|2,0,0]=3 284 B8R1.5 OC1=NC=NC=C1I NO12263 [1,0,0,0,0,0|3,0,0]=4 285 B8R1.5 SC1=C(I)C=CC=C1 DY41410 [1,0,0,0,0,0|1,1,0]=3 286 B8R1.5 [O-][N+]1=C(O)C=CC=C1 NO21603 [1,0,0,0,0,0|2,0,0]=3 287 B10R1.2 CC1=C(Br)C=CC=C1CBr DY584771 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.2 CC1=C(C#N)C=CC=C1Br NO13130 [0,1,0,0,0,0|2,0,0]=3 289 B10R1.2 CC1=C(C#N)C=CC=C1F NO10738 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.2 CC1=C(C#N)C=CN=C1Cl DY443679 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.2 CC1=C(C=O)C=CC=C1O NO15258 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.2 CC1=C(C=O)C=CN=C1F DY452458 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.2 CC1=C(CBr)C=CC=C1I DY584958 [0,1,0,0,0,0|2,0,0]=3 294 B10R1.2 CC1=C(CN)C=CC=C1Br DY769683 [0,1,0,0,0,0|2,0,0]=3 295 B10R1.2 CC1=C(CO)C=CC=C1Cl DY452962 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.2 CC1=C(CO)C=CC=C1I DY584812 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.2 CC1=C(CO)C=CC=C1N DY584258 [0,1,0,0,0,0|2,0,0]=3 298 B10R1.2 CC1=C(F)C=CN=C1C=O DY431962 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.2 CC1=CC=CC(C#N)=C1Br DY585081 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.2 CC1=CC=CC(C#N)=C1C NO11027 [0,1,0,0,0,0|2,0,0]=3 301 B10R1.2 CC1=CC=CC(C#N)=C1Cl DY20252 [0,1,0,0,0,0|3,0,0]=4 302 B10R1.2 CC1=CC=CC(C#N)=C1F NO10735 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.2 CC1=CC=CC(C=O)=C1Br DY505752 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.2 CC1=CC=CC(C=O)=C1C NO10889 [0,1,0,0,0,0|2,0,0]=3 305 B10R1.2 CC1=CC=CC(C=O)=C1F DY20031 [0,1,0,0,0,0|3,0,0]=4 306 B10R1.2 CC1=CC=CC(C=O)=C1O NO20930 [0,1,0,0,0,0|3,0,0]=4 307 B10R1.2 CC1=CC=CC(CBr)=C1Br DY584774 [0,1,0,0,0,0|3,0,0]=4 308 B10R1.2 CC1=CC=CC(CBr)=C1C NO10894 [0,1,0,0,0,0|2,0,0]=3 309 B10R1.2 CC1=CC=CC(CN)=C1Cl DY584892 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.2 CC1=CC=CC(CN)=C1F DY585032 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.2 CC1=CC=CC(CO)=C1C NO20113 [0,1,0,0,0,0|2,0,0]=3 312 B10R1.2 CC1=CC=CC(CO)=C1F DY451600 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.2 CCC1=C(O)C(C)=CC=C1 DY584282 [0,1,0,0,0,0|2,0,0]=3 314 B10R1.2 COC1=C(Br)C(C)=CC=C1 DY584924 [0,1,0,0,0,0|1,0,0]=2 315 B10R1.2 COC1=C(Br)C(Cl)=NC=C1 NO17952 [0,1,0,0,0,0|2,0,0]=3 316 B10R1.2 COC1=C(Br)C(Cl)=NC=N1 DY694757 [0,1,0,0,0,0|3,0,0]=4 317 B10R1.2 COC1=C(Br)C(F)=NC=C1 DY656920 [0,1,0,0,0,0|2,0,0]=3 318 B10R1.2 COC1=C(C)C(C)=CC=C1 DY20206 [0,1,0,0,0,0|0,0,0]=1 319 B10R1.2 COC1=C(C)C(O)=NC=N1 DY523593 [0,1,0,0,0,0|2,0,0]=3 320 B10R1.2 COC1=C(Cl)C(C)=CC=C1 DY822113 [0,1,0,0,0,0|1,0,0]=2 321 B10R1.2 COC1=C(Cl)C(Cl)=NC=C1 DY503313 [0,1,0,0,0,0|2,0,0]=3 322 B10R1.2 COC1=C(Cl)C(Cl)=NC=N1 DY460386 [0,1,0,0,0,0|3,0,0]=4 323 B10R1.2 COC1=C(Cl)C(N)=NC=N1 DY694878 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.2 COC1=C(F)C(Br)=CC=C1 DY20208 [0,1,0,0,0,0|1,0,0]=2 325 B10R1.2 COC1=C(F)C(Cl)=CC=C1 DY450850 [0,1,0,0,0,0|1,0,0]=2 326 B10R1.2 COC1=C(N)C(Br)=NC=C1 NO14869 [0,1,0,0,0,0|2,0,0]=3 327 B10R1.2 COC1=C(N)C(Cl)=NC=N1 NO12406 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.2 COC1=C(N)C(N)=CC=C1 NO12559 [0,1,0,0,0,0|1,0,0]=2 329 B10R1.2 COC1=CC=CC(Br)=C1C DY442371 [0,1,0,0,0,0|0,0,0]=1 330 B10R1.2 COC1=CC=CC(Br)=C1I NO14393 [0,1,0,0,0,0|1,0,0]=2 331 B10R1.2 COC1=CC=CC(Br)=C1O DY442834 [0,1,0,0,0,0|1,0,0]=2 332 B10R1.2 COC1=CC=CC(Cl)=C1N NO16113 [0,1,0,0,0,0|1,0,0]=2 333 B10R1.2 COC1=CC=CC(N)=C1Br NO21335 [0,1,0,0,0,0|1,0,0]=2 334 B10R1.2 COC1=CC=CC(N)=C1C NO10556 [0,1,0,0,0,0|0,0,0]=1 335 B10R1.2 COC1=CC=CC(N)=C1Cl NO18618 [0,1,0,0,0,0|1,0,0]=2 336 B10R1.2 COC1=CC=CC(N)=C1F NO12736 [0,1,0,0,0,0|1,0,0]=2 337 B10R1.2 COC1=CC=CC(N)=C1O NO17187 [0,1,0,0,0,0|1,0,0]=2 338 B10R1.2 COC1=CC=CC(O)=C1Cl NO21434 [0,1,0,0,0,0|1,0,0]=2 339 B10R1.2 COC1=CC=CC(O)=C1N NO16742 [0,1,0,0,0,0|1,0,0]=2 340 B10R1.2 COC1=CN=CC(N)=C1Br DY713125 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.2 COC1=NC=CC(N)=C1C DY655916 [0,1,0,0,0,0|1,0,0]=2 342 B10R1.2 COC1=NC=CC(N)=C1Cl DY657102 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 DY20573 [0,1,0,0,0,0|0,1,0]=2 344 B10R1.2 CSC1=C(C)C(Cl)=NC=N1 DY518661 [0,1,0,0,0,0|2,1,0]=4 345 B10R1.2 CSC1=C(F)C(Br)=CC=C1 DY451930 [0,1,0,0,0,0|1,1,0]=3 346 B10R1.2 CSC1=C(F)C(Cl)=NC=C1 DY450214 [0,1,0,0,0,0|2,1,0]=4 347 B10R1.2 CSC1=CC=CC(O)=C1F DY451822 [0,1,0,0,0,0|1,1,0]=3 348 B10R1.2 CSC1=NC=CC(=O)N1C DY693712 [0,1,0,0,0,0|2,1,0]=4 349 B10R1.2 ClC1=C(CBr)C=CC=C1Br DY585014 [0,1,0,0,0,0|3,0,0]=4 350 B10R1.2 ClC1=CC=CC(CBr)=C1Cl NO19151 [0,1,0,0,0,0|3,0,0]=4 351 B10R1.2 FC1=C(CBr)C=CC=C1Cl NO19361 [0,1,0,0,0,0|3,0,0]=4 352 B10R1.2 FC1=C(Cl)C=CC=C1CCl DY584895 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.2 FC1=CC=CC(CBr)=C1Cl NO19380 [0,1,0,0,0,0|3,0,0]=4 354 B10R1.2 FC1=CC=CC(CBr)=C1F NO18619 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.2 N#CC1=C(Br)C(Cl)=CC=C1 DY744739 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.2 N#CC1=C(Cl)C(Br)=CC=C1 NO13695 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.2 N#CC1=C(Cl)C(Cl)=CC=C1 NO19663 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.2 N#CC1=C(Cl)C(F)=CC=C1 DY20174 [0,1,0,0,0,0|3,0,0]=4 359 B10R1.2 N#CC1=C(F)C(F)=CC=C1 NO10193 [0,1,0,0,0,0|3,0,0]=4 360 B10R1.2 N#CC1=C(N)C(Cl)=CC=C1 NO10337 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.2 N#CC1=C(N)C(F)=CC=C1 NO10358 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.2 NC1=C(C=O)C=CC=C1Br NO16139 [0,1,0,0,0,0|3,0,0]=4 363 B10R1.2 NC1=C(C=O)C=CC=C1F NO17444 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.2 NC1=C(CO)C=CC=C1Br DY552981 [0,1,0,0,0,0|3,0,0]=4 365 B10R1.2 NC1=C(CO)C=CC=C1Cl NO14362 [0,1,0,0,0,0|3,0,0]=4 366 B10R1.2 NC1=CC=CC(CO)=C1Cl DY586503 [0,1,0,0,0,0|3,0,0]=4 367 B10R1.2 NC1=CC=CC(CO)=C1F NO12522 [0,1,0,0,0,0|3,0,0]=4 368 B10R1.2 NCC1=C(Br)C(F)=CC=C1 DY686413 [0,1,0,0,0,0|3,0,0]=4 369 B10R1.2 NCC1=C(F)C(Cl)=CC=C1 DY33194 [0,1,0,0,0,0|3,0,0]=4 370 B10R1.2 NNC1=C(Br)C(Cl)=CC=C1 DY584586 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.2 NNC1=C(Cl)C(Cl)=CC=C1 DY541383 [0,1,0,0,0,0|3,0,0]=4 372 B10R1.2 O=CC1=C(Br)C(Br)=CC=C1 DY10119 [0,1,0,0,0,0|3,0,0]=4 373 B10R1.2 O=CC1=C(Br)C(Cl)=CC=C1 NO13248 [0,1,0,0,0,0|3,0,0]=4 374 B10R1.2 O=CC1=C(Br)C(F)=CC=C1 NO21338 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.2 O=CC1=C(Br)C(O)=CC=C1 NO13249 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.2 O=CC1=C(Cl)C(Br)=CC=C1 NO17694 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.2 O=CC1=C(Cl)C(Cl)=CC=C1 NO13389 [0,1,0,0,0,0|3,0,0]=4 378 B10R1.2 O=CC1=C(Cl)C(F)=CC=C1 NO10258 [0,1,0,0,0,0|3,0,0]=4 379 B10R1.2 O=CC1=C(F)C(Cl)=CC=C1 NO10263 [0,1,0,0,0,0|3,0,0]=4 380 B10R1.2 O=CC1=C(F)C(O)=CC=C1 DY441017 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.2 O=CC1=C(O)C(Br)=CC=C1 NO20079 [0,1,0,0,0,0|3,0,0]=4 382 B10R1.2 O=CC1=C(O)C(Cl)=CC=C1 DY20676 [0,1,0,0,0,0|3,0,0]=4 383 B10R1.2 O=CC1=C(O)C(F)=CC=C1 NO20128 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.2 O=CC1=C(O)C(I)=CC=C1 DY442738 [0,1,0,0,0,0|3,0,0]=4 385 B10R1.4 C=CCC1=C(C)C=CN=C1 DY451588 [0,1,0,0,0,0|2,0,1]=4 386 B10R1.4 CC1=NC=CC=C1CCN DY653840 [0,1,0,0,0,0|2,0,0]=3 387 B10R1.4 CCOC1=C(Br)C=CC=C1 DY20149 [0,1,0,0,0,0|1,0,0]=2 388 B10R1.4 CCOC1=C(C)C=CN=C1 DY711121 [0,1,0,0,0,0|1,0,0]=2 389 B10R1.4 CCOC1=C(F)C=CC=C1 DY452620 [0,1,0,0,0,0|1,0,0]=2 390 B10R1.4 CCOC1=C(N)C=NC=C1 DY712177 [0,1,0,0,0,0|2,0,0]=3 391 B10R1.4 CCOC1=CC=CN=C1Br DY712381 [0,1,0,0,0,0|2,0,0]=3 392 B10R1.4 CCOC1=CC=CN=C1Cl DY564873 [0,1,0,0,0,0|2,0,0]=3 393 B10R1.4 CCOC1=CN=CN=C1N NO17842 [0,1,0,0,0,0|3,0,0]=4 394 B10R1.4 CCOC1=NC=CC=C1Br DY452812 [0,1,0,0,0,0|2,0,0]=3 395 B10R1.4 CCOC1=NC=CN=C1N NO21230 [0,1,0,0,0,0|3,0,0]=4 396 B10R1.4 CNCC1=C(Br)C=CC=C1 DY455892 [0,1,0,0,0,0|2,0,0]=3 397 B10R1.4 CNCC1=CC=CN=C1C DY711673 [0,1,0,0,0,0|2,0,0]=3 398 B10R1.4 CNCC1=CC=CN=C1Cl DY610776 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.4 COCC1=C(Br)C=NC=C1 DY714049 [0,1,0,0,0,0|2,0,0]=3 400 B10R1.4 C[n+]1ccccc1\C=N\O DY557475 [0,1,0,0,0,0|3,0,0]=4 401 B10R1.4 N#CCC1=C(Br)C=CC=C1 NO10707 [0,1,0,0,0,0|2,0,1]=4 402 B10R1.4 N#CCC1=C(Cl)C=CC=C1 NO21495 [0,1,0,0,0,0|2,0,1]=4 403 B10R1.4 N#CCC1=C(F)C=CC=C1 NO20772 [0,1,0,0,0,0|2,0,1]=4 404 B10R1.4 N#CCC1=C(N)C=CC=C1 NO20914 [0,1,0,0,0,0|2,0,1]=4 405 B10R1.4 NCCC1=C(Br)C=CC=C1 NO15138 [0,1,0,0,0,0|2,0,0]=3 406 B10R1.4 NCCC1=C(F)C=CC=C1 NO14793 [0,1,0,0,0,0|2,0,0]=3 407 B10R1.4 NCCC1=C(N)C=CC=C1 DY584423 [0,1,0,0,0,0|2,0,0]=3 408 B10R1.4 NCCC1=C(N)C=CC=C1 NO15970 [0,1,0,0,0,0|2,0,0]=3 409 B10R1.4 NCCC1=CC=CN=C1Cl DY585655 [0,1,0,0,0,0|3,0,0]=4 410 B10R1.4 NNCC1=C(F)C=CC=C1 NO20134 [0,1,0,0,0,0|3,0,0]=4 411 B10R1.4 O=C=NC1=C(Br)C=CC=C1 DY41031 [0,1,0,0,0,0|2,0,1]=4 412 B10R1.4 O=C=NC1=C(Cl)C=CC=C1 DY789879 [0,1,0,0,0,0|2,0,1]=4 413 B10R1.4 OCCC1=C(Br)C=CC=C1 NO21407 [0,1,0,0,0,0|2,0,0]=3 414 B10R1.4 OCCC1=C(I)C=CC=C1 DY545007 [0,1,0,0,0,0|2,0,0]=3 415 B10R1.4 O\N=C\C1=C(Br)C=CC=C1 DY558525 [0,1,0,0,0,0|3,0,0]=4 416 B10R1.4 O\N=C\C1=C(Br)C=CC=C1 DY794499 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.4 O\N=C\C1=C(F)C=CC=C1 DY106948 [0,1,0,0,0,0|3,0,0]=4 418 B10R1.4 O\N=C\C1=CC=CC=C1O DY581391 [0,1,0,0,0,0|3,0,0]=4 419 B10R1.20 BrCC1=C(CBr)C=CC=C1 DY20537 [0,1,0,0,0,0|2,0,0]=3 420 B10R1.20 C#CC1=C(OC)C=CC=C1 NO21618 [0,1,0,0,0,0|0,0,1]=2 421 B10R1.20 CCC1=C(C=O)C=CC=C1 DY20141 [0,1,0,0,0,0|1,0,1]=3 422 B10R1.20 CCC1=C(CO)C=CC=C1 DY451342 [0,1,0,0,0,0|1,0,0]=2 423 B10R1.20 CCC1=C(NN)C=CC=C1 NO15134 [0,1,0,0,0,0|2,0,0]=3 424 B10R1.20 CNC1=C(C=O)C=CC=C1 NO17054 [0,1,0,0,0,0|1,0,1]=3 425 B10R1.20 CNC1=C(OC)C=CC=C1 DY790233 [0,1,0,0,0,0|0,0,0]=1 426 B10R1.20 COC1=C(C=O)C=CC=N1 NO20317 [0,1,0,0,0,0|1,0,1]=3 427 B10R1.20 COC1=C(CCl)C=CC=C1 DY20247 [0,1,0,0,0,0|0,0,0]=1 428 B10R1.20 COC1=C(CCl)C=CN=C1 DY657907 [0,1,0,0,0,0|1,0,0]=2 429 B10R1.20 COC1=C(CN)C=CC=C1 NO15681 [0,1,0,0,0,0|0,0,0]=1 430 B10R1.20 COC1=C(NN)C=CC=C1 NO19579 [0,1,0,0,0,0|1,0,0]=2 431 B10R1.20 COC1=C(OC)C=CC=C1 NO12067 [0,1,0,0,0,0|0,0,0]=1 432 B10R1.20 COC1=CC=CN=C1C#N DY10410 [0,1,0,0,0,0|1,0,1]=3 433 B10R1.20 COC1=CC=CN=C1CBr NO13321 [0,1,0,0,0,0|1,0,0]=2 434 B10R1.20 COC1=CC=CN=C1CN NO18076 [0,1,0,0,0,0|1,0,0]=2 435 B10R1.20 COC1=CC=CN=C1CO DY558123 [0,1,0,0,0,0|1,0,0]=2 436 B10R1.20 COC1=CC=CN=C1OC NO14783 [0,1,0,0,0,0|1,0,0]=2 437 B10R1.20 COC1=CN=CN=C1OC DY568485 [0,1,0,0,0,0|2,0,0]=3 438 B10R1.20 COC1=NC=CC=C1CCl DY606789 [0,1,0,0,0,0|1,0,0]=2 439 B10R1.20 COC1=NC=CC=C1CCl NO16832 [0,1,0,0,0,0|1,0,0]=2 440 B10R1.20 COC1=NC=CC=C1CN NO14780 [0,1,0,0,0,0|1,0,0]=2 441 B10R1.20 COC1=NC=CC=C1CN NO17327 [0,1,0,0,0,0|1,0,0]=2 442 B10R1.20 COC1=NC=CC=C1CO NO13650 [0,1,0,0,0,0|1,0,0]=2 443 B10R1.20 COC1=NC=CN=C1OC DY710611 [0,1,0,0,0,0|2,0,0]=3 444 B10R1.20 ClCC1=C(CCl)C=CC=C1 DY563247 [0,1,0,0,0,0|2,0,0]=3 445 B10R1.20 N#CC1=C(C=O)C=CC=C1 NO15835 [0,1,0,0,0,0|2,0,1]=4 446 B10R1.20 N#CC1=C(CBr)C=CC=C1 NO18879 [0,1,0,0,0,0|2,0,0]=3 447 B10R1.20 N#CC1=C(CBr)C=NC=C1 DY713173 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.20 N#CC1=C(CBr)N=CC=C1 NO16812 [0,1,0,0,0,0|3,0,0]=4 449 B10R1.20 N#CC1=C(CCl)C=CC=C1 NO18396 [0,1,0,0,0,0|2,0,0]=3 450 B10R1.20 N#CC1=C(CN)C=CC=C1 NO15557 [0,1,0,0,0,0|2,0,0]=3 451 B10R1.20 N#CC1=C(CO)C=NC=C1 DY656692 [0,1,0,0,0,0|3,0,0]=4 452 B10R1.20 N#CC1=CC=CC=C1C#N NO11856 [0,1,0,0,0,0|2,0,1]=4 453 B10R1.20 N#CC1=NC=CC=C1CBr NO22182 [0,1,0,0,0,0|3,0,0]=4 454 B10R1.20 NCC1=C(CO)C=CC=C1 NO13269 [0,1,0,0,0,0|2,0,0]=3 455 B10R1.20 OCC1=C(CBr)C=CC=C1 NO17090 [0,1,0,0,0,0|2,0,0]=3 456 B10R1.20 OCC1=CC=CN=C1CO DY554235 [0,1,0,0,0,0|3,0,0]=4 457 B10R1.20 [C-]#[N+]C1=C(OC)C=CC=C1 DY745507 [0,1,0,0,0,0|0,0,1]=2 458 B10R1.25 C#CC1=C(Br)C=C(F)C=C1 DY788643 [0,1,0,0,0,0|2,0,1]=4 459 B10R1.25 C#CC1=C(F)C=C(F)C=C1 DY585106 [0,1,0,0,0,0|2,0,1]=4 460 B10R1.25 C#CC1=C(F)C=C(N)C=C1 DY33531 [0,1,0,0,0,0|2,0,1]=4 461 B10R1.25 C#CC1=NC=C(F)C=C1C DY714608 [0,1,0,0,0,0|2,0,1]=4 462 B10R1.25 C=CC1=C(O)C=C(O)C=C1 DY744937 [0,1,0,0,0,0|2,0,1]=4 463 B10R1.25 CC1=C(C#N)C=CC(Br)=C1 NO10708 [0,1,0,0,0,0|2,0,0]=3 464 B10R1.25 CC1=C(C#N)C=CC(Br)=N1 DY20334 [0,1,0,0,0,0|3,0,0]=4 465 B10R1.25 CC1=C(C#N)C=CC(F)=C1 DY20042 [0,1,0,0,0,0|2,0,0]=3 466 B10R1.25 CC1=C(C#N)C=CC(F)=N1 DY20007 [0,1,0,0,0,0|3,0,0]=4 467 B10R1.25 CC1=C(C#N)C=CC(N)=C1 NO16661 [0,1,0,0,0,0|2,0,0]=3 468 B10R1.25 CC1=C(C=O)C=CC(Br)=C1 NO22653 [0,1,0,0,0,0|2,0,0]=3 469 B10R1.25 CC1=C(C=O)C=CC(Br)=N1 DY443390 [0,1,0,0,0,0|3,0,0]=4 470 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 NO20823 [0,1,0,0,0,0|2,0,0]=3 471 B10R1.25 CC1=C(C=O)C=CC(F)=C1 NO10809 [0,1,0,0,0,0|2,0,0]=3 472 B10R1.25 CC1=C(C=O)C=CC(N)=N1 DY430302 [0,1,0,0,0,0|3,0,0]=4 473 B10R1.25 CC1=C(C=O)C=CC(O)=C1 NO20933 [0,1,0,0,0,0|2,0,0]=3 474 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 DY584433 [0,1,0,0,0,0|2,0,0]=3 475 B10R1.25 CC1=C(CN)C=NC(Br)=C1 DY715490 [0,1,0,0,0,0|3,0,0]=4 476 B10R1.25 CC1=C(CO)C=CC(O)=C1 DY449770 [0,1,0,0,0,0|2,0,0]=3 477 B10R1.25 CC1=CC(Br)=C(C#N)C=C1 NO21363 [0,1,0,0,0,0|3,0,0]=4 478 B10R1.25 CC1=CC(Br)=C(C=O)C=C1 NO20803 [0,1,0,0,0,0|3,0,0]=4 479 B10R1.25 CC1=CC(Br)=CN=C1C#N NO13175 [0,1,0,0,0,0|3,0,0]=4 480 B10R1.25 CC1=CC(Br)=NC=C1C#N DY20333 [0,1,0,0,0,0|3,0,0]=4 481 B10R1.25 CC1=CC(C)=C(C=O)C=C1 NO21114 [0,1,0,0,0,0|2,0,0]=3 482 B10R1.25 CC1=CC(C)=C(CBr)C=C1 NO21116 [0,1,0,0,0,0|2,0,0]=3 483 B10R1.25 CC1=CC(C)=C(CO)C=C1 DY744535 [0,1,0,0,0,0|2,0,0]=3 484 B10R1.25 CC1=CC(C)=C(NN)C=C1 NO20500 [0,1,0,0,0,0|2,0,0]=3 485 B10R1.25 CC1=CC(C)=NC=C1C#N NO22515 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.25 CC1=CC(Cl)=C(C#N)C=C1 NO21450 [0,1,0,0,0,0|3,0,0]=4 487 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 NO21448 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 DY433989 [0,1,0,0,0,0|3,0,0]=4 489 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 NO20405 [0,1,0,0,0,0|3,0,0]=4 490 B10R1.25 CC1=CC(Cl)=CN=C1C#N NO15581 [0,1,0,0,0,0|3,0,0]=4 491 B10R1.25 CC1=CC(F)=C(C#N)C=C1 NO10736 [0,1,0,0,0,0|3,0,0]=4 492 B10R1.25 CC1=CC(F)=C(CO)C=C1 DY451432 [0,1,0,0,0,0|3,0,0]=4 493 B10R1.25 CC1=CC(F)=CN=C1CN DY651571 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.25 CC1=CC(N)=C(C#N)C=C1 NO20911 [0,1,0,0,0,0|3,0,0]=4 495 B10R1.25 CC1=CC(N)=C(CO)C=C1 NO21019 [0,1,0,0,0,0|3,0,0]=4 496 B10R1.25 CC1=CC(N)=NC=C1C#N NO21277 [0,1,0,0,0,0|3,0,0]=4 497 B10R1.25 CC1=CC(O)=C(C#N)C=C1 NO21585 [0,1,0,0,0,0|3,0,0]=4 498 B10R1.25 CC1=CN=C(CCl)C(C)=C1 NO16524 [0,1,0,0,0,0|3,0,0]=4 499 B10R1.25 CC1=NC(Cl)=CC=C1C=O DY453082 [0,1,0,0,0,0|3,0,0]=4 500 B10R1.25 CCC1=CN=C(C)C=C1N DY660014 [0,1,0,0,0,0|3,0,0]=4 501 B10R1.25 CCC1=CN=C(C)C=C1N DY711175 [0,1,0,0,0,0|3,0,0]=4 502 B10R1.25 CCN1C=CC(N)=CC1=O DY517107 [0,1,0,0,0,0|3,0,0]=4 503 B10R1.25 CCc1ncc(C)nc1C DY793773 [0,1,0,0,0,0|3,0,0]=4 504 B10R1.25 CNC1=C(N)C=C(Br)N=C1 DY660952 [0,1,0,0,0,0|3,0,0]=4 505 B10R1.25 CNC1=NC=C(C)C=C1Br DY716366 [0,1,0,0,0,0|3,0,0]=4 506 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 NO20168 [0,1,0,0,0,0|1,0,0]=2 507 B10R1.25 COC1=C(Br)C=C(I)C=C1 DY41320 [0,1,0,0,0,0|1,0,0]=2 508 B10R1.25 COC1=C(Br)C=C(N)C=C1 DY20804 [0,1,0,0,0,0|1,0,0]=2 509 B10R1.25 COC1=C(Br)C=C(O)C=C1 NO18795 [0,1,0,0,0,0|1,0,0]=2 510 B10R1.25 COC1=C(C)C=C(Br)C=C1 NO22652 [0,1,0,0,0,0|0,0,0]=1 511 B10R1.25 COC1=C(C)C=C(N)C=C1 NO18714 [0,1,0,0,0,0|0,0,0]=1 512 B10R1.25 COC1=C(C)C=C(N)C=N1 NO15363 [0,1,0,0,0,0|1,0,0]=2 513 B10R1.25 COC1=C(C)C=[N+]([O-])C=C1 DY714488 [0,1,0,0,0,0|1,0,0]=2 514 B10R1.25 COC1=C(C)N=C(N)C=N1 DY710815 [0,1,0,0,0,0|2,0,0]=3 515 B10R1.25 COC1=C(Cl)C=C(N)C=C1 