0 B10R1.20 BrCC1=C(CBr)C=CC=C1 DY20537 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.20 C#CC1=C(OC)C=CC=C1 NO21618 [0,0,0,0,0,0|1,0,1]=2 2 B10R1.20 CCC1=C(C=O)C=CC=C1 DY20141 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.20 CCC1=C(CO)C=CC=C1 DY451342 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.20 CCC1=C(NN)C=CC=C1 NO15134 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.20 CNC1=C(C=O)C=CC=C1 NO17054 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.20 CNC1=C(OC)C=CC=C1 DY790233 [0,0,0,0,0,0|1,0,0]=1 7 B10R1.20 COC1=C(C=O)C=CC=N1 NO20317 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.20 COC1=C(CCl)C=CC=C1 DY20247 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.20 COC1=C(CCl)C=CN=C1 DY657907 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.20 COC1=C(CN)C=CC=C1 NO15681 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.20 COC1=C(NN)C=CC=C1 NO19579 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.20 COC1=C(OC)C=CC=C1 NO12067 [0,0,0,0,0,0|0,0,0]=0 13 B10R1.20 COC1=CC=CN=C1C#N DY10410 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.20 COC1=CC=CN=C1CBr NO13321 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.20 COC1=CC=CN=C1CN NO18076 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.20 COC1=CC=CN=C1CO DY558123 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.20 COC1=CC=CN=C1OC NO14783 [0,0,0,0,0,0|1,0,0]=1 18 B10R1.20 COC1=CN=CN=C1OC DY568485 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.20 COC1=NC=CC=C1CCl DY606789 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.20 COC1=NC=CC=C1CCl NO16832 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.20 COC1=NC=CC=C1CN NO14780 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.20 COC1=NC=CC=C1CN NO17327 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.20 COC1=NC=CC=C1CO NO13650 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.20 COC1=NC=CN=C1OC DY710611 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.20 ClCC1=C(CCl)C=CC=C1 DY563247 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.20 N#CC1=C(C=O)C=CC=C1 NO15835 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.20 N#CC1=C(CBr)C=CC=C1 NO18879 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.20 N#CC1=C(CCl)C=CC=C1 NO18396 [0,0,0,0,0,0|4,0,0]=4 29 B10R1.20 N#CC1=C(CN)C=CC=C1 NO15557 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.20 N#CC1=CC=CC=C1C#N NO11856 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.20 NCC1=C(CO)C=CC=C1 NO13269 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.20 OCC1=C(CBr)C=CC=C1 NO17090 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.20 [C-]#[N+]C1=C(OC)C=CC=C1 DY745507 [0,0,0,0,0,0|1,0,1]=2 34 B9R1.15 BrCC1=C(Br)C=CC=C1 DY20808 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.15 BrCC1=C(I)C=CC=C1 DY40561 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.15 C#CC1=C(Cl)C=CC=C1 NO20629 [1,0,0,0,0,0|2,0,1]=4 37 B9R1.15 C#CC1=C(N)C=CC=C1 NO21537 [1,0,0,0,0,0|2,0,1]=4 38 B9R1.15 C#CC1=C(O)C=CC=C1 NO21538 [1,0,0,0,0,0|1,0,1]=3 39 B9R1.15 C=CC1=C(Br)C=CC=C1 NO18853 [1,0,0,0,0,0|2,0,1]=4 40 B9R1.15 C=CC1=C(Cl)C=CC=C1 NO19873 [1,0,0,0,0,0|2,0,1]=4 41 B9R1.15 CC1=C(CBr)C=CC=C1 NO14791 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.15 CC1=C(CBr)C=NC=C1 DY656650 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.15 CC1=C(CBr)C=NC=C1 NO17496 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.15 CC1=C(CN)C=NC=C1 NO20204 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.15 CC1=C(NN)C=CC=C1 DY788973 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.15 CC1=C(NN)C=CC=C1 NO19575 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.15 CC1=CC=CC=C1C=O NO19114 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.15 CC1=CC=CN=C1C#N NO20234 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.15 CC1=CC=CN=C1C=O NO14987 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.15 CC1=CC=CN=C1CCl NO15725 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.15 CC1=CC=CN=C1CO NO19225 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.15 CC1=CC=NC=C1C#N NO22253 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.15 CC1=NC=CC=C1CBr DY520989 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.15 CC1=NC=CC=C1CO NO20145 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.15 CCC1=C(Br)C=CC=C1 NO20980 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.15 CCC1=C(C)C=CC=C1 NO21536 [1,0,0,0,0,0|1,0,0]=2 57 B9R1.15 CCC1=C(I)C=CC=C1 DY534201 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.15 CCC1=C(N)C=NC=C1 DY658535 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.15 CCC1=CC=CN=C1C DY522489 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.15 CN1C=CC=C\C1=N\N DY586632 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.15 CNC1=C(Br)C=CC=C1 DY584260 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.15 CNC1=C(F)C=CC=C1 NO13895 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.15 CNC1=C(N)C=NC=C1 DY10330 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.15 CNC1=CC=CC=C1N NO22302 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.15 CNC1=NC=CC=C1Br NO17281 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.15 COC1=C(Br)C=CC=C1 NO19150 [1,0,0,0,0,0|1,0,0]=2 67 B9R1.15 COC1=C(Br)C=CN=C1 NO14715 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.15 COC1=C(Br)C=NC=C1 NO18491 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.15 COC1=C(C)C=CC=C1 DY561483 [1,0,0,0,0,0|0,0,0]=1 70 B9R1.15 COC1=C(Cl)C=CN=C1 DY442708 [1,0,0,0,0,0|2,0,0]=3 71 B9R1.15 COC1=C(F)C=CC=C1 NO19904 [1,0,0,0,0,0|1,0,0]=2 72 B9R1.15 COC1=C(F)C=NC=C1 NO16194 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.15 COC1=C(I)C=NC=C1 NO18542 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.15 COC1=C(N)C=CC=C1 NO11812 [1,0,0,0,0,0|1,0,0]=2 75 B9R1.15 COC1=C(N)C=CN=C1 NO22564 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.15 COC1=C(N)C=NC=C1 NO18248 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.15 COC1=C(O)C=NC=C1 DY586059 [1,0,0,0,0,0|1,0,0]=2 78 B9R1.15 COC1=CC=CN=C1Br NO19255 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.15 COC1=CC=CN=C1Cl NO19305 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.15 COC1=CC=CN=C1F NO13044 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.15 COC1=CC=CN=C1N NO17216 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.15 COC1=CN=CN=C1Br NO17880 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.15 COC1=CN=CN=C1N NO13116 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.15 COC1=NC=CC=C1Br DY715700 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.15 COC1=NC=CC=C1Br NO19258 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.15 COC1=NC=CC=C1Cl NO18705 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.15 COC1=NC=CC=C1F NO19564 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.15 COC1=NC=CC=C1I NO13512 