0 B10R1.10 CC#CC1=CC=CC(C)=C1 DY788763 [0,0,0,0,0,0|1,0,2]=3 1 B10R1.10 CC1=CC(CC#N)=CC=C1 NO18941 [0,0,0,0,0,0|0,0,2]=2 2 B10R1.10 CC1=CC(CCN)=NC=C1 DY713209 [0,0,0,0,0,0|1,0,0]=1 3 B10R1.10 CC1=CC(CCO)=CC=C1 NO22372 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.10 CC1=CC=CC(CNN)=C1 DY514611 [0,0,0,0,0,0|1,0,0]=1 5 B10R1.10 CC1=CC=CC(N=[N+]=[N-])=N1 DY792987 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.10 CCCC1=CN=CC(O)=C1 DY660255 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.10 CCNC1=NC=CC(Cl)=C1 DY658481 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.10 CCNC1=NC=CC(N)=C1 NO14774 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.10 CCOC1=CC(N)=NC=C1 DY20309 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.10 CCOC1=CC=CC(Cl)=N1 DY655578 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.10 CNCC1=CC(Cl)=CC=C1 DY456640 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.10 CNCC1=CC=CC(N)=C1 DY789483 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.10 COCC1=CC(Br)=NC=C1 DY655107 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.10 Clc1cccc(CCBr)c1 DY584685 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.10 N#CCC1=CC(Br)=CC=C1 NO18969 [0,0,0,0,0,0|1,0,2]=3 16 B10R1.10 N#CCC1=CC(Cl)=CC=C1 NO13745 [0,0,0,0,0,0|1,0,2]=3 17 B10R1.10 N#CCC1=CC(F)=CC=C1 DY20212 [0,0,0,0,0,0|1,0,2]=3 18 B10R1.10 N#CCC1=CC(I)=CC=C1 DY584378 [0,0,0,0,0,0|1,0,2]=3 19 B10R1.10 N#CCC1=NC=CC(Br)=C1 NO17276 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.10 N#CCC1=NC=CC(F)=C1 DY711241 [0,0,0,0,0,0|2,0,2]=4 21 B10R1.10 NC1=CC=CC(CCO)=C1 NO22105 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.10 NC1=CC=CC(CCO)=N1 DY608453 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.10 NCCC1=CC(Br)=CC=C1 NO15159 [0,0,0,0,0,0|1,0,0]=1 24 B10R1.10 NCCC1=NC(Cl)=CC=C1 DY654324 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.10 NCCc1cccc(O)c1 DY552393 [0,0,0,0,0,0|1,0,0]=1 26 B10R1.10 NNCC1=CC(Cl)=CC=C1 DY544953 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.10 NNCC1=CC(O)=CC=C1 DY10382 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.10 O=C=NC1=CC(F)=CC=C1 DY41043 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.10 OCCC1=CC(Br)=CC=C1 NO22186 [0,0,0,0,0,0|2,0,0]=2 30 B10R1.10 OCCC1=CC(Cl)=CC=C1 NO22241 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.10 OCCC1=NC(Cl)=CC=C1 DY531777 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.10 O\N=C\C1=CC(Br)=CC=C1 DY796005 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.10 S=C=NC1=CC(I)=CC=C1 DY41073 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.2 BrCC1=CC=CC(Br)=C1 NO19344 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.2 C#CC1=CC(F)=CC=C1 NO20642 [1,0,0,0,0,0|1,0,2]=4 36 B9R1.2 C#CC1=CC=CC(N)=C1 NO10819 [1,0,0,0,0,0|1,0,2]=4 37 B9R1.2 CC1=CC(C#N)=NC=C1 NO20235 [1,0,0,0,0,0|1,0,2]=4 38 B9R1.2 CC1=CC(C=O)=NC=C1 NO19123 [1,0,0,0,0,0|2,0,1]=4 39 B9R1.2 CC1=CC(CCl)=NC=C1 NO15442 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.2 CC1=CC(CCl)=NC=N1 DY694001 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.2 CC1=CC(CN)=CC=C1 NO19644 [1,0,0,0,0,0|0,0,0]=1 42 B9R1.2 CC1=CC(CO)=NC=C1 NO11126 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.2 CC1=CC(NN)=CC=C1 NO19574 [1,0,0,0,0,0|1,0,0]=2 44 B9R1.2 CC1=CC(NN)=NC=C1 NO13399 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.2 CC1=CC=CC(C#N)=C1 NO19778 [1,0,0,0,0,0|0,0,2]=3 46 B9R1.2 CC1=CC=CC(C#N)=N1 NO15464 [1,0,0,0,0,0|1,0,2]=4 47 B9R1.2 CC1=CC=CC(C=O)=C1 DY41127 [1,0,0,0,0,0|1,0,1]=3 48 B9R1.2 CC1=CC=CC(CCl)=N1 DY547749 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.2 CC1=CC=CC(CN)=N1 NO18414 [1,0,0,0,0,0|1,0,0]=2 50 B9R1.2 CC1=CC=CC(CO)=N1 DY20920 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.2 CC1=CN=CC(CCl)=C1 NO14445 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.2 CC1=CN=CC(CCl)=N1 NO17402 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.2 CC1=CN=CC(CO)=C1 DY452566 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.2 CC1=CN=CC(CO)=N1 NO15787 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.2 CC1=NC(CN)=NC=C1 DY580845 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.2 CC1=NC(CN)=NC=C1 DY611424 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.2 CC1=NC=CC(C=O)=C1 NO15441 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.2 CCC1=CC(C)=CN=C1 DY657240 [1,0,0,0,0,0|1,0,0]=2 59 B9R1.2 CCC1=CC=CC(Br)=N1 NO15322 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.2 CCC1=CC=CC(Cl)=C1 DY584271 [1,0,0,0,0,0|1,0,0]=2 61 B9R1.2 CCC1=CN=CC(Br)=C1 NO11907 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.2 CCC1=CN=CC(Cl)=N1 DY447143 