NO14858 [0,1,0,0,0,0|1,0,0]=2 516 B10R1.25 COC1=C(Cl)C=C(N)C=N1 NO17094 [0,1,0,0,0,0|2,0,0]=3 517 B10R1.25 COC1=C(F)C=C(C)C=C1 DY452440 [0,1,0,0,0,0|1,0,0]=2 518 B10R1.25 COC1=C(F)C=C(Cl)C=C1 DY584280 [0,1,0,0,0,0|1,0,0]=2 519 B10R1.25 COC1=C(F)C=C(N)C=C1 NO10515 [0,1,0,0,0,0|1,0,0]=2 520 B10R1.25 COC1=C(F)C=C(N)C=N1 NO15127 [0,1,0,0,0,0|2,0,0]=3 521 B10R1.25 COC1=C(F)C=C(O)C=C1 NO22287 [0,1,0,0,0,0|1,0,0]=2 522 B10R1.25 COC1=C(I)C=C(Br)C=C1 NO17024 [0,1,0,0,0,0|1,0,0]=2 523 B10R1.25 COC1=C(I)C=C(N)C=C1 NO18915 [0,1,0,0,0,0|1,0,0]=2 524 B10R1.25 COC1=C(I)C=C(N)C=C1 NO19301 [0,1,0,0,0,0|1,0,0]=2 525 B10R1.25 COC1=C(N)C=C(Br)C=C1 NO10268 [0,1,0,0,0,0|1,0,0]=2 526 B10R1.25 COC1=C(N)C=C(C)C=C1 NO13548 [0,1,0,0,0,0|1,0,0]=2 527 B10R1.25 COC1=C(N)C=C(Cl)C=C1 DY745633 [0,1,0,0,0,0|1,0,0]=2 528 B10R1.25 COC1=C(N)C=C(I)C=C1 DY584281 [0,1,0,0,0,0|1,0,0]=2 529 B10R1.25 COC1=C(N)C=C(N)C=C1 NO21066 [0,1,0,0,0,0|1,0,0]=2 530 B10R1.25 COC1=C(O)C=C(C)C=C1 DY442401 [0,1,0,0,0,0|1,0,0]=2 531 B10R1.25 COC1=C(O)C=C(F)C=C1 NO15779 [0,1,0,0,0,0|1,0,0]=2 532 B10R1.25 COC1=CC=C(C)N=C1I DY527061 [0,1,0,0,0,0|2,0,0]=3 533 B10R1.25 COC1=CN=C(C)C=C1Br DY431792 [0,1,0,0,0,0|2,0,0]=3 534 B10R1.25 COC1=CN=C(C)N=C1C NO16889 [0,1,0,0,0,0|2,0,0]=3 535 B10R1.25 COC1=CN=C(C)N=C1N DY567813 [0,1,0,0,0,0|3,0,0]=4 536 B10R1.25 COC1=CN=C(Cl)N=C1Cl NO22707 [0,1,0,0,0,0|3,0,0]=4 537 B10R1.25 COC1=CN=C(Cl)N=C1N NO16929 [0,1,0,0,0,0|3,0,0]=4 538 B10R1.25 COC1=CN=C(O)N=C1O NO18000 [0,1,0,0,0,0|3,0,0]=4 539 B10R1.25 COC1=NC=C(Br)C=C1Br NO18704 [0,1,0,0,0,0|2,0,0]=3 540 B10R1.25 COC1=NC=C(Br)C=C1C NO17558 [0,1,0,0,0,0|1,0,0]=2 541 B10R1.25 COC1=NC=C(Br)C=C1Cl NO19358 [0,1,0,0,0,0|2,0,0]=3 542 B10R1.25 COC1=NC=C(Br)C=C1F NO17560 [0,1,0,0,0,0|2,0,0]=3 543 B10R1.25 COC1=NC=C(Br)C=C1N DY451156 [0,1,0,0,0,0|2,0,0]=3 544 B10R1.25 COC1=NC=C(Br)C=C1N NO17340 [0,1,0,0,0,0|2,0,0]=3 545 B10R1.25 COC1=NC=C(C)C=C1Br NO12715 [0,1,0,0,0,0|2,0,0]=3 546 B10R1.25 COC1=NC=C(C)N=C1C NO15176 [0,1,0,0,0,0|2,0,0]=3 547 B10R1.25 COC1=NC=C(Cl)C=C1Br NO17800 [0,1,0,0,0,0|2,0,0]=3 548 B10R1.25 COC1=NC=C(F)C=C1Br NO19396 [0,1,0,0,0,0|2,0,0]=3 549 B10R1.25 COC1=NC=C(F)C=C1F DY508988 [0,1,0,0,0,0|2,0,0]=3 550 B10R1.25 COC1=NC=C(N)C=C1Br DY20010 [0,1,0,0,0,0|2,0,0]=3 551 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 DY585122 [0,1,0,0,0,0|1,1,0]=3 552 B10R1.25 CSC1=C(Br)C=C(F)C=C1 DY452890 [0,1,0,0,0,0|1,1,0]=3 553 B10R1.25 CSC1=C(C)C=C(O)C=C1 DY20571 [0,1,0,0,0,0|0,1,0]=2 554 B10R1.25 ClC1=C(CBr)C=CC(Br)=C1 NO15047 [0,1,0,0,0,0|3,0,0]=4 555 B10R1.25 ClC1=CC(Cl)=C(CBr)C=C1 NO21097 [0,1,0,0,0,0|3,0,0]=4 556 B10R1.25 ClC1=CC(I)=C(CBr)C=C1 DY584761 [0,1,0,0,0,0|3,0,0]=4 557 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 NO19427 [0,1,0,0,0,0|3,0,0]=4 558 B10R1.25 FC1=C(CCl)C=CC(Cl)=C1 DY585180 [0,1,0,0,0,0|3,0,0]=4 559 B10R1.25 FC1=CC(Br)=C(CBr)C=C1 NO20064 [0,1,0,0,0,0|3,0,0]=4 560 B10R1.25 FC1=CC(F)=C(CBr)C=C1 DY40543 [0,1,0,0,0,0|3,0,0]=4 561 B10R1.25 FC1=CC(F)=C(CCl)C=C1 DY40591 [0,1,0,0,0,0|3,0,0]=4 562 B10R1.25 N#CC1=C(Br)C=C(Br)C=C1 DY584356 [0,1,0,0,0,0|3,0,0]=4 563 B10R1.25 N#CC1=C(Br)C=C(F)C=C1 NO19659 [0,1,0,0,0,0|3,0,0]=4 564 B10R1.25 N#CC1=C(Br)C=C(I)C=C1 DY744859 [0,1,0,0,0,0|3,0,0]=4 565 B10R1.25 N#CC1=C(Br)C=C(N)C=C1 NO15118 [0,1,0,0,0,0|3,0,0]=4 566 B10R1.25 N#CC1=C(Br)C=C(O)C=C1 DY744097 [0,1,0,0,0,0|3,0,0]=4 567 B10R1.25 N#CC1=C(Cl)C=C(Cl)C=C1 NO19664 [0,1,0,0,0,0|3,0,0]=4 568 B10R1.25 N#CC1=C(Cl)C=C(F)C=C1 NO10185 [0,1,0,0,0,0|3,0,0]=4 569 B10R1.25 N#CC1=C(Cl)C=C(O)C=C1 DY20251 [0,1,0,0,0,0|3,0,0]=4 570 B10R1.25 N#CC1=C(F)C=C(Br)C=C1 NO19661 [0,1,0,0,0,0|3,0,0]=4 571 B10R1.25 N#CC1=C(F)C=C(Cl)C=C1 NO10187 [0,1,0,0,0,0|3,0,0]=4 572 B10R1.25 N#CC1=C(F)C=C(F)C=C1 NO21106 [0,1,0,0,0,0|3,0,0]=4 573 B10R1.25 N#CC1=C(F)C=C(I)C=C1 DY429408 [0,1,0,0,0,0|3,0,0]=4 574 B10R1.25 N#CC1=C(F)C=C(N)C=C1 NO22548 [0,1,0,0,0,0|3,0,0]=4 575 B10R1.25 N#CC1=C(F)C=C(O)C=C1 NO20032 [0,1,0,0,0,0|3,0,0]=4 576 B10R1.25 N#CC1=C(I)C=C(Cl)C=C1 DY584899 [0,1,0,0,0,0|3,0,0]=4 577 B10R1.25 N#CC1=C(I)C=C(F)C=C1 NO16014 [0,1,0,0,0,0|3,0,0]=4 578 B10R1.25 N#CC1=C(N)C=C(F)C=C1 NO21248 [0,1,0,0,0,0|3,0,0]=4 579 B10R1.25 N#CC1=C(O)C=C(Br)C=C1 NO22646 [0,1,0,0,0,0|3,0,0]=4 580 B10R1.25 N#CC1=C(O)C=C(Cl)C=C1 NO14584 [0,1,0,0,0,0|3,0,0]=4 581 B10R1.25 N#CC1=C(O)C=C(O)C=C1 DY10369 [0,1,0,0,0,0|3,0,0]=4 582 B10R1.25 NC1=C(C=O)C=CC(Br)=C1 NO21241 [0,1,0,0,0,0|3,0,0]=4 583 B10R1.25 NC1=C(C=O)C=CC(Cl)=C1 NO17491 [0,1,0,0,0,0|3,0,0]=4 584 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 DY40814 [0,1,0,0,0,0|3,0,0]=4 585 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 DY585043 [0,1,0,0,0,0|3,0,0]=4 586 B10R1.25 NCC1=C(F)C=C(F)C=C1 NO10473 [0,1,0,0,0,0|3,0,0]=4 587 B10R1.25 NNC1=C(Cl)C=C(Cl)C=C1 NO23006 [0,1,0,0,0,0|3,0,0]=4 588 B10R1.25 NNC1=C(Cl)C=C(F)C=C1 NO19087 [0,1,0,0,0,0|3,0,0]=4 589 B10R1.25 NNC1=C(Cl)C=C(I)C=C1 NO17119 [0,1,0,0,0,0|3,0,0]=4 590 B10R1.25 NNC1=C(F)C=C(Br)C=C1 NO18334 [0,1,0,0,0,0|3,0,0]=4 591 B10R1.25 NNC1=C(F)C=C(F)C=C1 NO23012 [0,1,0,0,0,0|3,0,0]=4 592 B10R1.25 O=CC1=C(Br)C=C(Br)C=C1 NO16310 [0,1,0,0,0,0|3,0,0]=4 593 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 NO10226 [0,1,0,0,0,0|3,0,0]=4 594 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 NO19853 [0,1,0,0,0,0|3,0,0]=4 595 B10R1.25 O=CC1=C(Br)C=C(O)C=C1 NO16052 [0,1,0,0,0,0|3,0,0]=4 596 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 NO18762 [0,1,0,0,0,0|3,0,0]=4 597 B10R1.25 O=CC1=C(Cl)C=C(Cl)C=C1 DY33212 [0,1,0,0,0,0|3,0,0]=4 598 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 NO10260 [0,1,0,0,0,0|3,0,0]=4 599 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 NO10340 [0,1,0,0,0,0|3,0,0]=4 600 B10R1.25 O=CC1=C(F)C=C(Br)C=C1 NO10231 [0,1,0,0,0,0|3,0,0]=4 601 B10R1.25 O=CC1=C(F)C=C(Cl)C=C1 DY20030 [0,1,0,0,0,0|3,0,0]=4 602 B10R1.25 O=CC1=C(F)C=C(F)C=C1 NO18760 [0,1,0,0,0,0|3,0,0]=4 603 B10R1.25 O=CC1=C(F)C=C(O)C=C1 NO10365 [0,1,0,0,0,0|3,0,0]=4 604 B10R1.25 O=CC1=C(I)C=C(O)C=C1 NO16844 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 NO20081 [0,1,0,0,0,0|3,0,0]=4 606 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 NO20105 [0,1,0,0,0,0|3,0,0]=4 607 B10R1.25 O=CC1=C(O)C=C(F)C=C1 NO20130 [0,1,0,0,0,0|3,0,0]=4 608 B10R1.25 O=CC1=C(O)C=C(O)C=C1 NO19428 [0,1,0,0,0,0|3,0,0]=4 609 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 NO21073 [0,1,0,0,0,0|3,0,0]=4 610 B10R1.25 OCC1=C(Br)C=C(F)C=C1 DY452398 [0,1,0,0,0,0|3,0,0]=4 611 B10R1.25 OCC1=C(Br)C=C(I)C=C1 DY584784 [0,1,0,0,0,0|3,0,0]=4 612 B10R1.25 OCC1=C(F)C=C(O)C=C1 NO13215 [0,1,0,0,0,0|3,0,0]=4 613 B10R1.25 OCC1=C(O)C=C(Br)C=C1 NO10248 [0,1,0,0,0,0|3,0,0]=4 614 B10R1.30 BrCC1=C(Br)C=CC(I)=C1 DY584787 [0,1,0,0,0,0|3,0,0]=4 615 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 DY584786 [0,1,0,0,0,0|3,0,0]=4 616 B10R1.30 C#CC1=C(C)C=CC(N)=C1 DY103342 [0,1,0,0,0,0|1,0,1]=3 617 B10R1.30 C#CC1=C(F)C=CC(N)=C1 NO15160 [0,1,0,0,0,0|2,0,1]=4 618 B10R1.30 CC1=C(C#N)C=C(Br)C=C1 NO10274 [0,1,0,0,0,0|2,0,0]=3 619 B10R1.30 CC1=C(C#N)C=C(Cl)C=C1 DY40633 [0,1,0,0,0,0|2,0,0]=3 620 B10R1.30 CC1=C(C#N)C=C(N)C=C1 NO10209 [0,1,0,0,0,0|2,0,0]=3 621 B10R1.30 CC1=C(C=O)C=C(Br)C=C1 DY20545 [0,1,0,0,0,0|2,0,0]=3 622 B10R1.30 CC1=C(C=O)C=C(F)C=C1 DY20032 [0,1,0,0,0,0|2,0,0]=3 623 B10R1.30 CC1=C(C=O)C=C(O)C=C1 DY452542 [0,1,0,0,0,0|2,0,0]=3 624 B10R1.30 CC1=C(CCl)C=C(F)C=C1 DY584262 [0,1,0,0,0,0|2,0,0]=3 625 B10R1.30 CC1=C(CO)C=C(F)C=C1 DY452638 [0,1,0,0,0,0|2,0,0]=3 626 B10R1.30 CC1=CC(C#N)=C(Cl)C=C1 NO21470 [0,1,0,0,0,0|3,0,0]=4 627 B10R1.30 CC1=CC(C#N)=C(F)C=C1 NO10737 [0,1,0,0,0,0|3,0,0]=4 628 B10R1.30 CC1=CC(C=O)=C(Br)C=C1 NO13222 [0,1,0,0,0,0|3,0,0]=4 629 B10R1.30 CC1=CC(CBr)=C(C)C=C1 DY584839 [0,1,0,0,0,0|2,0,0]=3 630 B10R1.30 CC1=CC(CN)=C(C)C=C1 DY20405 [0,1,0,0,0,0|2,0,0]=3 631 B10R1.30 CC1=CC(CO)=C(F)C=C1 DY450466 [0,1,0,0,0,0|3,0,0]=4 632 B10R1.30 CC1=CC(NN)=C(C)C=C1 NO20501 [0,1,0,0,0,0|2,0,0]=3 633 B10R1.30 CC1=CC=C(Cl)N=C1C#N NO15377 [0,1,0,0,0,0|3,0,0]=4 634 B10R1.30 CC1=CN=C(Br)C=C1C#N DY108364 [0,1,0,0,0,0|3,0,0]=4 635 B10R1.30 CC1=CN=C(C)C=C1C#N DY653109 [0,1,0,0,0,0|3,0,0]=4 636 B10R1.30 CC1=NC=C(Br)C=C1CN DY656602 [0,1,0,0,0,0|3,0,0]=4 637 B10R1.30 CC1=NC=C(Br)C=C1CO DY518829 [0,1,0,0,0,0|3,0,0]=4 638 B10R1.30 CCC1=NC(C)=CC=C1O NO13984 [0,1,0,0,0,0|3,0,0]=4 639 B10R1.30 CCC1=NC(C)=CN=C1C DY710767 [0,1,0,0,0,0|3,0,0]=4 640 B10R1.30 CCC1=NC(Cl)=NC=C1C DY606669 [0,1,0,0,0,0|3,0,0]=4 641 B10R1.30 CNC1=CC(Br)=CC=C1N NO13254 [0,1,0,0,0,0|2,0,0]=3 642 B10R1.30 COC1=C(Br)C=CC(Br)=C1 NO12737 [0,1,0,0,0,0|1,0,0]=2 643 B10R1.30 COC1=C(Br)C=CC(C)=C1 DY20209 [0,1,0,0,0,0|1,0,0]=2 644 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 NO21371 [0,1,0,0,0,0|1,0,0]=2 645 B10R1.30 COC1=C(Br)C=CC(F)=C1 NO10394 [0,1,0,0,0,0|1,0,0]=2 646 B10R1.30 COC1=C(Br)C=CC(N)=C1 NO18102 [0,1,0,0,0,0|1,0,0]=2 647 B10R1.30 COC1=C(Br)C=CC(N)=N1 DY429703 [0,1,0,0,0,0|2,0,0]=3 648 B10R1.30 COC1=C(Br)N=CC(N)=C1 NO12409 [0,1,0,0,0,0|2,0,0]=3 649 B10R1.30 COC1=C(Cl)C=CC(C)=C1 DY456622 [0,1,0,0,0,0|1,0,0]=2 650 B10R1.30 COC1=C(Cl)C=CC(I)=C1 DY20290 [0,1,0,0,0,0|1,0,0]=2 651 B10R1.30 COC1=C(Cl)C=CC(N)=C1 NO22759 [0,1,0,0,0,0|1,0,0]=2 652 B10R1.30 COC1=C(Cl)N=NC(Cl)=C1 NO12992 [0,1,0,0,0,0|3,0,0]=4 653 B10R1.30 COC1=C(F)C=CC(Br)=C1 NO19804 [0,1,0,0,0,0|1,0,0]=2 654 B10R1.30 COC1=C(F)C=CC(I)=C1 DY571347 [0,1,0,0,0,0|1,0,0]=2 655 B10R1.30 COC1=C(F)C=CC(N)=C1 NO10516 [0,1,0,0,0,0|1,0,0]=2 656 B10R1.30 COC1=C(I)C=CC(Cl)=C1 DY20291 [0,1,0,0,0,0|1,0,0]=2 657 B10R1.30 COC1=C(N)C=CC(Br)=C1 NO19178 [0,1,0,0,0,0|1,0,0]=2 658 B10R1.30 COC1=C(N)C=CC(F)=C1 NO12096 [0,1,0,0,0,0|1,0,0]=2 659 B10R1.30 COC1=C(N)C=CC(I)=C1 DY21014 [0,1,0,0,0,0|1,0,0]=2 660 B10R1.30 COC1=C(N)C=CC(N)=C1 NO21132 [0,1,0,0,0,0|1,0,0]=2 661 B10R1.30 COC1=C(O)C=CC(Br)=C1 NO22682 [0,1,0,0,0,0|1,0,0]=2 662 B10R1.30 COC1=C(O)C=CC(C)=C1 NO16322 [0,1,0,0,0,0|1,0,0]=2 663 B10R1.30 COC1=CC(=O)NN=C1Cl DY736928 [0,1,0,0,0,0|3,0,0]=4 664 B10R1.30 COC1=CC(Br)=CN=C1Cl NO10254 [0,1,0,0,0,0|2,0,0]=3 665 B10R1.30 COC1=CC(Br)=CN=C1N NO14023 [0,1,0,0,0,0|2,0,0]=3 666 B10R1.30 COC1=CC(C)=CN=C1O DY657387 [0,1,0,0,0,0|2,0,0]=3 667 B10R1.30 COC1=CC(Cl)=NC=C1Br NO14850 [0,1,0,0,0,0|2,0,0]=3 668 B10R1.30 COC1=CC(Cl)=NC=C1C DY655410 [0,1,0,0,0,0|1,0,0]=2 669 B10R1.30 COC1=CC(Cl)=NC=C1Cl NO15874 [0,1,0,0,0,0|2,0,0]=3 670 B10R1.30 COC1=CC(O)=NC=C1Br DY429897 [0,1,0,0,0,0|2,0,0]=3 671 B10R1.30 COC1=NC(Br)=CC=C1Br DY533289 [0,1,0,0,0,0|2,0,0]=3 672 B10R1.30 COC1=NC(Br)=CC=C1N NO18540 [0,1,0,0,0,0|2,0,0]=3 673 B10R1.30 COC1=NC(Br)=CN=C1I NO16000 [0,1,0,0,0,0|3,0,0]=4 674 B10R1.30 COC1=NC(Br)=CN=C1N NO12445 [0,1,0,0,0,0|3,0,0]=4 675 B10R1.30 COC1=NC(Br)=CNC1=O DY578181 [0,1,0,0,0,0|3,0,0]=4 676 B10R1.30 COC1=NC(Br)=NC=C1Br DY692686 [0,1,0,0,0,0|3,0,0]=4 677 B10R1.30 COC1=NC(C)=CC=C1Br NO19284 [0,1,0,0,0,0|2,0,0]=3 678 B10R1.30 COC1=NC(Cl)=CC=C1Br NO16211 [0,1,0,0,0,0|2,0,0]=3 679 B10R1.30 COC1=NC(Cl)=CC=C1N NO10669 [0,1,0,0,0,0|2,0,0]=3 680 B10R1.30 COC1=NC(Cl)=CN=C1N NO12869 [0,1,0,0,0,0|3,0,0]=4 681 B10R1.30 COC1=NC(Cl)=NC=C1Br NO10257 [0,1,0,0,0,0|3,0,0]=4 682 B10R1.30 COC1=NC(F)=CC=C1Br DY429643 [0,1,0,0,0,0|2,0,0]=3 683 B10R1.30 COC1=NC(N)=NC=C1Br NO13148 [0,1,0,0,0,0|3,0,0]=4 684 B10R1.30 COC1=NC(N)=NC=C1I NO13040 [0,1,0,0,0,0|3,0,0]=4 685 B10R1.30 CSC1=C(Br)C=CC(Br)=C1 DY453532 [0,1,0,0,0,0|1,1,0]=3 686 B10R1.30 CSC1=C(Br)C=CC(F)=C1 DY525105 [0,1,0,0,0,0|1,1,0]=3 687 B10R1.30 CSC1=C(C)C=CC(Br)=C1 DY452878 [0,1,0,0,0,0|0,1,0]=2 688 B10R1.30 CSC1=CC(F)=CN=C1Br DY715124 [0,1,0,0,0,0|2,1,0]=4 689 B10R1.30 ClC1=C(CBr)C=C(I)C=C1 DY433851 [0,1,0,0,0,0|3,0,0]=4 690 B10R1.30 ClC1=CC(CBr)=C(Cl)C=C1 DY40541 [0,1,0,0,0,0|3,0,0]=4 691 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 NO16839 [0,1,0,0,0,0|3,0,0]=4 692 B10R1.30 FC1=CC(CBr)=C(Br)C=C1 DY20074 [0,1,0,0,0,0|3,0,0]=4 693 B10R1.30 N#CC1=C(Br)C=CC(Cl)=C1 NO19784 [0,1,0,0,0,0|3,0,0]=4 694 B10R1.30 N#CC1=C(Br)C=CC(F)=C1 NO10165 [0,1,0,0,0,0|3,0,0]=4 695 B10R1.30 N#CC1=C(Br)C=CC(N)=C1 NO15752 [0,1,0,0,0,0|3,0,0]=4 696 B10R1.30 N#CC1=C(Br)C=CC(O)=C1 NO21374 [0,1,0,0,0,0|3,0,0]=4 697 B10R1.30 N#CC1=C(Cl)C=CC(Br)=C1 NO19776 [0,1,0,0,0,0|3,0,0]=4 698 B10R1.30 N#CC1=C(Cl)C=CC(Cl)=C1 DY33078 [0,1,0,0,0,0|3,0,0]=4 699 B10R1.30 N#CC1=C(Cl)C=CC(N)=C1 NO10202 [0,1,0,0,0,0|3,0,0]=4 700 B10R1.30 N#CC1=C(F)C=CC(Br)=C1 NO19662 [0,1,0,0,0,0|3,0,0]=4 701 B10R1.30 N#CC1=C(F)C=CC(Cl)=C1 NO10190 [0,1,0,0,0,0|3,0,0]=4 702 B10R1.30 N#CC1=C(F)C=CC(F)=C1 NO10194 [0,1,0,0,0,0|3,0,0]=4 703 B10R1.30 N#CC1=C(F)C=CC(I)=C1 DY20256 [0,1,0,0,0,0|3,0,0]=4 704 B10R1.30 N#CC1=C(F)C=CC(N)=C1 NO10363 [0,1,0,0,0,0|3,0,0]=4 705 B10R1.30 N#CC1=C(F)C=CC(O)=C1 NO12738 [0,1,0,0,0,0|3,0,0]=4 706 B10R1.30 N#CC1=C(I)C=CC(Br)=C1 NO10267 [0,1,0,0,0,0|3,0,0]=4 707 B10R1.30 N#CC1=C(I)C=CC(I)=C1 DY572385 [0,1,0,0,0,0|3,0,0]=4 708 B10R1.30 N#CC1=C(N)C=CC(Br)=C1 DY20241 [0,1,0,0,0,0|3,0,0]=4 709 B10R1.30 N#CC1=C(N)C=CC(Cl)=C1 NO20097 [0,1,0,0,0,0|3,0,0]=4 710 B10R1.30 N#CC1=C(N)C=CC(F)=C1 DY40621 [0,1,0,0,0,0|3,0,0]=4 711 B10R1.30 N#CC1=C(N)C=CC(I)=C1 DY584643 [0,1,0,0,0,0|3,0,0]=4 712 B10R1.30 N#CC1=C(N)C=CC(N)=C1 DY584666 [0,1,0,0,0,0|3,0,0]=4 713 B10R1.30 N#CC1=C(N)C=CC(O)=C1 NO21280 [0,1,0,0,0,0|3,0,0]=4 714 B10R1.30 N#CC1=C(O)C=CC(Br)=C1 NO10240 [0,1,0,0,0,0|3,0,0]=4 715 B10R1.30 N#CC1=C(O)C=CC(N)=C1 NO10205 [0,1,0,0,0,0|3,0,0]=4 716 B10R1.30 NC1=C(C=O)C=C(Br)C=C1 NO13430 [0,1,0,0,0,0|3,0,0]=4 717 B10R1.30 NC1=C(C=O)C=C(Cl)C=C1 DY20404 [0,1,0,0,0,0|3,0,0]=4 718 B10R1.30 NC1=C(CO)C=C(Br)C=C1 NO20119 [0,1,0,0,0,0|3,0,0]=4 719 B10R1.30 NCC1=C(Br)C=CC(F)=C1 DY792813 [0,1,0,0,0,0|3,0,0]=4 720 B10R1.30 NCC1=C(Cl)C=CC(Br)=C1 NO12614 [0,1,0,0,0,0|3,0,0]=4 721 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 DY584885 [0,1,0,0,0,0|3,0,0]=4 722 B10R1.30 NCC1=C(F)C=CC(Br)=C1 DY40802 [0,1,0,0,0,0|3,0,0]=4 723 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 NO20282 [0,1,0,0,0,0|3,0,0]=4 724 B10R1.30 NCC1=C(N)C=CC(Br)=C1 NO17921 [0,1,0,0,0,0|3,0,0]=4 725 B10R1.30 NCC1=C(O)C=CC(Br)=C1 NO18138 [0,1,0,0,0,0|3,0,0]=4 726 B10R1.30 NNC1=C(Br)C=CC(Br)=C1 NO16988 [0,1,0,0,0,0|3,0,0]=4 727 B10R1.30 NNC1=C(Br)C=CC(F)=C1 DY40989 [0,1,0,0,0,0|3,0,0]=4 728 B10R1.30 NNC1=C(F)C=CC(F)=C1 NO23013 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.30 O=CC1=C(Br)C=CC(Br)=C1 NO10002 [0,1,0,0,0,0|3,0,0]=4 730 B10R1.30 O=CC1=C(Br)C=CC(Cl)=C1 NO18798 [0,1,0,0,0,0|3,0,0]=4 731 B10R1.30 O=CC1=C(Br)C=CC(F)=C1 NO10227 [0,1,0,0,0,0|3,0,0]=4 732 B10R1.30 O=CC1=C(Br)C=CC(O)=C1 NO20078 [0,1,0,0,0,0|3,0,0]=4 733 B10R1.30 O=CC1=C(Cl)C=CC(Br)=C1 DY20546 [0,1,0,0,0,0|3,0,0]=4 734 B10R1.30 O=CC1=C(Cl)C=CC(Cl)=C1 NO19231 [0,1,0,0,0,0|3,0,0]=4 735 B10R1.30 O=CC1=C(Cl)C=CC(O)=C1 NO15260 [0,1,0,0,0,0|3,0,0]=4 736 B10R1.30 O=CC1=C(F)C=CC(Br)=C1 NO10234 [0,1,0,0,0,0|3,0,0]=4 737 B10R1.30 O=CC1=C(F)C=CC(Cl)=C1 NO10265 [0,1,0,0,0,0|3,0,0]=4 738 B10R1.30 O=CC1=C(F)C=CC(O)=C1 NO13428 [0,1,0,0,0,0|3,0,0]=4 739 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 NO20107 [0,1,0,0,0,0|3,0,0]=4 740 B10R1.30 O=CC1=C(O)C=CC(F)=C1 NO10369 [0,1,0,0,0,0|3,0,0]=4 741 B10R1.30 O=CC1=C(O)C=CC(I)=C1 NO20136 [0,1,0,0,0,0|3,0,0]=4 742 B10R1.30 O=CC1=CC(Br)=CC=C1O NO20084 [0,1,0,0,0,0|3,0,0]=4 743 B10R1.30 OCC1=C(Br)C=CC(F)=C1 NO13914 [0,1,0,0,0,0|3,0,0]=4 744 B10R1.30 OCC1=C(Cl)C=CC(F)=C1 NO21464 [0,1,0,0,0,0|3,0,0]=4 745 B10R1.30 OCC1=C(I)C=CC(Br)=C1 DY537399 [0,1,0,0,0,0|3,0,0]=4 746 B10R1.30 OCC1=CC(Br)=CC=C1O NO20280 [0,1,0,0,0,0|3,0,0]=4 747 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 NO18866 [0,1,0,0,0,0|2,0,0]=3 748 B10R1.61 CC(=O)C1=C(C)C=CC=C1 NO19710 [0,1,0,0,0,0|1,0,0]=2 749 B10R1.61 CC(=O)C1=C(F)C=CC=C1 NO15490 [0,1,0,0,0,0|2,0,0]=3 750 B10R1.61 CC(=O)C1=C(N)C=CC=C1 NO19948 [0,1,0,0,0,0|2,0,0]=3 751 B10R1.61 CC(=O)C1=C(O)C=CC=C1 DY790197 [0,1,0,0,0,0|2,0,0]=3 752 B10R1.61 CC(=O)C1=C(O)C=CC=C1 NO15026 [0,1,0,0,0,0|2,0,0]=3 753 B10R1.61 CC(=O)C1=CC=CN=C1Br NO18506 [0,1,0,0,0,0|3,0,0]=4 754 B10R1.61 CC(=O)C1=CC=CN=C1C DY652208 [0,1,0,0,0,0|2,0,0]=3 755 B10R1.61 CC(=O)C1=CC=CN=C1Cl NO18365 [0,1,0,0,0,0|3,0,0]=4 756 B10R1.61 CC(=O)C1=CN=CN=C1C NO17792 [0,1,0,0,0,0|3,0,0]=4 757 B10R1.61 CC(=O)C1=NC=CC=C1Br NO16209 [0,1,0,0,0,0|3,0,0]=4 758 B10R1.61 CC(=O)C1=NC=CC=C1F NO16198 [0,1,0,0,0,0|3,0,0]=4 759 B10R1.61 CC(=O)C1=NC=CC=C1O NO14450 [0,1,0,0,0,0|3,0,0]=4 760 B10R1.61 CC(=O)c1ccncc1N DY509612 [0,1,0,0,0,0|3,0,0]=4 761 B10R1.61 CC(C)C1=C(Br)C=CC=C1 NO19988 [0,1,0,0,0,0|2,0,0]=3 762 B10R1.61 CC(Cl)C1=C(F)C=NC=C1 DY501981 [0,1,0,0,0,0|3,0,0]=4 763 B10R1.61 CC(N)C1=CC=CN=C1F DY714055 [0,1,0,0,0,0|3,0,0]=4 764 B10R1.61 CC1=C(B(O)O)C=CC=C1 NO20397 [0,1,0,0,0,0|2,0,0]=3 765 B10R1.61 CC1=C(B(O)O)C=CN=C1 NO17377 [0,1,0,0,0,0|3,0,0]=4 766 B10R1.61 CC1=C(C(=O)O)C=CC=C1 NO19823 [0,1,0,0,0,0|2,0,0]=3 767 B10R1.61 CC1=C(C(=O)O)C=CC=N1 NO18975 [0,1,0,0,0,0|3,0,0]=4 768 B10R1.61 CC1=C(C(=O)O)C=CN=C1 NO22360 [0,1,0,0,0,0|3,0,0]=4 769 B10R1.61 CC1=C(C(C)N)C=CC=C1 DY788943 [0,1,0,0,0,0|1,0,0]=2 770 B10R1.61 CC1=C(C(N)=O)C=CC=N1 NO22408 [0,1,0,0,0,0|3,0,0]=4 771 B10R1.61 CC1=C(C(N)=S)C=CC=C1 DY559011 [0,1,0,0,0,0|2,0,0]=3 772 B10R1.61 CC1=C([C@H](C)O)C=CC=C1 DY822244 [0,1,0,0,0,0|1,0,0]=2 773 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 NO19156 [0,1,0,0,0,0|3,0,0]=4 774 B10R1.61 CC1=CC=CN=C1C(=O)O NO19680 [0,1,0,0,0,0|3,0,0]=4 775 B10R1.61 CC1=CC=CN=C1C(C)N DY604773 [0,1,0,0,0,0|2,0,0]=3 776 B10R1.61 CC1=CC=CN=C1C(N)=O DY657435 [0,1,0,0,0,0|3,0,0]=4 777 B10R1.61 CC1=CC=NC=C1C(=O)O NO22976 [0,1,0,0,0,0|3,0,0]=4 778 B10R1.61 CC1=CC=NC=C1C(=O)O NO22977 [0,1,0,0,0,0|3,0,0]=4 779 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] DY10428 [0,1,0,0,0,0|3,0,0]=4 780 B10R1.61 CC1=NC=CN=C1N(C)C DY710281 [0,1,0,0,0,0|3,0,0]=4 781 B10R1.61 CN(C)C1=C(Br)C=CC=C1 DY20183 [0,1,0,0,0,0|2,0,0]=3 782 B10R1.61 CN(C)C1=C(Br)C=NC=C1 DY711151 [0,1,0,0,0,0|3,0,0]=4 783 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 DY20288 [0,1,0,0,0,0|2,0,0]=3 784 B10R1.61 CN(C)C1=C(F)C=CC=C1 DY20285 [0,1,0,0,0,0|2,0,0]=3 785 B10R1.61 CN(C)C1=C(N)C=NC=C1 DY557061 [0,1,0,0,0,0|3,0,0]=4 786 B10R1.61 CN(C)C1=C(O)C=CC=C1 NO14782 [0,1,0,0,0,0|2,0,0]=3 787 B10R1.61 CN(C)C1=CC=CC=C1N NO14204 [0,1,0,0,0,0|2,0,0]=3 788 B10R1.61 CN(C)C1=NC=CC=C1N DY606531 [0,1,0,0,0,0|3,0,0]=4 789 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 DY516003 [0,1,0,0,0,0|2,0,0]=3 790 B10R1.61 C[C@@H](N)C1=NC=CC=C1Br DY621531 [0,1,0,0,0,0|3,0,0]=4 791 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 NO13547 [0,1,0,0,0,0|2,0,0]=3 792 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 DY459372 [0,1,0,0,0,0|2,0,0]=3 793 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 NO20301 [0,1,0,0,0,0|2,0,0]=3 794 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 NO20318 [0,1,0,0,0,0|2,0,0]=3 795 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 NO15513 [0,1,0,0,0,0|2,0,0]=3 796 B10R1.61 C[C@H](O)C1=C(N)C=CC=C1 DY548415 [0,1,0,0,0,0|2,0,0]=3 797 B10R1.61 C[C@H](O)C1=CC=CN=C1N DY581181 [0,1,0,0,0,0|3,0,0]=4 798 B10R1.61 N=C(N)C1=C(F)C=CC=C1 DY455898 [0,1,0,0,0,0|3,0,0]=4 799 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 NO20174 [0,1,0,0,0,0|3,0,0]=4 800 B10R1.61 NC(=O)C1=C(O)C=CC=C1 NO11941 [0,1,0,0,0,0|3,0,0]=4 801 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 NO19188 [0,1,0,0,0,0|3,0,0]=4 802 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 NO16216 [0,1,0,0,0,0|3,0,0]=4 803 B10R1.61 O=C(O)C1=C(F)C=CC=C1 NO10366 [0,1,0,0,0,0|3,0,0]=4 804 B10R1.61 O=C(O)C1=C(I)C=CC=C1 NO20137 [0,1,0,0,0,0|3,0,0]=4 805 B10R1.61 O=C(O)C1=C(S)C=CC=C1 DY40297 [0,1,0,0,0,0|3,0,0]=4 806 B10R1.61 O=C(O)C1=CC=CC=C1O DY576081 [0,1,0,0,0,0|3,0,0]=4 807 B10R1.61 O=C([O-])C1=CC=CC=C1O DY560055 [0,1,0,0,0,0|3,0,0]=4 808 B10R1.61 O=C([O-])C1=CC=CC=C1O DY822576 [0,1,0,0,0,0|3,0,0]=4 809 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 NO22913 [0,1,0,0,0,0|3,0,0]=4 810 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 NO21724 [0,1,0,0,0,0|3,0,0]=4 811 B10R1.61 O=[N+]([O-])c1ccccc1I DY41585 [0,1,0,0,0,0|3,0,0]=4 812 B10R1.61 OB(O)C1=C(Br)C=CC=C1 NO21842 [0,1,0,0,0,0|3,0,0]=4 813 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 NO19224 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.61 OB(O)C1=C(F)C=CC=C1 NO16291 [0,1,0,0,0,0|3,0,0]=4 815 B10R1.61 OB(O)C1=C(O)C=CC=C1 NO21880 [0,1,0,0,0,0|3,0,0]=4 816 B10R1.245 BrCC1=C(Br)C=CC=C1Br DY100300 [0,1,0,0,0,0|3,0,0]=4 817 B10R1.245 CC1=C(C#N)C(Cl)=NC=C1 DY20495 [0,1,0,0,0,0|3,0,0]=4 818 B10R1.245 CC1=C(C=O)C(Br)=CC=N1 DY713119 [0,1,0,0,0,0|3,0,0]=4 819 B10R1.245 CC1=CC=CC(Br)=C1C#N NO12993 [0,1,0,0,0,0|2,0,0]=3 820 B10R1.245 CC1=CC=CC(C)=C1C#N NO21705 [0,1,0,0,0,0|2,0,0]=3 821 B10R1.245 CC1=CC=CC(C)=C1C=O NO21067 [0,1,0,0,0,0|2,0,0]=3 822 B10R1.245 CC1=CC=CC(C)=C1CCl DY20793 [0,1,0,0,0,0|2,0,0]=3 823 B10R1.245 CC1=CC=CC(C)=C1CN NO21184 [0,1,0,0,0,0|2,0,0]=3 824 B10R1.245 CC1=CC=CC(C)=C1CO NO10906 [0,1,0,0,0,0|2,0,0]=3 825 B10R1.245 CC1=CC=CC(C)=C1NN NO19886 [0,1,0,0,0,0|2,0,0]=3 826 B10R1.245 CC1=CC=CC(F)=C1C#N NO19871 [0,1,0,0,0,0|2,0,0]=3 827 B10R1.245 CC1=CC=CC(N)=C1C#N DY560523 [0,1,0,0,0,0|2,0,0]=3 828 B10R1.245 CC1=CC=CC(O)=C1C#N NO21595 [0,1,0,0,0,0|2,0,0]=3 829 B10R1.245 CC1=CC=NC(Cl)=C1C=O DY443360 [0,1,0,0,0,0|3,0,0]=4 830 B10R1.245 CC1=CN=CC(Cl)=C1CCl DY586468 [0,1,0,0,0,0|3,0,0]=4 831 B10R1.245 CC1=CN=CC(Cl)=C1CO DY586469 [0,1,0,0,0,0|3,0,0]=4 832 B10R1.245 CCC1=C(O)C=CC=C1N DY442227 [0,1,0,0,0,0|2,0,0]=3 833 B10R1.245 CNC1=C(N)C=NC=C1Br DY714686 [0,1,0,0,0,0|3,0,0]=4 834 B10R1.245 COC1=C(Br)C=CC=C1Br NO21160 [0,1,0,0,0,0|1,0,0]=2 835 B10R1.245 COC1=C(Cl)C=CC=C1C DY822112 [0,1,0,0,0,0|0,0,0]=1 836 B10R1.245 COC1=C(Cl)C=CC=C1F NO12979 [0,1,0,0,0,0|1,0,0]=2 837 B10R1.245 COC1=C(Cl)C=CN=C1N DY658414 [0,1,0,0,0,0|2,0,0]=3 838 B10R1.245 COC1=C(Cl)N=CN=C1Cl NO17497 [0,1,0,0,0,0|3,0,0]=4 839 B10R1.245 COC1=C(Cl)N=CN=C1N NO14562 [0,1,0,0,0,0|3,0,0]=4 840 B10R1.245 COC1=C(F)C=CC=C1I DY20137 [0,1,0,0,0,0|1,0,0]=2 841 B10R1.245 COC1=C(I)C=CN=C1Br DY655126 [0,1,0,0,0,0|2,0,0]=3 842 B10R1.245 COC1=C(N)C=CC=C1F DY20133 [0,1,0,0,0,0|1,0,0]=2 843 B10R1.245 COC1=C(N)C=CN=C1C DY608435 [0,1,0,0,0,0|1,0,0]=2 844 B10R1.245 COC1=C(N)C=NC=C1F DY432228 [0,1,0,0,0,0|2,0,0]=3 845 B10R1.245 Cc1cccc(Br)c1CBr DY584783 [0,1,0,0,0,0|2,0,0]=3 846 B10R1.245 ClCC1=C(Cl)C=CC=C1Cl DY537801 [0,1,0,0,0,0|3,0,0]=4 847 B10R1.245 FC1=C(CBr)C(Br)=CC=C1 DY584642 [0,1,0,0,0,0|3,0,0]=4 848 B10R1.245 FC1=C(CBr)C(I)=CC=C1 DY584763 [0,1,0,0,0,0|3,0,0]=4 849 B10R1.245 FC1=CC=CC(F)=C1CCl NO19270 [0,1,0,0,0,0|3,0,0]=4 850 B10R1.245 N#CC1=C(Br)C=CC=C1F NO10166 [0,1,0,0,0,0|3,0,0]=4 851 B10R1.245 N#CC1=C(Br)C=CC=C1I NO12679 [0,1,0,0,0,0|3,0,0]=4 852 B10R1.245 N#CC1=C(Cl)C=CC=C1I DY20045 [0,1,0,0,0,0|3,0,0]=4 853 B10R1.245 N#CC1=C(F)C=CC=C1I NO10212 [0,1,0,0,0,0|3,0,0]=4 854 B10R1.245 N#CC1=C(N)C=CC=C1Br NO12518 [0,1,0,0,0,0|3,0,0]=4 855 B10R1.245 N#CC1=C(N)C=CC=C1F NO10360 [0,1,0,0,0,0|3,0,0]=4 856 B10R1.245 NCC1=C(Br)C=CC=C1Br NO18032 [0,1,0,0,0,0|3,0,0]=4 857 B10R1.245 NCC1=C(F)C=CC=C1F NO10475 [0,1,0,0,0,0|3,0,0]=4 858 B10R1.245 NCC1=C(N)C=CC=C1F DY744949 [0,1,0,0,0,0|3,0,0]=4 859 B10R1.245 NNC1=C(Cl)C=CC=C1Cl NO19271 [0,1,0,0,0,0|3,0,0]=4 860 B10R1.245 O=CC1=C(Br)C=CC=C1Br NO21162 [0,1,0,0,0,0|3,0,0]=4 861 B10R1.245 O=CC1=C(Br)C=CC=C1Cl NO12691 [0,1,0,0,0,0|3,0,0]=4 862 B10R1.245 O=CC1=C(Br)C=CC=C1F NO10228 [0,1,0,0,0,0|3,0,0]=4 863 B10R1.245 O=CC1=C(Br)C=CC=C1O NO21383 [0,1,0,0,0,0|3,0,0]=4 864 B10R1.245 O=CC1=C(Cl)C=CC=C1Cl NO16083 [0,1,0,0,0,0|3,0,0]=4 865 B10R1.245 O=CC1=C(Cl)C=CC=C1F NO10261 [0,1,0,0,0,0|3,0,0]=4 866 B10R1.245 O=CC1=C(Cl)C=CC=C1O NO20108 [0,1,0,0,0,0|3,0,0]=4 867 B10R1.245 O=CC1=C(F)C=CC=C1O NO20127 [0,1,0,0,0,0|3,0,0]=4 868 B10R1.245 OCC1=C(Br)C=CC=C1F DY447825 [0,1,0,0,0,0|3,0,0]=4 869 B10R1.245 OCC1=C(F)C=CC=C1F NO10419 [0,1,0,0,0,0|3,0,0]=4 870 B10R2.7 C1=CC2=C(C=C1)CSC2 DY114506 [0,0,0,1,0,0|2,0,0]=3 871 B10R2.7 C1=CC2=C(C=C1)OC=N2 NO10994 [0,0,0,1,0,0|1,0,1]=3 872 B10R2.7 C1=CC2=C(C=C1)OCC2 NO20929 [0,0,0,1,0,0|0,0,0]=1 873 B10R2.7 C1=CC2=C(C=C1)SC=C2 NO16362 [0,0,0,1,0,0|0,1,2]=4 874 B10R2.7 C1=CC2=C(C=C1)SC=N2 NO10992 [0,0,0,1,0,0|1,1,1]=4 875 B10R2.7 C1=CC2=C(C=CO2)C=N1 DY545679 [0,0,0,1,0,0|1,0,2]=4 876 B10R2.7 C1=CC2=CNN=C2C=C1 DY761306 [0,0,0,1,0,0|2,0,1]=4 877 B10R2.7 C1=CC2=NCCN2C=C1 DY760292 [0,0,0,1,0,0|2,0,0]=3 878 B10R2.7 C1=CC2=NNN=C2C=C1 DY673386 [0,0,0,1,0,0|3,0,0]=4 879 B10R2.7 C1=CC2=NON=C2C=C1 NO10977 [0,0,0,1,0,0|3,0,0]=4 880 B10R2.7 C1=CC2=NSN=C2C=C1 NO22942 [0,0,0,1,0,0|3,0,0]=4 881 B10R2.7 C1=CC=C2CC=CC2=C1 DY20914 [0,0,0,1,0,0|1,0,1]=3 882 B10R2.7 C1=CC=C2CNCC2=C1 NO11516 [0,0,0,1,0,0|2,0,0]=3 883 B10R2.7 C1=CC=C2NC=CC2=C1 NO11496 [0,0,0,1,0,0|1,0,2]=4 884 B10R2.7 C1=CC=C2NCCC2=C1 NO19084 [0,0,0,1,0,0|1,0,0]=2 885 B10R2.7 C1=CC=C2NN=CC2=C1 NO11488 [0,0,0,1,0,0|2,0,1]=4 886 B10R2.7 C1=CC=C2OC=CC2=C1 NO11169 [0,0,0,1,0,0|0,0,2]=3 887 B10R2.7 C1=CN=C2CCCC2=C1 NO14838 [0,0,0,1,0,0|2,0,0]=3 888 B10R2.7 C1=CN=C2CCNC2=C1 DY107728 [0,0,0,1,0,0|2,0,0]=3 889 B10R2.7 C1=CN=C2CN=NC2=C1 DY675469 [0,0,0,1,0,0|3,0,0]=4 890 B10R2.7 C1=CN=C2CNCC2=C1 DY565581 [0,0,0,1,0,0|3,0,0]=4 891 B10R2.7 C1=CN=C2CNCC2=C1 NO15341 [0,0,0,1,0,0|3,0,0]=4 892 B10R2.7 C1=NC=C2N=NCC2=C1 NO18561 [0,0,0,1,0,0|3,0,0]=4 893 B10R2.7 C1=NC=C2NCCC2=C1 DY570663 [0,0,0,1,0,0|2,0,0]=3 894 B10R2.7 [C-]1=CSC2=CC=CC=C12 DY752635 [0,0,0,1,0,0|0,1,2]=4 895 B10R2.320 BrC1CC2=CC=CC=C21 DY539943 [0,0,0,1,0,0|2,0,0]=3 896 B8R1.11 CC1=C(C=O)C=CO1 DY759980 [0,0,0,0,1,0|3,0,0]=4 897 B8R1.11 CC1=C(CN)SC=C1 DY609391 [0,0,0,0,1,0|3,0,0]=4 898 B8R1.11 CC1=CSC=C1C=O DY570849 [0,0,0,0,1,0|3,0,0]=4 899 B8R1.11 CCC1=NNC=C1C DY647288 [0,0,0,0,1,0|3,0,0]=4 900 B8R1.11 CCN1C=CN=C1C DY540057 [0,0,0,0,1,0|3,0,0]=4 901 B8R1.11 CN1C=CC=C1CN DY717975 [0,0,0,0,1,0|3,0,0]=4 902 B8R1.11 CNC1=NC=CN1C DY725947 [0,0,0,0,1,0|3,0,0]=4 903 B8R1.11 CSC1=C(Br)C=CS1 DY452122 [0,0,0,0,1,0|2,1,0]=4 904 B7R1.3 BrC1=CC=CN=C1 NO19218 [2,0,0,0,0,0|2,0,0]=4 905 B7R1.3 BrC1=CC=NC=C1 NO13376 [2,0,0,0,0,0|2,0,0]=4 906 B7R1.3 BrC1=NC=CC=C1 NO17815 [2,0,0,0,0,0|2,0,0]=4 907 B7R1.3 CC1=CC=CN=N1 NO22374 [2,0,0,0,0,0|2,0,0]=4 908 B7R1.3 CC1=CN=CN=C1 NO18851 [2,0,0,0,0,0|2,0,0]=4 909 B7R1.3 CC1=CN=NC=C1 NO22983 [2,0,0,0,0,0|2,0,0]=4 910 B7R1.3 CC1=NC=NC=C1 NO19795 [2,0,0,0,0,0|2,0,0]=4 911 B7R1.3 C[N+]1=CC=CC=C1 NO17683 [2,0,0,0,0,0|1,0,0]=3 912 B7R1.3 ClC1=CC=NC=C1 DY715154 [2,0,0,0,0,0|2,0,0]=4 913 B7R1.3 ClC1=CC=NC=C1 NO13378 [2,0,0,0,0,0|2,0,0]=4 914 B7R1.3 ClC1=NC=CC=C1 DY20672 [2,0,0,0,0,0|2,0,0]=4 915 B7R1.3 FC1=CC=CC=C1 DY41489 [2,0,0,0,0,0|1,0,0]=3 916 B7R1.3 FC1=CC=CN=C1 DY20006 [2,0,0,0,0,0|2,0,0]=4 917 B7R1.3 FC1=NC=CC=C1 DY20005 [2,0,0,0,0,0|2,0,0]=4 918 B7R1.3 IC1=CC=CC=C1 NO19958 [2,0,0,0,0,0|1,0,0]=3 919 B7R1.3 IC1=NC=CC=C1 NO14565 [2,0,0,0,0,0|2,0,0]=4 920 B7R1.3 NC1=CC=CN=C1 NO19073 [2,0,0,0,0,0|2,0,0]=4 921 B7R1.3 NC1=CC=NC=C1 DY20017 [2,0,0,0,0,0|2,0,0]=4 922 B7R1.3 O=C1C=CC=CN1 NO18724 [2,0,0,0,0,0|1,0,1]=4 923 B7R1.3 O=c1ccocc1 DY460890 [2,0,0,0,0,0|1,0,1]=4 924 B7R1.3 OC1=CC=CN=C1 NO17813 [2,0,0,0,0,0|1,0,0]=3 925 B7R1.3 OC1=CC=NC=C1 NO19216 [2,0,0,0,0,0|1,0,0]=3 926 B7R1.3 OC1=CN=CN=C1 NO10407 [2,0,0,0,0,0|2,0,0]=4 927 B7R1.3 OC1=CN=NC=C1 DY538881 [2,0,0,0,0,0|2,0,0]=4 928 B7R1.3 OC1=CN=NC=C1 NO17666 [2,0,0,0,0,0|2,0,0]=4 929 B7R1.3 OC1=NC=CC=C1 NO21602 [2,0,0,0,0,0|1,0,0]=3 930 B7R1.3 OC1=NC=CC=N1 NO14246 [2,0,0,0,0,0|2,0,0]=4 931 B7R1.3 OC1=NC=CC=N1 NO16090 [2,0,0,0,0,0|2,0,0]=4 932 B7R1.3 OC1=NC=CN=C1 NO21601 [2,0,0,0,0,0|2,0,0]=4 933 B7R1.3 OC1=NC=NC=C1 DY737960 [2,0,0,0,0,0|2,0,0]=4 934 B7R1.3 OC1=NC=NC=C1 NO15728 [2,0,0,0,0,0|2,0,0]=4 935 B7R1.3 [15NH2]C1=CC=CC=C1 DY454761 [2,0,0,0,0,0|1,0,0]=3 936 B7R1.3 [Hg+]C1=CC=CC=C1 DY822438 [2,0,0,0,0,0|1,0,0]=3 937 B9R0.2 C\C=C\C=C\C=C\C(=O)O DY512841 [0,1,1,0,0,0|2,0,0]=4 938 B9R1.1 BrCC1=CC=C(Br)C=C1 NO19166 [1,1,0,0,0,0|2,0,0]=4 939 B9R1.1 BrCC1=CC=C(I)C=C1 NO20172 [1,1,0,0,0,0|2,0,0]=4 940 B9R1.1 CC1=CC=C(C#N)C=C1 NO19807 [1,1,0,0,0,0|2,0,0]=4 941 B9R1.1 CC1=CC=C(CBr)C=C1 NO22969 [1,1,0,0,0,0|2,0,0]=4 942 B9R1.1 CC1=CC=C(CCl)C=C1 DY40603 [1,1,0,0,0,0|2,0,0]=4 943 B9R1.1 CC1=CC=C(CN)C=C1 NO22970 [1,1,0,0,0,0|2,0,0]=4 944 B9R1.1 CC1=CC=C(CO)C=C1 NO19704 [1,1,0,0,0,0|2,0,0]=4 945 B9R1.1 CC1=CC=C(NN)C=C1 NO19576 [1,1,0,0,0,0|2,0,0]=4 946 B9R1.1 CCC1=CC=C(Br)C=C1 NO10865 [1,1,0,0,0,0|1,0,0]=3 947 B9R1.1 CCC1=CC=C(Cl)C=C1 DY584444 [1,1,0,0,0,0|1,0,0]=3 948 B9R1.1 CCC1=CC=C(F)C=C1 DY20965 [1,1,0,0,0,0|1,0,0]=3 949 B9R1.1 CCC1=CC=C(I)C=C1 DY20189 [1,1,0,0,0,0|1,0,0]=3 950 B9R1.1 CCC1=CC=C(N)C=N1 DY515529 [1,1,0,0,0,0|2,0,0]=4 951 B9R1.1 CCC1=CC=C(O)C=C1 DY20188 [1,1,0,0,0,0|1,0,0]=3 952 B9R1.1 CCC1=CN=C(Br)C=C1 NO13124 [1,1,0,0,0,0|2,0,0]=4 953 B9R1.1 CCC1=CN=C(C)C=C1 DY20566 [1,1,0,0,0,0|2,0,0]=4 954 B9R1.1 CCC1=CN=C(N)C=C1 DY585943 [1,1,0,0,0,0|2,0,0]=4 955 B9R1.1 CCC1=CN=C(O)C=C1 DY660020 [1,1,0,0,0,0|2,0,0]=4 956 B9R1.1 CCC1=NC=C(Br)C=C1 NO12376 [1,1,0,0,0,0|2,0,0]=4 957 B9R1.1 CNC1=CC=C(I)C=C1 NO22906 [1,1,0,0,0,0|1,0,0]=3 958 B9R1.1 CNC1=NC=C(Br)C=C1 NO10304 [1,1,0,0,0,0|2,0,0]=4 959 B9R1.1 CNC1=NC=C(F)C=C1 DY711535 [1,1,0,0,0,0|2,0,0]=4 960 B9R1.1 COC1=CC=C(Br)N=N1 NO14617 [1,1,0,0,0,0|2,0,0]=4 961 B9R1.1 COC1=CC=C(Cl)N=N1 NO17689 [1,1,0,0,0,0|2,0,0]=4 962 B9R1.1 COC1=CC=C(N)C=C1 DY584663 [1,1,0,0,0,0|0,0,0]=2 963 B9R1.1 COC1=CC=C(N)C=C1 NO18580 [1,1,0,0,0,0|0,0,0]=2 964 B9R1.1 COC1=CC=C(N)C=N1 NO19527 [1,1,0,0,0,0|1,0,0]=3 965 B9R1.1 COC1=CC=C(N)N=N1 NO22091 [1,1,0,0,0,0|2,0,0]=4 966 B9R1.1 COC1=CC=C(O)C=C1 NO22939 [1,1,0,0,0,0|0,0,0]=2 967 B9R1.1 COC1=CC=[N+]([O-])C=C1 NO18613 [1,1,0,0,0,0|1,0,0]=3 968 B9R1.1 COC1=CN=C(Br)C=C1 NO13470 [1,1,0,0,0,0|1,0,0]=3 969 B9R1.1 COC1=CN=C(Br)C=N1 NO21377 [1,1,0,0,0,0|2,0,0]=4 970 B9R1.1 COC1=CN=C(Cl)C=N1 NO14927 [1,1,0,0,0,0|2,0,0]=4 971 B9R1.1 COC1=CN=C(Cl)N=C1 NO21468 [1,1,0,0,0,0|2,0,0]=4 972 B9R1.1 COC1=CN=C(N)C=C1 NO17791 [1,1,0,0,0,0|1,0,0]=3 973 B9R1.1 COC1=CN=C(N)C=N1 NO19706 [1,1,0,0,0,0|2,0,0]=4 974 B9R1.1 COC1=CN=C(N)N=C1 NO12998 [1,1,0,0,0,0|2,0,0]=4 975 B9R1.1 COC1=CNC(=O)C=C1 DY563727 [1,1,0,0,0,0|1,0,0]=3 976 B9R1.1 COC1=NC=C(Br)C=C1 DY716534 [1,1,0,0,0,0|1,0,0]=3 977 B9R1.1 COC1=NC=C(Br)C=C1 NO22030 [1,1,0,0,0,0|1,0,0]=3 978 B9R1.1 COC1=NC=C(Br)C=N1 NO17652 [1,1,0,0,0,0|2,0,0]=4 979 B9R1.1 COC1=NC=C(C)C=C1 NO21644 [1,1,0,0,0,0|1,0,0]=3 980 B9R1.1 COC1=NC=C(Cl)C=C1 NO17976 [1,1,0,0,0,0|1,0,0]=3 981 B9R1.1 COC1=NC=C(Cl)C=N1 DY552357 [1,1,0,0,0,0|2,0,0]=4 982 B9R1.1 COC1=NC=C(F)C=N1 DY694914 [1,1,0,0,0,0|2,0,0]=4 983 B9R1.1 COC1=NC=C(I)C=C1 NO21641 [1,1,0,0,0,0|1,0,0]=3 984 B9R1.1 COC1=NC=C(N)C=N1 NO21652 [1,1,0,0,0,0|2,0,0]=4 985 B9R1.1 CSC1=CC=C(I)C=C1 DY585121 [1,1,0,0,0,0|0,1,0]=3 986 B9R1.1 CSC1=CC=C(N)C=N1 DY547125 [1,1,0,0,0,0|1,1,0]=4 987 B9R1.1 CSC1=CC=C(O)C=C1 DY20743 [1,1,0,0,0,0|0,1,0]=3 988 B9R1.1 CSC1=NC=C(Cl)C=C1 DY454120 [1,1,0,0,0,0|1,1,0]=4 989 B9R1.1 ClCC1=CC=C(Br)C=C1 NO19167 [1,1,0,0,0,0|2,0,0]=4 990 B9R1.1 ClCC1=CC=C(Cl)C=C1 NO19806 [1,1,0,0,0,0|2,0,0]=4 991 B9R1.1 FC1=CC=C(CBr)C=C1 NO19071 [1,1,0,0,0,0|2,0,0]=4 992 B9R1.1 FCC1=CC=C(Br)C=C1 DY555441 [1,1,0,0,0,0|2,0,0]=4 993 B9R1.1 N#CC1=CC=C(Br)C=C1 NO19210 [1,1,0,0,0,0|2,0,0]=4 994 B9R1.1 N#CC1=CC=C(Cl)C=C1 NO19211 [1,1,0,0,0,0|2,0,0]=4 995 B9R1.1 