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.15 COC1=NC=CC=C1N NO19526 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.15 COC1=NC=CN=C1Br NO12288 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.15 COC1=NC=CN=C1Cl NO14291 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.15 COC1=NC=CN=C1N DY441119 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.15 CSC1=CC=CN=C1Cl DY452032 [1,0,0,0,0,0|2,1,0]=4 94 B9R1.15 ClC1=C(CBr)C=CC=C1 NO19190 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.15 ClCC1=C(Br)C=CC=C1 DY584533 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.15 ClCC1=C(Cl)C=CC=C1 NO19964 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.15 FC1=C(CBr)C=CC=C1 NO21562 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.15 N#CC1=C(Br)C=CC=C1 DY20182 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.15 N#CC1=C(F)C=CC=C1 NO18285 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.15 N#CC1=C(I)C=CC=C1 NO21883 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.15 N#CC1=C(N)C=CC=C1 NO13393 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.15 N#CC1=C(O)C=CC=C1 NO19191 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.15 N#CC1=CC=CN=C1O NO13920 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.15 N#CC1=NC=CC=C1O NO21861 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.15 NC1=C(C=O)C=CC=C1 DY20756 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.15 NC1=C(CO)C=CC=C1 NO19122 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.15 NCC1=C(Br)C=CC=C1 NO19534 [1,0,0,0,0,0|3,0,0]=4 108 B9R1.15 NCC1=C(F)C=CC=C1 DY40826 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.15 NCC1=C(N)C=CC=C1 DY40796 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.15 NCC1=C(O)C=CC=C1 NO20889 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.15 NCC1=C(O)C=CN=C1 DY656620 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.15 NNC1=C(Br)C=CC=C1 NO19466 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.15 NNC1=C(Cl)C=CC=C1 NO19478 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.15 NNC1=C(F)C=CC=C1 NO23033 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.15 O=CC1=C(F)C=CC=C1 DY794301 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.15 O=CC1=C(F)C=CC=C1 NO21560 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.15 O=CC1=C(I)C=CC=C1 NO20131 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.15 O=CC1=C(O)C=CC=C1 DY41121 [1,0,0,0,0,0|2,0,0]=3 119 B9R1.15 O=CC1=C(O)C=NC=C1 NO13859 [1,0,0,0,0,0|3,0,0]=4 120 B9R1.15 O=CC1=C(O)N=CC=C1 NO19011 [1,0,0,0,0,0|3,0,0]=4 121 B9R1.15 OCC1=C(Br)C=CC=C1 NO18828 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.15 OCC1=C(Cl)C=CC=C1 NO21494 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.15 OCC1=C(I)C=CC=C1 NO19102 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.15 OCC1=C(O)C=CC=C1 NO16243 [1,0,0,0,0,0|2,0,0]=3 125 B9R1.15 OCC1=NC=CC=C1O DY20200 [1,0,0,0,0,0|3,0,0]=4 126 B11R1.37 CCC1=C(C=O)C=CC(Cl)=C1 DY584870 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.37 CCC1=C(CO)C=C(Br)C=C1 DY584341 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.37 CCC1=C(CO)C=CC(Br)=C1 DY452560 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.37 COC1=C(C#N)C=C(Cl)C=C1 NO20726 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.37 COC1=C(C#N)C=CC(Br)=C1 NO18242 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.37 COC1=C(C#N)C=CC(Br)=N1 DY712771 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.37 COC1=C(C#N)C=CC(C)=C1 NO21636 [0,1,0,0,0,0|2,0,0]=3 133 B11R1.37 COC1=C(C#N)C=CC(Cl)=N1 DY431143 [0,1,0,0,0,0|3,0,0]=4 134 B11R1.37 COC1=C(C#N)C=CC(F)=C1 DY30021 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.37 COC1=C(C#N)C=CC(N)=C1 NO22550 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.37 COC1=C(C#N)C=CC(O)=C1 DY442317 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.37 COC1=C(C=O)C=C(C)C=N1 DY511041 [0,1,0,0,0,0|3,0,0]=4 138 B11R1.37 COC1=C(C=O)C=C(Cl)C=C1 NO20830 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.37 COC1=C(C=O)C=C(F)C=C1 NO13891 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.37 COC1=C(C=O)C=CC(Br)=C1 NO22648 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.37 COC1=C(CBr)C=CC(Br)=C1 DY585097 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.37 COC1=C(CBr)C=CC(F)=C1 DY585074 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.37 COC1=C(CCl)C=C(C)C=C1 DY745693 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.37 COC1=C(CN)C=C(Cl)C=C1 NO16238 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.37 COC1=C(CN)C=C(N)C=C1 NO10206 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.37 COC1=C(CN)C=CC(F)=C1 NO12735 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.37 COC1=C(CO)C=C(Cl)C=C1 DY451366 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 DY445716 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.37 COC1=C(OC)C=C(Br)C=C1 NO19895 [0,1,0,0,0,0|0,0,0]=1 150 B11R1.37 COC1=C(OC)C=C(C)C=C1 NO21947 [0,1,0,0,0,0|0,0,0]=1 151 B11R1.37 COC1=C(OC)C=C(F)C=C1 NO20493 [0,1,0,0,0,0|0,0,0]=1 152 B11R1.37 COC1=C(OC)N=CC(N)=C1 NO15128 [0,1,0,0,0,0|1,0,0]=2 153 B11R1.37 COC1=C(OC)N=CC(O)=C1 DY509696 [0,1,0,0,0,0|1,0,0]=2 154 B11R1.37 COC1=CC(Cl)=CN=C1OC DY713233 [0,1,0,0,0,0|1,0,0]=2 155 B11R1.37 COC1=CC(Cl)=NC=C1C#N NO15634 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.37 COC1=CC(F)=NC=C1C#N DY432631 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.37 COC1=CC=C(Br)C=C1C=O DY33091 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.37 COC1=CC=C(Br)N=C1C=O NO15316 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.37 COC1=NC(Br)=CC=C1CN NO17510 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.37 COC1=NC(Br)=CC=C1CO NO17509 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.37 COC1=NC=C(Br)C=C1CO DY443486 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.37 COC1=NC=C(Br)N=C1OC NO14846 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.37 CSC1=C(C=O)C=C(F)C=C1 DY452806 [0,1,0,0,0,0|2,1,0]=4 164 B11R1.41 C#CC1=C(OCC)C=CC=C1 DY789147 [0,1,0,0,0,0|1,0,1]=3 165 B11R1.41 CCOC1=CC=NC=C1C#N DY658523 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.41 CNCC1=C(OC)C=CC=C1 DY584503 [0,1,0,0,0,0|1,0,0]=2 167 B11R1.41 COC1=C(CCO)C=CC=C1 NO15749 [0,1,0,0,0,0|1,0,0]=2 168 B11R1.41 COC1=C(CNN)C=CC=C1 DY610863 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.41 COC1=NC=CC=C1CC#N DY653828 [0,1,0,0,0,0|2,0,1]=4 170 B11R1.41 COCC1=CC=CN=C1C#N DY656704 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.41 COCC1=CC=CN=C1CCl DY714212 [0,1,0,0,0,0|3,0,0]=4 172 B11R1.41 N#CC1=C(CON)C=CC=C1 DY574887 [0,1,0,0,0,0|3,0,0]=4 173 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 NO21523 [0,1,0,0,0,0|3,0,0]=4 174 B11R1.53 CCC1=C(B(O)O)C=CC=C1 NO20466 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 NO15281 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.53 CCC1=C(C(C)=O)C=CN=C1 DY652292 [0,1,0,0,0,0|3,0,0]=4 177 B11R1.53 CN(C)C1=C(CN)C=CC=C1 DY745873 [0,1,0,0,0,0|3,0,0]=4 178 B11R1.53 COC1=C(B(O)O)C=CC=C1 NO20142 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.53 COC1=C(B(O)O)C=NC=C1 DY443759 [0,1,0,0,0,0|3,0,0]=4 180 B11R1.53 COC1=C(C(=N)N)C=CC=C1 DY795999 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.53 COC1=C(C(=O)O)C=CC=C1 NO15086 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.53 COC1=C(C(=O)O)C=CC=N1 NO20330 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.53 COC1=C(C(=O)O)C=CN=C1 NO10492 [0,1,0,0,0,0|3,0,0]=4 184 B11R1.53 COC1=C(C(C)=O)C=CN=C1 DY105760 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.53 COC1=C(C(C)N)C=CC=C1 DY553119 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 NO15754 [0,1,0,0,0,0|1,0,0]=2 187 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 NO19392 [0,1,0,0,0,0|3,0,0]=4 188 B11R1.53 COC1=CC=CN=C1C(=O)O NO22335 [0,1,0,0,0,0|3,0,0]=4 189 B11R1.53 COC1=CC=CN=C1C(C)=O NO16598 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] NO19391 [0,1,0,0,0,0|3,0,0]=4 191 B11R1.53 COC1=CC=NC=C1C(=O)O NO13273 [0,1,0,0,0,0|3,0,0]=4 192 B11R1.53 COC1=NC=CC=C1B(O)O DY20273 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.53 COC1=NC=CC=C1C(C)N DY652190 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] NO13911 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.53 CSC1=C(C(=O)O)C=CC=C1 DY551739 [0,1,0,0,0,0|2,1,0]=4 196 B11R1.53 C[Se]C1=C(C(=O)O)C=CC=C1 DY565725 [0,1,0,0,0,0|2,1,0]=4 197 B11R1.265 COC1=C(C#N)C(=O)NC=C1 DY20663 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.265 COC1=C(C#N)C(C)=CC=C1 NO14397 [0,1,0,0,0,0|2,0,0]=3 199 B11R1.265 COC1=C(C=O)C(C)=CC=C1 NO21645 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.265 COC1=C(C=O)C(F)=NC=C1 DY451558 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.265 COC1=C(C=O)C(I)=CC=N1 NO13769 [0,1,0,0,0,0|3,0,0]=4 202 B11R1.265 COC1=C(C=O)C=CC=C1Br NO22135 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.265 COC1=C(C=O)C=CC=C1C NO15730 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.265 COC1=C(C=O)C=CC=C1Cl NO12248 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.265 COC1=C(C=O)C=CN=C1Cl DY716408 [0,1,0,0,0,0|3,0,0]=4 206 B11R1.265 COC1=C(CBr)OC=CC1=O DY447335 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.265 COC1=C(CO)C=CC=C1F NO14762 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.265 COC1=C(OC)C(N)=NC=N1 DY10371 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.265 COC1=CC=CC(Br)=C1C#N NO16021 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.265 COC1=CC=CC(Br)=C1CO DY450976 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.265 COC1=CC=CC(Br)=C1OC NO14821 [0,1,0,0,0,0|0,0,0]=1 212 B11R1.265 COC1=CC=CC(Cl)=C1C#N NO21481 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.265 COC1=CC=CC(Cl)=C1C=O NO17258 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.265 COC1=CC=CC(F)=C1C#N NO10752 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.265 COC1=CC=CC(F)=C1C=O NO20843 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.265 COC1=CC=CC(F)=C1CN DY686419 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.265 COC1=CC=CC(F)=C1CN NO20435 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.265 COC1=NC=CC(Cl)=C1OC DY714980 [0,1,0,0,0,0|1,0,0]=2 219 B11R1.265 COc1cccc(I)c1OC DY584342 [0,1,0,0,0,0|0,0,0]=1 220 B11R1.265 CSC1=CC=CC(Br)=C1CO DY449488 [0,1,0,0,0,0|2,1,0]=4 221 B11R2.1 BrC1=COC2=C1C=CC=C2 NO20626 [0,0,0,1,0,0|2,0,1]=4 222 B11R2.1 CC1=CCC2=CC=CC=C12 DY106180 [0,0,0,1,0,0|2,0,1]=4 223 B11R2.1 CC1=CNC2=CC=CC=C12 NO11030 [0,0,0,1,0,0|2,0,1]=4 224 B11R2.1 CC1=NNC2=CC=CC=C21 NO17372 [0,0,0,1,0,0|3,0,0]=4 225 B11R2.1 CC1=NOC2=C1C=CC=C2 NO22352 [0,0,0,1,0,0|2,0,0]=3 226 B11R2.1 CC1CNC2=NC=CC=C21 DY739061 [0,0,0,1,0,0|3,0,0]=4 227 B11R2.1 CN1C=CC2=CC=CC=C21 NO11026 [0,0,0,1,0,0|2,0,1]=4 228 B11R2.1 C[N+]1=CSC2=C1C=CC=C2 DY546033 [0,0,0,1,0,0|1,1,1]=4 229 B11R2.1 ClC1=NOC2=C1C=CC=C2 NO19970 [0,0,0,1,0,0|3,0,0]=4 230 B11R2.1 NC1=NOC2=C1C=CC=C2 NO20240 [0,0,0,1,0,0|3,0,0]=4 231 B11R2.1 NC1CCC2=CC=CC=C21 NO19275 [0,0,0,1,0,0|3,0,0]=4 232 B11R2.1 N[C@@H]1CCC2=CC=CC=C21 NO19803 [0,0,0,1,0,0|3,0,0]=4 233 B11R2.1 N[C@H]1CCC2=CC=CC=C21 NO16005 [0,0,0,1,0,0|3,0,0]=4 234 B11R2.1 N[C@H]1CCC2=CC=CC=C21 NO20307 [0,0,0,1,0,0|3,0,0]=4 235 B11R2.1 O=C1CCC2=CC=CC=C12 NO18668 [0,0,0,1,0,0|3,0,0]=4 236 B11R2.1 O=C1COC2=NC=CC=C12 DY441318 [0,0,0,1,0,0|3,0,0]=4 237 B11R2.1 O=C1CSC2=C1C=CC=C2 NO20606 [0,0,0,1,0,0|2,1,0]=4 238 B11R2.1 O[C@@H]1CCC2=CC=CC=C21 DY567765 [0,0,0,1,0,0|3,0,0]=4 239 B11R2.20 C1=CC2=C(C=C1)SCCN2 DY459726 [0,0,0,1,0,0|1,1,0]=3 240 B11R2.20 C1=CC2=C(C=N1)NCCN2 DY669326 [0,0,0,1,0,0|3,0,0]=4 241 B11R2.20 C1=CC2=C(CCCC2)N=C1 NO13407 [0,0,0,1,0,0|3,0,0]=4 242 B11R2.20 C1=CC2=C(N=C1)NCCN2 NO12464 [0,0,0,1,0,0|3,0,0]=4 243 B11R2.20 C1=CC=C2CNCCC2=C1 NO19412 [0,0,0,1,0,0|3,0,0]=4 244 B11R2.20 C1=CC=C2COCCC2=C1 NO19933 [0,0,0,1,0,0|3,0,0]=4 245 B11R2.20 C1=CC=C2NCCNC2=C1 NO19000 [0,0,0,1,0,0|2,0,0]=3 246 B11R2.20 C1=CN=C2NCCCC2=C1 NO20465 [0,0,0,1,0,0|3,0,0]=4 247 B11R2.20 C1=NC=C2CCCNC2=C1 DY105356 [0,0,0,1,0,0|3,0,0]=4 248 B9R1.14 COC1=CSC=C1CN DY523269 [0,0,0,0,1,0|3,0,0]=4 249 B9R1.14 COC1=CSC=C1OC NO10119 [0,0,0,0,1,0|1,0,0]=2 250 B8R1.2 C#CC1=CC=CC=C1 NO19127 [2,0,0,0,0,0|1,0,1]=4 251 B8R1.2 CCC1=CC=CN=C1 NO22277 [2,0,0,0,0,0|2,0,0]=4 252 B8R1.2 CNC1=CC=CC=C1 NO11792 [2,0,0,0,0,0|1,0,0]=3 253 B8R1.2 CNC1=CC=CN=C1 NO13856 [2,0,0,0,0,0|2,0,0]=4 254 B8R1.2 COC1=CC=CN=C1 NO22348 [2,0,0,0,0,0|1,0,0]=3 255 B8R1.2 COC1=CC=CN=N1 NO22347 [2,0,0,0,0,0|2,0,0]=4 256 B8R1.2 COC1=CC=NC=C1 NO19206 [2,0,0,0,0,0|1,0,0]=3 257 B8R1.2 COC1=CC=[C-]C=C1 DY747109 [2,0,0,0,0,0|0,0,1]=3 258 B8R1.2 COC1=NC=CC=C1 NO18780 [2,0,0,0,0,0|1,0,0]=3 259 B8R1.2 COC1=NC=CN=C1 NO17887 [2,0,0,0,0,0|2,0,0]=4 260 B8R1.2 ClSC1=CC=CC=C1 DY799077 [2,0,0,0,0,0|1,1,0]=4 261 B8R1.2 ICC1=CC=CC=C1 NO11000 [2,0,0,0,0,0|2,0,0]=4 262 B8R1.2 N#Cc1ccccc1 NO13696 [2,0,0,0,0,0|2,0,0]=4 263 B8R1.2 NNC1=CC=CC=C1 NO15210 [2,0,0,0,0,0|2,0,0]=4 264 B8R1.5 BrC1=C(I)C=CC=C1 NO19157 [2,0,0,0,0,0|2,0,0]=4 265 B8R1.5 CC1=C(Br)C=CC=C1 DY20187 [2,0,0,0,0,0|1,0,0]=3 266 B8R1.5 CC1=C(Br)C=CN=C1 NO13416 [2,0,0,0,0,0|2,0,0]=4 267 B8R1.5 CC1=C(Br)C=NC=C1 NO21916 [2,0,0,0,0,0|2,0,0]=4 268 B8R1.5 CC1=C(Cl)C=CN=C1 DY460902 [2,0,0,0,0,0|2,0,0]=4 269 B8R1.5 CC1=C(Cl)C=CN=C1 NO18038 [2,0,0,0,0,0|2,0,0]=4 270 B8R1.5 CC1=C(Cl)C=NC=C1 NO15751 [2,0,0,0,0,0|2,0,0]=4 271 B8R1.5 CC1=C(F)C=CC=C1 DY41519 [2,0,0,0,0,0|1,0,0]=3 272 B8R1.5 CC1=C(F)C=NC=C1 NO19332 [2,0,0,0,0,0|2,0,0]=4 273 B8R1.5 CC1=C(I)C=CC=C1 NO19198 [2,0,0,0,0,0|1,0,0]=3 274 B8R1.5 CC1=C(N)C=CN=C1 NO19521 [2,0,0,0,0,0|2,0,0]=4 275 B8R1.5 CC1=C(N)C=NC=C1 NO21907 [2,0,0,0,0,0|2,0,0]=4 276 B8R1.5 CC1=C(O)C=CN=C1 NO13965 [2,0,0,0,0,0|1,0,0]=3 277 B8R1.5 CC1=CC=CC=C1C DY41549 [2,0,0,0,0,0|0,0,0]=2 278 B8R1.5 CC1=CC=CC=C1N NO20592 [2,0,0,0,0,0|1,0,0]=3 279 B8R1.5 CC1=CC=CC=C1O NO11813 [2,0,0,0,0,0|0,0,0]=2 