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.2 CCC1=NC=CC(Br)=C1 DY658183 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.2 CNC1=CC(Br)=CC=C1 NO22185 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.2 CNC1=CC(Cl)=CC=C1 DY20486 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.2 CNC1=CC(I)=CC=C1 DY563655 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.2 CNC1=CC(N)=CC=C1 NO16640 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.2 CNC1=CC=CC(O)=C1 DY442233 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.2 CNC1=NC=CC(F)=C1 DY714974 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.2 CNC1=NC=CC(I)=C1 DY452194 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.2 CNC1=NC=CC(N)=C1 NO16967 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.2 CNC1=NC=NC(C)=C1 DY695897 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.2 COC1=CC(Br)=NC=C1 NO16230 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.2 COC1=CC(C)=CN=C1 DY451846 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.2 COC1=CC(Cl)=NC=C1 NO19311 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.2 COC1=CC(F)=NC=C1 NO14826 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.2 COC1=CC(N)=NC=C1 NO19522 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.2 COC1=CC=CC(Br)=N1 NO14301 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.2 COC1=CC=CC(Cl)=C1 NO19894 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.2 COC1=CC=CC(Cl)=N1 NO13826 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.2 COC1=CC=CC(F)=C1 NO19929 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.2 COC1=CC=CC(F)=N1 NO13652 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.2 COC1=CC=CC(I)=N1 NO18075 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.2 COC1=CC=CC(N)=C1 NO19943 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.2 COC1=CC=CC(N)=N1 NO13845 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.2 COC1=CC=CC(O)=C1 NO18747 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.2 COC1=CC=C[N+]([O-])=C1 NO22349 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.2 COC1=CN=CC(N)=C1 NO19973 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.2 COC1=CN=CC(O)=C1 NO17819 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.2 COC1=NC(C)=CC=C1 NO15396 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.2 COC1=NC(C)=CN=C1 DY710569 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.2 COC1=NC(C)=NC=C1 NO11919 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.2 COC1=NC=CC(Br)=C1 NO22650 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.2 COC1=NC=CC(C)=C1 NO21637 [1,0,0,0,0,0|2,0,0]=3 95 B9R1.2 COC1=NC=CC(Cl)=C1 NO19313 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.2 COC1=NC=CC(F)=C1 NO11908 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.2 COC1=NC=CC(I)=C1 NO19594 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.2 COC1=NC=CC(N)=C1 NO19525 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.2 CSC1=CC(N)=CC=C1 DY20570 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.2 CSC1=CC(N)=NC=C1 DY657949 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.2 CSC1=CN=CC(Br)=C1 DY452608 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.2 CSC1=NC=CC(Cl)=C1 NO12493 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.2 ClC1=CC=CC(CBr)=C1 NO22235 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.2 ClC1=NC=CC(CBr)=C1 DY657889 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.2 ClCC1=CC(Br)=CC=C1 DY40579 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.2 ClCc1cccc(I)c1 DY585080 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.2 FC1=CC=CC(CBr)=N1 DY500445 [1,0,0,0,0,0|3,0,0]=4 108 B9R1.2 FC1=CC=CC(CCl)=C1 NO19068 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.2 FCC1=CC(Br)=NC=C1 DY512247 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.2 N#CC1=CC(Br)=CC=C1 NO19865 [1,0,0,0,0,0|1,0,2]=4 111 B9R1.2 N#CC1=CC(Cl)=CC=C1 NO19319 [1,0,0,0,0,0|1,0,2]=4 112 B9R1.2 N#CC1=CC(F)=CC=C1 DY20044 [1,0,0,0,0,0|1,0,2]=4 113 B9R1.2 N#CC1=CC(N)=CC=C1 NO13394 [1,0,0,0,0,0|1,0,2]=4 114 B9R1.2 N#CC1=CC(O)=CC=C1 NO19377 [1,0,0,0,0,0|1,0,2]=4 115 B9R1.2 NC1=CC(CBr)=CN=C1 DY659222 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.2 NC1=CC(CO)=NC=C1 DY33483 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.2 NC1=CC=CC(CO)=C1 NO18821 [1,0,0,0,0,0|2,0,0]=3 118 B9R1.2 NC1=CC=CC(CO)=N1 NO16612 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.2 NC1=CN=CC(CO)=C1 NO22079 [1,0,0,0,0,0|3,0,0]=4 120 B9R1.2 NC1=NC=CC(CO)=C1 NO17807 [1,0,0,0,0,0|3,0,0]=4 121 B9R1.2 NCC1=CC(=O)N=CN1 DY112983 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.2 