N#CC1=CC=C(F)C=C1 NO18637 [1,1,0,0,0,0|2,0,0]=4 996 B9R1.1 N#CC1=CC=C(I)C=C1 NO22010 [1,1,0,0,0,0|2,0,0]=4 997 B9R1.1 N#CC1=CC=C(N)C=C1 NO13395 [1,1,0,0,0,0|2,0,0]=4 998 B9R1.1 N#CC1=CC=C(O)C=C1 NO15887 [1,1,0,0,0,0|2,0,0]=4 999 B9R1.1 N#CC1=CC=C(S)C=C1 DY551463 [1,1,0,0,0,0|2,0,0]=4 1000 B9R1.1 NC1=CC=C(C=O)C=C1 DY20423 [1,1,0,0,0,0|2,0,0]=4 1001 B9R1.1 NCC1=CC=C(Br)C=C1 NO19587 [1,1,0,0,0,0|2,0,0]=4 1002 B9R1.1 NCC1=CC=C(F)C=C1 NO18721 [1,1,0,0,0,0|2,0,0]=4 1003 B9R1.1 NCC1=CC=C(O)C=C1 NO22886 [1,1,0,0,0,0|2,0,0]=4 1004 B9R1.1 NNC1=CC=C(Br)C=C1 NO15342 [1,1,0,0,0,0|2,0,0]=4 1005 B9R1.1 NNC1=CC=C(Cl)C=C1 NO13495 [1,1,0,0,0,0|2,0,0]=4 1006 B9R1.1 NNC1=CC=C(F)C=C1 NO22006 [1,1,0,0,0,0|2,0,0]=4 1007 B9R1.1 O=CC1=CC=C(Br)C=C1 NO18612 [1,1,0,0,0,0|2,0,0]=4 1008 B9R1.1 O=CC1=CC=C(Cl)C=C1 NO14843 [1,1,0,0,0,0|2,0,0]=4 1009 B9R1.1 O=CC1=CC=C(F)C=C1 NO19072 [1,1,0,0,0,0|2,0,0]=4 1010 B9R1.1 O=CC1=CC=C(I)C=C1 NO20133 [1,1,0,0,0,0|2,0,0]=4 1011 B9R1.1 O=CC1=CC=C(O)C=C1 NO18686 [1,1,0,0,0,0|2,0,0]=4 1012 B9R1.1 OCC1=CC=C(Br)C=C1 NO19378 [1,1,0,0,0,0|2,0,0]=4 1013 B9R1.1 OCC1=CC=C(Cl)C=C1 NO19353 [1,1,0,0,0,0|2,0,0]=4 1014 B9R1.1 OCC1=CC=C(O)C=C1 NO19212 [1,1,0,0,0,0|2,0,0]=4 1015 B9R1.2 BrCC1=CC=CC(Br)=C1 NO19344 [1,1,0,0,0,0|2,0,0]=4 1016 B9R1.2 C#CC1=CC(F)=CC=C1 NO20642 [1,1,0,0,0,0|1,0,1]=4 1017 B9R1.2 C#CC1=CC=CC(N)=C1 NO10819 [1,1,0,0,0,0|1,0,1]=4 1018 B9R1.2 CC1=CC(CN)=CC=C1 NO19644 [1,1,0,0,0,0|2,0,0]=4 1019 B9R1.2 CC1=CC(NN)=CC=C1 NO19574 [1,1,0,0,0,0|2,0,0]=4 1020 B9R1.2 CC1=CC=CC(C#N)=C1 NO19778 [1,1,0,0,0,0|2,0,0]=4 1021 B9R1.2 CC1=CC=CC(C=O)=C1 DY41127 [1,1,0,0,0,0|2,0,0]=4 1022 B9R1.2 CCC1=CC(C)=CN=C1 DY657240 [1,1,0,0,0,0|2,0,0]=4 1023 B9R1.2 CCC1=CC=CC(Br)=N1 NO15322 [1,1,0,0,0,0|2,0,0]=4 1024 B9R1.2 CCC1=CC=CC(Cl)=C1 DY584271 [1,1,0,0,0,0|1,0,0]=3 1025 B9R1.2 CCC1=CN=CC(Br)=C1 NO11907 [1,1,0,0,0,0|2,0,0]=4 1026 B9R1.2 CCC1=NC=CC(Br)=C1 DY658183 [1,1,0,0,0,0|2,0,0]=4 1027 B9R1.2 CNC1=CC(Br)=CC=C1 NO22185 [1,1,0,0,0,0|1,0,0]=3 1028 B9R1.2 CNC1=CC(Cl)=CC=C1 DY20486 [1,1,0,0,0,0|1,0,0]=3 1029 B9R1.2 CNC1=CC(I)=CC=C1 DY563655 [1,1,0,0,0,0|1,0,0]=3 1030 B9R1.2 CNC1=CC(N)=CC=C1 NO16640 [1,1,0,0,0,0|1,0,0]=3 1031 B9R1.2 CNC1=CC=CC(O)=C1 DY442233 [1,1,0,0,0,0|1,0,0]=3 1032 B9R1.2 CNC1=NC=CC(F)=C1 DY714974 [1,1,0,0,0,0|2,0,0]=4 1033 B9R1.2 CNC1=NC=CC(I)=C1 DY452194 [1,1,0,0,0,0|2,0,0]=4 1034 B9R1.2 CNC1=NC=CC(N)=C1 NO16967 [1,1,0,0,0,0|2,0,0]=4 1035 B9R1.2 COC1=CC(Br)=NC=C1 NO16230 [1,1,0,0,0,0|1,0,0]=3 1036 B9R1.2 COC1=CC(C)=CN=C1 DY451846 [1,1,0,0,0,0|1,0,0]=3 1037 B9R1.2 COC1=CC(Cl)=NC=C1 NO19311 [1,1,0,0,0,0|1,0,0]=3 1038 B9R1.2 COC1=CC(Cl)=NC=N1 NO17690 [1,1,0,0,0,0|2,0,0]=4 1039 B9R1.2 COC1=CC(F)=NC=C1 NO14826 [1,1,0,0,0,0|1,0,0]=3 1040 B9R1.2 COC1=CC(I)=NC=N1 NO17505 [1,1,0,0,0,0|2,0,0]=4 1041 B9R1.2 COC1=CC(N)=NC=C1 NO19522 [1,1,0,0,0,0|1,0,0]=3 1042 B9R1.2 COC1=CC(N)=NC=N1 NO18114 [1,1,0,0,0,0|2,0,0]=4 1043 B9R1.2 COC1=CC=CC(Br)=N1 NO14301 [1,1,0,0,0,0|1,0,0]=3 1044 B9R1.2 COC1=CC=CC(Cl)=C1 NO19894 [1,1,0,0,0,0|0,0,0]=2 1045 B9R1.2 COC1=CC=CC(Cl)=N1 NO13826 [1,1,0,0,0,0|1,0,0]=3 1046 B9R1.2 COC1=CC=CC(F)=C1 NO19929 [1,1,0,0,0,0|0,0,0]=2 1047 B9R1.2 COC1=CC=CC(F)=N1 NO13652 [1,1,0,0,0,0|1,0,0]=3 1048 B9R1.2 COC1=CC=CC(I)=N1 NO18075 [1,1,0,0,0,0|1,0,0]=3 1049 B9R1.2 COC1=CC=CC(N)=C1 NO19943 [1,1,0,0,0,0|0,0,0]=2 1050 B9R1.2 COC1=CC=CC(N)=N1 NO13845 [1,1,0,0,0,0|1,0,0]=3 1051 B9R1.2 COC1=CC=CC(O)=C1 NO18747 [1,1,0,0,0,0|0,0,0]=2 1052 B9R1.2 COC1=CC=C[N+]([O-])=C1 NO22349 [1,1,0,0,0,0|1,0,0]=3 1053 B9R1.2 COC1=CN=CC(Br)=N1 DY431625 [1,1,0,0,0,0|2,0,0]=4 1054 B9R1.2 COC1=CN=CC(Cl)=N1 NO21483 [1,1,0,0,0,0|2,0,0]=4 1055 B9R1.2 COC1=CN=CC(N)=C1 NO19973 [1,1,0,0,0,0|1,0,0]=3 1056 B9R1.2 COC1=CN=CC(N)=N1 NO12541 [1,1,0,0,0,0|2,0,0]=4 1057 B9R1.2 COC1=CN=CC(O)=C1 NO17819 [1,1,0,0,0,0|1,0,0]=3 1058 B9R1.2 COC1=CN=NC(Cl)=C1 NO22227 [1,1,0,0,0,0|2,0,0]=4 1059 B9R1.2 COC1=NC(Br)=NC=C1 NO12506 [1,1,0,0,0,0|2,0,0]=4 1060 B9R1.2 COC1=NC(C)=CC=C1 NO15396 [1,1,0,0,0,0|1,0,0]=3 1061 B9R1.2 COC1=NC(C)=CN=C1 DY710569 [1,1,0,0,0,0|2,0,0]=4 1062 B9R1.2 COC1=NC(C)=NC=C1 NO11919 [1,1,0,0,0,0|2,0,0]=4 1063 B9R1.2 COC1=NC(Cl)=NC=C1 NO21447 [1,1,0,0,0,0|2,0,0]=4 1064 B9R1.2 COC1=NC(I)=NC=C1 NO11917 [1,1,0,0,0,0|2,0,0]=4 1065 B9R1.2 COC1=NC=CC(Br)=C1 NO22650 [1,1,0,0,0,0|1,0,0]=3 1066 B9R1.2 COC1=NC=CC(C)=C1 NO21637 [1,1,0,0,0,0|1,0,0]=3 1067 B9R1.2 COC1=NC=CC(Cl)=C1 NO19313 [1,1,0,0,0,0|1,0,0]=3 1068 B9R1.2 COC1=NC=CC(F)=C1 NO11908 [1,1,0,0,0,0|1,0,0]=3 1069 B9R1.2 COC1=NC=CC(I)=C1 NO19594 [1,1,0,0,0,0|1,0,0]=3 1070 B9R1.2 COC1=NC=CC(N)=C1 NO19525 [1,1,0,0,0,0|1,0,0]=3 1071 B9R1.2 COC1=NC=CC(N)=N1 NO10114 [1,1,0,0,0,0|2,0,0]=4 1072 B9R1.2 CSC1=CC(N)=CC=C1 DY20570 [1,1,0,0,0,0|0,1,0]=3 1073 B9R1.2 CSC1=CC(N)=NC=C1 DY657949 [1,1,0,0,0,0|1,1,0]=4 1074 B9R1.2 CSC1=CN=CC(Br)=C1 DY452608 [1,1,0,0,0,0|1,1,0]=4 1075 B9R1.2 CSC1=NC=CC(Cl)=C1 NO12493 [1,1,0,0,0,0|1,1,0]=4 1076 B9R1.2 ClC1=CC=CC(CBr)=C1 NO22235 [1,1,0,0,0,0|2,0,0]=4 1077 B9R1.2 ClCC1=CC(Br)=CC=C1 DY40579 [1,1,0,0,0,0|2,0,0]=4 1078 B9R1.2 ClCc1cccc(I)c1 DY585080 [1,1,0,0,0,0|2,0,0]=4 1079 B9R1.2 FC1=CC=CC(CCl)=C1 NO19068 [1,1,0,0,0,0|2,0,0]=4 1080 B9R1.2 N#CC1=CC(Br)=CC=C1 NO19865 [1,1,0,0,0,0|2,0,0]=4 1081 B9R1.2 N#CC1=CC(Cl)=CC=C1 NO19319 [1,1,0,0,0,0|2,0,0]=4 1082 B9R1.2 N#CC1=CC(F)=CC=C1 DY20044 [1,1,0,0,0,0|2,0,0]=4 1083 B9R1.2 N#CC1=CC(N)=CC=C1 NO13394 [1,1,0,0,0,0|2,0,0]=4 1084 B9R1.2 N#CC1=CC(O)=CC=C1 NO19377 [1,1,0,0,0,0|2,0,0]=4 1085 B9R1.2 NC1=CC=CC(CO)=C1 NO18821 [1,1,0,0,0,0|2,0,0]=4 1086 B9R1.2 NCC1=CC(Br)=CC=C1 NO19652 [1,1,0,0,0,0|2,0,0]=4 1087 B9R1.2 NCC1=CC(Cl)=CC=C1 DY33134 [1,1,0,0,0,0|2,0,0]=4 1088 B9R1.2 NCC1=CC(I)=CC=C1 DY584527 [1,1,0,0,0,0|2,0,0]=4 1089 B9R1.2 NCC1=CC(I)=CC=C1 NO22330 [1,1,0,0,0,0|2,0,0]=4 1090 B9R1.2 NCC1=CC=CC(O)=C1 DY745447 [1,1,0,0,0,0|2,0,0]=4 1091 B9R1.2 NNC1=CC(Br)=CC=C1 NO19465 [1,1,0,0,0,0|2,0,0]=4 1092 B9R1.2 NNC1=CC(Cl)=CC=C1 NO19479 [1,1,0,0,0,0|2,0,0]=4 1093 B9R1.2 NNC1=CC(F)=CC=C1 NO19485 [1,1,0,0,0,0|2,0,0]=4 1094 B9R1.2 O=CC1=CC(Br)=CC=C1 NO18958 [1,1,0,0,0,0|2,0,0]=4 1095 B9R1.2 O=CC1=CC(Cl)=CC=C1 DY20579 [1,1,0,0,0,0|2,0,0]=4 1096 B9R1.2 O=CC1=CC(F)=CC=C1 NO22298 [1,1,0,0,0,0|2,0,0]=4 1097 B9R1.2 O=CC1=CC(I)=CC=C1 NO20132 [1,1,0,0,0,0|2,0,0]=4 1098 B9R1.2 O=CC1=CC(O)=CC=C1 DY20422 [1,1,0,0,0,0|2,0,0]=4 1099 B9R1.2 OCC1=CC(F)=CC=C1 NO19069 [1,1,0,0,0,0|2,0,0]=4 1100 B9R1.6 CC(=O)C1=CC=CN=C1 NO18256 [1,1,0,0,0,0|2,0,0]=4 1101 B9R1.6 CC(=O)C1=CC=NC=C1 NO22535 [1,1,0,0,0,0|2,0,0]=4 1102 B9R1.6 CC(=O)C1=NC=CC=C1 NO18611 [1,1,0,0,0,0|2,0,0]=4 1103 B9R1.6 CC(C)C1=NC=CC=C1 NO21621 [1,1,0,0,0,0|2,0,0]=4 1104 B9R1.6 CC(N)C1=CC=CC=C1 DY457042 [1,1,0,0,0,0|1,0,0]=3 1105 B9R1.6 CC(O)C1=NC=CC=C1 NO20801 [1,1,0,0,0,0|2,0,0]=4 1106 B9R1.6 CN(C)C1=CC=NC=C1 NO13386 [1,1,0,0,0,0|2,0,0]=4 1107 B9R1.6 CS(=O)C1=CC=CC=C1 DY510356 [1,1,0,0,0,0|0,1,0]=3 1108 B9R1.6 C[C@@H](N)C1=CC=CN=C1 DY553203 [1,1,0,0,0,0|2,0,0]=4 1109 B9R1.6 C[C@@H](N)C1=CC=CN=C1 DY621669 [1,1,0,0,0,0|2,0,0]=4 1110 B9R1.6 C[C@@H](O)C1=NC=CC=C1 DY20310 [1,1,0,0,0,0|2,0,0]=4 1111 B9R1.6 C[C@H](N)C1=CC=CN=C1 DY546027 [1,1,0,0,0,0|2,0,0]=4 1112 B9R1.6 C[C@H](N)C1=NC=CC=C1 NO15370 [1,1,0,0,0,0|2,0,0]=4 1113 B9R1.6 C[PH](=O)C1=CC=CC=C1 NO16386 [1,1,0,0,0,0|1,0,0]=3 1114 B9R1.6 C[S@@](=O)C1=CC=CC=C1 DY621380 [1,1,0,0,0,0|0,1,0]=3 1115 B9R1.6 ClP(Cl)C1=CC=CC=C1 DY822051 [1,1,0,0,0,0|2,0,0]=4 1116 B9R1.6 N=C(N)C1=CC=CC=C1 NO14830 [1,1,0,0,0,0|2,0,0]=4 1117 B9R1.6 O=C(Br)C1=CC=CC=C1 DY585100 [1,1,0,0,0,0|2,0,0]=4 1118 B9R1.6 O=C(Cl)C1=CC=CC=C1 DY40435 [1,1,0,0,0,0|2,0,0]=4 1119 B9R1.6 O=C([O-])C1=CC=CC=C1 DY558819 [1,1,0,0,0,0|2,0,0]=4 1120 B9R1.6 O=[PH](O)C1=CC=CC=C1 DY532299 [1,1,0,0,0,0|2,0,0]=4 1121 B9R1.6 OB(O)C1=CC=CC=C1 NO19450 [1,1,0,0,0,0|2,0,0]=4 1122 B9R1.8 BrCCC1=CC=CN=C1 DY608158 [1,1,0,0,0,0|2,0,0]=4 1123 B9R1.8 C#CCC1=CC=CC=C1 DY501873 [1,1,0,0,0,0|1,0,1]=4 1124 B9R1.8 CCCC1=CC=CN=C1 NO22402 [1,1,0,0,0,0|2,0,0]=4 1125 B9R1.8 CCOC1=CC=CN=N1 DY736406 [1,1,0,0,0,0|2,0,0]=4 1126 B9R1.8 CCOC1=NC=CN=C1 NO21524 [1,1,0,0,0,0|2,0,0]=4 1127 B9R1.8 CNCC1=CC=CC=C1 DY10559 [1,1,0,0,0,0|1,0,0]=3 1128 B9R1.8 CNCC1=CC=CC=C1 DY20323 [1,1,0,0,0,0|1,0,0]=3 1129 B9R1.8 CNCC1=CC=CC=C1 DY21006 [1,1,0,0,0,0|1,0,0]=3 1130 B9R1.8 CNCC1=CC=CN=C1 NO18846 [1,1,0,0,0,0|2,0,0]=4 1131 B9R1.8 CNCC1=CC=NC=C1 DY712153 [1,1,0,0,0,0|2,0,0]=4 1132 B9R1.8 CNCC1=NC=CC=C1 DY501242 [1,1,0,0,0,0|2,0,0]=4 1133 B9R1.8 CNCC1=NC=CC=C1 DY663671 [1,1,0,0,0,0|2,0,0]=4 1134 B9R1.8 COCC1=NC=CC=C1 NO20909 [1,1,0,0,0,0|1,0,0]=3 1135 B9R1.8 ClCCC1=CC=NC=C1 NO17913 [1,1,0,0,0,0|2,0,0]=4 1136 B9R1.8 ClCSC1=CC=CC=C1 DY797799 [1,1,0,0,0,0|0,1,0]=3 1137 B9R1.8 N#C[Se]C1=CC=CC=C1 DY822031 [1,1,0,0,0,0|0,1,1]=4 1138 B9R1.8 NCCC1=CC=CN=C1 NO21892 [1,1,0,0,0,0|2,0,0]=4 1139 B9R1.8 NCCC1=NC=CC=C1 NO14064 [1,1,0,0,0,0|2,0,0]=4 1140 B9R1.8 NNCC1=CC=CC=C1 NO11006 [1,1,0,0,0,0|2,0,0]=4 1141 B9R1.8 NNCC1=CC=CC=C1 NO12127 [1,1,0,0,0,0|2,0,0]=4 1142 B9R1.8 NOCC1=CC=CC=C1 NO14063 [1,1,0,0,0,0|1,0,0]=3 1143 B9R1.8 ONCC1=CC=CC=C1 DY563853 [1,1,0,0,0,0|2,0,0]=4 1144 B9R1.8 ONCC1=CC=CC=C1 NO11753 [1,1,0,0,0,0|2,0,0]=4 1145 B9R1.3 CC1=C(Br)C(Cl)=NC=C1 NO14983 [1,1,0,0,0,0|2,0,0]=4 1146 B9R1.3 CC1=C(Br)C(F)=NC=C1 NO20037 [1,1,0,0,0,0|2,0,0]=4 1147 B9R1.3 CC1=C(Br)C(O)=NC=C1 NO21575 [1,1,0,0,0,0|2,0,0]=4 1148 B9R1.3 CC1=C(Br)C=CC=C1Br NO20164 [1,1,0,0,0,0|1,0,0]=3 1149 B9R1.3 CC1=C(Br)C=CC=C1F NO19838 [1,1,0,0,0,0|1,0,0]=3 1150 B9R1.3 CC1=C(Br)C=CC=C1I NO16145 [1,1,0,0,0,0|1,0,0]=3 1151 B9R1.3 CC1=C(Br)C=CN=C1Cl NO21442 [1,1,0,0,0,0|2,0,0]=4 1152 B9R1.3 CC1=C(Br)C=NC=C1Cl DY452524 [1,1,0,0,0,0|2,0,0]=4 1153 B9R1.3 CC1=C(C)C(Br)=CC=C1 NO19738 [1,1,0,0,0,0|0,0,0]=2 1154 B9R1.3 CC1=C(C)C(N)=NC=C1 NO14451 [1,1,0,0,0,0|1,0,0]=3 1155 B9R1.3 CC1=C(C)C(O)=NC=C1 DY431552 [1,1,0,0,0,0|1,0,0]=3 1156 B9R1.3 CC1=C(Cl)C=CC=C1Cl NO21173 [1,1,0,0,0,0|1,0,0]=3 1157 B9R1.3 CC1=C(F)C(Br)=CC=C1 DY30221 [1,1,0,0,0,0|1,0,0]=3 1158 B9R1.3 CC1=C(F)C(Br)=NC=C1 NO19394 [1,1,0,0,0,0|2,0,0]=4 1159 B9R1.3 CC1=C(F)C(Cl)=NC=C1 NO19389 [1,1,0,0,0,0|2,0,0]=4 1160 B9R1.3 CC1=C(F)C(N)=NC=C1 DY433034 [1,1,0,0,0,0|2,0,0]=4 1161 B9R1.3 CC1=C(F)C=CC=C1F NO19669 [1,1,0,0,0,0|1,0,0]=3 1162 B9R1.3 CC1=C(F)C=CN=C1Cl DY450904 [1,1,0,0,0,0|2,0,0]=4 1163 B9R1.3 CC1=C(I)C(Cl)=CC=C1 NO20195 [1,1,0,0,0,0|1,0,0]=3 1164 B9R1.3 CC1=C(I)C(Cl)=NC=C1 DY448288 [1,1,0,0,0,0|2,0,0]=4 1165 B9R1.3 CC1=C(I)C(F)=CC=C1 NO20026 [1,1,0,0,0,0|1,0,0]=3 1166 B9R1.3 CC1=C(I)C=CN=C1Cl DY425783 [1,1,0,0,0,0|2,0,0]=4 1167 B9R1.3 CC1=C(I)C=CN=C1F NO18757 [1,1,0,0,0,0|2,0,0]=4 1168 B9R1.3 CC1=C(N)C(Br)=NC=C1 NO13575 [1,1,0,0,0,0|2,0,0]=4 1169 B9R1.3 CC1=C(N)C(Cl)=NC=C1 NO19470 [1,1,0,0,0,0|2,0,0]=4 1170 B9R1.3 CC1=C(N)C(N)=CC=C1 DY790251 [1,1,0,0,0,0|1,0,0]=3 1171 B9R1.3 CC1=C(N)C=CC=C1Br DY20171 [1,1,0,0,0,0|1,0,0]=3 1172 B9R1.3 CC1=C(N)C=CC=C1Cl NO16197 [1,1,0,0,0,0|1,0,0]=3 1173 B9R1.3 CC1=C(N)C=CC=C1F DY585178 [1,1,0,0,0,0|1,0,0]=3 1174 B9R1.3 CC1=C(N)C=CC=C1F NO10512 [1,1,0,0,0,0|1,0,0]=3 1175 B9R1.3 CC1=C(N)C=NC=C1Br NO14627 [1,1,0,0,0,0|2,0,0]=4 1176 B9R1.3 CC1=C(O)C(=O)C=CO1 DY21095 [1,1,0,0,0,0|1,0,0]=3 1177 B9R1.3 CC1=C(O)C(Cl)=NC=C1 NO16152 [1,1,0,0,0,0|1,0,0]=3 1178 B9R1.3 CC1=C(O)C=CC=C1Br NO14415 [1,1,0,0,0,0|0,0,0]=2 1179 B9R1.3 CC1=C(O)C=CC=C1Cl NO22210 [1,1,0,0,0,0|0,0,0]=2 1180 B9R1.3 CC1=C(O)C=CC=C1F DY433104 [1,1,0,0,0,0|0,0,0]=2 1181 B9R1.3 CC1=C(O)C=CC=C1O DY20744 [1,1,0,0,0,0|0,0,0]=2 1182 B9R1.3 CC1=C(O)N=CN=C1O DY461148 [1,1,0,0,0,0|2,0,0]=4 1183 B9R1.3 CC1=CC=CC(Br)=C1Br DY585024 [1,1,0,0,0,0|1,0,0]=3 1184 B9R1.3 CC1=CC=CC(Br)=C1N NO10505 [1,1,0,0,0,0|1,0,0]=3 1185 B9R1.3 CC1=CC=CC(Br)=[N+]1[O-] DY584264 [1,1,0,0,0,0|1,0,1]=4 1186 B9R1.3 CC1=CC=CC(C)=C1Br NO19952 [1,1,0,0,0,0|1,0,0]=3 1187 B9R1.3 CC1=CC=CC(C)=C1O NO21185 [1,1,0,0,0,0|0,0,0]=2 1188 B9R1.3 CC1=CC=CC(C)=C1S DY789459 [1,1,0,0,0,0|0,1,0]=3 1189 B9R1.3 CC1=CC=CC(Cl)=C1F NO22205 [1,1,0,0,0,0|1,0,0]=3 1190 B9R1.3 CC1=CC=CC(Cl)=C1N NO13397 [1,1,0,0,0,0|1,0,0]=3 1191 B9R1.3 CC1=CC=CC(F)=C1F NO19914 [1,1,0,0,0,0|1,0,0]=3 1192 B9R1.3 CC1=CC=CC(F)=C1N NO10511 [1,1,0,0,0,0|1,0,0]=3 1193 B9R1.3 CC1=CC=CC(N)=C1Br NO12669 [1,1,0,0,0,0|1,0,0]=3 1194 B9R1.3 CC1=CC=CC(N)=C1O NO13842 [1,1,0,0,0,0|0,0,0]=2 1195 B9R1.3 CC1=CC=CC(O)=C1F DY20207 [1,1,0,0,0,0|1,0,0]=3 1196 B9R1.3 CC1=CC=CC(O)=C1I DY442299 [1,1,0,0,0,0|1,0,0]=3 1197 B9R1.3 CC1=CC=CC(O)=C1N NO14085 [1,1,0,0,0,0|1,0,0]=3 1198 B9R1.3 CC1=CN=CC(Br)=C1C DY453100 [1,1,0,0,0,0|1,0,0]=3 1199 B9R1.3 CC1=CN=CC(Br)=C1N NO19435 [1,1,0,0,0,0|2,0,0]=4 1200 B9R1.3 CC1=NC=CC(Br)=C1C NO15313 [1,1,0,0,0,0|1,0,0]=3 1201 B9R1.3 CC1=NC=CC(Br)=C1Cl DY658207 [1,1,0,0,0,0|2,0,0]=4 1202 B9R1.3 CC1=NC=CC(Br)=C1F NO17321 [1,1,0,0,0,0|2,0,0]=4 1203 B9R1.3 CC1=NC=CC(Br)=C1N DY713107 [1,1,0,0,0,0|2,0,0]=4 1204 B9R1.3 CC1=NC=CC(C)=C1O DY430625 [1,1,0,0,0,0|1,0,0]=3 1205 B9R1.3 CC1=NC=CC(Cl)=C1F DY711385 [1,1,0,0,0,0|2,0,0]=4 1206 B9R1.3 CC1=NC=CC(Cl)=C1I DY658407 [1,1,0,0,0,0|2,0,0]=4 1207 B9R1.3 CC1=NC=CC(Cl)=C1N NO15139 [1,1,0,0,0,0|2,0,0]=4 1208 B9R1.3 CC1=NC=CC(I)=C1Cl DY586507 [1,1,0,0,0,0|2,0,0]=4 1209 B9R1.3 CC1=NC=CC(N)=C1C NO14420 [1,1,0,0,0,0|1,0,0]=3 1210 B9R1.3 CC1=NC=CC(N)=C1N NO21697 [1,1,0,0,0,0|2,0,0]=4 1211 B9R1.3 CC1=NC=CC(O)=C1N DY512937 [1,1,0,0,0,0|2,0,0]=4 1212 B9R1.3 CC1=NC=CC(O)=C1O DY656055 [1,1,0,0,0,0|1,0,0]=3 1213 B9R1.3 CN1C(=O)C=CC=C1Cl NO17012 [1,1,0,0,0,0|1,0,1]=4 1214 B9R1.3 CN1C=CC=C(N)C1=O DY425210 [1,1,0,0,0,0|1,0,1]=4 1215 B9R1.3 ClC1=C(Br)C=CC=C1Br NO15022 [1,1,0,0,0,0|2,0,0]=4 1216 B9R1.3 ClC1=CC=CC(Br)=C1I DY452860 [1,1,0,0,0,0|2,0,0]=4 1217 B9R1.3 ClC1=CC=CC(Cl)=C1Br NO13889 [1,1,0,0,0,0|2,0,0]=4 1218 B9R1.3 FC1=C(Br)C=CC=C1Br NO16311 [1,1,0,0,0,0|2,0,0]=4 1219 B9R1.3 FC1=C(Br)C=CC=C1Cl DY31054 [1,1,0,0,0,0|2,0,0]=4 1220 B9R1.3 FC1=C(Cl)C(I)=CC=C1 DY686533 [1,1,0,0,0,0|2,0,0]=4 1221 B9R1.3 FC1=C(Cl)C=CC=C1Cl NO21170 [1,1,0,0,0,0|2,0,0]=4 1222 B9R1.3 FC1=CC=CC(Br)=C1I DY452848 [1,1,0,0,0,0|2,0,0]=4 1223 B9R1.3 FC1=CC=CC(Cl)=C1Br NO12182 [1,1,0,0,0,0|2,0,0]=4 1224 B9R1.3 FC1=CC=CC(F)=C1Cl DY30191 [1,1,0,0,0,0|2,0,0]=4 1225 B9R1.3 NC1=C(Br)C(Br)=CC=C1 DY584419 [1,1,0,0,0,0|2,0,0]=4 1226 B9R1.3 NC1=C(Br)C(Cl)=CC=C1 NO12729 [1,1,0,0,0,0|2,0,0]=4 1227 B9R1.3 NC1=C(Br)C(F)=CC=C1 NO22950 [1,1,0,0,0,0|2,0,0]=4 1228 B9R1.3 NC1=C(Br)C=CC=C1Br NO19185 [1,1,0,0,0,0|2,0,0]=4 1229 B9R1.3 NC1=C(Br)C=CC=C1Cl NO17061 [1,1,0,0,0,0|2,0,0]=4 1230 B9R1.3 NC1=C(Cl)C(Cl)=CC=C1 NO15257 [1,1,0,0,0,0|2,0,0]=4 1231 B9R1.3 NC1=C(Cl)C(F)=CC=C1 NO22961 [1,1,0,0,0,0|2,0,0]=4 1232 B9R1.3 NC1=C(Cl)C=CC=C1Cl NO19030 [1,1,0,0,0,0|2,0,0]=4 1233 B9R1.3 NC1=C(Cl)C=CC=C1F NO14207 [1,1,0,0,0,0|2,0,0]=4 1234 B9R1.3 NC1=C(Cl)C=CC=C1I NO21480 [1,1,0,0,0,0|2,0,0]=4 1235 B9R1.3 NC1=C(F)C(Cl)=CC=C1 NO22203 [1,1,0,0,0,0|2,0,0]=4 1236 B9R1.3 NC1=C(F)C=CC=C1F NO22980 [1,1,0,0,0,0|2,0,0]=4 1237 B9R1.3 NC1=C(F)C=CC=C1I DY577713 [1,1,0,0,0,0|2,0,0]=4 1238 B9R1.3 NC1=C(I)C(Cl)=CC=C1 NO17354 [1,1,0,0,0,0|2,0,0]=4 1239 B9R1.3 NC1=C(I)C(F)=CC=C1 DY20040 [1,1,0,0,0,0|2,0,0]=4 1240 B9R1.3 NC1=C(O)C(Br)=CC=C1 NO14079 [1,1,0,0,0,0|1,0,0]=3 1241 B9R1.3 NC1=C(O)C(Br)=CN=C1 DY113808 [1,1,0,0,0,0|2,0,0]=4 1242 B9R1.3 NC1=C(O)C(Br)=CN=C1 NO14319 [1,1,0,0,0,0|2,0,0]=4 1243 B9R1.3 NC1=C(O)C(Cl)=CC=C1 NO13388 [1,1,0,0,0,0|1,0,0]=3 1244 B9R1.3 NC1=C(O)C(Cl)=NC=C1 DY512913 [1,1,0,0,0,0|2,0,0]=4 1245 B9R1.3 NC1=C(O)C(Cl)=NC=C1 DY608152 [1,1,0,0,0,0|2,0,0]=4 1246 B9R1.3 NC1=C(O)C(F)=CC=C1 NO10703 [1,1,0,0,0,0|1,0,0]=3 1247 B9R1.3 NC1=C(O)C=CC=C1Br NO12191 [1,1,0,0,0,0|1,0,0]=3 1248 B9R1.3 NC1=C(O)C=CC=C1F NO13672 [1,1,0,0,0,0|1,0,0]=3 1249 B9R1.3 NC1=C(O)C=CC=C1I DY584579 [1,1,0,0,0,0|1,0,0]=3 1250 B9R1.3 NC1=C(O)C=CC=C1O NO21312 [1,1,0,0,0,0|1,0,0]=3 1251 B9R1.3 NC1=CC=CC(Br)=C1N NO13189 [1,1,0,0,0,0|2,0,0]=4 1252 B9R1.3 NC1=CC=CC(F)=C1N NO21010 [1,1,0,0,0,0|2,0,0]=4 1253 B9R1.3 NC1=CC=CC(N)=C1O DY793185 [1,1,0,0,0,0|1,0,0]=3 1254 B9R1.3 NC1=CC=CC(O)=C1Br NO15538 [1,1,0,0,0,0|1,0,0]=3 1255 B9R1.3 NC1=CC=CC(O)=C1Cl DY584534 [1,1,0,0,0,0|1,0,0]=3 1256 B9R1.3 O=C1NC=CC(O)=C1Br DY427594 [1,1,0,0,0,0|2,0,0]=4 1257 B9R1.3 OC1=C(Br)C(Cl)=CC=C1 NO21337 [1,1,0,0,0,0|1,0,0]=3 1258 B9R1.3 OC1=C(Br)C=CC=C1Br NO15261 [1,1,0,0,0,0|1,0,0]=3 1259 B9R1.3 OC1=C(Br)C=CC=C1Cl NO15849 [1,1,0,0,0,0|1,0,0]=3 1260 B9R1.3 OC1=C(Br)C=CC=C1F NO22904 [1,1,0,0,0,0|1,0,0]=3 1261 B9R1.3 OC1=C(Br)C=CC=C1I DY441065 [1,1,0,0,0,0|1,0,0]=3 1262 B9R1.3 OC1=C(Cl)C(Br)=CC=C1 NO19373 [1,1,0,0,0,0|1,0,0]=3 1263 B9R1.3 OC1=C(Cl)C(Cl)=CC=C1 NO21020 [1,1,0,0,0,0|1,0,0]=3 1264 B9R1.3 OC1=C(Cl)C(F)=CC=C1 NO21431 [1,1,0,0,0,0|1,0,0]=3 1265 B9R1.3 OC1=C(Cl)C=CC=C1Cl NO21171 [1,1,0,0,0,0|1,0,0]=3 1266 B9R1.3 OC1=C(Cl)C=CC=C1F NO18835 [1,1,0,0,0,0|1,0,0]=3 1267 B9R1.3 OC1=C(Cl)C=CC=C1I DY441025 [1,1,0,0,0,0|1,0,0]=3 1268 B9R1.3 OC1=C(Cl)C=NC=C1Cl NO22692 [1,1,0,0,0,0|2,0,0]=4 1269 B9R1.3 OC1=C(F)C(Cl)=CC=C1 NO22204 [1,1,0,0,0,0|1,0,0]=3 1270 B9R1.3 OC1=C(F)C(F)=CC=C1 NO18870 [1,1,0,0,0,0|1,0,0]=3 1271 B9R1.3 OC1=C(F)C=CC=C1F NO18872 [1,1,0,0,0,0|1,0,0]=3 1272 B9R1.3 OC1=CC=CC(F)=C1O DY20210 [1,1,0,0,0,0|1,0,0]=3 1273 B9R1.3 OC1=CC=CC(O)=C1Br DY443180 [1,1,0,0,0,0|1,0,0]=3 1274 B9R1.3 OC1=CC=CC(O)=C1Cl NO19075 [1,1,0,0,0,0|1,0,0]=3 1275 B9R1.3 OC1=CC=CC(O)=C1F DY433390 [1,1,0,0,0,0|1,0,0]=3 1276 B9R1.3 OC1=CC=CC(O)=C1I DY443433 [1,1,0,0,0,0|1,0,0]=3 1277 B9R1.3 OC1=NC=CC(Br)=C1F DY658213 [1,1,0,0,0,0|2,0,0]=4 1278 B9R1.69 BrC1=C(I)C=C(I)C=C1 DY584301 [1,1,0,0,0,0|2,0,0]=4 1279 B9R1.69 CC1=C(Br)C=C(Br)C=C1 DY33103 [1,1,0,0,0,0|1,0,0]=3 1280 B9R1.69 CC1=C(Br)C=C(F)C=C1 DY20047 [1,1,0,0,0,0|1,0,0]=3 1281 B9R1.69 CC1=C(Br)C=C(I)C=C1 NO21358 [1,1,0,0,0,0|1,0,0]=3 1282 B9R1.69 CC1=C(Br)C=C(N)C=C1 NO10506 [1,1,0,0,0,0|1,0,0]=3 1283 B9R1.69 CC1=C(Br)C=C(N)C=N1 NO18819 [1,1,0,0,0,0|2,0,0]=4 1284 B9R1.69 CC1=C(Br)C=C(O)C=C1 NO12184 [1,1,0,0,0,0|1,0,0]=3 1285 B9R1.69 CC1=C(Br)C=CC(Br)=C1 NO21137 [1,1,0,0,0,0|1,0,0]=3 1286 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 NO20166 [1,1,0,0,0,0|1,0,0]=3 1287 B9R1.69 CC1=C(Br)C=CC(F)=C1 NO10390 [1,1,0,0,0,0|1,0,0]=3 1288 B9R1.69 CC1=C(Br)C=CC(N)=C1 NO15448 [1,1,0,0,0,0|1,0,0]=3 1289 B9R1.69 CC1=C(Br)C=CC(N)=N1 NO23028 [1,1,0,0,0,0|2,0,0]=4 1290 B9R1.69 CC1=C(Br)C=CC(O)=C1 NO20279 [1,1,0,0,0,0|1,0,0]=3 1291 B9R1.69 CC1=C(Br)C=CC(O)=N1 NO18359 [1,1,0,0,0,0|2,0,0]=4 1292 B9R1.69 CC1=C(Br)N=CC(N)=C1 NO19464 [1,1,0,0,0,0|2,0,0]=4 1293 B9R1.69 CC1=C(C)C=C(S)C=C1 DY535125 [1,1,0,0,0,0|0,0,0]=2 1294 B9R1.69 CC1=C(C)N=C(N)C=N1 DY115982 [1,1,0,0,0,0|2,0,0]=4 1295 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 NO22639 [1,1,0,0,0,0|1,0,0]=3 1296 B9R1.69 CC1=C(Cl)C=C(Cl)C=C1 NO21102 [1,1,0,0,0,0|1,0,0]=3 1297 B9R1.69 CC1=C(Cl)C=C(F)C=C1 NO10409 [1,1,0,0,0,0|1,0,0]=3 1298 B9R1.69 CC1=C(Cl)C=C(I)C=C1 DY451264 [1,1,0,0,0,0|1,0,0]=3 1299 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 NO19135 [1,1,0,0,0,0|1,0,0]=3 1300 B9R1.69 CC1=C(Cl)C=CC(I)=C1 NO20194 [1,1,0,0,0,0|1,0,0]=3 1301 B9R1.69 CC1=C(Cl)N=C(N)C=C1 NO21753 [1,1,0,0,0,0|2,0,0]=4 1302 B9R1.69 CC1=C(Cl)N=CC(N)=C1 NO14239 [1,1,0,0,0,0|2,0,0]=4 1303 B9R1.69 CC1=C(Cl)N=CC(O)=C1 NO15214 [1,1,0,0,0,0|2,0,0]=4 1304 B9R1.69 CC1=C(F)C=C(Br)C=C1 NO14669 [1,1,0,0,0,0|1,0,0]=3 1305 B9R1.69 CC1=C(F)C=C(Cl)C=C1 DY41507 [1,1,0,0,0,0|1,0,0]=3 1306 B9R1.69 CC1=C(F)C=C(F)C=C1 NO19066 [1,1,0,0,0,0|1,0,0]=3 1307 B9R1.69 CC1=C(F)C=C(N)C=C1 DY20039 [1,1,0,0,0,0|1,0,0]=3 1308 B9R1.69 CC1=C(F)C=C(O)C=C1 NO10481 [1,1,0,0,0,0|1,0,0]=3 1309 B9R1.69 CC1=C(F)C=CC(Cl)=C1 NO14434 [1,1,0,0,0,0|1,0,0]=3 1310 B9R1.69 CC1=C(F)C=CC(F)=C1 NO19928 [1,1,0,0,0,0|1,0,0]=3 1311 B9R1.69 CC1=C(F)C=CC(I)=C1 NO10424 [1,1,0,0,0,0|1,0,0]=3 1312 B9R1.69 CC1=C(F)C=CC(N)=C1 NO10514 [1,1,0,0,0,0|1,0,0]=3 1313 B9R1.69 CC1=C(F)C=CC(O)=C1 NO10483 [1,1,0,0,0,0|1,0,0]=3 1314 B9R1.69 CC1=C(I)C=C(Br)C=C1 DY41501 [1,1,0,0,0,0|1,0,0]=3 1315 B9R1.69 CC1=C(I)C=CC(=O)N1 NO15056 [1,1,0,0,0,0|2,0,0]=4 1316 B9R1.69 CC1=C(I)C=CC(Br)=C1 NO10398 [1,1,0,0,0,0|1,0,0]=3 1317 B9R1.69 CC1=C(I)C=CC(O)=C1 NO22901 [1,1,0,0,0,0|1,0,0]=3 1318 B9R1.69 CC1=C(I)N=CC(N)=C1 DY661206 [1,1,0,0,0,0|2,0,0]=4 1319 B9R1.69 CC1=C(N)C=C(Br)C=C1 NO14257 [1,1,0,0,0,0|1,0,0]=3 1320 B9R1.69 CC1=C(N)C=C(I)C=C1 NO20374 [1,1,0,0,0,0|1,0,0]=3 1321 B9R1.69 CC1=C(N)C=CC(=O)N1 DY425072 [1,1,0,0,0,0|2,0,0]=4 1322 B9R1.69 CC1=C(N)C=CC(Br)=C1 NO15106 [1,1,0,0,0,0|1,0,0]=3 1323 B9R1.69 CC1=C(N)C=CC(Cl)=C1 NO16371 [1,1,0,0,0,0|1,0,0]=3 1324 B9R1.69 CC1=C(N)C=CC(F)=C1 NO10513 [1,1,0,0,0,0|1,0,0]=3 1325 B9R1.69 CC1=C(N)C=CC(I)=C1 NO20371 [1,1,0,0,0,0|1,0,0]=3 1326 B9R1.69 CC1=C(N)C=CC(N)=C1 NO18566 [1,1,0,0,0,0|1,0,0]=3 1327 B9R1.69 CC1=C(N)C=CC(O)=C1 NO14087 [1,1,0,0,0,0|1,0,0]=3 1328 B9R1.69 CC1=C(N)C=NC(Br)=C1 NO19458 [1,1,0,0,0,0|2,0,0]=4 1329 B9R1.69 CC1=C(N)C=NC(Cl)=C1 NO19473 [1,1,0,0,0,0|2,0,0]=4 1330 B9R1.69 CC1=C(N)C=NC(F)=C1 DY20830 [1,1,0,0,0,0|2,0,0]=4 1331 B9R1.69 CC1=C(O)C=C(Br)C=C1 NO10275 [1,1,0,0,0,0|0,0,0]=2 1332 B9R1.69 CC1=C(O)C=C(F)C=C1 NO10484 [1,1,0,0,0,0|0,0,0]=2 1333 B9R1.69 CC1=C(O)C=C(I)C=C1 DY451996 [1,1,0,0,0,0|0,0,0]=2 1334 B9R1.69 CC1=C(O)C=C(O)C=C1 NO20391 [1,1,0,0,0,0|0,0,0]=2 1335 B9R1.69 CC1=C(O)C=CC(Br)=C1 DY20395 [1,1,0,0,0,0|0,0,0]=2 1336 B9R1.69 CC1=C(O)C=CC(Cl)=C1 NO20290 [1,1,0,0,0,0|0,0,0]=2 1337 B9R1.69 CC1=C(O)C=CC(F)=C1 NO10482 [1,1,0,0,0,0|0,0,0]=2 1338 B9R1.69 CC1=C(S)C=CC(F)=C1 DY584410 [1,1,0,0,0,0|0,1,0]=3 1339 B9R1.69 CC1=CC(Br)=C(Br)C=C1 DY41513 [1,1,0,0,0,0|2,0,0]=4 1340 B9R1.69 CC1=CC(Br)=C(C)C=C1 NO21410 [1,1,0,0,0,0|1,0,0]=3 1341 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 NO20167 [1,1,0,0,0,0|2,0,0]=4 1342 B9R1.69 CC1=CC(Br)=C(F)C=C1 DY20046 [1,1,0,0,0,0|2,0,0]=4 1343 B9R1.69 CC1=CC(Br)=C(N)C=C1 NO19777 [1,1,0,0,0,0|2,0,0]=4 1344 B9R1.69 CC1=CC(Br)=CN=C1Br NO18978 [1,1,0,0,0,0|2,0,0]=4 1345 B9R1.69 CC1=CC(Br)=CN=C1F NO14095 [1,1,0,0,0,0|2,0,0]=4 1346 B9R1.69 CC1=CC(Br)=CN=C1N DY20013 [1,1,0,0,0,0|2,0,0]=4 1347 B9R1.69 CC1=CC(Br)=CN=C1O NO18541 [1,1,0,0,0,0|1,0,0]=3 1348 B9R1.69 CC1=CC(Br)=NC=C1Br NO14171 [1,1,0,0,0,0|2,0,0]=4 1349 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 NO19979 [1,1,0,0,0,0|2,0,0]=4 1350 B9R1.69 CC1=CC(Cl)=C(Cl)C=C1 NO21935 [1,1,0,0,0,0|2,0,0]=4 1351 B9R1.69 CC1=CC(Cl)=C(O)C=C1 NO20292 [1,1,0,0,0,0|1,0,0]=3 1352 B9R1.69 CC1=CC(Cl)=CN=C1Br NO15514 [1,1,0,0,0,0|2,0,0]=4 1353 B9R1.69 CC1=CC(Cl)=CN=C1Cl NO15205 [1,1,0,0,0,0|2,0,0]=4 1354 B9R1.69 CC1=CC(Cl)=CN=C1F NO14231 [1,1,0,0,0,0|2,0,0]=4 1355 B9R1.69 CC1=CC(Cl)=CN=C1N NO13921 [1,1,0,0,0,0|2,0,0]=4 1356 B9R1.69 CC1=CC(Cl)=CN=C1O DY20516 [1,1,0,0,0,0|1,0,0]=3 1357 B9R1.69 CC1=CC(Cl)=NC=C1Cl DY20731 [1,1,0,0,0,0|2,0,0]=4 1358 B9R1.69 CC1=CC(Cl)=NC=C1F NO19390 [1,1,0,0,0,0|2,0,0]=4 1359 B9R1.69 CC1=CC(F)=C(Br)C=C1 NO10392 [1,1,0,0,0,0|2,0,0]=4 1360 B9R1.69 CC1=CC(F)=C(C)C=C1 DY433527 [1,1,0,0,0,0|1,0,0]=3 1361 B9R1.69 CC1=CC(F)=C(C)C=C1 NO13237 [1,1,0,0,0,0|1,0,0]=3 1362 B9R1.69 CC1=CC(F)=C(Cl)C=C1 NO22757 [1,1,0,0,0,0|2,0,0]=4 1363 B9R1.69 CC1=CC(F)=C(F)C=C1 NO19897 [1,1,0,0,0,0|2,0,0]=4 1364 B9R1.69 CC1=CC(F)=CN=C1Br NO21373 [1,1,0,0,0,0|2,0,0]=4 1365 B9R1.69 CC1=CC(F)=CN=C1Cl NO14240 [1,1,0,0,0,0|2,0,0]=4 1366 B9R1.69 CC1=CC(F)=CN=C1N NO17590 [1,1,0,0,0,0|2,0,0]=4 1367 B9R1.69 CC1=CC(F)=NC=C1Br NO10262 [1,1,0,0,0,0|2,0,0]=4 1368 B9R1.69 CC1=CC(I)=C(F)C=C1 DY555255 [1,1,0,0,0,0|2,0,0]=4 1369 B9R1.69 CC1=CC(I)=C(N)C=C1 NO10517 [1,1,0,0,0,0|2,0,0]=4 1370 B9R1.69 CC1=CC(I)=CN=C1N NO13801 [1,1,0,0,0,0|2,0,0]=4 1371 B9R1.69 CC1=CC(N)=C(Br)C=C1 NO18349 [1,1,0,0,0,0|2,0,0]=4 1372 B9R1.69 CC1=CC(N)=C(Cl)C=C1 NO20365 [1,1,0,0,0,0|2,0,0]=4 1373 B9R1.69 CC1=CC(N)=C(F)C=C1 NO10510 [1,1,0,0,0,0|2,0,0]=4 1374 B9R1.69 CC1=CC(N)=C(I)C=C1 NO20372 [1,1,0,0,0,0|2,0,0]=4 1375 B9R1.69 CC1=CC(N)=NC=C1Br NO19457 [1,1,0,0,0,0|2,0,0]=4 1376 B9R1.69 CC1=CC(N)=NC=C1Cl NO19468 [1,1,0,0,0,0|2,0,0]=4 1377 B9R1.69 CC1=CC(O)=C(Br)C=C1 NO16357 [1,1,0,0,0,0|1,0,0]=3 1378 B9R1.69 CC1=CC(O)=C(C)C=C1 NO19431 [1,1,0,0,0,0|0,0,0]=2 1379 B9R1.69 CC1=CC(O)=C(N)C=C1 NO14086 [1,1,0,0,0,0|1,0,0]=3 1380 B9R1.69 CC1=CC(O)=NC=C1Br NO13793 [1,1,0,0,0,0|2,0,0]=4 1381 B9R1.69 CC1=CC(S)=C(N)C=C1 DY793311 [1,1,0,0,0,0|1,1,0]=4 1382 B9R1.69 CC1=CC=C(Br)C(C)=N1 NO20363 [1,1,0,0,0,0|2,0,0]=4 1383 B9R1.69 CC1=CC=C(Br)N=C1N DY443537 [1,1,0,0,0,0|2,0,0]=4 1384 B9R1.69 CC1=CC=C(C)C(Cl)=N1 NO16816 [1,1,0,0,0,0|2,0,0]=4 1385 B9R1.69 CC1=CC=C(C)C(N)=N1 NO16045 [1,1,0,0,0,0|2,0,0]=4 1386 B9R1.69 CC1=CC=C(Cl)N=C1Br NO16574 [1,1,0,0,0,0|2,0,0]=4 1387 B9R1.69 CC1=CC=C(Cl)N=C1Cl NO15124 [1,1,0,0,0,0|2,0,0]=4 1388 B9R1.69 CC1=CC=C(Cl)N=C1I DY660983 [1,1,0,0,0,0|2,0,0]=4 1389 B9R1.69 CC1=CC=C(F)C=C1N NO20370 [1,1,0,0,0,0|1,0,0]=3 1390 B9R1.69 CC1=CC=C(N)C(C)=N1 NO19572 [1,1,0,0,0,0|2,0,0]=4 1391 B9R1.69 CC1=CC=C(N)C(N)=C1 NO21925 [1,1,0,0,0,0|2,0,0]=4 1392 B9R1.69 CC1=CC=C(O)C(Br)=N1 NO21385 [1,1,0,0,0,0|2,0,0]=4 1393 B9R1.69 CC1=CC=C(O)C(Cl)=N1 NO21487 [1,1,0,0,0,0|2,0,0]=4 1394 B9R1.69 CC1=CC=C(O)C(I)=N1 NO21614 [1,1,0,0,0,0|2,0,0]=4 1395 B9R1.69 CC1=CC=C(O)C(N)=N1 DY431086 [1,1,0,0,0,0|2,0,0]=4 1396 B9R1.69 CC1=CC=C(O)C(O)=C1 NO14435 [1,1,0,0,0,0|1,0,0]=3 1397 B9R1.69 CC1=CN=C(Br)C(C)=C1 DY20801 [1,1,0,0,0,0|2,0,0]=4 1398 B9R1.69 CC1=CN=C(Br)C=C1N NO16645 [1,1,0,0,0,0|2,0,0]=4 1399 B9R1.69 CC1=CN=C(C)C(C)=C1 NO20999 [1,1,0,0,0,0|1,0,0]=3 1400 B9R1.69 CC1=CN=C(C)C(N)=C1 DY578583 [1,1,0,0,0,0|2,0,0]=4 1401 B9R1.69 CC1=CN=C(C)C=C1Cl NO15163 [1,1,0,0,0,0|2,0,0]=4 1402 B9R1.69 CC1=CN=C(Cl)C=C1Cl DY20301 [1,1,0,0,0,0|2,0,0]=4 1403 B9R1.69 CC1=CN=C(Cl)C=C1N NO14350 [1,1,0,0,0,0|2,0,0]=4 1404 B9R1.69 CC1=CN=C(F)C=C1I NO18758 [1,1,0,0,0,0|2,0,0]=4 1405 B9R1.69 CC1=CN=C(N)C(C)=C1 DY427372 [1,1,0,0,0,0|2,0,0]=4 1406 B9R1.69 CC1=CN=C(N)C=C1Br DY712393 [1,1,0,0,0,0|2,0,0]=4 1407 B9R1.69 CC1=CN=C(O)C(Br)=C1 NO13830 [1,1,0,0,0,0|2,0,0]=4 1408 B9R1.69 CC1=CN=C(O)C(C)=N1 NO12599 [1,1,0,0,0,0|2,0,0]=4 1409 B9R1.69 CC1=CN=C(O)C=C1N DY582459 [1,1,0,0,0,0|2,0,0]=4 1410 B9R1.69 CC1=CNC(=O)C=C1Br DY658226 [1,1,0,0,0,0|2,0,0]=4 1411 B9R1.69 CC1=NC(Br)=CC=C1Br NO19042 [1,1,0,0,0,0|2,0,0]=4 1412 B9R1.69 CC1=NC(Br)=CC=C1N NO13574 [1,1,0,0,0,0|2,0,0]=4 1413 B9R1.69 CC1=NC(Br)=CC=C1O NO15297 [1,1,0,0,0,0|1,0,0]=3 1414 B9R1.69 CC1=NC(Cl)=CC=C1F NO19395 [1,1,0,0,0,0|2,0,0]=4 1415 B9R1.69 CC1=NC(Cl)=CC=C1N NO13794 [1,1,0,0,0,0|2,0,0]=4 1416 B9R1.69 CC1=NC(F)=CC=C1Br NO19026 [1,1,0,0,0,0|2,0,0]=4 1417 B9R1.69 CC1=NC(F)=CC=C1O DY452518 [1,1,0,0,0,0|1,0,0]=3 1418 B9R1.69 CC1=NC(I)=CC=C1O DY431760 [1,1,0,0,0,0|1,0,0]=3 1419 B9R1.69 CC1=NC=C(Br)C=C1Br NO13993 [1,1,0,0,0,0|2,0,0]=4 1420 B9R1.69 CC1=NC=C(Br)C=C1N NO10276 [1,1,0,0,0,0|2,0,0]=4 1421 B9R1.69 CC1=NC=C(Br)C=C1O NO15115 [1,1,0,0,0,0|1,0,0]=3 1422 B9R1.69 CC1=NC=C(Cl)N=C1C DY442143 [1,1,0,0,0,0|2,0,0]=4 1423 B9R1.69 CC1=NC=C(O)C(C)=N1 NO16008 [1,1,0,0,0,0|2,0,0]=4 1424 B9R1.69 CC1=[N+]([O-])C=CC(N)=C1 DY715184 [1,1,0,0,0,0|1,0,1]=4 1425 B9R1.69 CN1C=C(Cl)C=CC1=O DY659816 [1,1,0,0,0,0|1,0,1]=4 1426 B9R1.69 CN1C=CC(=O)C(O)=C1 NO17435 [1,1,0,0,0,0|2,0,0]=4 1427 B9R1.69 CN1C=CC(Br)=CC1=O NO12571 [1,1,0,0,0,0|1,0,1]=4 1428 B9R1.69 CN1C=CC(I)=CC1=O DY442287 [1,1,0,0,0,0|1,0,1]=4 1429 B9R1.69 ClC1=C(Br)C=C(Br)C=C1 DY584370 [1,1,0,0,0,0|2,0,0]=4 1430 B9R1.69 ClC1=C(Br)C=CC(I)=C1 NO12748 [1,1,0,0,0,0|2,0,0]=4 1431 B9R1.69 ClC1=C(Cl)C=C(Br)C=C1 NO18812 [1,1,0,0,0,0|2,0,0]=4 1432 B9R1.69 ClC1=CC(Br)=C(I)C=C1 NO21351 [1,1,0,0,0,0|2,0,0]=4 1433 B9R1.69 ClC1=CC(Cl)=C(Br)C=C1 NO18636 [1,1,0,0,0,0|2,0,0]=4 1434 B9R1.69 ClC1=CC(I)=C(Br)C=C1 NO20652 [1,1,0,0,0,0|2,0,0]=4 1435 B9R1.69 ClC1=CC(I)=C(Cl)C=C1 DY546969 [1,1,0,0,0,0|2,0,0]=4 1436 B9R1.69 FC1=C(Br)C=C(Br)C=C1 DY20168 [1,1,0,0,0,0|2,0,0]=4 1437 B9R1.69 FC1=C(Br)C=C(Cl)C=C1 NO18841 [1,1,0,0,0,0|2,0,0]=4 1438 B9R1.69 FC1=C(Br)C=CC(Br)=C1 NO18653 [1,1,0,0,0,0|2,0,0]=4 1439 B9R1.69 FC1=C(Br)C=CC(I)=C1 NO18663 [1,1,0,0,0,0|2,0,0]=4 1440 B9R1.69 FC1=C(Cl)C=C(Br)C=C1 NO19184 [1,1,0,0,0,0|2,0,0]=4 1441 B9R1.69 FC1=C(Cl)C=CC(Br)=C1 NO19182 [1,1,0,0,0,0|2,0,0]=4 1442 B9R1.69 FC1=C(Cl)C=CC(I)=C1 NO18849 [1,1,0,0,0,0|2,0,0]=4 1443 B9R1.69 FC1=C(I)C=C(Br)C=C1 NO22852 [1,1,0,0,0,0|2,0,0]=4 1444 B9R1.69 FC1=C(I)C=C(Cl)C=C1 DY508694 [1,1,0,0,0,0|2,0,0]=4 1445 B9R1.69 FC1=C(I)C=CC(Br)=C1 NO22850 [1,1,0,0,0,0|2,0,0]=4 1446 B9R1.69 FC1=CC(Br)=C(Cl)C=C1 NO18847 [1,1,0,0,0,0|2,0,0]=4 1447 B9R1.69 FC1=CC(Br)=C(F)C=C1 NO19044 [1,1,0,0,0,0|2,0,0]=4 1448 B9R1.69 FC1=CC(Br)=C(I)C=C1 NO18665 [1,1,0,0,0,0|2,0,0]=4 1449 B9R1.69 FC1=CC(Cl)=C(Cl)C=C1 DY33048 [1,1,0,0,0,0|2,0,0]=4 1450 B9R1.69 FC1=CC(Cl)=C(F)C=C1 DY41471 [1,1,0,0,0,0|2,0,0]=4 1451 B9R1.69 FC1=CC(F)=C(F)C=C1 DY41495 [1,1,0,0,0,0|2,0,0]=4 1452 B9R1.69 FC1=CC(F)=C(S)C=C1 DY41404 [1,1,0,0,0,0|1,1,0]=4 1453 B9R1.69 FC1=CC(I)=C(Cl)C=C1 DY433497 [1,1,0,0,0,0|2,0,0]=4 1454 B9R1.69 FC1=CC=C(Br)C=C1F DY452314 [1,1,0,0,0,0|2,0,0]=4 1455 B9R1.69 Fc1ccc(I)c(Cl)c1 NO19647 [1,1,0,0,0,0|2,0,0]=4 1456 B9R1.69 IC1=CC(I)=C(I)C=C1 DY822105 [1,1,0,0,0,0|2,0,0]=4 1457 B9R1.69 NC1=C(Br)C=C(F)C=C1 DY40868 [1,1,0,0,0,0|2,0,0]=4 1458 B9R1.69 NC1=C(Br)C=C(I)C=C1 NO21357 [1,1,0,0,0,0|2,0,0]=4 1459 B9R1.69 NC1=C(Br)C=C(O)C=C1 DY41139 [1,1,0,0,0,0|2,0,0]=4 1460 B9R1.69 NC1=C(Br)C=CC(Br)=C1 NO18980 [1,1,0,0,0,0|2,0,0]=4 1461 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 NO18496 [1,1,0,0,0,0|2,0,0]=4 1462 B9R1.69 NC1=C(Br)C=CC(F)=C1 NO22951 [1,1,0,0,0,0|2,0,0]=4 1463 B9R1.69 NC1=C(Br)C=CC(I)=C1 DY822107 [1,1,0,0,0,0|2,0,0]=4 1464 B9R1.69 NC1=C(Br)C=CC(O)=C1 NO14504 [1,1,0,0,0,0|2,0,0]=4 1465 B9R1.69 NC1=C(Cl)C=C(Cl)C=C1 NO21094 [1,1,0,0,0,0|2,0,0]=4 1466 B9R1.69 NC1=C(Cl)C=C(O)C=C1 DY10180 [1,1,0,0,0,0|2,0,0]=4 1467 B9R1.69 NC1=C(Cl)C=C(O)C=C1 NO18805 [1,1,0,0,0,0|2,0,0]=4 1468 B9R1.69 NC1=C(Cl)C=CC(Br)=C1 NO15250 [1,1,0,0,0,0|2,0,0]=4 1469 B9R1.69 NC1=C(Cl)C=CC(Cl)=C1 NO21140 [1,1,0,0,0,0|2,0,0]=4 1470 B9R1.69 NC1=C(Cl)C=CC(F)=C1 NO22962 [1,1,0,0,0,0|2,0,0]=4 1471 B9R1.69 NC1=C(Cl)C=CC(I)=C1 DY822106 [1,1,0,0,0,0|2,0,0]=4 1472 B9R1.69 NC1=C(F)C=C(Br)C=C1 NO22953 [1,1,0,0,0,0|2,0,0]=4 1473 B9R1.69 NC1=C(F)C=C(Cl)C=C1 NO22965 [1,1,0,0,0,0|2,0,0]=4 1474 B9R1.69 NC1=C(F)C=C(F)C=C1 NO19091 [1,1,0,0,0,0|2,0,0]=4 1475 B9R1.69 NC1=C(F)C=C(I)C=C1 NO19120 [1,1,0,0,0,0|2,0,0]=4 1476 B9R1.69 NC1=C(F)C=C(O)C=C1 NO23017 [1,1,0,0,0,0|2,0,0]=4 1477 B9R1.69 NC1=C(F)C=CC(Br)=C1 NO22955 [1,1,0,0,0,0|2,0,0]=4 1478 B9R1.69 NC1=C(F)C=CC(Cl)=C1 DY30003 [1,1,0,0,0,0|2,0,0]=4 1479 B9R1.69 NC1=C(F)C=CC(F)=C1 NO22979 [1,1,0,0,0,0|2,0,0]=4 1480 B9R1.69 NC1=C(F)C=CC(I)=C1 NO19543 [1,1,0,0,0,0|2,0,0]=4 1481 B9R1.69 NC1=C(F)C=CC(O)=C1 NO19712 [1,1,0,0,0,0|2,0,0]=4 1482 B9R1.69 NC1=C(I)C=C(Br)C=C1 NO22647 [1,1,0,0,0,0|2,0,0]=4 1483 B9R1.69 NC1=C(I)C=C(Cl)C=C1 NO15394 [1,1,0,0,0,0|2,0,0]=4 1484 B9R1.69 NC1=C(I)C=C(F)C=C1 NO19121 [1,1,0,0,0,0|2,0,0]=4 1485 B9R1.69 NC1=C(I)C=C(I)C=C1 DY796137 [1,1,0,0,0,0|2,0,0]=4 1486 B9R1.69 NC1=C(I)C=CC(Cl)=C1 NO18421 [1,1,0,0,0,0|2,0,0]=4 1487 B9R1.69 NC1=C(I)C=CC(F)=C1 NO22986 [1,1,0,0,0,0|2,0,0]=4 1488 B9R1.69 NC1=C(I)C=CC(I)=C1 DY822103 [1,1,0,0,0,0|2,0,0]=4 1489 B9R1.69 NC1=C(N)C=C(S)C=C1 DY565749 [1,1,0,0,0,0|2,0,0]=4 1490 B9R1.69 NC1=C(O)C=C(Br)C=C1 NO21272 [1,1,0,0,0,0|1,0,0]=3 1491 B9R1.69 NC1=C(O)C=C(Cl)C=C1 NO19300 [1,1,0,0,0,0|1,0,0]=3 1492 B9R1.69 NC1=C(O)C=C(F)C=C1 NO23016 [1,1,0,0,0,0|1,0,0]=3 1493 B9R1.69 NC1=C(O)C=C(O)C=C1 NO22592 [1,1,0,0,0,0|1,0,0]=3 1494 B9R1.69 NC1=C(O)C=CC(Br)=C1 NO14311 [1,1,0,0,0,0|1,0,0]=3 1495 B9R1.69 NC1=C(O)C=CC(Cl)=C1 NO16374 [1,1,0,0,0,0|1,0,0]=3 1496 B9R1.69 NC1=C(O)C=NC(Cl)=C1 DY432273 [1,1,0,0,0,0|2,0,0]=4 1497 B9R1.69 NC1=C(S)C=CC(Cl)=C1 DY500643 [1,1,0,0,0,0|1,1,0]=4 1498 B9R1.69 NC1=CC(Br)=C(Cl)C=C1 NO22147 [1,1,0,0,0,0|2,0,0]=4 1499 B9R1.69 NC1=CC(Br)=C(F)C=C1 NO15522 [1,1,0,0,0,0|2,0,0]=4 1500 B9R1.69 NC1=CC(Br)=C(I)C=C1 DY575307 [1,1,0,0,0,0|2,0,0]=4 1501 B9R1.69 NC1=CC(Br)=CN=C1O NO14285 [1,1,0,0,0,0|2,0,0]=4 1502 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 NO18864 [1,1,0,0,0,0|2,0,0]=4 1503 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 NO21929 [1,1,0,0,0,0|2,0,0]=4 1504 B9R1.69 NC1=CC(Cl)=C(F)C=C1 NO19039 [1,1,0,0,0,0|2,0,0]=4 1505 B9R1.69 NC1=CC(Cl)=C(O)C=C1 NO19309 [1,1,0,0,0,0|1,0,0]=3 1506 B9R1.69 NC1=CC(F)=C(Br)C=C1 NO22954 [1,1,0,0,0,0|2,0,0]=4 1507 B9R1.69 NC1=CC(F)=C(Cl)C=C1 NO22968 [1,1,0,0,0,0|2,0,0]=4 1508 B9R1.69 NC1=CC(F)=C(I)C=C1 NO22985 [1,1,0,0,0,0|2,0,0]=4 1509 B9R1.69 NC1=CC(F)=C(O)C=N1 DY660813 [1,1,0,0,0,0|2,0,0]=4 1510 B9R1.69 NC1=CC(N)=C(Cl)C=C1 NO14655 [1,1,0,0,0,0|2,0,0]=4 1511 B9R1.69 NC1=CC(N)=C(F)C=C1 NO23032 [1,1,0,0,0,0|2,0,0]=4 1512 B9R1.69 NC1=CC(N)=C(O)C=C1 NO16325 [1,1,0,0,0,0|1,0,0]=3 1513 B9R1.69 NC1=CC(O)=C(F)C=C1 NO13999 [1,1,0,0,0,0|1,0,0]=3 1514 B9R1.69 NC1=CC(O)=CN=C1O DY656872 [1,1,0,0,0,0|2,0,0]=4 1515 B9R1.69 NC1=CC=C(Br)C=C1N NO19462 [1,1,0,0,0,0|2,0,0]=4 1516 B9R1.69 NC1=CC=C(Cl)C=C1N NO23029 [1,1,0,0,0,0|2,0,0]=4 1517 B9R1.69 NC1=CC=C(F)C=C1N NO19484 [1,1,0,0,0,0|2,0,0]=4 1518 B9R1.69 NC1=CN=C(O)C(I)=C1 DY715736 [1,1,0,0,0,0|2,0,0]=4 1519 B9R1.69 NC1=NC(Br)=CC=C1O NO15126 [1,1,0,0,0,0|2,0,0]=4 1520 B9R1.69 NC1=NC(Cl)=CC=C1O DY528201 [1,1,0,0,0,0|2,0,0]=4 1521 B9R1.69 NC1=NC=C(F)C=C1O NO14876 [1,1,0,0,0,0|2,0,0]=4 1522 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 NO15632 [1,1,0,0,0,0|1,0,0]=3 1523 B9R1.69 OC1=C(Br)C=C(F)C=C1 DY10138 [1,1,0,0,0,0|1,0,0]=3 1524 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 NO21372 [1,1,0,0,0,0|1,0,0]=3 1525 B9R1.69 OC1=C(Br)C=CC(F)=C1 DY20075 [1,1,0,0,0,0|1,0,0]=3 1526 B9R1.69 OC1=C(Br)C=CC(I)=C1 NO13046 [1,1,0,0,0,0|1,0,0]=3 1527 B9R1.69 OC1=C(Cl)C=C(F)C=C1 NO13904 [1,1,0,0,0,0|1,0,0]=3 1528 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 DY20037 [1,1,0,0,0,0|1,0,0]=3 1529 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 NO21143 [1,1,0,0,0,0|1,0,0]=3 1530 B9R1.69 OC1=C(Cl)C=CC(F)=C1 NO22918 [1,1,0,0,0,0|1,0,0]=3 1531 B9R1.69 OC1=C(F)C=C(Br)C=C1 NO22908 [1,1,0,0,0,0|1,0,0]=3 1532 B9R1.69 OC1=C(F)C=C(F)C=C1 NO19015 [1,1,0,0,0,0|1,0,0]=3 1533 B9R1.69 OC1=C(F)C=CC(Br)=C1 NO22910 [1,1,0,0,0,0|1,0,0]=3 1534 B9R1.69 OC1=C(F)C=CC(Cl)=C1 NO22920 [1,1,0,0,0,0|1,0,0]=3 1535 B9R1.69 OC1=C(F)C=CC(I)=C1 NO12536 [1,1,0,0,0,0|1,0,0]=3 1536 B9R1.69 OC1=C(I)C=C(Cl)C=C1 NO22744 [1,1,0,0,0,0|1,0,0]=3 1537 B9R1.69 OC1=C(I)C=C(F)C=C1 NO13176 [1,1,0,0,0,0|1,0,0]=3 1538 B9R1.69 OC1=C(I)C=C(I)C=C1 DY584396 [1,1,0,0,0,0|1,0,0]=3 1539 B9R1.69 OC1=C(I)C=CC(Br)=C1 DY442822 [1,1,0,0,0,0|1,0,0]=3 1540 B9R1.69 OC1=C(I)C=CC(Cl)=C1 NO10328 [1,1,0,0,0,0|1,0,0]=3 1541 B9R1.69 OC1=CC(Br)=C(Cl)C=C1 NO22149 [1,1,0,0,0,0|2,0,0]=4 1542 B9R1.69 OC1=CC(Br)=C(F)C=C1 NO22905 [1,1,0,0,0,0|2,0,0]=4 1543 B9R1.69 OC1=CC(Br)=NC=C1F DY655168 [1,1,0,0,0,0|2,0,0]=4 1544 B9R1.69 OC1=CC(Cl)=C(Br)C=C1 DY20176 [1,1,0,0,0,0|2,0,0]=4 1545 B9R1.69 OC1=CC(Cl)=CN=C1Br DY106828 [1,1,0,0,0,0|2,0,0]=4 1546 B9R1.69 OC1=CC(Cl)=NC=C1Cl DY454126 [1,1,0,0,0,0|2,0,0]=4 1547 B9R1.69 OC1=CC(F)=C(Br)C=C1 NO22909 [1,1,0,0,0,0|2,0,0]=4 1548 B9R1.69 OC1=CC(F)=C(Cl)C=C1 NO22919 [1,1,0,0,0,0|2,0,0]=4 1549 B9R1.69 OC1=CC(F)=C(F)C=C1 NO22926 [1,1,0,0,0,0|2,0,0]=4 1550 B9R1.69 OC1=CC(F)=C(I)C=C1 NO15852 [1,1,0,0,0,0|2,0,0]=4 1551 B9R1.69 OC1=CC(F)=C(O)C=C1 DY20784 [1,1,0,0,0,0|1,0,0]=3 1552 B9R1.69 OC1=CC(F)=CN=C1Cl DY430677 [1,1,0,0,0,0|2,0,0]=4 1553 B9R1.69 OC1=CC(F)=NC=C1Br DY659534 [1,1,0,0,0,0|2,0,0]=4 1554 B9R1.69 OC1=CC(I)=C(F)C=C1 DY442383 [1,1,0,0,0,0|2,0,0]=4 1555 B9R1.69 OC1=CC(I)=CN=C1Br DY655181 [1,1,0,0,0,0|2,0,0]=4 1556 B9R1.69 OC1=CC(O)=C(Br)C=C1 NO22703 [1,1,0,0,0,0|1,0,0]=3 1557 B9R1.69 OC1=CC(O)=C(F)C=C1 NO22989 [1,1,0,0,0,0|1,0,0]=3 1558 B9R1.69 OC1=CC=C(Br)C=C1O NO22676 [1,1,0,0,0,0|1,0,0]=3 1559 B9R1.69 OC1=CC=C(Br)N=C1Br NO21158 [1,1,0,0,0,0|2,0,0]=4 1560 B9R1.69 OC1=CC=C(Cl)C=C1O DY584662 [1,1,0,0,0,0|1,0,0]=3 1561 B9R1.69 OC1=CC=C(F)N=C1I DY540615 [1,1,0,0,0,0|2,0,0]=4 1562 B9R1.69 OC1=NC=C(Br)C=C1Br NO21965 [1,1,0,0,0,0|2,0,0]=4 1563 B9R1.69 OC1=NC=C(Cl)C=C1Br NO13641 [1,1,0,0,0,0|2,0,0]=4 1564 B9R1.69 OC1=NC=C(F)C=C1Br DY20706 [1,1,0,0,0,0|2,0,0]=4 1565 B9R1.69 SC1=C(Cl)C=CC(Cl)=C1 DY561891 [1,1,0,0,0,0|1,1,0]=4 1566 B9R1.69 SC1=CC(Cl)=C(Cl)C=C1 DY585101 [1,1,0,0,0,0|2,0,0]=4 1567 B9R1.14 COC1=CSC=C1CN DY523269 [0,1,0,0,1,0|1,0,0]=3 1568 B9R1.14 COC1=CSC=C1OC NO10119 [0,1,0,0,1,0|1,0,0]=3 1569 B9R1.33 CCOC1=C(C)N=CO1 DY20466 [0,1,0,0,1,0|2,0,0]=4 1570 B9R1.33 CN1C=CC=C1CCO DY106498 [0,1,0,0,1,0|2,0,0]=4 1571 B11R1.8 CC1=C(C#N)C=C(Br)C=C1F DY584942 [0,2,0,0,0,0|2,0,0]=4 1572 B11R1.8 CC1=C(CCl)C=C(F)C=C1F DY110278 [0,2,0,0,0,0|2,0,0]=4 1573 B11R1.8 CC1=C(O)C=C(Br)C=C1CO DY111510 [0,2,0,0,0,0|2,0,0]=4 1574 B11R1.8 COC1=C(Cl)C(Cl)=CC(C)=C1 DY109834 [0,2,0,0,0,0|1,0,0]=3 1575 B11R1.8 COC1=C(F)C(Cl)=CC(Cl)=C1 DY109594 [0,2,0,0,0,0|1,0,0]=3 1576 B11R1.8 COC1=CC(Br)=CC(Br)=C1N DY798675 [0,2,0,0,0,0|1,0,0]=3 1577 B11R1.8 COC1=CC(Br)=CC(F)=C1F NO10250 [0,2,0,0,0,0|1,0,0]=3 1578 B11R1.13 CC1=C(CC#N)C=CC=C1Br DY584724 [0,2,0,0,0,0|1,0,1]=4 1579 B11R1.13 CC1=C(CC#N)C=CC=C1F DY585162 [0,2,0,0,0,0|1,0,1]=4 1580 B11R1.13 CC1=C(CC#N)C=CC=C1I DY584865 [0,2,0,0,0,0|1,0,1]=4 1581 B11R1.13 CC1=C(Cl)C=CC=C1N=C=S DY20564 [0,2,0,0,0,0|1,0,1]=4 1582 B11R1.13 CNCC1=C(Cl)C(Cl)=CC=C1 NO20112 [0,2,0,0,0,0|2,0,0]=4 1583 B11R1.13 CNCC1=C(F)C(Cl)=CC=C1 DY516897 [0,2,0,0,0,0|2,0,0]=4 1584 B11R1.72 CC1=CC=C(C)C(C=O)=C1O NO12222 [0,2,0,0,0,0|2,0,0]=4 1585 B11R1.72 CC1=CC=C(F)C(F)=C1C=O DY585062 [0,2,0,0,0,0|2,0,0]=4 1586 B11R1.72 COC1=C(Cl)C(C)=CC=C1O DY449590 [0,2,0,0,0,0|1,0,0]=3 1587 B11R1.72 COC1=C(Cl)C(Cl)=CC=C1Br DY449572 [0,2,0,0,0,0|1,0,0]=3 1588 B11R1.72 COC1=C(I)C(Cl)=CN=C1Cl DY653084 [0,2,0,0,0,0|2,0,0]=4 1589 B11R1.72 COC1=C(O)C(F)=CC=C1C DY449752 [0,2,0,0,0,0|0,0,0]=2 1590 B11R1.72 COC1=C(O)C=CC(Cl)=C1Cl DY449530 [0,2,0,0,0,0|1,0,0]=3 1591 B11R1.72 CSC1=C(Br)C=CC(C)=C1Cl DY451174 [0,2,0,0,0,0|1,1,0]=4 1592 B11R1.159 CC(=O)C1=C(C)C(Br)=CC=C1 DY585075 [0,2,0,0,0,0|1,0,0]=3 1593 B11R1.159 CC(=O)C1=C(Cl)C(Cl)=CC=C1 NO21018 [0,2,0,0,0,0|2,0,0]=4 1594 B11R1.159 CC(=O)C1=C(F)C(Br)=CC=C1 DY20204 [0,2,0,0,0,0|2,0,0]=4 1595 B11R1.159 CC(=O)C1=C(F)C(C)=CC=C1 DY585016 [0,2,0,0,0,0|2,0,0]=4 1596 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 NO20991 [0,2,0,0,0,0|2,0,0]=4 1597 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 NO20407 [0,2,0,0,0,0|2,0,0]=4 1598 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 NO13325 [0,2,0,0,0,0|2,0,0]=4 1599 B11R1.159 CC(=O)C1=C(O)C(Cl)=CC=C1 NO10781 [0,2,0,0,0,0|2,0,0]=4 1600 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 NO15701 [0,2,0,0,0,0|2,0,0]=4 1601 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 NO20939 [0,2,0,0,0,0|2,0,0]=4 1602 B11R1.159 CC(=O)c1cccc(Br)c1N DY433201 [0,2,0,0,0,0|2,0,0]=4 1603 B11R1.159 CC(C)C1=CC=CC(=O)N1C DY661218 [0,2,0,0,0,0|2,0,0]=4 1604 B11R1.159 CC1=C(Br)C=CC=C1[N+](=O)[O-] NO20183 [0,2,0,0,0,0|2,0,0]=4 1605 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br NO10774 [0,2,0,0,0,0|2,0,0]=4 1606 B11R1.159 CC1=C(C(=O)O)C=CC=C1Cl NO22209 [0,2,0,0,0,0|2,0,0]=4 1607 B11R1.159 CC1=C(C(=O)O)C=CC=C1F NO20846 [0,2,0,0,0,0|2,0,0]=4 1608 B11R1.159 CC1=C(C(=O)O)C=CC=C1I DY20967 [0,2,0,0,0,0|2,0,0]=4 1609 B11R1.159 CC1=C(C(=O)O)C=CC=C1N NO20997 [0,2,0,0,0,0|2,0,0]=4 1610 B11R1.159 CC1=C(C(=O)O)C=CC=C1O NO20942 [0,2,0,0,0,0|2,0,0]=4 1611 B11R1.159 CC1=C(C(N)=O)C=CC=C1Br DY451270 [0,2,0,0,0,0|2,0,0]=4 1612 B11R1.159 CC1=C(C)C([N+](=O)[O-])=CC=C1 NO13408 [0,2,0,0,0,0|2,0,0]=4 1613 B11R1.159 CC1=C(Cl)C=CC=C1[N+](=O)[O-] NO16088 [0,2,0,0,0,0|2,0,0]=4 1614 B11R1.159 CC1=C(F)C=CC=C1[N+](=O)[O-] NO10434 [0,2,0,0,0,0|2,0,0]=4 1615 B11R1.159 CC1=C(N)C=CC=C1[N+](=O)[O-] NO21889 [0,2,0,0,0,0|2,0,0]=4 1616 B11R1.159 CC1=C(O)C=CC=C1[N+](=O)[O-] NO14960 [0,2,0,0,0,0|2,0,0]=4 1617 B11R1.159 CC1=C([C@H](C)N)C=CC=C1F DY623692 [0,2,0,0,0,0|1,0,0]=3 1618 B11R1.159 CC1=CC=CC(C(=O)O)=C1C NO21070 [0,2,0,0,0,0|2,0,0]=4 1619 B11R1.265 BrCC1=CC=CC(Br)=C1CBr NO17160 [0,2,0,0,0,0|2,0,0]=4 1620 B11R1.265 COC1=C(C#N)C(=O)NC=C1 DY20663 [0,2,0,0,0,0|1,0,1]=4 1621 B11R1.265 COC1=C(C#N)C(C)=CC=C1 NO14397 [0,2,0,0,0,0|0,0,1]=3 1622 B11R1.265 COC1=C(C=O)C(C)=CC=C1 NO21645 [0,2,0,0,0,0|0,0,1]=3 1623 B11R1.265 COC1=C(C=O)C(F)=NC=C1 DY451558 [0,2,0,0,0,0|1,0,1]=4 1624 B11R1.265 COC1=C(C=O)C(I)=CC=N1 NO13769 [0,2,0,0,0,0|1,0,1]=4 1625 B11R1.265 COC1=C(C=O)C=CC=C1Br NO22135 [0,2,0,0,0,0|0,0,1]=3 1626 B11R1.265 COC1=C(C=O)C=CC=C1C NO15730 [0,2,0,0,0,0|0,0,0]=2 1627 B11R1.265 COC1=C(C=O)C=CC=C1Cl NO12248 [0,2,0,0,0,0|0,0,1]=3 1628 B11R1.265 COC1=C(C=O)C=CN=C1Cl DY716408 [0,2,0,0,0,0|1,0,1]=4 1629 B11R1.265 COC1=C(CBr)OC=CC1=O DY447335 [0,2,0,0,0,0|1,0,0]=3 1630 B11R1.265 COC1=C(CO)C=CC=C1F NO14762 [0,2,0,0,0,0|0,0,0]=2 1631 B11R1.265 COC1=C(OC)C(N)=NC=N1 DY10371 [0,2,0,0,0,0|2,0,0]=4 1632 B11R1.265 COC1=CC=CC(Br)=C1C#N NO16021 [0,2,0,0,0,0|0,0,1]=3 1633 B11R1.265 COC1=CC=CC(Br)=C1CO DY450976 [0,2,0,0,0,0|0,0,0]=2 1634 B11R1.265 COC1=CC=CC(Br)=C1OC NO14821 [0,2,0,0,0,0|0,0,0]=2 1635 B11R1.265 COC1=CC=CC(Cl)=C1C#N NO21481 [0,2,0,0,0,0|0,0,1]=3 1636 B11R1.265 COC1=CC=CC(Cl)=C1C=O NO17258 [0,2,0,0,0,0|0,0,1]=3 1637 B11R1.265 COC1=CC=CC(F)=C1C#N NO10752 [0,2,0,0,0,0|0,0,1]=3 1638 B11R1.265 COC1=CC=CC(F)=C1C=O NO20843 [0,2,0,0,0,0|0,0,1]=3 1639 B11R1.265 COC1=CC=CC(F)=C1CN DY686419 [0,2,0,0,0,0|0,0,0]=2 1640 B11R1.265 COC1=CC=CC(F)=C1CN NO20435 [0,2,0,0,0,0|0,0,0]=2 1641 B11R1.265 COC1=NC=CC(Cl)=C1OC DY714980 [0,2,0,0,0,0|1,0,0]=3 1642 B11R1.265 COc1cccc(I)c1OC DY584342 [0,2,0,0,0,0|0,0,0]=2 1643 B11R1.265 CSC1=CC=CC(Br)=C1CO DY449488 [0,2,0,0,0,0|0,1,0]=3 1644 B11R1.265 N#CC1=C(CBr)C(Br)=CC=C1 DY584988 [0,2,0,0,0,0|2,0,0]=4 1645 B11R1.265 N#CC1=C(CBr)C=CC=C1F DY584923 [0,2,0,0,0,0|2,0,0]=4 1646 B11R1.265 N#CC1=C(CO)C=CC=C1Br DY584762 [0,2,0,0,0,0|2,0,0]=4 1647 B11R1.267 CCC1=CC=CC(CC)=C1Br DY442359 [0,2,0,0,0,0|2,0,0]=4 1648 B11R1.267 CCC1=CC=CC(CC)=C1N NO21174 [0,2,0,0,0,0|2,0,0]=4 1649 B11R1.267 CCC1=CC=CC(CC)=C1O NO21175 [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.267 COC1=CC=CC(C#N)=C1C DY30009 [0,2,0,0,0,0|0,0,0]=2 1651 B11R1.267 COC1=CC=CC(C#N)=C1F DY20257 [0,2,0,0,0,0|1,0,0]=3 1652 B11R1.267 COC1=CC=CC(C=O)=C1Cl DY451252 [0,2,0,0,0,0|1,0,0]=3 1653 B11R1.267 COC1=CC=CC(C=O)=C1F DY30215 [0,2,0,0,0,0|1,0,0]=3 1654 B11R1.267 COC1=CC=CC(C=O)=C1O NO21576 [0,2,0,0,0,0|1,0,0]=3 1655 B11R1.267 COC1=CC=CC(CBr)=C1F DY584632 [0,2,0,0,0,0|1,0,0]=3 1656 B11R1.267 COC1=CC=CC(OC)=C1Br NO20645 [0,2,0,0,0,0|1,0,0]=3 1657 B11R1.267 COC1=CC=CC(OC)=C1I NO14848 [0,2,0,0,0,0|1,0,0]=3 1658 B11R1.267 COC1=CC=CC(OC)=C1N DY551889 [0,2,0,0,0,0|1,0,0]=3 1659 B11R1.267 COC1=CC=CC(OC)=C1N NO18207 [0,2,0,0,0,0|1,0,0]=3 1660 B11R1.267 COc1cccc(C=O)c1C DY584912 [0,2,0,0,0,0|0,0,0]=2 1661 B11R1.267 Cc1c(C#N)cccc1C=O DY584918 [0,2,0,0,0,0|2,0,0]=4 1662 B11R1.278 CC1=C(C#N)C=CC(F)=C1F DY433095 [0,2,0,0,0,0|2,0,0]=4 1663 B11R1.278 CC1=C(C=O)C=CC(F)=C1F NO17527 [0,2,0,0,0,0|2,0,0]=4 1664 B11R1.278 CC1=C(CO)C=CC(Br)=C1F DY448198 [0,2,0,0,0,0|2,0,0]=4 1665 B11R1.278 CC1=C(CO)C=CC(Cl)=C1F DY449242 [0,2,0,0,0,0|2,0,0]=4 1666 B11R1.278 COC1=C(Br)C(=O)N(C)C=C1 DY656963 [0,2,0,0,0,0|2,0,0]=4 1667 B11R1.278 COC1=C(Br)C(Br)=C(F)C=C1 DY584397 [0,2,0,0,0,0|1,0,0]=3 1668 B11R1.278 COC1=C(C)C(C)=C(I)C=C1 NO20738 [0,2,0,0,0,0|0,0,0]=2 1669 B11R1.278 COC1=C(Cl)C(F)=C(Br)C=C1 DY822072 [0,2,0,0,0,0|1,0,0]=3 1670 B11R1.278 COC1=CC=C(Cl)C(N)=C1Br DY30088 [0,2,0,0,0,0|1,0,0]=3 1671 B11R1.278 COC1=CC=C(F)C(O)=C1F DY451576 [0,2,0,0,0,0|1,0,0]=3 1672 B11R1.278 COC1=NC=C(Br)C(C)=C1N DY659546 [0,2,0,0,0,0|2,0,0]=4 1673 B11R1.278 CSC1=C(F)C(Cl)=C(Br)C=C1 DY448090 [0,2,0,0,0,0|1,1,0]=4 1674 B11R1.17 CC1=C(CN=[N+]=[N-])C=CC=C1 DY607155 [0,2,0,0,0,0|2,0,0]=4 1675 B11R1.17 CC1=C(OCC#N)C=CC=C1 NO14720 [0,2,0,0,0,0|0,0,0]=2 1676 B11R1.17 CC1=C(OCCN)C=CC=C1 DY605519 [0,2,0,0,0,0|0,0,0]=2 1677 B11R1.17 CCCOC1=C(O)C=CC=C1 DY20673 [0,2,0,0,0,0|1,0,0]=3 1678 B11R1.17 OCCCC1=C(O)C=CC=C1 DY791619 [0,2,0,0,0,0|2,0,0]=4 1679 B11R1.41 C#CC1=C(OCC)C=CC=C1 DY789147 [0,2,0,0,0,0|0,0,1]=3 1680 B11R1.41 CCOC1=CC=NC=C1C#N DY658523 [0,2,0,0,0,0|1,0,1]=4 1681 B11R1.41 CNCC1=C(OC)C=CC=C1 DY584503 [0,2,0,0,0,0|0,0,0]=2 1682 B11R1.41 COC1=C(CCO)C=CC=C1 NO15749 [0,2,0,0,0,0|0,0,0]=2 1683 B11R1.41 COC1=C(CNN)C=CC=C1 DY610863 [0,2,0,0,0,0|0,0,0]=2 1684 B11R1.41 COC1=NC=CC=C1CC#N DY653828 [0,2,0,0,0,0|1,0,0]=3 1685 B11R1.41 COCC1=CC=CN=C1C#N DY656704 [0,2,0,0,0,0|1,0,1]=4 1686 B11R1.41 COCC1=CC=CN=C1CCl DY714212 [0,2,0,0,0,0|1,0,0]=3 1687 B11R1.41 N#CC1=C(CON)C=CC=C1 DY574887 [0,2,0,0,0,0|1,0,1]=4 1688 B11R1.81 CC1=C(N=C=O)C=CC(Cl)=C1 DY794829 [0,2,0,0,0,0|1,0,1]=4 1689 B11R1.81 CCOC1=C(C)C=C(O)C=N1 DY715682 [0,2,0,0,0,0|1,0,0]=3 1690 B11R1.81 CCOC1=C(C)N=C(N)C=C1 NO10572 [0,2,0,0,0,0|1,0,0]=3 1691 B11R1.81 CCOC1=C(F)C=C(N)C=N1 NO17642 [0,2,0,0,0,0|2,0,0]=4 1692 B11R1.81 CCOC1=C(N)C=C(C)C=C1 DY584348 [0,2,0,0,0,0|1,0,0]=3 1693 B11R1.81 CCOC1=C(O)C=C(Cl)C=C1 DY451090 [0,2,0,0,0,0|1,0,0]=3 1694 B11R1.81 CCOC1=CC=C(Cl)N=C1Cl DY451378 [0,2,0,0,0,0|2,0,0]=4 1695 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 DY822069 [0,2,0,0,0,0|2,0,0]=4 1696 B11R1.81 NOCC1=C(Cl)C=C(Cl)C=C1 DY557865 [0,2,0,0,0,0|2,0,0]=4 1697 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 DY584702 [0,2,0,0,0,0|2,0,0]=4 1698 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 DY10294 [0,2,0,0,0,0|2,0,0]=4 1699 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 DY10318 [0,2,0,0,0,0|2,0,0]=4 1700 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 DY427446 [0,2,0,0,0,0|2,0,0]=4 1701 B11R1.86 CC(=O)NC1=C(C)C=CC=C1 DY744961 [0,2,0,0,0,0|1,0,0]=3 1702 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 NO21203 [0,2,0,0,0,0|2,0,0]=4 1703 B11R1.86 CC(=S)OC1=C(Cl)C=CC=C1 DY534765 [0,2,0,0,0,0|1,0,0]=3 1704 B11R1.86 CC(C)OC1=C(F)C=CC=C1 DY453190 [0,2,0,0,0,0|1,0,0]=3 1705 B11R1.86 CC(C)OC1=C(N)C=CC=C1 NO13469 [0,2,0,0,0,0|1,0,0]=3 1706 B11R1.86 CC(C)OC1=NC=CC=C1I DY657345 [0,2,0,0,0,0|2,0,0]=4 1707 B11R1.86 CC(N)CC1=C(Cl)C=CC=C1 DY550599 [0,2,0,0,0,0|2,0,0]=4 1708 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 NO21083 [0,2,0,0,0,0|1,0,1]=4 1709 B11R1.86 CC1=C(NC(N)=S)C=CC=C1 DY563439 [0,2,0,0,0,0|1,0,1]=4 1710 B11R1.86 NC1=CC=CN=C1OC(F)F NO18069 [0,2,0,0,0,0|2,0,0]=4 1711 B11R1.182 CC1=C(CC#N)C=C(Br)C=C1 DY584752 [0,2,0,0,0,0|1,0,1]=4 1712 B11R1.182 CC1=C(CC#N)C=C(F)C=C1 NO19339 [0,2,0,0,0,0|1,0,1]=4 1713 B11R1.182 CC1=C(NC=O)C=C(F)C=C1 DY789909 [0,2,0,0,0,0|1,0,1]=4 1714 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 NO21152 [0,2,0,0,0,0|1,0,1]=4 1715 B11R1.182 CC1=CC(CCO)=C(C)C=C1 DY40742 [0,2,0,0,0,0|1,0,0]=3 1716 B11R1.182 CC1=CC(CNN)=C(C)C=C1 DY519153 [0,2,0,0,0,0|2,0,0]=4 1717 B11R1.182 CCOC1=C(Br)C=CC(C)=C1 DY451888 [0,2,0,0,0,0|1,0,0]=3 1718 B11R1.182 CCOC1=C(Br)C=CC(N)=C1 NO20424 [0,2,0,0,0,0|1,0,0]=3 1719 B11R1.182 CCOC1=C(Br)N=CC(N)=C1 NO12418 [0,2,0,0,0,0|2,0,0]=4 1720 B11R1.182 CCOC1=CC(N)=CN=C1N DY657234 [0,2,0,0,0,0|2,0,0]=4 1721 B11R1.182 CNCC1=C(F)C=CC(F)=C1 DY456646 [0,2,0,0,0,0|2,0,0]=4 1722 B11R1.182 NCCC1=C(Br)C=CC(Cl)=C1 DY522951 [0,2,0,0,0,0|2,0,0]=4 