280 B8R1.5 CC1=CC=CN=C1Br NO23002 [2,0,0,0,0,0|2,0,0]=4 281 B8R1.5 CC1=CC=CN=C1C NO21050 [2,0,0,0,0,0|1,0,0]=3 282 B8R1.5 CC1=CC=CN=C1Cl NO13857 [2,0,0,0,0,0|2,0,0]=4 283 B8R1.5 CC1=CC=CN=C1F NO19328 [2,0,0,0,0,0|2,0,0]=4 284 B8R1.5 CC1=CC=CN=C1N NO13775 [2,0,0,0,0,0|2,0,0]=4 285 B8R1.5 CC1=CN=CN=C1O NO10459 [2,0,0,0,0,0|2,0,0]=4 286 B8R1.5 CC1=CNC=CC1=O DY502725 [2,0,0,0,0,0|1,0,1]=4 287 B8R1.5 CC1=NC=CC=C1Br DY20012 [2,0,0,0,0,0|2,0,0]=4 288 B8R1.5 CC1=NC=CC=C1F NO19850 [2,0,0,0,0,0|2,0,0]=4 289 B8R1.5 CC1=NC=CC=C1N NO19518 [2,0,0,0,0,0|2,0,0]=4 290 B8R1.5 CC1=NC=CN=C1C NO10108 [2,0,0,0,0,0|2,0,0]=4 291 B8R1.5 CC1=NC=CN=C1O NO21577 [2,0,0,0,0,0|2,0,0]=4 292 B8R1.5 C[N+]1=C(Cl)C=CC=C1 NO19467 [2,0,0,0,0,0|2,0,0]=4 293 B8R1.5 ClC1=C(Br)C=CC=C1 NO21391 [2,0,0,0,0,0|2,0,0]=4 294 B8R1.5 FC1=C(Br)C=CC=C1 NO19658 [2,0,0,0,0,0|2,0,0]=4 295 B8R1.5 FC1=C(F)C=CC=C1 NO20490 [2,0,0,0,0,0|2,0,0]=4 296 B8R1.5 NC1=C(Br)C=CC=C1 NO19197 [2,0,0,0,0,0|2,0,0]=4 297 B8R1.5 NC1=C(I)C=CC=C1 NO23020 [2,0,0,0,0,0|2,0,0]=4 298 B8R1.5 NC1=C(O)C=CC=C1 NO21309 [2,0,0,0,0,0|1,0,0]=3 299 B8R1.5 NC1=C(O)C=NC=C1 NO14741 [2,0,0,0,0,0|2,0,0]=4 300 B8R1.5 NC1=NC=CC=C1O NO22765 [2,0,0,0,0,0|2,0,0]=4 301 B8R1.5 O=C1C=COC=C1O NO16007 [2,0,0,0,0,0|1,0,1]=4 302 B8R1.5 O=C1NC=CC=C1O NO22752 [2,0,0,0,0,0|1,0,1]=4 303 B8R1.5 OC1=C(Br)C=CC=C1 NO19429 [2,0,0,0,0,0|1,0,0]=3 304 B8R1.5 OC1=C(Br)C=CN=C1 NO13781 [2,0,0,0,0,0|2,0,0]=4 305 B8R1.5 OC1=C(Br)C=NC=C1 NO14222 [2,0,0,0,0,0|2,0,0]=4 306 B8R1.5 OC1=C(Cl)C=CN=C1 NO16383 [2,0,0,0,0,0|2,0,0]=4 307 B8R1.5 OC1=C(Cl)C=NC=C1 NO16225 [2,0,0,0,0,0|2,0,0]=4 308 B8R1.5 OC1=C(F)C=NC=C1 NO22284 [2,0,0,0,0,0|2,0,0]=4 309 B8R1.5 OC1=C(I)C=CC=C1 DY20193 [2,0,0,0,0,0|1,0,0]=3 310 B8R1.5 OC1=C(I)C=CN=C1 NO12130 [2,0,0,0,0,0|2,0,0]=4 311 B8R1.5 OC1=CC=CC=C1O NO11109 [2,0,0,0,0,0|0,0,0]=2 312 B8R1.5 OC1=CC=CN=C1Cl NO17508 [2,0,0,0,0,0|2,0,0]=4 313 B8R1.5 OC1=CC=CN=C1F NO13836 [2,0,0,0,0,0|2,0,0]=4 314 B8R1.5 OC1=CC=CN=C1I NO14294 [2,0,0,0,0,0|2,0,0]=4 315 B8R1.5 OC1=NC=CC=C1Br NO18703 [2,0,0,0,0,0|2,0,0]=4 316 B8R1.5 SC1=C(I)C=CC=C1 DY41410 [2,0,0,0,0,0|1,1,0]=4 317 B8R1.5 [O-][N+]1=C(O)C=CC=C1 NO21603 [2,0,0,0,0,0|1,0,1]=4 318 B10R1.2 CC1=C(Br)C=CC=C1CBr DY584771 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.2 CC1=C(C#N)C=CC=C1Br NO13130 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.2 CC1=C(C#N)C=CC=C1F NO10738 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.2 CC1=C(C=O)C=CC=C1O NO15258 [1,1,0,0,0,0|2,0,0]=4 322 B10R1.2 CC1=C(CBr)C=CC=C1I DY584958 [1,1,0,0,0,0|2,0,0]=4 323 B10R1.2 CC1=C(CN)C=CC=C1Br DY769683 [1,1,0,0,0,0|2,0,0]=4 324 B10R1.2 CC1=C(CO)C=CC=C1Cl DY452962 [1,1,0,0,0,0|2,0,0]=4 325 B10R1.2 CC1=C(CO)C=CC=C1I DY584812 [1,1,0,0,0,0|2,0,0]=4 326 B10R1.2 CC1=C(CO)C=CC=C1N DY584258 [1,1,0,0,0,0|2,0,0]=4 327 B10R1.2 CC1=CC=CC(C#N)=C1C NO11027 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.2 CC1=CC=CC(C=O)=C1C NO10889 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.2 CC1=CC=CC(C=O)=C1O NO20930 [1,1,0,0,0,0|2,0,0]=4 330 B10R1.2 CC1=CC=CC(CBr)=C1C NO10894 [1,1,0,0,0,0|2,0,0]=4 331 B10R1.2 CC1=CC=CC(CO)=C1C NO20113 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.2 CCC1=C(O)C(C)=CC=C1 DY584282 [1,1,0,0,0,0|1,0,0]=3 333 B10R1.2 COC1=C(Br)C(C)=CC=C1 DY584924 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.2 COC1=C(Br)C(Cl)=NC=C1 NO17952 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.2 COC1=C(Br)C(F)=NC=C1 DY656920 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.2 COC1=C(C)C(C)=CC=C1 DY20206 [1,1,0,0,0,0|0,0,0]=2 337 B10R1.2 COC1=C(C)C(O)=NC=N1 DY523593 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.2 COC1=C(Cl)C(C)=CC=C1 DY822113 [1,1,0,0,0,0|1,0,0]=3 339 B10R1.2 COC1=C(Cl)C(Cl)=NC=C1 DY503313 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.2 COC1=C(F)C(Br)=CC=C1 DY20208 [1,1,0,0,0,0|1,0,0]=3 341 B10R1.2 COC1=C(F)C(Cl)=CC=C1 DY450850 [1,1,0,0,0,0|1,0,0]=3 342 B10R1.2 COC1=C(N)C(Br)=NC=C1 NO14869 [1,1,0,0,0,0|2,0,0]=4 343 B10R1.2 COC1=C(N)C(N)=CC=C1 NO12559 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.2 COC1=CC=CC(Br)=C1C DY442371 [1,1,0,0,0,0|0,0,0]=2 345 B10R1.2 COC1=CC=CC(Br)=C1I NO14393 [1,1,0,0,0,0|1,0,0]=3 346 B10R1.2 COC1=CC=CC(Br)=C1O DY442834 [1,1,0,0,0,0|0,0,0]=2 347 B10R1.2 COC1=CC=CC(Cl)=C1N NO16113 [1,1,0,0,0,0|1,0,0]=3 348 B10R1.2 COC1=CC=CC(N)=C1Br NO21335 [1,1,0,0,0,0|1,0,0]=3 349 B10R1.2 COC1=CC=CC(N)=C1C NO10556 [1,1,0,0,0,0|0,0,0]=2 350 B10R1.2 COC1=CC=CC(N)=C1Cl NO18618 [1,1,0,0,0,0|1,0,0]=3 351 B10R1.2 COC1=CC=CC(N)=C1F NO12736 [1,1,0,0,0,0|1,0,0]=3 352 B10R1.2 COC1=CC=CC(N)=C1O NO17187 [1,1,0,0,0,0|0,0,0]=2 353 B10R1.2 COC1=CC=CC(O)=C1Cl NO21434 [1,1,0,0,0,0|1,0,0]=3 354 B10R1.2 COC1=CC=CC(O)=C1N NO16742 [1,1,0,0,0,0|1,0,0]=3 355 B10R1.2 COC1=CN=CC(N)=C1Br DY713125 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.2 COC1=NC=CC(N)=C1C DY655916 [1,1,0,0,0,0|1,0,0]=3 357 B10R1.2 COC1=NC=CC(N)=C1Cl DY657102 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 DY20573 [1,1,0,0,0,0|0,1,0]=3 359 B10R1.2 CSC1=C(F)C(Br)=CC=C1 DY451930 [1,1,0,0,0,0|1,1,0]=4 360 B10R1.2 CSC1=CC=CC(O)=C1F DY451822 [1,1,0,0,0,0|1,1,0]=4 361 B10R1.2 O=CC1=C(O)C(Br)=CC=C1 NO20079 [1,1,0,0,0,0|2,0,0]=4 362 B10R1.2 O=CC1=C(O)C(Cl)=CC=C1 DY20676 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.2 O=CC1=C(O)C(F)=CC=C1 NO20128 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.2 O=CC1=C(O)C(I)=CC=C1 DY442738 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.4 CC1=NC=CC=C1CCN DY653840 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.4 CCOC1=C(Br)C=CC=C1 DY20149 [1,1,0,0,0,0|1,0,0]=3 367 B10R1.4 CCOC1=C(C)C=CN=C1 DY711121 [1,1,0,0,0,0|1,0,0]=3 368 B10R1.4 CCOC1=C(F)C=CC=C1 DY452620 [1,1,0,0,0,0|1,0,0]=3 369 B10R1.4 CCOC1=C(N)C=NC=C1 DY712177 [1,1,0,0,0,0|2,0,0]=4 370 B10R1.4 CCOC1=CC=CN=C1Br DY712381 [1,1,0,0,0,0|2,0,0]=4 371 B10R1.4 CCOC1=CC=CN=C1Cl DY564873 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.4 CCOC1=NC=CC=C1Br DY452812 [1,1,0,0,0,0|2,0,0]=4 373 B10R1.4 CNCC1=C(Br)C=CC=C1 DY455892 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.4 CNCC1=CC=CN=C1C DY711673 [1,1,0,0,0,0|2,0,0]=4 375 B10R1.4 COCC1=C(Br)C=NC=C1 DY714049 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.4 NCCC1=C(Br)C=CC=C1 NO15138 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.4 NCCC1=C(F)C=CC=C1 NO14793 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.4 NCCC1=C(N)C=CC=C1 DY584423 [1,1,0,0,0,0|2,0,0]=4 379 B10R1.4 NCCC1=C(N)C=CC=C1 NO15970 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.4 OCCC1=C(Br)C=CC=C1 NO21407 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.4 OCCC1=C(I)C=CC=C1 DY545007 [1,1,0,0,0,0|2,0,0]=4 382 B10R1.4 O\N=C\C1=CC=CC=C1O DY581391 [1,1,0,0,0,0|2,0,0]=4 383 B10R1.25 C=CC1=C(O)C=C(O)C=C1 DY744937 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.25 CC1=C(C#N)C=CC(Br)=C1 NO10708 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.25 CC1=C(C#N)C=CC(F)=C1 