NCC1=CC(Br)=CC=C1 NO19652 [1,0,0,0,0,0|1,0,0]=2 123 B9R1.2 NCC1=CC(Br)=NC=C1 NO17247 [1,0,0,0,0,0|2,0,0]=3 124 B9R1.2 NCC1=CC(Cl)=CC=C1 DY33134 [1,0,0,0,0,0|1,0,0]=2 125 B9R1.2 NCC1=CC(Cl)=NC=C1 NO16037 [1,0,0,0,0,0|2,0,0]=3 126 B9R1.2 NCC1=CC(I)=CC=C1 DY584527 [1,0,0,0,0,0|1,0,0]=2 127 B9R1.2 NCC1=CC(I)=CC=C1 NO22330 [1,0,0,0,0,0|1,0,0]=2 128 B9R1.2 NCC1=CC=CC(=O)N1 DY582837 [1,0,0,0,0,0|2,0,0]=3 129 B9R1.2 NCC1=CC=CC(O)=C1 DY745447 [1,0,0,0,0,0|1,0,0]=2 130 B9R1.2 NCC1=NC(Br)=CC=C1 NO10635 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.2 NCC1=NC(Cl)=CC=C1 DY527445 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.2 NCC1=NC(Cl)=CN=C1 DY106438 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.2 NCC1=NC(F)=CC=C1 NO13193 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.2 NCC1=NC=CC(Br)=C1 NO12824 [1,0,0,0,0,0|2,0,0]=3 135 B9R1.2 NCC1=NC=CC(Br)=C1 NO15559 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.2 NNC1=CC(Br)=CC=C1 NO19465 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.2 NNC1=CC(Cl)=CC=C1 NO19479 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.2 NNC1=CC(F)=CC=C1 NO19485 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.2 NNC1=CC=CC(Br)=N1 DY545589 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.2 NNC1=CC=CC(Cl)=N1 NO21479 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.2 O=C1C=CNC(CO)=C1 DY654576 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.2 O=CC1=CC(Br)=CC=C1 NO18958 [1,0,0,0,0,0|2,0,1]=4 143 B9R1.2 O=CC1=CC(Cl)=CC=C1 DY20579 [1,0,0,0,0,0|2,0,1]=4 144 B9R1.2 O=CC1=CC(F)=CC=C1 NO22298 [1,0,0,0,0,0|2,0,1]=4 145 B9R1.2 O=CC1=CC(I)=CC=C1 NO20132 [1,0,0,0,0,0|2,0,1]=4 146 B9R1.2 O=CC1=CC(O)=CC=C1 DY20422 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.2 OCC1=CC(Br)=CN=C1 NO18272 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.2 OCC1=CC(Br)=NC=C1 NO19256 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.2 OCC1=CC(F)=CC=C1 NO19069 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.2 OCC1=CC(F)=CN=C1 DY430713 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.2 OCC1=NC(Br)=CC=C1 NO23004 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.2 OCC1=NC(Cl)=CC=C1 NO10667 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.2 OCC1=NC(Cl)=CC=C1 NO19907 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.2 OCC1=NC=CC(Br)=C1 NO18696 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.2 OCC1=NC=CC(Cl)=C1 DY20517 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.2 OCC1=NC=CC(O)=C1 NO17612 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.2 [O-][n+]1cccc(CO)c1 DY567759 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.8 BrCCC1=CC=CN=C1 DY608158 [1,0,0,0,0,0|2,0,0]=3 159 B9R1.8 C#CCC1=CC=CC=C1 DY501873 [1,0,0,0,0,0|1,0,1]=3 160 B9R1.8 CCCC1=CC=CN=C1 NO22402 [1,0,0,0,0,0|2,0,0]=3 161 B9R1.8 CNCC1=CC=CC=C1 DY10559 [1,0,0,0,0,0|2,0,0]=3 162 B9R1.8 CNCC1=CC=CC=C1 DY20323 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.8 CNCC1=CC=CC=C1 DY21006 [1,0,0,0,0,0|2,0,0]=3 164 B9R1.8 CNCC1=CC=CN=C1 NO18846 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.8 CNCC1=CC=NC=C1 DY712153 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.8 CNCC1=NC=CC=C1 DY501242 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.8 CNCC1=NC=CC=C1 DY663671 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.8 COCC1=NC=CC=C1 NO20909 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.8 ClCCC1=CC=NC=C1 NO17913 [1,0,0,0,0,0|2,0,0]=3 170 B9R1.8 ClCCC1=NC=CN=C1 DY585865 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.8 ClCSC1=CC=CC=C1 DY797799 [1,0,0,0,0,0|2,0,0]=3 172 B9R1.8 N#CCC1=CC=CN=C1 NO18407 [1,0,0,0,0,0|1,0,2]=4 173 B9R1.8 N#CCC1=CC=NC=C1 NO20239 [1,0,0,0,0,0|1,0,2]=4 174 B9R1.8 N#CCC1=NC=CC=C1 NO18926 [1,0,0,0,0,0|1,0,2]=4 175 B9R1.8 N#C[Se]C1=CC=CC=C1 DY822031 [1,0,0,0,0,0|1,0,2]=4 176 B9R1.8 NCCC1=CC=CN=C1 NO21892 [1,0,0,0,0,0|1,0,0]=2 177 B9R1.8 NCCC1=CN=CN=C1 DY693160 [1,0,0,0,0,0|2,0,0]=3 178 B9R1.8 NCCC1=NC=CC=C1 NO14064 [1,0,0,0,0,0|1,0,0]=2 179 B9R1.8 NCCC1=NC=CC=N1 DY510693 [1,0,0,0,0,0|2,0,0]=3 180 B9R1.8 NNCC1=CC=CC=C1 NO11006 [1,0,0,0,0,0|1,0,0]=2 181 B9R1.8 NNCC1=CC=CC=C1 NO12127 [1,0,0,0,0,0|1,0,0]=2 182 B9R1.8 NNCC1=CC=NC=C1 DY518961 [1,0,0,0,0,0|2,0,0]=3 183 B9R1.8 NNCC1=NC=CC=C1 DY578445 [1,0,0,0,0,0|2,0,0]=3 184 B9R1.8 NOCC1=CC=CC=C1 NO14063 [1,0,0,0,0,0|1,0,0]=2 185 B9R1.8 OCCC1=CN=CN=C1 NO12401 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.8 ONCC1=CC=CC=C1 DY563853 [1,0,0,0,0,0|2,0,0]=3 187 B9R1.8 ONCC1=CC=CC=C1 NO11753 [1,0,0,0,0,0|2,0,0]=3 188 B11R1.13 CC1=C(CC#N)C=CC=C1Br DY584724 [0,1,0,0,0,0|1,0,2]=4 189 B11R1.13 CC1=C(CC#N)C=CC=C1F DY585162 [0,1,0,0,0,0|1,0,2]=4 190 B11R1.13 CC1=C(CC#N)C=CC=C1I DY584865 [0,1,0,0,0,0|1,0,2]=4 191 B11R1.13 CC1=CC=CC(CC#N)=C1Br DY584581 [0,1,0,0,0,0|0,0,2]=3 192 B11R1.13 CNCC1=C(Cl)C(Cl)=CC=C1 NO20112 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.13 CNCC1=C(F)C(Cl)=CC=C1 DY516897 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.13 N#CCC1=C(Br)C(Cl)=CC=C1 DY584930 [0,1,0,0,0,0|1,0,2]=4 195 B11R1.13 N#CCC1=C(Cl)C(Cl)=CC=C1 NO18973 [0,1,0,0,0,0|1,0,2]=4 196 B11R1.23 C=CC(O)C1=CC(Br)=CC=C1 DY745051 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 DY41278 [0,1,0,0,0,0|2,0,1]=4 198 B11R1.23 CCC(=O)C1=CC(C)=CC=C1 DY745657 [0,1,0,0,0,0|1,0,1]=3 199 B11R1.23 CCC(=O)C1=CC(F)=CC=C1 DY41284 [0,1,0,0,0,0|2,0,1]=4 200 B11R1.23 CCC(N)C1=NC(C)=CC=C1 DY606027 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.23 CC[C@@H](N)C1=CC(Cl)=CC=C1 DY508850 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 DY585435 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.23 CN[C@H](C)C1=CC(F)=CC=C1 DY744907 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.23 NC(CO)C1=CC(Br)=CC=C1 DY535233 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.23 NC(CO)C1=CC(Cl)=CC=C1 DY518181 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.23 NCC(O)C1=CC=CC(O)=C1 DY556047 [0,1,0,0,0,0|1,0,0]=2 207 B11R1.23 NC[C@@H](O)C1=CC(Cl)=CC=C1 DY530577 [0,1,0,0,0,0|1,0,0]=2 208 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 DY741673 [0,1,0,0,0,0|1,0,0]=2 209 B11R1.23 NNC(=O)C1=CC(I)=CC=C1 DY552699 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.23 N[C@@H](CO)C1=CC(Cl)=CC=C1 DY513939 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.23 N[C@H](CO)C1=CC(Cl)=CC=C1 DY563793 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 NO19056 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 NO15383 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.23 O=C(CCl)C1=CC(Cl)=CC=C1 DY20163 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.23 O=C(CCl)C1=CC=CC(F)=C1 DY584626 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.24 CCCOC1=NC=CC(Br)=C1 DY430459 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.24 CCNCC1=CC=CC(O)=C1 DY579381 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.24 CNCCC1=CC(C)=CC=C1 DY520263 [0,1,0,0,0,0|0,0,0]=1 219 B11R1.24 COCOC1=CC=CC(Cl)=C1 DY449110 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.24 FC1=CC=CC(CN=C=S)=C1 DY41079 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.24 FC1=CC=CC(OCCBr)=C1 DY574785 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.24 N#CCOC1=CC(Cl)=CC=C1 DY744883 [0,1,0,0,0,0|1,0,2]=4 223 B11R1.24 NC1=CC=CC(OCCO)=C1 DY557451 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.24 O=C=NCC1=CC(F)=CC=C1 DY790131 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.24 OCCNC1=NC(Cl)=CC=C1 DY653604 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.34 C#CCC1=CC(F)=CC(F)=C1 DY431174 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.34 CCCC1=CC(Cl)=NC(C)=N1 DY455610 [0,1,0,0,0,0|3,0,0]=4 228 B11R1.34 CCCC1=NC(C)=CC(Cl)=N1 DY603027 [0,1,0,0,0,0|3,0,0]=4 229 B11R1.34 N#CCC1=CC(Cl)=CC(Cl)=C1 NO20845 [0,1,0,0,0,0|1,0,2]=4 230 B11R1.34 N#CCC1=CC(F)=CC(F)=C1 NO20643 [0,1,0,0,0,0|1,0,2]=4 231 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 NO16793 [0,1,0,0,0,0|1,0,0]=2 232 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 NO22187 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.157 CC(C)CC1=CC=CC(N)=C1 DY822133 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.157 CC(N)CC1=CC(Br)=CC=C1 DY511737 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.157 FC(F)Oc1cccc(I)c1 DY585165 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.157 FC1=CC=CC(OC(F)F)=C1 DY722347 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.157 NC(=O)CC1=CC(Cl)=CC=C1 DY799707 [0,1,0,0,0,0|1,0,1]=3 238 B11R1.157 NC(=S)NC1=CC(F)=CC=C1 DY795615 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.157 NC1=CC(OC(F)F)=CC=C1 NO13961 [0,1,0,0,0,0|3,0,0]=4 240 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 NO21911 [0,1,0,0,0,0|2,0,1]=4 241 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 NO10775 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 NO21923 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 NO20851 [0,1,0,0,0,0|2,0,1]=4 244 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 NO20944 [0,1,0,0,0,0|2,0,1]=4 245 B11R1.157 OB(O)CC1=CC(F)=CC=C1 DY706879 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.157 OC1=CC(OC(F)F)=CC=C1 DY431656 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.182 C=CCC1=CC(C)=CN=C1Cl DY511029 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.182 CC1=C(CC#N)C=C(Br)C=C1 