1723 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 DY795369 [0,2,0,0,0,0|2,0,0]=4 1724 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 NO15813 [0,2,0,0,0,0|2,0,0]=4 1725 B11R1.222 CCC(C)C1=C(N)C=CC=C1 NO21765 [0,2,0,0,0,0|2,0,0]=4 1726 B11R1.222 CC[C@@H](N)C1=C(C)C=CC=C1 NO14530 [0,2,0,0,0,0|1,0,0]=3 1727 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 NO20442 [0,2,0,0,0,0|2,0,0]=4 1728 B11R1.222 COC(=N)C1=C(O)N=CC=C1 DY662303 [0,2,0,0,0,0|2,0,0]=4 1729 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 DY20192 [0,2,0,0,0,0|1,0,0]=3 1730 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 NO22176 [0,2,0,0,0,0|2,0,0]=4 1731 B11R1.222 COC(=O)C1=C(C)N=CC=C1 NO21004 [0,2,0,0,0,0|1,0,0]=3 1732 B11R1.222 COC(=O)C1=C(Cl)N=CC=C1 NO20210 [0,2,0,0,0,0|2,0,0]=4 1733 B11R1.222 COC(=O)C1=C(F)C=CC=C1 NO11605 [0,2,0,0,0,0|1,0,0]=3 1734 B11R1.222 COC(=O)C1=C(F)N=CC=C1 NO14405 [0,2,0,0,0,0|2,0,0]=4 1735 B11R1.222 COC(=O)C1=C(I)C=CC=C1 NO15277 [0,2,0,0,0,0|1,0,0]=3 1736 B11R1.222 COC(=O)C1=C(I)C=NC=C1 NO22331 [0,2,0,0,0,0|2,0,0]=4 1737 B11R1.222 COC(=O)C1=C(O)C=NC=C1 NO11627 [0,2,0,0,0,0|2,0,0]=4 1738 B11R1.222 COC(=O)C1=CC=CN=C1N NO18010 [0,2,0,0,0,0|2,0,0]=4 1739 B11R1.222 COC(=O)C1=CN=CC=C1C NO11648 [0,2,0,0,0,0|1,0,0]=3 1740 B11R1.222 COC(=O)C1=CN=CC=C1Cl NO15530 [0,2,0,0,0,0|2,0,0]=4 1741 B11R1.222 COC(=O)C1=CN=CC=C1N NO18774 [0,2,0,0,0,0|2,0,0]=4 1742 B11R1.222 COC(=O)C1=NC=CC=C1Br NO12168 [0,2,0,0,0,0|2,0,0]=4 1743 B11R1.222 COC(=O)C1=NC=CC=C1F NO19566 [0,2,0,0,0,0|2,0,0]=4 1744 B11R1.222 COC(=O)C1=NC=CC=C1N NO22111 [0,2,0,0,0,0|2,0,0]=4 1745 B11R1.222 COC(=O)C1=NC=CC=C1O NO21936 [0,2,0,0,0,0|2,0,0]=4 1746 B11R1.222 COC(=O)C1=NC=CN=C1C DY585289 [0,2,0,0,0,0|2,0,0]=4 1747 B11R1.222 C\C(=N/O)C1=C(O)C=CC=C1 DY745441 [0,2,0,0,0,0|2,0,0]=4 1748 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 NO15388 [0,2,0,0,0,0|2,0,0]=4 1749 B11R1.222 NC[C@H](O)C1=C(Cl)C=CC=C1 DY746437 [0,2,0,0,0,0|2,0,0]=4 1750 B11R1.222 O=C(CBr)C1=C(Br)C=CC=C1 DY795819 [0,2,0,0,0,0|2,0,0]=4 1751 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 NO14555 [0,2,0,0,0,0|2,0,0]=4 1752 B11R1.605 CC1=CC=CC(C)=C1CC#N DY584747 [0,2,0,0,0,0|1,0,1]=4 1753 B11R1.605 CC1=CC=CC(C)=C1N=C=O DY584542 [0,2,0,0,0,0|1,0,1]=4 1754 B11R1.605 CNCC1=C(Cl)C=CC=C1F DY456652 [0,2,0,0,0,0|2,0,0]=4 1755 B11R1.605 NCCC1=C(F)C=CC=C1F DY822024 [0,2,0,0,0,0|2,0,0]=4 1756 B11R1.605 OCCC1=C(Cl)C=CC=C1F DY40736 [0,2,0,0,0,0|2,0,0]=4 1757 B11R1.37 CCC1=C(C=O)C=CC(Cl)=C1 DY584870 [0,2,0,0,0,0|1,0,1]=4 1758 B11R1.37 CCC1=C(CO)C=C(Br)C=C1 DY584341 [0,2,0,0,0,0|1,0,0]=3 1759 B11R1.37 CCC1=C(CO)C=CC(Br)=C1 DY452560 [0,2,0,0,0,0|1,0,0]=3 1760 B11R1.37 COC1=C(C#N)C=C(Cl)C=C1 NO20726 [0,2,0,0,0,0|0,0,1]=3 1761 B11R1.37 COC1=C(C#N)C=CC(Br)=C1 NO18242 [0,2,0,0,0,0|0,0,1]=3 1762 B11R1.37 COC1=C(C#N)C=CC(Br)=N1 DY712771 [0,2,0,0,0,0|1,0,1]=4 1763 B11R1.37 COC1=C(C#N)C=CC(C)=C1 NO21636 [0,2,0,0,0,0|0,0,1]=3 1764 B11R1.37 COC1=C(C#N)C=CC(Cl)=N1 DY431143 [0,2,0,0,0,0|1,0,1]=4 1765 B11R1.37 COC1=C(C#N)C=CC(F)=C1 DY30021 [0,2,0,0,0,0|0,0,1]=3 1766 B11R1.37 COC1=C(C#N)C=CC(N)=C1 NO22550 [0,2,0,0,0,0|0,0,1]=3 1767 B11R1.37 COC1=C(C#N)C=CC(O)=C1 DY442317 [0,2,0,0,0,0|0,0,1]=3 1768 B11R1.37 COC1=C(C=O)C=C(C)C=N1 DY511041 [0,2,0,0,0,0|1,0,1]=4 1769 B11R1.37 COC1=C(C=O)C=C(Cl)C=C1 NO20830 [0,2,0,0,0,0|0,0,1]=3 1770 B11R1.37 COC1=C(C=O)C=C(F)C=C1 NO13891 [0,2,0,0,0,0|0,0,1]=3 1771 B11R1.37 COC1=C(C=O)C=CC(Br)=C1 NO22648 [0,2,0,0,0,0|0,0,1]=3 1772 B11R1.37 COC1=C(CBr)C=CC(Br)=C1 DY585097 [0,2,0,0,0,0|0,0,0]=2 1773 B11R1.37 COC1=C(CBr)C=CC(F)=C1 DY585074 [0,2,0,0,0,0|0,0,0]=2 1774 B11R1.37 COC1=C(CCl)C=C(C)C=C1 DY745693 [0,2,0,0,0,0|0,0,0]=2 1775 B11R1.37 COC1=C(CN)C=C(Cl)C=C1 NO16238 [0,2,0,0,0,0|0,0,0]=2 1776 B11R1.37 COC1=C(CN)C=C(N)C=C1 NO10206 [0,2,0,0,0,0|0,0,0]=2 1777 B11R1.37 COC1=C(CN)C=CC(F)=C1 NO12735 [0,2,0,0,0,0|0,0,0]=2 1778 B11R1.37 COC1=C(CO)C=C(Cl)C=C1 DY451366 [0,2,0,0,0,0|0,0,0]=2 1779 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 DY445716 [0,2,0,0,0,0|1,0,0]=3 1780 B11R1.37 COC1=C(OC)C=C(Br)C=C1 NO19895 [0,2,0,0,0,0|0,0,0]=2 1781 B11R1.37 COC1=C(OC)C=C(C)C=C1 NO21947 [0,2,0,0,0,0|0,0,0]=2 1782 B11R1.37 COC1=C(OC)C=C(F)C=C1 NO20493 [0,2,0,0,0,0|0,0,0]=2 1783 B11R1.37 COC1=C(OC)N=CC(N)=C1 NO15128 [0,2,0,0,0,0|1,0,0]=3 1784 B11R1.37 COC1=C(OC)N=CC(O)=C1 DY509696 [0,2,0,0,0,0|1,0,0]=3 1785 B11R1.37 COC1=CC(Cl)=CN=C1OC DY713233 [0,2,0,0,0,0|1,0,0]=3 1786 B11R1.37 COC1=CC(Cl)=NC=C1C#N NO15634 [0,2,0,0,0,0|1,0,1]=4 1787 B11R1.37 COC1=CC(F)=NC=C1C#N DY432631 [0,2,0,0,0,0|1,0,1]=4 1788 B11R1.37 COC1=CC=C(Br)C=C1C=O DY33091 [0,2,0,0,0,0|0,0,1]=3 1789 B11R1.37 COC1=CC=C(Br)N=C1C=O NO15316 [0,2,0,0,0,0|1,0,1]=4 1790 B11R1.37 COC1=NC(Br)=CC=C1CN NO17510 [0,2,0,0,0,0|1,0,0]=3 1791 B11R1.37 COC1=NC(Br)=CC=C1CO NO17509 [0,2,0,0,0,0|1,0,0]=3 1792 B11R1.37 COC1=NC=C(Br)C=C1CO DY443486 [0,2,0,0,0,0|1,0,0]=3 1793 B11R1.37 COC1=NC=C(Br)N=C1OC NO14846 [0,2,0,0,0,0|2,0,0]=4 1794 B11R1.37 CSC1=C(C=O)C=C(F)C=C1 DY452806 [0,2,0,0,0,0|0,1,1]=4 1795 B11R1.37 N#CC1=C(CBr)C=C(F)C=C1 NO14326 [0,2,0,0,0,0|2,0,0]=4 1796 B11R1.37 N#CC1=C(CBr)C=CC(F)=C1 DY584790 [0,2,0,0,0,0|2,0,0]=4 1797 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 NO21523 [0,2,0,0,0,0|1,0,1]=4 1798 B11R1.53 CCC1=C(B(O)O)C=CC=C1 NO20466 [0,2,0,0,0,0|2,0,0]=4 1799 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 NO15281 [0,2,0,0,0,0|1,0,1]=4 1800 B11R1.53 CCC1=C(C(C)=O)C=CN=C1 DY652292 [0,2,0,0,0,0|2,0,0]=4 1801 B11R1.53 CN(C)C1=C(CN)C=CC=C1 DY745873 [0,2,0,0,0,0|1,0,0]=3 1802 B11R1.53 CN(C)C1=CC=CN=C1CN DY654378 [0,2,0,0,0,0|2,0,0]=4 1803 B11R1.53 COC1=C(B(O)O)C=CC=C1 NO20142 [0,2,0,0,0,0|1,0,0]=3 1804 B11R1.53 COC1=C(B(O)O)C=NC=C1 DY443759 [0,2,0,0,0,0|2,0,0]=4 1805 B11R1.53 COC1=C(C(=N)N)C=CC=C1 DY795999 [0,2,0,0,0,0|0,0,1]=3 1806 B11R1.53 COC1=C(C(=O)O)C=CC=C1 NO15086 [0,2,0,0,0,0|0,0,1]=3 1807 B11R1.53 COC1=C(C(=O)O)C=CC=N1 NO20330 [0,2,0,0,0,0|1,0,1]=4 1808 B11R1.53 COC1=C(C(=O)O)C=CN=C1 NO10492 [0,2,0,0,0,0|1,0,1]=4 1809 B11R1.53 COC1=C(C(C)=O)C=CN=C1 DY105760 [0,2,0,0,0,0|1,0,0]=3 1810 B11R1.53 COC1=C(C(C)N)C=CC=C1 DY553119 [0,2,0,0,0,0|0,0,0]=2 1811 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 NO15754 [0,2,0,0,0,0|0,0,0]=2 1812 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 NO19392 [0,2,0,0,0,0|2,0,0]=4 1813 B11R1.53 COC1=CC=CN=C1C(=O)O NO22335 [0,2,0,0,0,0|1,0,1]=4 1814 B11R1.53 COC1=CC=CN=C1C(C)=O NO16598 [0,2,0,0,0,0|1,0,0]=3 1815 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] NO19391 [0,2,0,0,0,0|2,0,0]=4 1816 B11R1.53 COC1=CC=NC=C1C(=O)O NO13273 [0,2,0,0,0,0|1,0,1]=4 1817 B11R1.53 COC1=NC=CC=C1B(O)O DY20273 [0,2,0,0,0,0|2,0,0]=4 1818 B11R1.53 COC1=NC=CC=C1C(C)N DY652190 [0,2,0,0,0,0|1,0,0]=3 1819 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] NO13911 [0,2,0,0,0,0|2,0,0]=4 1820 B11R1.53 CSC1=C(C(=O)O)C=CC=C1 DY551739 [0,2,0,0,0,0|0,1,1]=4 1821 B11R1.53 C[Se]C1=C(C(=O)O)C=CC=C1 DY565725 [0,2,0,0,0,0|0,1,1]=4 1822 B11R1.53 N#CC1=C(C(F)F)C=CC=C1 DY584860 [0,2,0,0,0,0|2,0,0]=4 1823 B11R1.53 NC(=O)C1=C(CBr)C=CC=C1 NO16759 [0,2,0,0,0,0|2,0,0]=4 1824 B11R1.53 NCC1=C(B(O)O)C=CC=C1 NO20890 [0,2,0,0,0,0|2,0,0]=4 1825 B11R1.53 O=CC1=C(C(F)F)C=CC=C1 NO15613 [0,2,0,0,0,0|2,0,0]=4 1826 B11R1.53 O=[N+]([O-])C1=C(CBr)C=CC=C1 NO20177 [0,2,0,0,0,0|2,0,0]=4 1827 B11R1.53 O=[N+]([O-])C1=C(CO)C=CC=C1 NO21716 [0,2,0,0,0,0|2,0,0]=4 1828 B11R1.53 OB(O)C1=C(CBr)C=CC=C1 DY31222 [0,2,0,0,0,0|2,0,0]=4 1829 B11R1.53 OCC1=C(B(O)O)C=CC=C1 DY20276 [0,2,0,0,0,0|2,0,0]=4 1830 B11R1.166 CC(=O)C1=C(Br)C=C(Br)C=C1 DY549171 [0,2,0,0,0,0|2,0,0]=4 1831 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 NO21355 [0,2,0,0,0,0|2,0,0]=4 1832 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 DY577989 [0,2,0,0,0,0|1,0,0]=3 1833 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 NO14036 [0,2,0,0,0,0|2,0,0]=4 1834 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 NO21093 [0,2,0,0,0,0|2,0,0]=4 1835 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 NO21444 [0,2,0,0,0,0|2,0,0]=4 1836 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 NO20824 [0,2,0,0,0,0|2,0,0]=4 1837 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 NO20682 [0,2,0,0,0,0|2,0,0]=4 1838 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 DY430999 [0,2,0,0,0,0|2,0,0]=4 1839 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 NO22739 [0,2,0,0,0,0|2,0,0]=4 1840 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 NO19013 [0,2,0,0,0,0|2,0,0]=4 1841 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 NO16419 [0,2,0,0,0,0|2,0,0]=4 1842 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 NO22645 [0,2,0,0,0,0|2,0,0]=4 1843 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 DY10406 [0,2,0,0,0,0|2,0,0]=4 1844 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 DY10405 [0,2,0,0,0,0|2,0,0]=4 1845 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 NO20409 [0,2,0,0,0,0|2,0,0]=4 1846 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 NO19678 [0,2,0,0,0,0|2,0,0]=4 1847 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C DY652460 [0,2,0,0,0,0|2,0,0]=4 1848 B11R1.166 CC(C)C1=C(I)C=C(Cl)C=C1 DY450586 [0,2,0,0,0,0|2,0,0]=4 1849 B11R1.166 CC(N)C1=C(Cl)C=C(Cl)C=C1 DY600215 [0,2,0,0,0,0|2,0,0]=4 1850 B11R1.166 CC(O)C1=C(Cl)C=C(Cl)C=C1 DY40730 [0,2,0,0,0,0|2,0,0]=4 1851 B11R1.166 CC1=C(B(O)O)C=CC(Cl)=C1 NO10504 [0,2,0,0,0,0|2,0,0]=4 1852 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 NO15606 [0,2,0,0,0,0|2,0,0]=4 1853 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 NO22749 [0,2,0,0,0,0|2,0,0]=4 1854 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 NO21999 [0,2,0,0,0,0|2,0,0]=4 1855 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 NO18188 [0,2,0,0,0,0|2,0,0]=4 1856 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 NO12971 [0,2,0,0,0,0|2,0,0]=4 1857 B11R1.166 CC1=C(C(=O)[O-])C=CC(Cl)=C1 DY584431 [0,2,0,0,0,0|2,0,0]=4 1858 B11R1.166 CC1=C(C(N)=O)C=CC(Cl)=C1 DY584696 [0,2,0,0,0,0|2,0,0]=4 1859 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Cl)=C1 NO20209 [0,2,0,0,0,0|2,0,0]=4 1860 B11R1.166 CC1=C([N+](=O)[O-])C=CC(F)=C1 NO10444 [0,2,0,0,0,0|2,0,0]=4 1861 B11R1.166 CC1=C([N+](=O)[O-])C=CC(I)=C1 DY429685 [0,2,0,0,0,0|2,0,0]=4 1862 B11R1.166 CC1=CC(C)=C(B(O)O)C=C1 NO20463 [0,2,0,0,0,0|2,0,0]=4 1863 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 NO21071 [0,2,0,0,0,0|2,0,0]=4 1864 B11R1.166 CC1=CC(O)=CC=C1[N+](=O)[O-] NO20328 [0,2,0,0,0,0|2,0,0]=4 1865 B11R1.166 CN(C)C1=C(Cl)C=C(Br)C=C1 DY20295 [0,2,0,0,0,0|2,0,0]=4 1866 B11R1.166 CN(C)C1=C(F)C=C(F)C=C1 DY798183 [0,2,0,0,0,0|2,0,0]=4 1867 B11R1.166 CN(C)C1=CC=C(Cl)C=C1N DY534249 [0,2,0,0,0,0|2,0,0]=4 1868 B11R1.166 C[C@@H](N)C1=C(F)C=C(Cl)C=C1 DY575031 [0,2,0,0,0,0|2,0,0]=4 1869 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 DY572097 [0,2,0,0,0,0|2,0,0]=4 1870 B11R1.277 CC1=CC(C#N)=C(C)C=C1N DY585113 [0,2,0,0,0,0|2,0,0]=4 1871 B11R1.277 CC1=CC(C#N)=C(C)C=C1O NO19365 [0,2,0,0,0,0|2,0,0]=4 1872 B11R1.277 CC1=CC(C)=C(C#N)C=C1N DY585033 [0,2,0,0,0,0|2,0,0]=4 1873 B11R1.277 CC1=CC(C=O)=C(C)C=C1O NO19366 [0,2,0,0,0,0|2,0,0]=4 1874 B11R1.277 CCC1=CC(Cl)=C(Cl)C=C1F DY747979 [0,2,0,0,0,0|2,0,0]=4 1875 B11R1.277 COC1=C(Br)C=C(C)C(C)=C1 DY450520 [0,2,0,0,0,0|1,0,0]=3 1876 B11R1.277 COC1=C(C)NC(=O)C(N)=C1 DY656842 [0,2,0,0,0,0|1,0,0]=3 1877 B11R1.277 COC1=C(Cl)C=C(Cl)C(F)=C1 DY109588 [0,2,0,0,0,0|1,0,0]=3 1878 B11R1.277 COC1=CC(Br)=C(Cl)C=C1F DY584300 [0,2,0,0,0,0|1,0,0]=3 1879 B11R1.277 COC1=CC(Br)=C(Cl)C=C1N DY584793 [0,2,0,0,0,0|1,0,0]=3 1880 B11R1.277 COC1=CC(Br)=C(F)C=C1F DY450076 [0,2,0,0,0,0|1,0,0]=3 1881 B11R1.277 COC1=CC(C)=C(N)C=C1Br NO16621 [0,2,0,0,0,0|1,0,0]=3 1882 B11R1.277 COC1=CC(C)=C(N)C=C1C DY508976 [0,2,0,0,0,0|0,0,0]=2 1883 B11R1.277 COC1=CC(C)=C(O)C=C1Br DY446820 [0,2,0,0,0,0|1,0,0]=3 1884 B11R1.277 COC1=CC(F)=C(Br)C=C1Cl DY450034 [0,2,0,0,0,0|1,0,0]=3 1885 B11R1.277 COC1=CC(N)=C(Br)C=C1F DY795339 [0,2,0,0,0,0|1,0,0]=3 1886 B11R1.277 COC1=CC(N)=C(C)C=C1Br DY107170 [0,2,0,0,0,0|1,0,0]=3 1887 B11R1.277 COC1=CC(N)=C(Cl)C=C1Br DY30039 [0,2,0,0,0,0|1,0,0]=3 1888 B11R1.277 COC1=CC(N)=C(Cl)C=C1Cl DY20225 [0,2,0,0,0,0|1,0,0]=3 1889 B11R1.277 COC1=CC(N)=C(F)C=C1F DY799365 [0,2,0,0,0,0|1,0,0]=3 1890 B11R1.279 CCC1=NC=C(C#N)C=C1C DY712687 [0,2,0,0,0,0|2,0,0]=4 1891 B11R1.279 CNC1=C(F)C=C(C#N)C=C1 DY33368 [0,2,0,0,0,0|2,0,0]=4 1892 B11R1.279 COC1=C(C)C=C(C#N)C=N1 DY451096 [0,2,0,0,0,0|1,0,0]=3 1893 B11R1.279 COC1=C(C)C=C(C=O)C=C1 NO10892 [0,2,0,0,0,0|0,0,0]=2 1894 B11R1.279 COC1=C(Cl)C=C(CBr)C=C1 NO22687 [0,2,0,0,0,0|1,0,0]=3 1895 B11R1.279 COC1=C(Cl)C=C(CN)C=C1 DY746923 [0,2,0,0,0,0|1,0,0]=3 1896 B11R1.279 COC1=C(Cl)C=C(CN)C=C1 NO20430 [0,2,0,0,0,0|1,0,0]=3 1897 B11R1.279 COC1=C(F)C=C(C#N)C=C1 DY433110 [0,2,0,0,0,0|1,0,0]=3 1898 B11R1.279 COC1=C(O)C=C(C#N)C=C1 NO14799 [0,2,0,0,0,0|1,0,0]=3 1899 B11R1.279 COC1=C(O)C=C(C=O)C=C1 NO15324 [0,2,0,0,0,0|1,0,0]=3 1900 B11R1.279 COC1=CC(F)=C(OC)C=C1 NO20541 [0,2,0,0,0,0|1,0,0]=3 1901 B11R1.279 COC1=CC(N)=C(OC)C=C1 NO21148 [0,2,0,0,0,0|1,0,0]=3 1902 B11R1.279 COC1=CC(O)=C(OC)C=C1 NO21149 [0,2,0,0,0,0|1,0,0]=3 1903 B11R1.279 COC1=CC=C(OC)C(Br)=N1 DY655063 [0,2,0,0,0,0|2,0,0]=4 1904 B11R1.279 COC1=COC(CO)=CC1=O DY564165 [0,2,0,0,0,0|2,0,0]=4 1905 B11R1.279 CSC1=C(C)C=C(C#N)C=C1 DY112206 [0,2,0,0,0,0|0,1,0]=3 1906 B11R1.279 CSC1=C(F)C=C(C=O)C=C1 DY452332 [0,2,0,0,0,0|1,1,0]=4 1907 B11R1.279 CSC1=C(F)C=C(CO)C=C1 DY451408 [0,2,0,0,0,0|1,1,0]=4 1908 B11R1.464 CC1=CC(Br)=CC(C)=C1C=O DY453424 [0,2,0,0,0,0|2,0,0]=4 1909 B11R1.464 CC1=CC(Br)=CC(Cl)=C1C=O DY448504 [0,2,0,0,0,0|2,0,0]=4 1910 B11R1.464 CC1=CC(Br)=CC(F)=C1C#N DY523221 [0,2,0,0,0,0|2,0,0]=4 1911 B11R1.464 CC1=CC(C)=C(C#N)C(O)=C1 DY585005 [0,2,0,0,0,0|2,0,0]=4 1912 B11R1.464 CC1=CC(C)=C(C=O)C(C)=C1 DY20140 [0,2,0,0,0,0|2,0,0]=4 1913 B11R1.464 CC1=CC(F)=CC(Br)=C1C#N NO10661 [0,2,0,0,0,0|2,0,0]=4 1914 B11R1.464 CC1=CC(F)=CC(Br)=C1C=O DY20028 [0,2,0,0,0,0|2,0,0]=4 1915 B11R1.464 CC1=CC(F)=CC(C)=C1C#N DY584875 [0,2,0,0,0,0|2,0,0]=4 1916 B11R1.464 CC1=CC(F)=CC(C)=C1CO DY450256 [0,2,0,0,0,0|2,0,0]=4 1917 B11R1.464 CC1=CC(F)=CC(F)=C1CBr DY110266 [0,2,0,0,0,0|2,0,0]=4 1918 B11R1.464 CC1=CC(F)=CC(F)=C1CO DY584955 [0,2,0,0,0,0|2,0,0]=4 1919 B11R1.464 CC1=CC(O)=CC(C)=C1C#N NO22864 [0,2,0,0,0,0|2,0,0]=4 1920 B11R1.464 CC1=CC(O)=CC(C)=C1C=O NO15683 [0,2,0,0,0,0|2,0,0]=4 1921 B11R1.464 CCC1=C(I)C=C(I)C=C1F DY747919 [0,2,0,0,0,0|2,0,0]=4 1922 B11R1.464 CCN1C(=O)C=C(O)C=C1C DY716234 [0,2,0,0,0,0|2,0,0]=4 1923 B11R1.464 COC1=C(C)C=C(Br)C=C1C NO21145 [0,2,0,0,0,0|0,0,0]=2 1924 B11R1.464 COC1=C(C)C=C(C)C=C1C DY433401 [0,2,0,0,0,0|0,0,0]=2 1925 B11R1.464 COC1=C(C)N=C(C)N=C1Cl DY694253 [0,2,0,0,0,0|2,0,0]=4 1926 B11R1.464 COC1=C(Cl)C=C(Br)C=C1Br DY451936 [0,2,0,0,0,0|1,0,0]=3 1927 B11R1.464 COC1=C(Cl)C=C(Br)C=C1Cl DY453586 [0,2,0,0,0,0|1,0,0]=3 1928 B11R1.464 COC1=C(Cl)C=C(Cl)C=C1F DY584311 [0,2,0,0,0,0|1,0,0]=3 1929 B11R1.464 COC1=C(F)C=C(Br)C=C1F DY433142 [0,2,0,0,0,0|1,0,0]=3 1930 B11R1.464 COC1=C(F)C=C(I)C=C1F DY450340 [0,2,0,0,0,0|1,0,0]=3 1931 B11R1.464 COC1=C(I)C=C(I)N=C1Br DY655101 [0,2,0,0,0,0|2,0,0]=4 1932 B11R1.464 CSC1=C(Br)C=C(F)C=C1Br DY448282 [0,2,0,0,0,0|1,1,0]=4 1933 B11R1.464 CSC1=C(Cl)C=C(Cl)C=C1C DY109978 [0,2,0,0,0,0|0,1,0]=3 1934 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 NO14948 [0,2,0,0,0,0|2,0,0]=4 1935 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 DY10476 [0,2,0,0,0,0|2,0,0]=4 1936 B11R1.167 CC(=O)C1=C(Cl)C=CC(Cl)=C1 NO21139 [0,2,0,0,0,0|2,0,0]=4 1937 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 