DY20042 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.25 CC1=C(C#N)C=CC(N)=C1 NO16661 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.25 CC1=C(C=O)C=CC(Br)=C1 NO22653 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 NO20823 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.25 CC1=C(C=O)C=CC(F)=C1 NO10809 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.25 CC1=C(C=O)C=CC(O)=C1 NO20933 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 DY584433 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.25 CC1=C(CO)C=CC(O)=C1 DY449770 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.25 CC1=CC(C)=C(C=O)C=C1 NO21114 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.25 CC1=CC(C)=C(CBr)C=C1 NO21116 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.25 CC1=CC(C)=C(CO)C=C1 DY744535 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.25 CC1=CC(C)=C(NN)C=C1 NO20500 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.25 CC1=CC(O)=C(C#N)C=C1 NO21585 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 NO20168 [1,1,0,0,0,0|1,0,0]=3 399 B10R1.25 COC1=C(Br)C=C(I)C=C1 DY41320 [1,1,0,0,0,0|1,0,0]=3 400 B10R1.25 COC1=C(Br)C=C(N)C=C1 DY20804 [1,1,0,0,0,0|1,0,0]=3 401 B10R1.25 COC1=C(Br)C=C(O)C=C1 NO18795 [1,1,0,0,0,0|1,0,0]=3 402 B10R1.25 COC1=C(C)C=C(Br)C=C1 NO22652 [1,1,0,0,0,0|0,0,0]=2 403 B10R1.25 COC1=C(C)C=C(N)C=C1 NO18714 [1,1,0,0,0,0|0,0,0]=2 404 B10R1.25 COC1=C(C)C=C(N)C=N1 NO15363 [1,1,0,0,0,0|1,0,0]=3 405 B10R1.25 COC1=C(C)C=[N+]([O-])C=C1 DY714488 [1,1,0,0,0,0|1,0,0]=3 406 B10R1.25 COC1=C(C)N=C(N)C=N1 DY710815 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.25 COC1=C(Cl)C=C(N)C=C1 NO14858 [1,1,0,0,0,0|1,0,0]=3 408 B10R1.25 COC1=C(Cl)C=C(N)C=N1 NO17094 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.25 COC1=C(F)C=C(C)C=C1 DY452440 [1,1,0,0,0,0|1,0,0]=3 410 B10R1.25 COC1=C(F)C=C(Cl)C=C1 DY584280 [1,1,0,0,0,0|1,0,0]=3 411 B10R1.25 COC1=C(F)C=C(N)C=C1 NO10515 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.25 COC1=C(F)C=C(N)C=N1 NO15127 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.25 COC1=C(F)C=C(O)C=C1 NO22287 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.25 COC1=C(I)C=C(Br)C=C1 NO17024 [1,1,0,0,0,0|1,0,0]=3 415 B10R1.25 COC1=C(I)C=C(N)C=C1 NO18915 [1,1,0,0,0,0|1,0,0]=3 416 B10R1.25 COC1=C(I)C=C(N)C=C1 NO19301 [1,1,0,0,0,0|1,0,0]=3 417 B10R1.25 COC1=C(N)C=C(Br)C=C1 NO10268 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.25 COC1=C(N)C=C(C)C=C1 NO13548 [1,1,0,0,0,0|1,0,0]=3 419 B10R1.25 COC1=C(N)C=C(Cl)C=C1 DY745633 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.25 COC1=C(N)C=C(I)C=C1 DY584281 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.25 COC1=C(N)C=C(N)C=C1 NO21066 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.25 COC1=C(O)C=C(C)C=C1 DY442401 [1,1,0,0,0,0|0,0,0]=2 423 B10R1.25 COC1=C(O)C=C(F)C=C1 NO15779 [1,1,0,0,0,0|0,0,0]=2 424 B10R1.25 COC1=CC=C(C)N=C1I DY527061 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.25 COC1=CN=C(C)C=C1Br DY431792 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.25 COC1=CN=C(C)N=C1C NO16889 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.25 COC1=CN=C(O)N=C1O NO18000 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.25 COC1=NC=C(Br)C=C1Br NO18704 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.25 COC1=NC=C(Br)C=C1C NO17558 [1,1,0,0,0,0|1,0,0]=3 430 B10R1.25 COC1=NC=C(Br)C=C1Cl NO19358 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.25 COC1=NC=C(Br)C=C1F NO17560 [1,1,0,0,0,0|2,0,0]=4 432 B10R1.25 COC1=NC=C(Br)C=C1N DY451156 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.25 COC1=NC=C(Br)C=C1N NO17340 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.25 COC1=NC=C(C)C=C1Br NO12715 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.25 COC1=NC=C(C)N=C1C NO15176 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.25 COC1=NC=C(Cl)C=C1Br NO17800 [1,1,0,0,0,0|2,0,0]=4 437 B10R1.25 COC1=NC=C(F)C=C1Br NO19396 [1,1,0,0,0,0|2,0,0]=4 438 B10R1.25 COC1=NC=C(F)C=C1F DY508988 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.25 COC1=NC=C(N)C=C1Br DY20010 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 DY585122 [1,1,0,0,0,0|1,1,0]=4 441 B10R1.25 CSC1=C(Br)C=C(F)C=C1 DY452890 [1,1,0,0,0,0|1,1,0]=4 442 B10R1.25 CSC1=C(C)C=C(O)C=C1 DY20571 [1,1,0,0,0,0|0,1,0]=3 443 B10R1.25 N#CC1=C(O)C=C(Br)C=C1 NO22646 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.25 N#CC1=C(O)C=C(Cl)C=C1 NO14584 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.25 N#CC1=C(O)C=C(O)C=C1 DY10369 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 NO20081 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 NO20105 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.25 O=CC1=C(O)C=C(F)C=C1 NO20130 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.25 O=CC1=C(O)C=C(O)C=C1 NO19428 [1,1,0,0,0,0|2,0,0]=4 450 B10R1.25 OCC1=C(O)C=C(Br)C=C1 NO10248 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.30 C#CC1=C(C)C=CC(N)=C1 DY103342 [1,1,0,0,0,0|1,0,1]=4 452 B10R1.30 CC1=C(C#N)C=C(Br)C=C1 NO10274 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.30 CC1=C(C#N)C=C(Cl)C=C1 DY40633 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.30 CC1=C(C#N)C=C(N)C=C1 NO10209 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.30 CC1=C(C=O)C=C(Br)C=C1 DY20545 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.30 CC1=C(C=O)C=C(F)C=C1 DY20032 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.30 CC1=C(C=O)C=C(O)C=C1 DY452542 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.30 CC1=C(CCl)C=C(F)C=C1 DY584262 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.30 CC1=C(CO)C=C(F)C=C1 DY452638 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.30 CC1=CC(CBr)=C(C)C=C1 DY584839 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.30 CC1=CC(CN)=C(C)C=C1 DY20405 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.30 CC1=CC(NN)=C(C)C=C1 NO20501 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.30 CCC1=NC(C)=CC=C1O NO13984 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.30 CNC1=CC(Br)=CC=C1N NO13254 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.30 COC1=C(Br)C=CC(Br)=C1 NO12737 [1,1,0,0,0,0|1,0,0]=3 466 B10R1.30 COC1=C(Br)C=CC(C)=C1 DY20209 [1,1,0,0,0,0|1,0,0]=3 467 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 NO21371 [1,1,0,0,0,0|1,0,0]=3 468 B10R1.30 COC1=C(Br)C=CC(F)=C1 NO10394 [1,1,0,0,0,0|1,0,0]=3 469 B10R1.30 COC1=C(Br)C=CC(N)=C1 NO18102 [1,1,0,0,0,0|1,0,0]=3 470 B10R1.30 COC1=C(Br)C=CC(N)=N1 DY429703 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.30 COC1=C(Br)N=CC(N)=C1 NO12409 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.30 COC1=C(Cl)C=CC(C)=C1 DY456622 [1,1,0,0,0,0|1,0,0]=3 473 B10R1.30 COC1=C(Cl)C=CC(I)=C1 DY20290 [1,1,0,0,0,0|1,0,0]=3 474 B10R1.30 COC1=C(Cl)C=CC(N)=C1 NO22759 [1,1,0,0,0,0|1,0,0]=3 475 B10R1.30 COC1=C(F)C=CC(Br)=C1 NO19804 [1,1,0,0,0,0|1,0,0]=3 476 B10R1.30 