DY584752 [0,1,0,0,0,0|1,0,2]=4 249 B11R1.182 CC1=C(CC#N)C=C(F)C=C1 NO19339 [0,1,0,0,0,0|1,0,2]=4 250 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 NO21152 [0,1,0,0,0,0|0,0,2]=3 251 B11R1.182 CC1=CC(CCO)=C(C)C=C1 DY40742 [0,1,0,0,0,0|1,0,0]=2 252 B11R1.182 CC1=CC(CNN)=C(C)C=C1 DY519153 [0,1,0,0,0,0|1,0,0]=2 253 B11R1.182 CC1=NN(CCN)C(=O)C=C1 DY549939 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.182 CCOC1=C(Br)C=CC(C)=C1 DY451888 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.182 CCOC1=C(Br)C=CC(N)=C1 NO20424 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.182 CNCC1=C(F)C=CC(F)=C1 DY456646 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.182 N#CCC1=C(Br)C=CC(Br)=C1 DY585001 [0,1,0,0,0,0|1,0,2]=4 258 B11R1.182 N#CCC1=C(Cl)C=CC(Cl)=C1 NO18974 [0,1,0,0,0,0|1,0,2]=4 259 B11R1.182 N#CCC1=C(F)C=CC(Br)=C1 NO16321 [0,1,0,0,0,0|1,0,2]=4 260 B11R1.182 NCCC1=C(Br)C=CC(Cl)=C1 DY522951 [0,1,0,0,0,0|1,0,0]=2 261 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 DY795369 [0,1,0,0,0,0|1,0,0]=2 262 B11R1.189 CCOC1=CC=CC(C#N)=C1 DY584293 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.189 CCOC1=CC=CC(C=O)=C1 DY433437 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.189 COC1=CC=CC(CC#N)=C1 NO11040 [0,1,0,0,0,0|0,0,2]=3 265 B11R1.189 COC1=CC=CC(CCN)=C1 NO13916 [0,1,0,0,0,0|0,0,0]=1 266 B11R1.189 COC1=CC=CC(CCO)=C1 NO22342 [0,1,0,0,0,0|1,0,0]=2 267 B11R1.189 COC1=CC=CC(N=C=S)=C1 DY794235 [0,1,0,0,0,0|2,0,1]=4 268 B11R1.189 COC1=CN=CC(CC#N)=C1 DY654252 [0,1,0,0,0,0|1,0,2]=4 269 B11R1.189 COCC1=CC=CC(C#N)=C1 NO18233 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.189 COCC1=CC=CC(CN)=C1 NO15687 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.189 N#CC1=CC(CNN)=CC=C1 DY686755 [0,1,0,0,0,0|1,0,1]=3 272 B11R1.189 NCC1=CC=CC(CCO)=C1 NO17053 [0,1,0,0,0,0|1,0,0]=2 273 B11R1.192 CC1=C(Br)C=C(CC#N)C=C1 DY584714 [0,1,0,0,0,0|1,0,2]=4 274 B11R1.192 CC1=C(C)C=C(N=C=S)C=C1 DY20511 [0,1,0,0,0,0|2,0,1]=4 275 B11R1.192 CC1=C(Cl)C=CC(N=C=O)=C1 DY41037 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.192 CC1=C(F)C=CC(CC#N)=C1 DY40778 [0,1,0,0,0,0|0,0,2]=3 277 B11R1.192 CCOC1=CC(C)=C(N)C=N1 DY711829 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.192 CCOC1=CC(Cl)=C(Br)C=C1 NO16022 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.192 CNCC1=CC(Cl)=C(Cl)C=C1 NO11711 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.192 CNCC1=CC=C(O)C(O)=C1 DY502761 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.192 FC1=C(F)C=C(CCBr)C=C1 DY584641 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.192 Fc1ccc(C[Zn]Br)cc1F DY794193 [0,1,0,0,0,0|3,0,0]=4 283 B11R1.192 N#CCC1=CC(Cl)=C(Cl)C=C1 NO20633 [0,1,0,0,0,0|1,0,2]=4 284 B11R1.192 N#CCC1=CC(Cl)=C(F)C=C1 NO18657 [0,1,0,0,0,0|1,0,2]=4 285 B11R1.192 N#CCC1=CC(F)=C(Br)C=C1 NO15044 [0,1,0,0,0,0|1,0,2]=4 286 B11R1.192 NCCC1=CC(Cl)=C(Cl)C=C1 NO21933 [0,1,0,0,0,0|1,0,0]=2 287 B11R1.192 NCCC1=CC(F)=C(F)C=C1 DY584648 [0,1,0,0,0,0|1,0,0]=2 288 B11R1.192 NCCC1=CC=C(O)C(O)=C1 NO15345 [0,1,0,0,0,0|1,0,0]=2 289 B11R1.192 O=CCC1=CC(O)=C(O)C=C1 DY745117 [0,1,0,0,0,0|2,0,1]=4 290 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 NO21932 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.192 OCCC1=CC(Cl)=C(F)C=C1 DY584825 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.192 OCCC1=CC(F)=C(Cl)C=C1 DY584900 [0,1,0,0,0,0|2,0,0]=3 293 B11R2.35 CC1=CC(C2=NC2)=CC=C1 DY770565 [0,0,0,1,0,0|0,0,2]=3 294 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 NO10238 [0,0,0,1,0,0|2,0,1]=4 295 B11R2.36 BrC1=CC2=C(C=C1)OCC2 DY20389 [0,0,0,1,0,0|2,0,0]=3 296 B11R2.36 BrC1=CC=C2C=CCC2=C1 DY549009 [0,0,0,1,0,0|2,0,1]=4 297 B11R2.36 BrC1=CC=C2CCNC2=C1 NO17623 [0,0,0,1,0,0|3,0,0]=4 298 B11R2.36 BrC1=CC=C2CNCC2=C1 DY20658 [0,0,0,1,0,0|3,0,0]=4 299 B11R2.36 BrC1=CC=C2CNCC2=C1 NO14408 [0,0,0,1,0,0|3,0,0]=4 300 B11R2.36 BrC1=CC=C2NC=CC2=C1 NO17784 [0,0,0,1,0,0|1,0,2]=4 301 B11R2.36 BrC1=CC=C2NCCC2=C1 NO10836 [0,0,0,1,0,0|1,0,0]=2 302 B11R2.36 BrC1=CC=C2NN=CC2=C1 NO15506 [0,0,0,1,0,0|2,0,1]=4 303 B11R2.36 BrC1=CN=C2CCCC2=C1 NO22164 [0,0,0,1,0,0|3,0,0]=4 304 B11R2.36 BrC1=CN=C2NCCC2=C1 DY533421 [0,0,0,1,0,0|2,0,0]=3 305 B11R2.36 BrC1=CN=C2NCCC2=C1 NO18623 [0,0,0,1,0,0|2,0,0]=3 306 B11R2.36 Brc1ccc2c(c1)OCO2 NO19789 [0,0,0,1,0,0|3,0,0]=4 307 B11R2.36 CC1=CC2=C(C=C1)OC=C2 DY441161 [0,0,0,1,0,0|1,0,2]=4 308 B11R2.36 CC1=CC2=C(C=C1)SC=C2 DY447819 [0,0,0,1,0,0|1,0,2]=4 309 B11R2.36 CC1=CC=C2C=CNC2=C1 DY455868 [0,0,0,1,0,0|2,0,1]=4 310 B11R2.36 CC1=CC=C2CNCC2=C1 DY431420 [0,0,0,1,0,0|2,0,0]=3 311 B11R2.36 CC1=CC=C2NC=CC2=C1 NO11033 [0,0,0,1,0,0|0,0,2]=3 312 B11R2.36 CC1=CN2CCN=C2C=C1 DY760340 [0,0,0,1,0,0|1,0,1]=3 