NO10721 [0,2,0,0,0,0|2,0,0]=4 1938 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=C1 NO12150 [0,2,0,0,0,0|2,0,0]=4 1939 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 DY41254 [0,2,0,0,0,0|2,0,0]=4 1940 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 NO18839 [0,2,0,0,0,0|2,0,0]=4 1941 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 DY10366 [0,2,0,0,0,0|2,0,0]=4 1942 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 NO12985 [0,2,0,0,0,0|2,0,0]=4 1943 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 NO12192 [0,2,0,0,0,0|2,0,0]=4 1944 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 NO15935 [0,2,0,0,0,0|2,0,0]=4 1945 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 DY10135 [0,2,0,0,0,0|2,0,0]=4 1946 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 NO13715 [0,2,0,0,0,0|2,0,0]=4 1947 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 NO20840 [0,2,0,0,0,0|2,0,0]=4 1948 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 NO19932 [0,2,0,0,0,0|2,0,0]=4 1949 B11R1.167 CC(=O)C1=NC(C)=CC=C1C DY111076 [0,2,0,0,0,0|2,0,0]=4 1950 B11R1.167 CC(=O)c1cc(C)ccc1C DY585131 [0,2,0,0,0,0|1,0,0]=3 1951 B11R1.167 CC(=O)c1cc(N)ccc1Cl DY799413 [0,2,0,0,0,0|2,0,0]=4 1952 B11R1.167 CC(C)C1=C(O)C=CC(Br)=C1 DY443460 [0,2,0,0,0,0|2,0,0]=4 1953 B11R1.167 CC(C)c1cc(Br)ccc1Cl DY111654 [0,2,0,0,0,0|2,0,0]=4 1954 B11R1.167 CC(O)C1=C(F)C=CC(Br)=C1 NO12149 [0,2,0,0,0,0|2,0,0]=4 1955 B11R1.167 CC1=C(B(O)O)C=C(Cl)C=C1 NO22046 [0,2,0,0,0,0|2,0,0]=4 1956 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 NO20805 [0,2,0,0,0,0|2,0,0]=4 1957 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 NO10331 [0,2,0,0,0,0|2,0,0]=4 1958 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 NO14966 [0,2,0,0,0,0|2,0,0]=4 1959 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 NO21678 [0,2,0,0,0,0|2,0,0]=4 1960 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 NO10400 [0,2,0,0,0,0|2,0,0]=4 1961 B11R1.167 CC1=C(C(C)C)C=C(N)C=C1 DY608951 [0,2,0,0,0,0|1,0,0]=3 1962 B11R1.167 CC1=C(C(N)=O)C=C(F)C=C1 DY746125 [0,2,0,0,0,0|2,0,0]=4 1963 B11R1.167 CC1=C([N+](=O)[O-])C=C(Br)C=C1 NO18642 [0,2,0,0,0,0|2,0,0]=4 1964 B11R1.167 CC1=C([N+](=O)[O-])C=C(F)C=C1 NO10442 [0,2,0,0,0,0|2,0,0]=4 1965 B11R1.167 CC1=C([N+](=O)[O-])C=C(I)C=C1 NO20233 [0,2,0,0,0,0|2,0,0]=4 1966 B11R1.167 CC1=C([N+](=O)[O-])C=C(N)C=C1 NO20382 [0,2,0,0,0,0|2,0,0]=4 1967 B11R1.167 CC1=C([N+](=O)[O-])C=C(O)C=C1 NO10493 [0,2,0,0,0,0|2,0,0]=4 1968 B11R1.167 CC1=CC(B(O)O)=C(C)C=C1 NO20464 [0,2,0,0,0,0|2,0,0]=4 1969 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 NO21075 [0,2,0,0,0,0|2,0,0]=4 1970 B11R1.167 CC1=CC(C(C)C)=C(O)C=C1 DY507343 [0,2,0,0,0,0|2,0,0]=4 1971 B11R1.167 CC1=CC([C@@H](C)N)=C(F)C=C1 DY621471 [0,2,0,0,0,0|2,0,0]=4 1972 B11R1.167 CC1=CC([N+](=O)[O-])=C(C)C=C1 NO20996 [0,2,0,0,0,0|2,0,0]=4 1973 B11R1.167 C[C@H](O)C1=C(I)C=CC(F)=C1 DY460740 [0,2,0,0,0,0|2,0,0]=4 1974 B11R1.280 C#CC1=NC=C(C)C(OC)=N1 DY107230 [0,2,0,0,0,0|2,0,0]=4 1975 B11R1.280 C=CC1=CC(OC)=C(O)C=C1 NO21640 [0,2,0,0,0,0|1,0,0]=3 1976 B11R1.280 COC1=C(Br)C=CC(CO)=C1 NO21375 [0,2,0,0,0,0|1,0,0]=3 1977 B11R1.280 COC1=C(C)C=CC(C#N)=C1 NO22338 [0,2,0,0,0,0|0,0,0]=2 1978 B11R1.280 COC1=C(C)C=CC(C=O)=C1 NO21938 [0,2,0,0,0,0|0,0,0]=2 1979 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 NO15135 [0,2,0,0,0,0|1,0,0]=3 1980 B11R1.280 COC1=C(Cl)C=CC(CO)=C1 NO17422 [0,2,0,0,0,0|1,0,0]=3 1981 B11R1.280 COC1=C(F)C=CC(C#N)=C1 DY30271 [0,2,0,0,0,0|1,0,0]=3 1982 B11R1.280 COC1=C(F)C=CC(SC)=C1 DY448666 [0,2,0,0,0,0|1,0,0]=3 1983 B11R1.280 COC1=C(N)C=CC(C#N)=C1 NO14461 [0,2,0,0,0,0|1,0,0]=3 1984 B11R1.280 COC1=C(O)C=CC(C=O)=C1 NO13553 [0,2,0,0,0,0|1,0,0]=3 1985 B11R1.280 COC1=C(O)C=CC(CN)=C1 NO22873 [0,2,0,0,0,0|1,0,0]=3 1986 B11R1.280 COC1=CC(C#N)=CN=C1Cl DY514755 [0,2,0,0,0,0|2,0,0]=4 1987 B11R1.280 COC1=CC(C#N)=NC=C1Br DY712585 [0,2,0,0,0,0|2,0,0]=4 1988 B11R1.280 COC1=CC(OC)=C(O)C=C1 NO21112 [0,2,0,0,0,0|1,0,0]=3 1989 B11R1.280 COC1=CC(OC)=C(S)C=C1 DY788073 [0,2,0,0,0,0|1,0,0]=3 1990 B11R1.280 COC1=CC(OC)=NC=C1Br DY558477 [0,2,0,0,0,0|2,0,0]=4 1991 B11R1.280 COC1=CC(SC)=C(F)C=C1 DY452104 [0,2,0,0,0,0|1,1,0]=4 1992 B11R1.280 COC1=CC=C(N)C(OC)=N1 NO13926 [0,2,0,0,0,0|2,0,0]=4 1993 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 NO21769 [0,2,0,0,0,0|2,0,0]=4 1994 B11R1.87 CC(C)(C)C1=C(O)C=CC=C1 NO21771 [0,2,0,0,0,0|2,0,0]=4 1995 B11R1.87 CC(C)(N)C1=C(Br)C=CC=C1 DY789705 [0,2,0,0,0,0|2,0,0]=4 1996 B11R1.87 CC1=C(C(F)(F)F)C=CC=C1 DY20049 [0,2,0,0,0,0|2,0,0]=4 1997 B11R1.87 CC1=C(S(=O)(=O)F)C=CC=C1 DY456946 [0,2,0,0,0,0|1,1,0]=4 1998 B11R1.87 CC1=CC=CC=C1S(=O)(=O)Cl DY791277 [0,2,0,0,0,0|1,1,0]=4 1999 B11R1.156 CC(=O)C1=C(Br)C=CC=C1Cl DY584842 [0,2,0,0,0,0|2,0,0]=4 2000 B11R1.156 CC(=O)C1=C(Br)C=CC=C1F NO13264 [0,2,0,0,0,0|2,0,0]=4 2001 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O NO15783 [0,2,0,0,0,0|2,0,0]=4 2002 B11R1.156 CC(=O)C1=C(C)C=NC=C1C DY652232 [0,2,0,0,0,0|2,0,0]=4 2003 B11R1.156 CC(=O)C1=C(F)C=CC=C1C DY584837 [0,2,0,0,0,0|1,0,0]=3 2004 B11R1.156 CC(=O)C1=C(F)C=CC=C1F NO18713 [0,2,0,0,0,0|2,0,0]=4 2005 B11R1.156 CC(=O)C1=C(F)C=CC=C1O NO19423 [0,2,0,0,0,0|2,0,0]=4 2006 B11R1.156 CC(=O)C1=C(O)C=CC=C1O NO21180 [0,2,0,0,0,0|2,0,0]=4 2007 B11R1.156 CC(O)C1=C(Cl)C=CC=C1Cl DY585102 [0,2,0,0,0,0|2,0,0]=4 2008 B11R1.156 CC1=C([N+](=O)[O-])C(Cl)=CC=C1 NO10415 [0,2,0,0,0,0|2,0,0]=4 2009 B11R1.156 CC1=C([N+](=O)[O-])C(F)=CC=C1 DY31114 [0,2,0,0,0,0|2,0,0]=4 2010 B11R1.156 CC1=CC=CC(Br)=C1C(=O)O NO21386 [0,2,0,0,0,0|2,0,0]=4 2011 B11R1.156 CC1=CC=CC(C)=C1B(O)O NO21186 [0,2,0,0,0,0|2,0,0]=4 2012 B11R1.156 CC1=CC=CC(C)=C1C(=O)O NO10891 [0,2,0,0,0,0|2,0,0]=4 2013 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)O NO20825 [0,2,0,0,0,0|2,0,0]=4 2014 B11R1.156 CC1=CC=CC(F)=C1C(=O)O NO21875 [0,2,0,0,0,0|2,0,0]=4 2015 B11R1.156 CC1=CC=CC(N)=C1C(=O)O NO20994 [0,2,0,0,0,0|2,0,0]=4 2016 B11R1.156 CC1=CC=CC(O)=C1C(=O)O NO21594 [0,2,0,0,0,0|2,0,0]=4 2017 B11R1.156 CC1=CC=CC(O)=C1[N+](=O)[O-] NO14543 [0,2,0,0,0,0|2,0,0]=4 2018 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F DY517047 [0,2,0,0,0,0|2,0,0]=4 2019 B9R1.11 COC(=O)C1=CC=CN1 NO17868 [0,0,1,1,0,0|2,0,0]=4 2020 B9R1.11 COC(=O)C1=CC=CO1 NO11606 [0,0,1,1,0,0|2,0,0]=4 2021 B9R2.50 C1=CC=C2CCC2=C1 NO19267 [1,0,0,1,0,0|1,0,0]=3 2022 B11R2.106 BrC1=C2CCCC2=CC=C1 NO16754 [0,1,0,1,0,0|1,0,0]=3 2023 B11R2.106 BrC1=C2CCNC2=CC=C1 NO18513 [0,1,0,1,0,0|1,0,0]=3 2024 B11R2.106 BrC1=C2CNCC2=CC=C1 NO22684 [0,1,0,1,0,0|2,0,0]=4 2025 B11R2.106 BrC1=CC=CC2=C1C=NO2 NO12976 [0,1,0,1,0,0|1,0,1]=4 2026 B11R2.106 BrC1=CC=CC2=C1N=CO2 NO22673 [0,1,0,1,0,0|1,0,1]=4 2027 B11R2.106 BrC1=CC=CC2=C1OCC2 NO12983 [0,1,0,1,0,0|0,0,0]=2 2028 B11R2.106 BrC1=CC=CC2=C1OCO2 NO22623 [0,1,0,1,0,0|1,0,0]=3 2029 B11R2.106 CC1=C2C=CNC2=CC=C1 NO21706 [0,1,0,1,0,0|1,0,1]=4 2030 B11R2.106 CC1=C2C=NNC2=CC=C1 NO22943 [0,1,0,1,0,0|2,0,0]=4 2031 B11R2.106 CC1=C2CNCC2=CC=C1 NO17946 [0,1,0,1,0,0|1,0,0]=3 2032 B11R2.106 CC1=C2NC=CC2=CC=C1 NO11034 [0,1,0,1,0,0|1,0,1]=4 2033 B11R2.106 CC1=C2NCCC2=CC=C1 NO18412 [0,1,0,1,0,0|1,0,0]=3 2034 B11R2.106 CC1=C2NN=CC2=CC=C1 NO10824 [0,1,0,1,0,0|1,0,1]=4 2035 B11R2.106 CC1=CC=CC2=C1C=CO2 DY751237 [0,1,0,1,0,0|0,0,2]=4 2036 B11R2.106 CC1=CC=CC2=C1SC=C2 DY441270 [0,1,0,1,0,0|0,1,1]=4 2037 B11R2.106 CC1=CC=CC2=NCCN12 DY760358 [0,1,0,1,0,0|2,0,0]=4 2038 B11R2.106 ClC1=C2CCCC2=NC=C1 NO12915 [0,1,0,1,0,0|2,0,0]=4 2039 B11R2.106 ClC1=C2CCNC2=CC=C1 NO10845 [0,1,0,1,0,0|1,0,0]=3 2040 B11R2.106 ClC1=C2CCNC2=CN=C1 DY585263 [0,1,0,1,0,0|2,0,0]=4 2041 B11R2.106 ClC1=C2CNCC2=CC=C1 DY630146 [0,1,0,1,0,0|2,0,0]=4 2042 B11R2.106 ClC1=C2CNCC2=CC=C1 NO15338 [0,1,0,1,0,0|2,0,0]=4 2043 B11R2.106 ClC1=C2NCCC2=CC=N1 DY518367 [0,1,0,1,0,0|2,0,0]=4 2044 B11R2.106 FC1=C2CCNC2=CC=C1 DY433917 [0,1,0,1,0,0|1,0,0]=3 2045 B11R2.106 FC1=C2CNCC2=CC=C1 DY430022 [0,1,0,1,0,0|2,0,0]=4 2046 B11R2.106 FC1=C2CNCC2=CC=C1 DY580305 [0,1,0,1,0,0|2,0,0]=4 2047 B11R2.106 IC1=C2CCNC2=CC=C1 DY630170 [0,1,0,1,0,0|1,0,0]=3 2048 B11R2.106 IC1=CC=CC2=C1OCO2 NO12923 [0,1,0,1,0,0|1,0,0]=3 2049 B11R2.106 NC1=C2N=COC2=CC=C1 DY443226 [0,1,0,1,0,0|1,0,1]=4 2050 B11R2.106 NC1=CC=CC2=C1CCN2 NO11498 [0,1,0,1,0,0|1,0,0]=3 2051 B11R2.106 NC1=CC=CC2=C1OC=N2 NO17297 [0,1,0,1,0,0|1,0,1]=4 2052 B11R2.106 NC1=CC=CC2=C1ON=C2 NO17211 [0,1,0,1,0,0|1,0,1]=4 2053 B11R2.106 O=C1C=CC=C2NCCN12 NO15111 [0,1,0,1,0,0|2,0,0]=4 2054 B11R2.106 O=C1C=CC=C2NCCN12 NO17486 [0,1,0,1,0,0|2,0,0]=4 2055 B11R2.106 OC1=CC=CC2=C1CCC2 NO22898 [0,1,0,1,0,0|1,0,0]=3 2056 B11R2.106 OC1=CC=NC2=C1CCN2 DY534099 [0,1,0,1,0,0|2,0,0]=4 2057 B11R2.106 [O-][N+]1=CC=CC2=C1CCC2 DY579003 [0,1,0,1,0,0|2,0,0]=4 2058 B11R2.10 BrC1=CC2=CC=CC=C2C1 NO21490 [0,1,0,1,0,0|1,0,1]=4 2059 B11R2.10 CC1=CC2=C(C=CN=C2)O1 DY673188 [0,1,0,1,0,0|1,0,1]=4 2060 B11R2.10 CC1=CC2=CC=CC=C2N1 NO18563 [0,1,0,1,0,0|1,0,1]=4 2061 B11R2.10 CC1=NC2=C(C=CC=C2)N1 NO15288 [0,1,0,1,0,0|2,0,0]=4 2062 B11R2.10 CC1=NC2=C(C=CC=C2)S1 NO21687 [0,1,0,1,0,0|1,1,0]=4 2063 B11R2.10 CC1=NC2=NC=CC=C2O1 DY445727 [0,1,0,1,0,0|2,0,0]=4 2064 B11R2.10 C[C@@H]1CC2=CC=CC=C2N1 DY541863 [0,1,0,1,0,0|1,0,0]=3 2065 B11R2.10 ClC1CC2=CC=CC=C2C1 DY686677 [0,1,0,1,0,0|1,0,0]=3 2066 B11R2.10 O=C1CC2=C(C=CC=C2)O1 DY20944 [0,1,0,1,0,0|0,0,1]=3 2067 B11R2.10 O=C1CC2=CC=CC=C2C1 NO16080 [0,1,0,1,0,0|1,0,1]=4 2068 B11R2.10 O=C1CC2=CC=CC=C2N1 NO15184 [0,1,0,1,0,0|1,0,1]=4 2069 B11R2.10 O=C1NC2=C(C=CC=C2)O1 NO15190 [0,1,0,1,0,0|1,0,1]=4 2070 B11R2.10 O=C1OC2=C(C=CC=C2)O1 NO10973 [0,1,0,1,0,0|1,0,1]=4 2071 B11R2.10 OC1=CC2=C(C=CC=C2)O1 DY751579 [0,1,0,1,0,0|0,0,2]=4 2072 B11R2.10 OC1CC2=CC=CC=C2C1 NO21608 [0,1,0,1,0,0|1,0,0]=3 2073 B11R2.10 SC1=NC2=C(C=CC=C2)O1 DY20463 [0,1,0,1,0,0|1,0,1]=4 2074 B11R2.20 C1=CC2=C(C=C1)SCCN2 DY459726 [0,1,0,1,0,0|0,1,0]=3 2075 B11R2.20 C1=CC2=C(C=N1)NCCN2 DY669326 [0,1,0,1,0,0|2,0,0]=4 2076 B11R2.20 C1=CC2=C(CCCC2)N=C1 NO13407 [0,1,0,1,0,0|2,0,0]=4 2077 B11R2.20 C1=CC2=C(CCNC2)N=C1 NO14841 [0,1,0,1,0,0|2,0,0]=4 2078 B11R2.20 C1=CC2=C(N=C1)NCCN2 NO12464 [0,1,0,1,0,0|2,0,0]=4 2079 B11R2.20 C1=CC=C2CNCCC2=C1 NO19412 [0,1,0,1,0,0|1,0,0]=3 2080 B11R2.20 C1=CC=C2COCCC2=C1 NO19933 [0,1,0,1,0,0|0,0,0]=2 2081 B11R2.20 C1=CC=C2NCCNC2=C1 NO19000 [0,1,0,1,0,0|1,0,0]=3 2082 B11R2.20 C1=CN=C2NCCCC2=C1 NO20465 [0,1,0,1,0,0|2,0,0]=4 2083 B11R2.20 C1=NC=C2CCCNC2=C1 DY105356 [0,1,0,1,0,0|2,0,0]=4 2084 B11R2.20 C1=NC=C2CCNCC2=C1 NO15863 [0,1,0,1,0,0|2,0,0]=4 2085 B11R2.20 C1=NC=C2CNCCC2=C1 DY113298 [0,1,0,1,0,0|2,0,0]=4 2086 B11R2.20 C1=NC=C2CNCCC2=C1 NO17812 [0,1,0,1,0,0|2,0,0]=4 2087 B11R2.55 OC1=C(C2CC2)C=CC=C1 DY757459 [0,1,0,1,0,0|2,0,0]=4 2088 B11R2.1 BrC1=COC2=C1C=CC=C2 NO20626 [0,1,0,1,0,0|0,0,2]=4 2089 B11R2.1 CC1=CCC2=CC=CC=C12 DY106180 [0,1,0,1,0,0|1,0,0]=3 2090 B11R2.1 CC1=CNC2=CC=CC=C12 NO11030 [0,1,0,1,0,0|1,0,1]=4 2091 B11R2.1 CC1=NNC2=CC=CC=C21 NO17372 [0,1,0,1,0,0|2,0,0]=4 2092 B11R2.1 CC1=NOC2=C1C=CC=C2 NO22352 [0,1,0,1,0,0|1,0,0]=3 2093 B11R2.1 CC1CNC2=NC=CC=C21 DY739061 [0,1,0,1,0,0|2,0,0]=4 2094 B11R2.1 CN1C=CC2=CC=CC=C21 NO11026 [0,1,0,1,0,0|1,0,1]=4 2095 B11R2.1 C[N+]1=CSC2=C1C=CC=C2 DY546033 [0,1,0,1,0,0|0,1,1]=4 2096 B11R2.1 ClC1=NOC2=C1C=CC=C2 NO19970 [0,1,0,1,0,0|1,0,1]=4 2097 B11R2.1 NC1=NCC2=CC=CC=C21 DY459738 [0,1,0,1,0,0|2,0,0]=4 2098 B11R2.1 NC1=NOC2=C1C=CC=C2 NO20240 [0,1,0,1,0,0|1,0,1]=4 2099 B11R2.1 NC1CCC2=CC=CC=C21 NO19275 [0,1,0,1,0,0|1,0,0]=3 2100 B11R2.1 N[C@@H]1CCC2=CC=CC=C21 NO19803 [0,1,0,1,0,0|1,0,0]=3 2101 B11R2.1 N[C@H]1CCC2=CC=CC=C21 NO16005 [0,1,0,1,0,0|1,0,0]=3 2102 B11R2.1 N[C@H]1CCC2=CC=CC=C21 NO20307 [0,1,0,1,0,0|1,0,0]=3 2103 B11R2.1 N[C@H]1CCC2=NC=CC=C21 DY515745 [0,1,0,1,0,0|2,0,0]=4 2104 B11R2.1 O=C1CCC2=CC=CC=C12 NO18668 [0,1,0,1,0,0|1,0,0]=3 2105 B11R2.1 O=C1CCC2=CC=CN=C12 NO10816 [0,1,0,1,0,0|2,0,0]=4 2106 B11R2.1 O=C1CCC2=NC=CC=C12 NO18212 [0,1,0,1,0,0|2,0,0]=4 2107 B11R2.1 O=C1COC2=NC=CC=C12 DY441318 [0,1,0,1,0,0|1,0,1]=4 2108 B11R2.1 O=C1CSC2=C1C=CC=C2 NO20606 [0,1,0,1,0,0|0,1,1]=4 2109 B11R2.1 O=C1NCC2=CC=CC=C12 NO11515 [0,1,0,1,0,0|2,0,0]=4 2110 B11R2.1 O=C1OCC2=CC=CC=C12 NO11853 [0,1,0,1,0,0|2,0,0]=4 2111 B11R2.1 OC1CCC2=CC=CN=C21 NO10573 [0,1,0,1,0,0|2,0,0]=4 2112 B11R2.1 O[C@@H]1CCC2=CC=CC=C21 DY567765 [0,1,0,1,0,0|1,0,0]=3 2113 B11R2.36 BrC1=CC2=C(C=C1)C=NO2 NO13230 [0,1,0,1,0,0|1,0,1]=4 2114 B11R2.36 BrC1=CC2=C(C=C1)N=CO2 NO14721 [0,1,0,1,0,0|1,0,1]=4 2115 B11R2.36 BrC1=CC2=C(C=C1)OCC2 DY20389 [0,1,0,1,0,0|0,0,0]=2 2116 B11R2.36 BrC1=CC2=C(C=C1)ON=C2 NO12317 [0,1,0,1,0,0|1,0,1]=4 2117 B11R2.36 BrC1=CC=C2C=CCC2=C1 DY549009 [0,1,0,1,0,0|1,0,1]=4 2118 B11R2.36 BrC1=CC=C2CCNC2=C1 NO17623 [0,1,0,1,0,0|1,0,0]=3 2119 B11R2.36 BrC1=CC=C2CNCC2=C1 DY20658 [0,1,0,1,0,0|2,0,0]=4 2120 B11R2.36 BrC1=CC=C2CNCC2=C1 NO14408 [0,1,0,1,0,0|2,0,0]=4 2121 B11R2.36 BrC1=CC=C2NCCC2=C1 NO10836 [0,1,0,1,0,0|1,0,0]=3 2122 B11R2.36 BrC1=CN=C2CCCC2=C1 NO22164 [0,1,0,1,0,0|2,0,0]=4 2123 B11R2.36 BrC1=CN=C2NCCC2=C1 DY533421 [0,1,0,1,0,0|2,0,0]=4 2124 B11R2.36 BrC1=CN=C2NCCC2=C1 NO18623 [0,1,0,1,0,0|2,0,0]=4 2125 B11R2.36 Brc1ccc2c(c1)OCO2 NO19789 [0,1,0,1,0,0|1,0,0]=3 2126 B11R2.36 CC1=CC2=C(C=C1)OC=C2 DY441161 [0,1,0,1,0,0|0,0,2]=4 2127 B11R2.36 CC1=CC=C2CNCC2=C1 DY431420 [0,1,0,1,0,0|2,0,0]=4 2128 B11R2.36 CC1=CN2CCN=C2C=C1 DY760340 [0,1,0,1,0,0|2,0,0]=4 2129 B11R2.36 ClC1=CC2=C(C=C1)OC=N2 NO19972 [0,1,0,1,0,0|1,0,1]=4 2130 B11R2.36 ClC1=CC2=C(C=N1)CCN2 NO14935 [0,1,0,1,0,0|2,0,0]=4 2131 B11R2.36 ClC1=CC=C2CCNC2=C1 NO19407 [0,1,0,1,0,0|1,0,0]=3 2132 B11R2.36 ClC1=CC=C2CNCC2=C1 NO15340 [0,1,0,1,0,0|2,0,0]=4 2133 B11R2.36 ClC1=CC=C2NCCC2=C1 DY20079 [0,1,0,1,0,0|1,0,0]=3 2134 B11R2.36 ClC1=CC=C2NCCC2=C1 DY630382 [0,1,0,1,0,0|1,0,0]=3 2135 B11R2.36 FC1=CC2=C(C=C1)ON=C2 DY751753 [0,1,0,1,0,0|1,0,1]=4 2136 B11R2.36 FC1=CC=C2CCCC2=C1 NO16751 [0,1,0,1,0,0|1,0,0]=3 2137 B11R2.36 FC1=CC=C2CCNC2=C1 DY443334 [0,1,0,1,0,0|1,0,0]=3 2138 B11R2.36 FC1=CC=C2CNCC2=C1 DY459041 [0,1,0,1,0,0|2,0,0]=4 2139 B11R2.36 FC1=CC=C2CNCC2=C1 NO15207 [0,1,0,1,0,0|2,0,0]=4 2140 B11R2.36 IC1=CN=C2CCCC2=C1 DY675123 [0,1,0,1,0,0|2,0,0]=4 2141 B11R2.36 NC1=CC2=C(C=C1)C=NO2 NO12165 [0,1,0,1,0,0|1,0,1]=4 2142 B11R2.36 NC1=CC2=C(C=C1)CCO2 DY561471 [0,1,0,1,0,0|0,0,0]=2 2143 B11R2.36 NC1=CC2=C(C=C1)N=CO2 NO20506 [0,1,0,1,0,0|1,0,1]=4 2144 B11R2.36 NC1=CC2=C(C=C1)OCO2 NO20315 [0,1,0,1,0,0|1,0,0]=3 2145 B11R2.36 NC1=CC2=C(C=C1)ON=C2 NO14807 [0,1,0,1,0,0|1,0,1]=4 2146 B11R2.36 NC1=CC=C2CNCC2=C1 DY20849 [0,1,0,1,0,0|2,0,0]=4 2147 B11R2.36 NC1=CC=C2CNCC2=C1 DY555549 [0,1,0,1,0,0|2,0,0]=4 2148 B11R2.36 NC1=CC=C2NCCC2=C1 DY630744 [0,1,0,1,0,0|1,0,0]=3 2149 B11R2.36 NC1=CN=C2CCCC2=C1 DY100354 [0,1,0,1,0,0|2,0,0]=4 2150 B11R2.36 OC1=CC2=C(C=C1)C=NO2 NO12459 [0,1,0,1,0,0|1,0,1]=4 2151 B11R2.36 OC1=CC2=C(C=C1)CCO2 NO16031 [0,1,0,1,0,0|0,0,0]=2 2152 B11R2.36 OC1=CC2=C(C=CO2)C=C1 NO20605 [0,1,0,1,0,0|0,0,2]=4 2153 B11R2.36 OC1=CC=C2CCNC2=C1 DY630750 [0,1,0,1,0,0|1,0,0]=3 2154 B11R2.36 OC1=CC=C2CNCC2=C1 DY446903 [0,1,0,1,0,0|2,0,0]=4 2155 B7R1.1 CNC1=CC=CS1 DY786838 [1,0,0,0,1,0|2,0,0]=4 2156 B7R1.1 COC1=CC=CO1 DY759896 [1,0,0,0,1,0|1,0,0]=3 2157 B7R1.1 COC1=CNC=N1 DY725797 [1,0,0,0,1,0|2,0,0]=4 2158 B7R1.1 COC1=CSC=C1 NO22351 [1,0,0,0,1,0|1,0,0]=3 2159 B7R1.1 COC1=NC=CS1 NO22597 [1,0,0,0,1,0|2,0,0]=4 2160 B7R1.4 CC1=C(Br)SC=C1 NO13700 [1,0,0,0,1,0|2,0,0]=4 2161 B7R1.4 CC1=C(C)NC=N1 DY20435 [1,0,0,0,1,0|2,0,0]=4 2162 B7R1.4 CC1=C(C)NC=N1 DY575295 [1,0,0,0,1,0|2,0,0]=4 2163 B7R1.4 CC1=C(C)SC=N1 NO22784 [1,0,0,0,1,0|2,0,0]=4 2164 B7R1.4 CC1=CC=NN1C NO19266 [1,0,0,0,1,0|2,0,0]=4 2165 B7R1.4 CC1=CNN=C1C NO13346 [1,0,0,0,1,0|2,0,0]=4 2166 B7R1.4 CN1N=CC=C1O NO10399 [1,0,0,0,1,0|2,0,0]=4