COC1=C(F)C=CC(I)=C1 DY571347 [1,1,0,0,0,0|1,0,0]=3 477 B10R1.30 COC1=C(F)C=CC(N)=C1 NO10516 [1,1,0,0,0,0|1,0,0]=3 478 B10R1.30 COC1=C(I)C=CC(Cl)=C1 DY20291 [1,1,0,0,0,0|1,0,0]=3 479 B10R1.30 COC1=C(N)C=CC(Br)=C1 NO19178 [1,1,0,0,0,0|1,0,0]=3 480 B10R1.30 COC1=C(N)C=CC(F)=C1 NO12096 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.30 COC1=C(N)C=CC(I)=C1 DY21014 [1,1,0,0,0,0|1,0,0]=3 482 B10R1.30 COC1=C(N)C=CC(N)=C1 NO21132 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.30 COC1=C(O)C=CC(Br)=C1 NO22682 [1,1,0,0,0,0|0,0,0]=2 484 B10R1.30 COC1=C(O)C=CC(C)=C1 NO16322 [1,1,0,0,0,0|0,0,0]=2 485 B10R1.30 COC1=CC(Br)=CN=C1Cl NO10254 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.30 COC1=CC(Br)=CN=C1N NO14023 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.30 COC1=CC(C)=CN=C1O DY657387 [1,1,0,0,0,0|1,0,0]=3 488 B10R1.30 COC1=CC(Cl)=NC=C1Br NO14850 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.30 COC1=CC(Cl)=NC=C1C DY655410 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.30 COC1=CC(Cl)=NC=C1Cl NO15874 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.30 COC1=CC(O)=NC=C1Br DY429897 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.30 COC1=NC(Br)=CC=C1Br DY533289 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.30 COC1=NC(Br)=CC=C1N NO18540 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.30 COC1=NC(C)=CC=C1Br NO19284 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.30 COC1=NC(Cl)=CC=C1Br NO16211 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.30 COC1=NC(Cl)=CC=C1N NO10669 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.30 COC1=NC(F)=CC=C1Br DY429643 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.30 CSC1=C(Br)C=CC(Br)=C1 DY453532 [1,1,0,0,0,0|1,1,0]=4 499 B10R1.30 CSC1=C(Br)C=CC(F)=C1 DY525105 [1,1,0,0,0,0|1,1,0]=4 500 B10R1.30 CSC1=C(C)C=CC(Br)=C1 DY452878 [1,1,0,0,0,0|0,1,0]=3 501 B10R1.30 N#CC1=C(O)C=CC(Br)=C1 NO10240 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.30 N#CC1=C(O)C=CC(N)=C1 NO10205 [1,1,0,0,0,0|2,0,0]=4 503 B10R1.30 NCC1=C(O)C=CC(Br)=C1 NO18138 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 NO20107 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.30 O=CC1=C(O)C=CC(F)=C1 NO10369 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.30 O=CC1=C(O)C=CC(I)=C1 NO20136 [1,1,0,0,0,0|2,0,0]=4 507 B10R1.30 O=CC1=CC(Br)=CC=C1O NO20084 [1,1,0,0,0,0|2,0,0]=4 508 B10R1.30 OCC1=CC(Br)=CC=C1O NO20280 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 NO18866 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.61 CC(=O)C1=C(C)C=CC=C1 NO19710 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.61 CC(=O)C1=C(F)C=CC=C1 NO15490 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.61 CC(=O)C1=C(N)C=CC=C1 NO19948 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.61 CC(=O)C1=C(O)C=CC=C1 DY790197 [1,1,0,0,0,0|1,0,0]=3 514 B10R1.61 CC(=O)C1=C(O)C=CC=C1 NO15026 [1,1,0,0,0,0|1,0,0]=3 515 B10R1.61 CC(=O)C1=CC=CN=C1C DY652208 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.61 CC(=O)C1=NC=CC=C1O NO14450 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.61 CC(C)C1=C(Br)C=CC=C1 NO19988 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.61 CC1=C(B(O)O)C=CC=C1 NO20397 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.61 CC1=C(C(=O)O)C=CC=C1 NO19823 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.61 CC1=C(C(C)N)C=CC=C1 DY788943 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.61 CC1=C(C(N)=S)C=CC=C1 DY559011 [1,1,0,0,0,0|2,0,0]=4 522 B10R1.61 CC1=C([C@H](C)O)C=CC=C1 DY822244 [1,1,0,0,0,0|1,0,0]=3 523 B10R1.61 CC1=CC=CN=C1C(C)N DY604773 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.61 CN(C)C1=C(Br)C=CC=C1 DY20183 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 DY20288 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.61 CN(C)C1=C(F)C=CC=C1 DY20285 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.61 CN(C)C1=C(O)C=CC=C1 NO14782 [1,1,0,0,0,0|1,0,0]=3 528 B10R1.61 CN(C)C1=CC=CC=C1N NO14204 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 DY516003 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 NO13547 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 DY459372 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 NO20301 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 NO20318 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 NO15513 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.61 C[C@H](O)C1=C(N)C=CC=C1 DY548415 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.61 NC(=O)C1=C(O)C=CC=C1 NO11941 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.61 O=C(O)C1=CC=CC=C1O DY576081 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.61 O=C([O-])C1=CC=CC=C1O DY560055 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.61 O=C([O-])C1=CC=CC=C1O DY822576 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 NO21724 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.61 OB(O)C1=C(O)C=CC=C1 NO21880 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.245 CC1=CC=CC(Br)=C1C#N NO12993 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.245 CC1=CC=CC(C)=C1C#N NO21705 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.245 CC1=CC=CC(C)=C1C=O NO21067 [1,1,0,0,0,0|2,0,0]=4 545 B10R1.245 CC1=CC=CC(C)=C1CCl DY20793 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.245 CC1=CC=CC(C)=C1CN NO21184 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.245 CC1=CC=CC(C)=C1CO NO10906 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.245 CC1=CC=CC(C)=C1NN NO19886 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.245 CC1=CC=CC(F)=C1C#N NO19871 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.245 CC1=CC=CC(N)=C1C#N DY560523 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.245 CC1=CC=CC(O)=C1C#N NO21595 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.245 CCC1=C(O)C=CC=C1N DY442227 [1,1,0,0,0,0|1,0,0]=3 553 B10R1.245 COC1=C(Br)C=CC=C1Br NO21160 [1,1,0,0,0,0|1,0,0]=3 554 B10R1.245 COC1=C(Cl)C=CC=C1C DY822112 [1,1,0,0,0,0|0,0,0]=2 555 B10R1.245 COC1=C(Cl)C=CC=C1F NO12979 [1,1,0,0,0,0|1,0,0]=3 556 B10R1.245 COC1=C(Cl)C=CN=C1N DY658414 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.245 COC1=C(F)C=CC=C1I DY20137 [1,1,0,0,0,0|1,0,0]=3 558 B10R1.245 COC1=C(I)C=CN=C1Br DY655126 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.245 COC1=C(N)C=CC=C1F DY20133 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.245 COC1=C(N)C=CN=C1C DY608435 [1,1,0,0,0,0|1,0,0]=3 561 B10R1.245 COC1=C(N)C=NC=C1F DY432228 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.245 Cc1cccc(Br)c1CBr DY584783 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.245 O=CC1=C(Br)C=CC=C1O NO21383 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.245 O=CC1=C(Cl)C=CC=C1O NO20108 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.245 O=CC1=C(F)C=CC=C1O NO20127 [1,1,0,0,0,0|2,0,0]=4 566 B12R1.46 COC1=C(B(O)O)C=C(Br)C=C1 