313 B11R2.36 CC1=CN=C2NC=CC2=C1 NO10438 [0,0,0,1,0,0|1,0,2]=4 314 B11R2.36 CC1=NC=C2NC=CC2=C1 DY585624 [0,0,0,1,0,0|1,0,2]=4 315 B11R2.36 ClC1=CC=C2CCNC2=C1 NO19407 [0,0,0,1,0,0|3,0,0]=4 316 B11R2.36 ClC1=CC=C2CNCC2=C1 NO15340 [0,0,0,1,0,0|3,0,0]=4 317 B11R2.36 ClC1=CC=C2NC=CC2=C1 NO22049 [0,0,0,1,0,0|1,0,2]=4 318 B11R2.36 ClC1=CC=C2NCCC2=C1 DY20079 [0,0,0,1,0,0|1,0,0]=2 319 B11R2.36 ClC1=CC=C2NCCC2=C1 DY630382 [0,0,0,1,0,0|1,0,0]=2 320 B11R2.36 ClC1=CC=C2NN=CC2=C1 NO10312 [0,0,0,1,0,0|2,0,1]=4 321 B11R2.36 FC1=CC=C2CCCC2=C1 NO16751 [0,0,0,1,0,0|2,0,0]=3 322 B11R2.36 FC1=CC=C2CCNC2=C1 DY443334 [0,0,0,1,0,0|3,0,0]=4 323 B11R2.36 FC1=CC=C2CNCC2=C1 DY459041 [0,0,0,1,0,0|3,0,0]=4 324 B11R2.36 FC1=CC=C2CNCC2=C1 NO15207 [0,0,0,1,0,0|3,0,0]=4 325 B11R2.36 FC1=CC=C2NN=CC2=C1 NO18254 [0,0,0,1,0,0|2,0,1]=4 326 B11R2.36 IC1=CC=C2NN=CC2=C1 NO10408 [0,0,0,1,0,0|2,0,1]=4 327 B11R2.36 IC1=CN=C2CCCC2=C1 DY675123 [0,0,0,1,0,0|3,0,0]=4 328 B11R2.36 NC1=CC2=C(C=C1)CCO2 DY561471 [0,0,0,1,0,0|3,0,0]=4 329 B11R2.36 NC1=CC2=C(C=C1)OCO2 NO20315 [0,0,0,1,0,0|3,0,0]=4 330 B11R2.36 NC1=CC=C2CNCC2=C1 DY20849 [0,0,0,1,0,0|3,0,0]=4 331 B11R2.36 NC1=CC=C2CNCC2=C1 DY555549 [0,0,0,1,0,0|3,0,0]=4 332 B11R2.36 NC1=CC=C2NC=CC2=C1 NO20917 [0,0,0,1,0,0|1,0,2]=4 333 B11R2.36 NC1=CC=C2NCCC2=C1 DY630744 [0,0,0,1,0,0|1,0,0]=2 334 B11R2.36 NC1=CC=C2NN=CC2=C1 DY444376 [0,0,0,1,0,0|2,0,1]=4 335 B11R2.36 NC1=CN=C2CCCC2=C1 DY100354 [0,0,0,1,0,0|3,0,0]=4 336 B11R2.36 OC1=CC2=C(C=C1)CCO2 NO16031 [0,0,0,1,0,0|3,0,0]=4 337 B11R2.36 OC1=CC=C2CCNC2=C1 DY630750 [0,0,0,1,0,0|3,0,0]=4 338 B11R2.36 OC1=CC=C2CNCC2=C1 DY446903 [0,0,0,1,0,0|3,0,0]=4 339 B11R2.36 OC1=CC=C2NC=CC2=C1 NO20861 [0,0,0,1,0,0|1,0,2]=4 340 B11R2.36 OC1=CC=C2NN=CC2=C1 NO20711 [0,0,0,1,0,0|2,0,1]=4 341 B11R2.106 BrC1=C2CCCC2=CC=C1 NO16754 [0,0,0,1,0,0|2,0,0]=3 342 B11R2.106 BrC1=C2CCNC2=CC=C1 NO18513 [0,0,0,1,0,0|3,0,0]=4 343 B11R2.106 BrC1=C2CNCC2=CC=C1 NO22684 [0,0,0,1,0,0|3,0,0]=4 344 B11R2.106 BrC1=C2NC=CC2=CC=C1 NO10709 [0,0,0,1,0,0|1,0,2]=4 345 B11R2.106 BrC1=CC=CC2=C1OCC2 NO12983 [0,0,0,1,0,0|2,0,0]=3 346 B11R2.106 BrC1=CC=CC2=C1OCO2 NO22623 [0,0,0,1,0,0|3,0,0]=4 347 B11R2.106 CC1=C2C=CNC2=CC=C1 NO21706 [0,0,0,1,0,0|2,0,1]=4 348 B11R2.106 CC1=C2C=NNC2=CC=C1 NO22943 [0,0,0,1,0,0|3,0,0]=4 349 B11R2.106 CC1=C2CNCC2=CC=C1 NO17946 [0,0,0,1,0,0|2,0,0]=3 350 B11R2.106 CC1=C2NC=CC2=CC=C1 NO11034 [0,0,0,1,0,0|0,0,2]=3 351 B11R2.106 CC1=C2NC=CC2=CC=N1 DY456412 [0,0,0,1,0,0|1,0,2]=4 352 B11R2.106 CC1=C2NCCC2=CC=C1 NO18412 [0,0,0,1,0,0|0,0,0]=1 353 B11R2.106 CC1=C2NN=CC2=CC=C1 NO10824 [0,0,0,1,0,0|1,0,1]=3 354 B11R2.106 CC1=CC=CC2=C1C=CO2 DY751237 [0,0,0,1,0,0|2,0,1]=4 355 B11R2.106 CC1=CC=CC2=C1SC=C2 DY441270 [0,0,0,1,0,0|1,0,2]=4 356 B11R2.106 CC1=CC=CC2=NCCN12 DY760358 [0,0,0,1,0,0|3,0,0]=4 357 B11R2.106 ClC1=C2CCCC2=NC=C1 NO12915 [0,0,0,1,0,0|3,0,0]=4 358 B11R2.106 ClC1=C2CCNC2=CC=C1 NO10845 [0,0,0,1,0,0|3,0,0]=4 359 B11R2.106 ClC1=C2CNCC2=CC=C1 DY630146 [0,0,0,1,0,0|3,0,0]=4 360 B11R2.106 ClC1=C2CNCC2=CC=C1 NO15338 [0,0,0,1,0,0|3,0,0]=4 361 B11R2.106 ClC1=C2NC=CC2=CC=C1 NO14936 [0,0,0,1,0,0|1,0,2]=4 362 B11R2.106 ClC1=C2NCCC2=CC=N1 DY518367 [0,0,0,1,0,0|2,0,0]=3 363 B11R2.106 FC1=C2CCNC2=CC=C1 DY433917 [0,0,0,1,0,0|3,0,0]=4 364 B11R2.106 FC1=C2CNCC2=CC=C1 DY430022 [0,0,0,1,0,0|3,0,0]=4 365 B11R2.106 FC1=C2CNCC2=CC=C1 DY580305 [0,0,0,1,0,0|3,0,0]=4 366 B11R2.106 FC1=C2NC=CC2=CC=C1 NO10747 [0,0,0,1,0,0|1,0,2]=4 367 B11R2.106 FC1=C2NN=CC2=CC=C1 NO10814 [0,0,0,1,0,0|2,0,1]=4 368 B11R2.106 IC1=C2CCNC2=CC=C1 DY630170 [0,0,0,1,0,0|3,0,0]=4 369 B11R2.106 IC1=CC=CC2=C1NC=N2 DY427402 [0,0,0,1,0,0|2,0,1]=4 370 B11R2.106 IC1=CC=CC2=C1OCO2 NO12923 [0,0,0,1,0,0|3,0,0]=4 371 B11R2.106 NC1=C2NC=CC2=CC=C1 NO10501 [0,0,0,1,0,0|1,0,2]=4 372 B11R2.106 NC1=CC=CC2=C1CCN2 NO11498 [0,0,0,1,0,0|3,0,0]=4 373 B11R2.106 NC1=CC=CC2=C1NC=N2 DY20436 [0,0,0,1,0,0|2,0,1]=4 374 B11R2.106 OC1=C2NN=CC2=CC=C1 NO17029 [0,0,0,1,0,0|2,0,1]=4 375 B11R2.106 OC1=CC=CC2=C1CCC2 NO22898 [0,0,0,1,0,0|2,0,0]=3 376 B11R2.106 OC1=CC=CC2=C1NN=N2 DY545445 [0,0,0,1,0,0|3,0,0]=4 377 B11R2.106 [O-][N+]1=CC=CC2=C1CCC2 DY579003 [0,0,0,1,0,0|3,0,0]=4 378 B9R1.7 CC1=NC(CCCl)=CS1 DY605062 [0,0,0,0,1,0|3,0,0]=4 379 B9R1.7 NCCC1=CN=C(O)S1 DY110548 [0,0,0,0,1,0|3,0,0]=4 380 B9R1.7 NCCC1=CSC(N)=N1 DY602437 [0,0,0,0,1,0|3,0,0]=4 381 B9R1.7 NCCN1C=C(F)C=N1 DY646050 [0,0,0,0,1,0|3,0,0]=4 382 B9R1.7 NNCC1=CSC(Cl)=C1 DY104510 [0,0,0,0,1,0|3,0,0]=4 383 B9R1.7 OCCC1=CC=C(Br)S1 DY447413 [0,0,0,0,1,0|3,0,0]=4 384 B9R1.33 CC1=C(CCO)SC=N1 NO19563 [0,0,0,0,1,0|3,0,0]=4 385 B9R1.33 CC1=CN=CN1CCN DY725977 [0,0,0,0,1,0|2,0,0]=3 386 B9R1.33 CC1=NC=CN1CCBr DY610893 [0,0,0,0,1,0|3,0,0]=4 387 B9R1.33 CN1C=CC=C1CCO DY106498 [0,0,0,0,1,0|2,0,0]=3 388 B9R1.33 CN1C=CN=C1CCO DY606807 [0,0,0,0,1,0|3,0,0]=4 389 B9R1.33 CN1C=CN=C1CNN DY725419 [0,0,0,0,1,0|3,0,0]=4 390 B8R1.2 BrCC1=CC=NC=C1 NO22459 [2,0,0,0,0,0|2,0,0]=4 391 B8R1.2 C#CC1=CC=CC=C1 NO19127 [2,0,0,0,0,0|0,0,2]=4 392 B8R1.2 CCC1=CC=CN=C1 NO22277 [2,0,0,0,0,0|1,0,0]=3 393 B8R1.2 CCC1=NC=CN=C1 NO21534 [2,0,0,0,0,0|2,0,0]=4 394 B8R1.2 CNC1=CC=CC=C1 NO11792 [2,0,0,0,0,0|1,0,0]=3 395 B8R1.2 CNC1=CC=CN=C1 NO13856 [2,0,0,0,0,0|2,0,0]=4 396 B8R1.2 COC1=CC=CN=C1 NO22348 [2,0,0,0,0,0|2,0,0]=4 397 B8R1.2 COC1=CC=NC=C1 NO19206 [2,0,0,0,0,0|2,0,0]=4 398 B8R1.2 COC1=CC=[C-]C=C1 DY747109 [2,0,0,0,0,0|1,0,1]=4 399 B8R1.2 COC1=NC=CC=C1 NO18780 [2,0,0,0,0,0|2,0,0]=4 400 B8R1.2 ClCC1=CC=CN=C1 NO19291 [2,0,0,0,0,0|2,0,0]=4 401 B8R1.2 ClCC1=NC=CC=C1 NO19289 [2,0,0,0,0,0|2,0,0]=4 402 B8R1.2 ClSC1=CC=CC=C1 DY799077 [2,0,0,0,0,0|2,0,0]=4 403 B8R1.2 ICC1=CC=CC=C1 NO11000 [2,0,0,0,0,0|1,0,0]=3 404 B8R1.2 N#Cc1ccccc1 NO13696 [2,0,0,0,0,0|0,0,2]=4 405 B8R1.2 NCC1=CC=CN=C1 NO14226 [2,0,0,0,0,0|1,0,0]=3 406 B8R1.2 NCC1=CC=NC=C1 NO11906 [2,0,0,0,0,0|1,0,0]=3 407 B8R1.2 NCC1=CC=NC=C1 NO19023 [2,0,0,0,0,0|1,0,0]=3 408 B8R1.2 NCC1=CN=NC=C1 NO15014 [2,0,0,0,0,0|2,0,0]=4 409 B8R1.2 NCC1=CN=NC=C1 NO15515 [2,0,0,0,0,0|2,0,0]=4 410 B8R1.2 NCC1=NC=CC=C1 DY663911 [2,0,0,0,0,0|1,0,0]=3 411 B8R1.2 NCC1=NC=CC=N1 NO21304 [2,0,0,0,0,0|2,0,0]=4 412 B8R1.2 NCC1=NC=CN=C1 DY710323 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.2 NCC1=NC=CN=C1 NO19691 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.2 NCC1=NC=CN=C1 NO20245 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.2 NNC1=CC=CC=C1 NO15210 [2,0,0,0,0,0|1,0,0]=3 416 B8R1.2 NNC1=CC=CN=C1 NO15491 [2,0,0,0,0,0|2,0,0]=4 417 B8R1.2 NNC1=CC=CN=C1 NO22308 [2,0,0,0,0,0|2,0,0]=4 418 B8R1.2 NNC1=CC=NC=C1 DY20777 [2,0,0,0,0,0|2,0,0]=4 419 B8R1.2 NNC1=NC=CC=C1 NO15589 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.2 NNC1=NC=CC=C1 NO21573 [2,0,0,0,0,0|2,0,0]=4 421 B8R1.2 OCC1=CC=CN=C1 NO22409 [2,0,0,0,0,0|2,0,0]=4 422 B8R1.2 OCC1=CC=NC=C1 NO19163 [2,0,0,0,0,0|2,0,0]=4 423 B8R1.2 OCC1=NC=CC=C1 NO19164 [2,0,0,0,0,0|2,0,0]=4 424 B8R1.4 BrC1=CC(I)=CC=C1 DY433479 [2,0,0,0,0,0|2,0,0]=4 425 B8R1.4 BrC1=CC=CC(Br)=C1 NO19814 [2,0,0,0,0,0|2,0,0]=4 426 B8R1.4 CC1=CC(C)=NC=N1 NO19849 [2,0,0,0,0,0|2,0,0]=4 427 B8R1.4 CC1=CC(Cl)=NC=C1 NO23009 [2,0,0,0,0,0|2,0,0]=4 428 B8R1.4 CC1=CC(F)=NC=C1 NO21868 [2,0,0,0,0,0|2,0,0]=4 429 B8R1.4 CC1=CC(N)=NC=C1 NO15630 [2,0,0,0,0,0|1,0,0]=3 430 B8R1.4 CC1=CC(N)=NC=N1 NO12473 [2,0,0,0,0,0|2,0,0]=4 431 B8R1.4 CC1=CC(O)=NC=C1 NO23034 [2,0,0,0,0,0|2,0,0]=4 432 B8R1.4 CC1=CC=CC(Br)=C1 NO19957 [2,0,0,0,0,0|1,0,0]=3 433 B8R1.4 CC1=CC=CC(Br)=N1 NO21841 [2,0,0,0,0,0|2,0,0]=4 434 B8R1.4 CC1=CC=CC(C)=N1 NO18597 [2,0,0,0,0,0|1,0,0]=3 435 B8R1.4 CC1=CC=CC(Cl)=N1 NO23010 [2,0,0,0,0,0|2,0,0]=4 436 B8R1.4 CC1=CC=CC(F)=C1 NO19910 [2,0,0,0,0,0|1,0,0]=3 437 B8R1.4 CC1=CC=CC(F)=N1 NO19330 [2,0,0,0,0,0|2,0,0]=4 438 B8R1.4 CC1=CC=CC(I)=C1 NO19968 [2,0,0,0,0,0|1,0,0]=3 439 B8R1.4 CC1=CC=CC(N)=C1 NO11698 [2,0,0,0,0,0|0,0,0]=2 440 B8R1.4 CC1=CC=CC(N)=N1 NO18078 [2,0,0,0,0,0|1,0,0]=3 441 B8R1.4 CC1=CN=CC(C)=C1 DY714404 [2,0,0,0,0,0|1,0,0]=3 442 B8R1.4 CC1=CN=CC(Cl)=C1 NO13884 [2,0,0,0,0,0|2,0,0]=4 443 B8R1.4 CC1=CN=CC(F)=C1 NO19335 [2,0,0,0,0,0|2,0,0]=4 444 B8R1.4 CC1=CN=CC(N)=C1 NO14172 [2,0,0,0,0,0|1,0,0]=3 445 B8R1.4 CC1=CN=CC(O)=C1 NO14332 [2,0,0,0,0,0|2,0,0]=4 446 B8R1.4 CC1=NC=CC(Br)=C1 DY658195 [2,0,0,0,0,0|2,0,0]=4 447 B8R1.4 CC1=NC=CC(Br)=C1 NO13967 [2,0,0,0,0,0|2,0,0]=4 448 B8R1.4 CC1=NC=CC(Cl)=C1 NO14214 [2,0,0,0,0,0|2,0,0]=4 449 B8R1.4 CC1=NC=CC(F)=C1 NO15882 [2,0,0,0,0,0|2,0,0]=4 450 B8R1.4 CC1=NC=CC(I)=C1 NO22899 [2,0,0,0,0,0|2,0,0]=4 451 B8R1.4 CC1=NC=CC(N)=C1 NO19520 [2,0,0,0,0,0|1,0,0]=3 452 B8R1.4 CC1=NC=CC(N)=N1 DY693586 [2,0,0,0,0,0|2,0,0]=4 453 B8R1.4 CC1=NC=CC(N)=N1 NO13322 [2,0,0,0,0,0|2,0,0]=4 454 B8R1.4 CC1=NC=CC(O)=C1 NO22867 [2,0,0,0,0,0|2,0,0]=4 455 B8R1.4 ClC1=CC(I)=CC=C1 NO20663 [2,0,0,0,0,0|2,0,0]=4 456 B8R1.4 ClC1=CC=CC(Br)=C1 NO22170 [2,0,0,0,0,0|2,0,0]=4 457 B8R1.4 FC1=CC(I)=CC=C1 NO18882 [2,0,0,0,0,0|2,0,0]=4 458 B8R1.4 FC1=CC=CC(S)=C1 DY20298 [2,0,0,0,0,0|2,0,0]=4 459 B8R1.4 IC1=CC=CC(I)=C1 DY433521 [2,0,0,0,0,0|2,0,0]=4 460 B8R1.4 NC1=CC(Br)=CC=C1 NO19169 [2,0,0,0,0,0|1,0,0]=3 461 B8R1.4 NC1=CC(Br)=CN=C1 NO22730 [2,0,0,0,0,0|2,0,0]=4 462 B8R1.4 NC1=CC(Br)=NC=C1 NO21962 [2,0,0,0,0,0|2,0,0]=4 463 B8R1.4 NC1=CC(Cl)=CC=C1 NO22234 [2,0,0,0,0,0|1,0,0]=3 464 B8R1.4 NC1=CC(Cl)=CN=C1 DY31090 [2,0,0,0,0,0|2,0,0]=4 465 B8R1.4 NC1=CC(Cl)=NC=C1 NO21964 [2,0,0,0,0,0|2,0,0]=4 466 B8R1.4 NC1=CC(F)=CC=C1 NO19913 [2,0,0,0,0,0|1,0,0]=3 467 B8R1.4 NC1=CC(F)=CN=C1 NO13934 [2,0,0,0,0,0|2,0,0]=4 468 