NO20347 [0,2,0,0,0,0|2,0,0]=4 567 B12R1.46 COC1=C(C(=O)Cl)C=C(Cl)C=C1 DY794025 [0,2,0,0,0,0|2,0,0]=4 568 B12R1.46 COC1=C(C(=O)O)C=C(Br)C=C1 NO14019 [0,2,0,0,0,0|2,0,0]=4 569 B12R1.46 COC1=C(C(=O)O)C=C(Cl)C=C1 NO20833 [0,2,0,0,0,0|2,0,0]=4 570 B12R1.46 COC1=C(C(=O)O)C=C(F)C=C1 DY10307 [0,2,0,0,0,0|2,0,0]=4 571 B12R1.46 COC1=C(C(=O)O)C=C(O)C=C1 DY451684 [0,2,0,0,0,0|2,0,0]=4 572 B12R1.46 COC1=C(C(C)=O)C=C(Cl)C=C1 DY442666 [0,2,0,0,0,0|1,0,0]=3 573 B12R1.46 COC1=C(C(C)O)C=C(F)C=C1 DY576903 [0,2,0,0,0,0|1,0,0]=3 574 B12R1.46 COC1=C(C(F)F)C=C(Br)C=C1 DY585061 [0,2,0,0,0,0|2,0,0]=4 575 B12R1.46 COC1=C([C@H](C)O)C=C(F)C=C1 DY527649 [0,2,0,0,0,0|1,0,0]=3 576 B12R1.46 COC1=C([N+](=O)[O-])C=C(Br)C=C1 NO10404 [0,2,0,0,0,0|2,0,0]=4 577 B12R1.46 COC1=C([N+](=O)[O-])C=C(N)C=C1 NO20387 [0,2,0,0,0,0|2,0,0]=4 578 B12R1.46 COC1=C([N+](=O)[O-])C=C(O)C=C1 DY20905 [0,2,0,0,0,0|2,0,0]=4 579 B12R1.57 COC1=C(B(O)O)C=CC(F)=C1 NO20358 [0,2,0,0,0,0|2,0,0]=4 580 B12R1.57 COC1=C(B(O)O)C=CC(O)=C1 DY450844 [0,2,0,0,0,0|2,0,0]=4 581 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=C1 NO22649 [0,2,0,0,0,0|2,0,0]=4 582 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=C1 NO10785 [0,2,0,0,0,0|2,0,0]=4 583 B12R1.57 COC1=C(C(=O)O)C=CC(F)=C1 NO14268 [0,2,0,0,0,0|2,0,0]=4 584 B12R1.57 COC1=C(C(C)=O)C=CC(Br)=C1 NO16731 [0,2,0,0,0,0|1,0,0]=3 585 B12R1.57 COC1=C([N+](=O)[O-])C=CC(F)=C1 NO14411 [0,2,0,0,0,0|2,0,0]=4 586 B12R1.57 COC1=C([N+](=O)[O-])C=CC(N)=C1 NO16631 [0,2,0,0,0,0|2,0,0]=4 587 B12R1.57 COC1=C([N+](=O)[O-])C=CC(O)=C1 NO12660 [0,2,0,0,0,0|2,0,0]=4 588 B12R1.57 COC1=CC(Br)=CN=C1C(C)=O NO17619 [0,2,0,0,0,0|2,0,0]=4 589 B12R1.78 C#CC1=C(OC)C=CC(OC)=C1 DY788805 [0,2,0,0,0,0|1,0,1]=4 590 B12R1.78 COC1=C(C=O)C=C(SC)C=C1 DY451312 [0,2,0,0,0,0|2,0,0]=4 591 B12R1.78 COC1=C(C=O)C=CC(C#N)=C1 NO21535 [0,2,0,0,0,0|2,0,0]=4 592 B12R1.78 COC1=C(CO)C=C(C=O)C=C1 DY611815 [0,2,0,0,0,0|2,0,0]=4 593 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 DY10449 [0,2,0,0,0,0|0,0,0]=2 594 B12R1.78 COC1=C(OC)C=C(CBr)C=C1 NO21945 [0,2,0,0,0,0|0,0,0]=2 595 B12R1.78 COC1=C(OC)C=C(CCl)C=C1 DY10289 [0,2,0,0,0,0|0,0,0]=2 596 B12R1.78 COC1=C(OC)C=C(CO)C=C1 NO19420 [0,2,0,0,0,0|0,0,0]=2 597 B12R1.78 COC1=C(OC)N=C(C=O)C=C1 DY431779 [0,2,0,0,0,0|1,0,0]=3 598 B12R1.78 COC1=CC(OC)=C(C=O)C=C1 NO15286 [0,2,0,0,0,0|2,0,0]=4 599 B12R1.78 COC1=CC(OC)=C(CCl)C=C1 DY10526 [0,2,0,0,0,0|2,0,0]=4 600 B12R1.78 COC1=CC(OC)=C(CN)C=C1 DY538965 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.78 COC1=CC(OC)=C(CN)C=C1 NO15120 [0,2,0,0,0,0|2,0,0]=4 602 B12R1.78 COC1=CC(OC)=C(CO)C=C1 NO21200 [0,2,0,0,0,0|2,0,0]=4 603 B12R1.78 COC1=CC(OC)=C(OC)C=C1 NO18710 [0,2,0,0,0,0|0,0,0]=2 604 B12R1.112 CCOC1=C(C=O)C=C(F)C=C1 DY448552 [0,2,0,0,0,0|2,0,0]=4 605 B12R1.112 COC1=C(CC#N)C=CC(Br)=C1 DY40760 [0,2,0,0,0,0|1,0,1]=4 606 B12R1.234 COC1=C(CO)C=C(Br)C=C1C DY449638 [0,2,0,0,0,0|2,0,0]=4 607 B12R1.234 COC1=C(CO)C=C(F)C=C1F DY430756 [0,2,0,0,0,0|2,0,0]=4 608 B12R1.234 COC1=C(OC)C(Br)=NC(I)=C1 DY715028 [0,2,0,0,0,0|1,0,0]=3 609 B12R1.234 COC1=CC(F)=CC(F)=C1C#N DY585085 [0,2,0,0,0,0|2,0,0]=4 610 B12R1.268 COC1=C(CC#N)C=C(Br)C=C1 NO10269 [0,2,0,0,0,0|1,0,1]=4 611 B12R1.268 COC1=C(CC#N)C=C(Cl)C=C1 NO20218 [0,2,0,0,0,0|1,0,1]=4 612 B12R1.268 COC1=C(CC#N)C=C(F)C=C1 DY584422 [0,2,0,0,0,0|1,0,1]=4 613 B12R1.268 COC1=C(N=C=S)C=C(Cl)C=C1 DY585098 [0,2,0,0,0,0|1,0,1]=4 614 B12R1.448 COC1=C(C#N)C=C(Br)C(C)=C1 DY520707 [0,2,0,0,0,0|2,0,0]=4 615 B12R1.448 COC1=C(OC)C=C(N)C(N)=C1 DY546021 [0,2,0,0,0,0|0,0,0]=2 616 B12R1.448 COC1=CC(C)=C(N)C=C1OC NO10914 [0,2,0,0,0,0|0,0,0]=2 617 B12R1.448 COC1=CC(N)=C(N)C=C1OC DY584670 [0,2,0,0,0,0|0,0,0]=2 618 B12R1.652 COC1=C(C#N)C=CC(F)=C1F DY584654 [0,2,0,0,0,0|2,0,0]=4 619 B12R1.652 COC1=C(C=O)C=CC(F)=C1F DY452602 [0,2,0,0,0,0|2,0,0]=4 620 B12R1.652 COC1=C(CO)C=CC(C)=C1Cl DY449626 [0,2,0,0,0,0|2,0,0]=4 621 B12R1.652 COC1=CC=C(F)C(F)=C1C#N DY20254 [0,2,0,0,0,0|2,0,0]=4 622 B12R1.75 COC1=C(CC(=N)N)C=CC=C1 DY602937 [0,2,0,0,0,0|1,0,1]=4 623 B12R1.75 COC1=C(CC(=N)N)C=CC=C1 DY610288 [0,2,0,0,0,0|1,0,1]=4 624 B12R1.75 COC1=C(CC(=O)O)C=CC=C1 NO16300 [0,2,0,0,0,0|1,0,1]=4 625 B12R1.75 COC1=C(CC(N)=O)C=CC=C1 DY549267 [0,2,0,0,0,0|1,0,1]=4 626 B12R1.77 CNC(C)C1=C(OC)C=CC=C1 DY580131 [0,2,0,0,0,0|1,0,0]=3 627 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 NO21630 [0,2,0,0,0,0|2,0,0]=4 628 B12R1.77 COC(=O)C1=C(CBr)C=CC=C1 NO18185 [0,2,0,0,0,0|2,0,0]=4 629 B12R1.77 COC(=O)C1=C(CCl)C=CC=C1 DY584659 [0,2,0,0,0,0|2,0,0]=4 630 B12R1.77 COC(=O)C1=C(OC)N=CC=C1 NO13707 [0,2,0,0,0,0|1,0,0]=3 631 B12R1.77 COC(=O)C1=NC=CC=C1OC NO22344 [0,2,0,0,0,0|1,0,0]=3 632 B12R1.77 COC1=C(C(=O)CBr)C=CC=C1 NO11020 [0,2,0,0,0,0|1,0,0]=3 633 B12R1.77 COC1=C(C(O)C#N)C=CC=C1 DY558897 [0,2,0,0,0,0|1,0,1]=4 634 B12R1.121 CCNCC1=C(OC)C=CC=C1 DY604484 [0,2,0,0,0,0|1,0,0]=3 635 B12R1.121 CCNCC1=C(OC)C=CC=C1 DY609427 [0,2,0,0,0,0|1,0,0]=3 636 B12R1.121 COC1=C(OCC=O)C=CC=C1 DY112452 [0,2,0,0,0,0|0,0,0]=2 637 B12R1.121 COC1=C(OCCN)C=CC=C1 NO21224 [0,2,0,0,0,0|0,0,0]=2 638 B12R1.121 COC1=C(\C=C\C=O)C=CC=C1 NO15311 [0,2,0,0,0,0|1,0,1]=4 639 B12R1.121 COCOC1=C(CCl)C=CC=C1 DY568989 [0,2,0,0,0,0|2,0,0]=4 640 B12R1.169 CCOC1=C(CCN)C=CC=C1 DY795099 [0,2,0,0,0,0|1,0,0]=3 641 B12R1.169 CCOC1=C(OCC)C=CC=C1 DY792861 [0,2,0,0,0,0|0,0,0]=2 642 B12R1.283 CCOC1=C(C(C)=O)C=CC=C1 DY791631 [0,2,0,0,0,0|1,0,0]=3 643 B12R1.283 CCOC1=C(C(C)N)C=CC=C1 DY605092 [0,2,0,0,0,0|1,0,0]=3 644 B12R1.283 COCC1=C([N+](=O)[O-])C=CC=C1 DY584639 [0,2,0,0,0,0|2,0,0]=4 645 B12R1.542 COC1=C(CC#N)C=CC=C1Br DY584893 [0,2,0,0,0,0|1,0,1]=4 646 B12R1.542 COC1=C(CC#N)C=CC=C1C DY585057 [0,2,0,0,0,0|1,0,1]=4 647 B12R1.542 COC1=C(CON)C=CC=C1C DY521109 [0,2,0,0,0,0|1,0,0]=3 648 B12R1.1112 CCOC1=C(C=O)C=CC=C1Br DY103354 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.76 [2H]C([2H])([2H])C1=C(OC)C=CC=C1 DY454929 [0,2,0,0,0,0|2,0,0]=4 650 B12R1.87 COC1=C(B(O)O)C=CC=C1Br NO16115 [0,2,0,0,0,0|2,0,0]=4 651 B12R1.87 COC1=C(B(O)O)C=CC=C1F NO11072 [0,2,0,0,0,0|2,0,0]=4 652 B12R1.87 COC1=C(C(=O)O)C=CC=C1Cl NO22208 [0,2,0,0,0,0|2,0,0]=4 653 B12R1.87 COC1=C(C(=O)O)C=CC=C1F DY30253 [0,2,0,0,0,0|2,0,0]=4 654 B12R1.87 COC1=C(C(=O)O)C=CC=C1O DY450652 [0,2,0,0,0,0|2,0,0]=4 655 B12R1.87 COC1=C(C(C)=O)C=CC=C1Cl DY686497 [0,2,0,0,0,0|1,0,0]=3 656 B12R1.87 COC1=C(C(N)=O)C=CC=C1Br DY572103 [0,2,0,0,0,0|2,0,0]=4 657 B12R1.437 COC1=C(C(=O)O)C(C)=CC=C1 NO21646 [0,2,0,0,0,0|2,0,0]=4 658 B12R1.437 COC1=C([N+](=O)[O-])C(C)=CC=C1 DY427414 [0,2,0,0,0,0|2,0,0]=4 659 B12R1.437 COC1=CC=CC(Br)=C1C(=O)O NO21384 [0,2,0,0,0,0|2,0,0]=4 660 B12R1.437 COC1=CC=CC(Br)=C1C(C)=O NO17977 [0,2,0,0,0,0|1,0,0]=3 661 B12R1.437 COC1=CC=CC(C)=C1C(N)=O DY433809 [0,2,0,0,0,0|2,0,0]=4 662 B12R1.437 COC1=CC=CC(Cl)=C1C(=O)O NO12215 [0,2,0,0,0,0|2,0,0]=4 663 B12R1.437 COC1=CC=CC(Cl)=C1C(C)=O NO17184 [0,2,0,0,0,0|1,0,0]=3 664 B12R1.437 COC1=CC=CC(F)=C1B(O)O NO20357 [0,2,0,0,0,0|2,0,0]=4 665 B12R1.437 COC1=CC=CC(F)=C1C(=O)O NO13643 [0,2,0,0,0,0|2,0,0]=4 666 B12R1.437 COC1=CC=CC(F)=C1[C@@H](C)N DY746425 [0,2,0,0,0,0|1,0,0]=3 667 B12R1.437 COC1=CC=CC(I)=C1[N+](=O)[O-] DY584616 [0,2,0,0,0,0|2,0,0]=4 668 B12R1.437 COC1=NC=CC(N)=C1C(C)=O DY507341 [0,2,0,0,0,0|2,0,0]=4 669 B12R1.741 COC1=C(C=O)C(F)=CC=C1Cl DY453400 [0,2,0,0,0,0|2,0,0]=4 670 B12R1.741 COC1=C(CO)C(F)=CC=C1Br DY451048 [0,2,0,0,0,0|2,0,0]=4 671 B12R1.1879 CNC1=CC=CC(OC)=C1C#N DY518079 [0,2,0,0,0,0|2,0,0]=4 672 B12R1.1879 COC1=C(OC)C(CCl)=NC=C1 DY459228 [0,2,0,0,0,0|1,0,0]=3 673 B12R1.1879 COC1=CC=CC(C=O)=C1OC NO19374 [0,2,0,0,0,0|0,0,0]=2 674 B12R1.1879 COC1=CC=CC(OC)=C1OC NO20476 [0,2,0,0,0,0|0,0,0]=2 675 B10R1.176 COC1=CC(C)=C(N)C=C1 NO13421 [0,0,1,1,0,0|2,0,0]=4 676 B10R1.176 COC1=CC(C)=C(O)C=C1 NO15470 [0,0,1,1,0,0|2,0,0]=4 677 B10R2.7 C1=CC2=C(C=C1)CSC2 DY114506 [1,0,0,1,0,0|2,0,0]=4 678 B10R2.7 C1=CC2=C(C=C1)OC=N2 NO10994 [1,0,0,1,0,0|1,0,1]=4 679 B10R2.7 C1=CC2=C(C=C1)OCC2 NO20929 [1,0,0,1,0,0|0,0,0]=2 680 B10R2.7 C1=CC2=NCCN2C=C1 DY760292 [1,0,0,1,0,0|2,0,0]=4 681 B10R2.7 C1=CC=C2CC=CC2=C1 DY20914 [1,0,0,1,0,0|1,0,1]=4 682 B10R2.7 C1=CC=C2CNCC2=C1 NO11516 [1,0,0,1,0,0|2,0,0]=4 683 B10R2.7 C1=CC=C2NCCC2=C1 NO19084 [1,0,0,1,0,0|1,0,0]=3 684 B10R2.7 C1=CC=C2OC=CC2=C1 NO11169 [1,0,0,1,0,0|0,0,2]=4 685 B10R2.7 C1=CN=C2CCCC2=C1 NO14838 [1,0,0,1,0,0|2,0,0]=4 686 B10R2.7 C1=CN=C2CCNC2=C1 DY107728 [1,0,0,1,0,0|2,0,0]=4 687 B10R2.7 C1=NC=C2NCCC2=C1 DY570663 [1,0,0,1,0,0|2,0,0]=4 688 B10R2.320 BrC1CC2=CC=CC=C21 DY539943 [1,0,0,1,0,0|2,0,0]=4 689 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 NO10787 [0,1,0,1,0,0|1,0,0]=3 690 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 NO15185 [0,1,0,1,0,0|1,0,0]=3 691 B12R2.24 BrC1=CC2=C(C=C1)OCCN2 NO15468 [0,1,0,1,0,0|1,0,0]=3 692 B12R2.24 BrC1=CC2=C(C=C1)OCCO2 NO10776 [0,1,0,1,0,0|0,0,0]=2 693 B12R2.24 BrC1=CC=C2CCCCC2=C1 NO16753 [0,1,0,1,0,0|2,0,0]=4 694 B12R2.24 BrC1=CC=C2CCCNC2=C1 DY784852 [0,1,0,1,0,0|2,0,0]=4 695 B12R2.24 BrC1=CC=C2CCCNC2=C1 NO18621 [0,1,0,1,0,0|2,0,0]=4 696 B12R2.24 BrC1=CC=C2NCCCC2=C1 NO19737 [0,1,0,1,0,0|2,0,0]=4 697 B12R2.24 BrC1=CC=C2OCCCC2=C1 NO19916 [0,1,0,1,0,0|1,0,0]=3 698 B12R2.24 BrC1=NC2=C(C=C1)NCCO2 DY511035 [0,1,0,1,0,0|2,0,0]=4 699 B12R2.24 CC1=CC2=C(C=N1)OCCO2 DY681045 [0,1,0,1,0,0|1,0,0]=3 700 B12R2.24 CC1=CC=C2CCCCC2=C1 NO10746 [0,1,0,1,0,0|2,0,0]=4 701 B12R2.24 CC1=NC2=C(C=C1)OCCN2 DY679869 [0,1,0,1,0,0|2,0,0]=4 702 B12R2.24 CC1CNC2=CC=CC=C2C1 DY33343 [0,1,0,1,0,0|2,0,0]=4 703 B12R2.24 CN1CCC2=CC=CC=C2C1 NO16157 [0,1,0,1,0,0|2,0,0]=4 704 B12R2.24 ClC1=CC2=C(N=N1)OCCO2 NO17021 [0,1,0,1,0,0|2,0,0]=4 705 B12R2.24 ClC1=CC=C2NCCCC2=C1 NO14585 [0,1,0,1,0,0|2,0,0]=4 706 B12R2.24 ClC1=CC=C2NCCNC2=C1 DY744199 [0,1,0,1,0,0|2,0,0]=4 707 B12R2.24 FC1=CC=C2OCCCC2=C1 DY584315 [0,1,0,1,0,0|1,0,0]=3 708 B12R2.24 IC1=CC=C2CCCNC2=C1 DY450838 [0,1,0,1,0,0|2,0,0]=4 709 B12R2.24 NC1=CC2=C(C=C1)CCCC2 DY541887 [0,1,0,1,0,0|2,0,0]=4 710 B12R2.24 NC1=CC=C2CCCNC2=C1 DY526875 [0,1,0,1,0,0|2,0,0]=4 711 B12R2.24 NC1CCC2=CC=CC=C2C1 NO18799 [0,1,0,1,0,0|2,0,0]=4 712 B12R2.24 N[C@@H]1CCC2=CC=CC=C2C1 DY765191 [0,1,0,1,0,0|2,0,0]=4 713 B12R2.24 O=C1COC2=C(C=CC=C2)N1 NO21568 [0,1,0,1,0,0|1,0,1]=4 714 B12R2.24 O=C1COC2=CC=CC=C2C1 DY681882 [0,1,0,1,0,0|1,0,1]=4 715 B12R2.24 OC1=CC2=C(C=C1)CCCC2 NO13514 [0,1,0,1,0,0|2,0,0]=4 716 B12R2.24 OC1=CC2=C(C=C1)NCCO2 DY442455 [0,1,0,1,0,0|1,0,0]=3 717 B12R2.24 OC1=CC2=C(C=CC=C2)OC1 DY673380 [0,1,0,1,0,0|1,0,1]=4 718 B12R2.24 OC1=CC=C2CCCNC2=C1 NO10898 [0,1,0,1,0,0|2,0,0]=4 719 B12R2.24 OC1CCC2=CC=CC=C2O1 DY681876 [0,1,0,1,0,0|1,0,0]=3 720 B12R2.132 CC1=COC2=C1C=C(O)C=C2 DY459204 [0,1,0,1,0,0|1,0,1]=4 721 B12R2.132 CC1=NOC2=C1C=C(N)C=C2 NO16745 [0,1,0,1,0,0|2,0,0]=4 722 B12R2.132 CC1=NOC2=C1C=C(O)C=C2 DY751759 [0,1,0,1,0,0|2,0,0]=4 723 B12R2.132 NC1COC2=C1C=C(Br)C=C2 DY577467 [0,1,0,1,0,0|2,0,0]=4 724 B12R2.132 NC1COC2=C1C=C(F)C=C2 DY431482 [0,1,0,1,0,0|2,0,0]=4 725 B12R2.132 N[C@@H]1COC2=C1C=C(Br)C=C2 DY625417 [0,1,0,1,0,0|2,0,0]=4 726 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 NO18239 [0,1,0,1,0,0|2,0,0]=4 727 B12R2.612 CC1=NOC2=C1C=CC(O)=C2 NO12249 [0,1,0,1,0,0|2,0,0]=4 728 B12R2.612 CN1CCC2=CC(F)=CC=C21 DY630394 [0,1,0,1,0,0|2,0,0]=4 729 B12R2.612 CN1CCC2=CC(N)=CC=C21 DY629369 [0,1,0,1,0,0|2,0,0]=4 730 B12R2.612 N[C@@H]1COC2=C1C=CC(Br)=C2 DY625465 [0,1,0,1,0,0|2,0,0]=4 731 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 NO15082 [0,1,0,1,0,0|2,0,0]=4 732 B12R2.612 O=C1COC2=C1C=CC(O)=C2 NO20793 [0,1,0,1,0,0|2,0,0]=4 733 B12R2.612 OC1COC2=C1C=CC(Br)=C2 DY586466 [0,1,0,1,0,0|2,0,0]=4 734 B12R2.612 O[C@H]1COC2=C1C=CC(Br)=C2 DY586465 [0,1,0,1,0,0|2,0,0]=4 735 B12R2.1 CON1C=CC2=CC=CC=C21 DY559761 [0,1,0,1,0,0|1,0,1]=4 736 B12R2.18 CC1=CC2=CC=CC=C2N1C NO10010 [0,1,0,1,0,0|2,0,0]=4 737 B12R2.18 CC1=NC2=C(C=CC=C2)N1C DY451150 [0,1,0,1,0,0|2,0,0]=4 738 B12R2.315 BrCC1=CC=CC2=C1OCO2 NO15539 [0,1,0,1,0,0|2,0,0]=4 739 B12R2.315 COC1=C2C=CNC2=CC=C1 NO21717 [0,1,0,1,0,0|1,0,1]=4 740 B12R2.315 COC1=C2CCNC2=CC=C1 DY570405 [0,1,0,1,0,0|1,0,0]=3 741 B12R2.315 COC1=C2CNCC2=CC=C1 NO17395 [0,1,0,1,0,0|1,0,0]=3 742 B12R2.315 COC1=C2NCCC2=CC=C1 DY549339 [0,1,0,1,0,0|1,0,0]=3 743 B12R2.315 COC1=CC=CC2=C1N=CS2 DY752107 [0,1,0,1,0,0|1,0,1]=4 744 B12R2.315 COC1=CC=CC2=C1NC=N2 DY545673 [0,1,0,1,0,0|1,0,1]=4 745 B12R2.315 COC1=CC=CC2=C1OC=C2 NO21625 [0,1,0,1,0,0|0,0,1]=3 746 B12R2.1081 BrC1=C2CCCCC2=CC=C1 DY768527 [0,1,0,1,0,0|2,0,0]=4 747 B12R2.1081 BrC1=C2CCCNC2=CC=C1 NO18620 [0,1,0,1,0,0|2,0,0]=4 748 B12R2.1081 BrC1=C2CCCOC2=CC=C1 DY677682 [0,1,0,1,0,0|1,0,0]=3 749 B12R2.1081 BrC1=C2OCCCC2=CC=C1 DY551733 [0,1,0,1,0,0|1,0,0]=3 750 B12R2.1081 CC1=C2NCCCC2=CC=C1 DY784858 [0,1,0,1,0,0|2,0,0]=4 751 B12R2.1081 CC1CCNC2=CC=CC=C21 NO17518 [0,1,0,1,0,0|2,0,0]=4 752 B12R2.1081 CC1CNCC2=CC=CC=C21 NO17240 [0,1,0,1,0,0|2,0,0]=4 753 B12R2.1081 CC1NCCC2=CC=CC=C21 NO12178 [0,1,0,1,0,0|2,0,0]=4 754 B12R2.1081 CC1NCCC2=CC=CC=C21 NO15270 [0,1,0,1,0,0|2,0,0]=4 755 B12R2.1081 CN1CCNC2=CC=CC=C21 DY783466 [0,1,0,1,0,0|2,0,0]=4 756 B12R2.1081 CN1CCNC2=CC=CC=C21 NO19012 [0,1,0,1,0,0|2,0,0]=4 757 B12R2.1081 C[C@@H]1CNCC2=CC=CC=C21 DY550353 [0,1,0,1,0,0|2,0,0]=4 758 B12R2.1081 ClC1=C2CCCNC2=CC=C1 NO19411 [0,1,0,1,0,0|2,0,0]=4 759 B12R2.1081 FC1=CC=CC2=C1NCCO2 DY443372 [0,1,0,1,0,0|1,0,0]=3 760 B12R2.1081 IC1CCCC2=CC=CC=C21 DY528825 [0,1,0,1,0,0|2,0,0]=4 761 B12R2.1081 NC1CCOC2=CC=CC=C21 NO18355 [0,1,0,1,0,0|1,0,0]=3 762 B12R2.1081 N[C@H]1CCCC2=CC=CC=C21 NO13980 [0,1,0,1,0,0|2,0,0]=4 763 B12R2.1081 O=C1CCCC2=CC=CC=C12 NO14809 [0,1,0,1,0,0|2,0,0]=4 764 B12R2.1081 O=C1CCNC2=CC=CC=C12 NO15321 [0,1,0,1,0,0|2,0,0]=4 765 B12R2.1081 O=C1CCOC2=CC=CC=C12 NO22800 [0,1,0,1,0,0|1,0,0]=3 766 B12R2.1081 OC1=CC=CC2=C1OCCO2 NO12196 [0,1,0,1,0,0|0,0,0]=2 767 B12R2.1081 OC1CCNC2=CC=CC=C21 DY543693 [0,1,0,1,0,0|2,0,0]=4 768 B12R2.2028 CC1NC(C)C2=CC=CC=C21 DY541491 [0,1,0,1,0,0|2,0,0]=4 769 B12R2.2403 CC1(N)CCC2=CC=CC=C21 DY742447 [0,1,0,1,0,0|2,0,0]=4 770 B12R2.196 CC1=CC=CC2=C1OC[C@@H]2N DY622563 [0,1,0,1,0,0|2,0,0]=4