B8R1.4 NC1=CC(I)=CC=C1 NO19215 [2,0,0,0,0,0|1,0,0]=3 469 B8R1.4 NC1=CC(N)=NC=C1 NO11909 [2,0,0,0,0,0|2,0,0]=4 470 B8R1.4 NC1=CC(O)=NC=C1 NO18280 [2,0,0,0,0,0|2,0,0]=4 471 B8R1.4 NC1=CC=CC(=O)N1 NO22760 [2,0,0,0,0,0|2,0,0]=4 472 B8R1.4 NC1=CC=CC(N)=N1 NO13686 [2,0,0,0,0,0|2,0,0]=4 473 B8R1.4 NC1=CN=CC(N)=C1 NO21958 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.4 NC1=CN=CC(O)=C1 NO12372 [2,0,0,0,0,0|2,0,0]=4 475 B8R1.4 NC1=CN=CC(O)=C1 NO22080 [2,0,0,0,0,0|2,0,0]=4 476 B8R1.4 NC1=NC(Br)=CC=C1 NO17641 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.4 NC1=NC(Cl)=CC=C1 NO17675 [2,0,0,0,0,0|2,0,0]=4 478 B8R1.4 NC1=NC(F)=CC=C1 NO17727 [2,0,0,0,0,0|2,0,0]=4 479 B8R1.4 NC1=NC=CC(Br)=C1 NO16114 [2,0,0,0,0,0|2,0,0]=4 480 B8R1.4 NC1=NC=CC(Cl)=C1 NO17669 [2,0,0,0,0,0|2,0,0]=4 481 B8R1.4 NC1=NC=CC(F)=C1 NO21251 [2,0,0,0,0,0|2,0,0]=4 482 B8R1.4 NC1=NC=CC(O)=C1 NO14161 [2,0,0,0,0,0|2,0,0]=4 483 B8R1.4 OC1=CC(Br)=CC=C1 NO15169 [2,0,0,0,0,0|2,0,0]=4 484 B8R1.4 OC1=CC(F)=CC=C1 NO19021 [2,0,0,0,0,0|2,0,0]=4 485 B8R1.4 OC1=CC(I)=CC=C1 NO19969 [2,0,0,0,0,0|2,0,0]=4 486 B8R1.4 SC1=CC(Br)=CC=C1 DY564537 [2,0,0,0,0,0|2,0,0]=4 487 B10R1.2 CC1=C(Br)C=CC=C1CBr DY584771 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.2 CC1=C(CBr)C=CC=C1I DY584958 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.2 CC1=C(CN)C=CC=C1Br DY769683 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.2 CC1=C(CO)C=CC=C1Cl DY452962 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.2 CC1=C(CO)C=CC=C1I DY584812 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.2 CC1=C(CO)C=CC=C1N DY584258 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.2 CC1=CC=CC(C#N)=C1Br DY585081 [1,1,0,0,0,0|0,0,2]=4 494 B10R1.2 CC1=CC=CC(C#N)=C1C NO11027 [1,1,0,0,0,0|0,0,2]=4 495 B10R1.2 CC1=CC=CC(C#N)=C1Cl DY20252 [1,1,0,0,0,0|0,0,2]=4 496 B10R1.2 CC1=CC=CC(C#N)=C1F NO10735 [1,1,0,0,0,0|0,0,2]=4 497 B10R1.2 CC1=CC=CC(C=O)=C1Br DY505752 [1,1,0,0,0,0|1,0,1]=4 498 B10R1.2 CC1=CC=CC(C=O)=C1C NO10889 [1,1,0,0,0,0|1,0,1]=4 499 B10R1.2 CC1=CC=CC(C=O)=C1F DY20031 [1,1,0,0,0,0|1,0,1]=4 500 B10R1.2 CC1=CC=CC(C=O)=C1O NO20930 [1,1,0,0,0,0|1,0,1]=4 501 B10R1.2 CC1=CC=CC(CBr)=C1Br DY584774 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.2 CC1=CC=CC(CBr)=C1C NO10894 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.2 CC1=CC=CC(CN)=C1Cl DY584892 [1,1,0,0,0,0|0,0,0]=2 504 B10R1.2 CC1=CC=CC(CN)=C1F DY585032 [1,1,0,0,0,0|0,0,0]=2 505 B10R1.2 CC1=CC=CC(CO)=C1C NO20113 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.2 CC1=CC=CC(CO)=C1F DY451600 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.2 CCC1=C(O)C(C)=CC=C1 DY584282 [1,1,0,0,0,0|0,0,0]=2 508 B10R1.2 COC1=C(Br)C(C)=CC=C1 DY584924 [1,1,0,0,0,0|1,0,0]=3 509 B10R1.2 COC1=C(C)C(C)=CC=C1 DY20206 [1,1,0,0,0,0|1,0,0]=3 510 B10R1.2 COC1=C(Cl)C(C)=CC=C1 DY822113 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.2 COC1=C(F)C(Br)=CC=C1 DY20208 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.2 COC1=C(F)C(Cl)=CC=C1 DY450850 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.2 COC1=C(N)C(N)=CC=C1 NO12559 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.2 COC1=CC=CC(Br)=C1C DY442371 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.2 COC1=CC=CC(Br)=C1I NO14393 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.2 COC1=CC=CC(Br)=C1O DY442834 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.2 COC1=CC=CC(Cl)=C1N NO16113 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.2 COC1=CC=CC(N)=C1Br NO21335 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.2 COC1=CC=CC(N)=C1C NO10556 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.2 COC1=CC=CC(N)=C1Cl NO18618 [1,1,0,0,0,0|2,0,0]=4 521 B10R1.2 COC1=CC=CC(N)=C1F NO12736 [1,1,0,0,0,0|2,0,0]=4 522 B10R1.2 COC1=CC=CC(N)=C1O NO17187 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.2 COC1=CC=CC(O)=C1Cl NO21434 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.2 COC1=CC=CC(O)=C1N NO16742 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 DY20573 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.2 CSC1=C(F)C(Br)=CC=C1 DY451930 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.2 CSC1=CC=CC(O)=C1F DY451822 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.2 ClC1=C(CBr)C=CC=C1Br DY585014 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.2 ClC1=CC=CC(CBr)=C1Cl NO19151 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.2 FC1=C(CBr)C=CC=C1Cl NO19361 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.2 FC1=C(Cl)C=CC=C1CCl DY584895 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.2 FC1=CC=CC(CBr)=C1Cl NO19380 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.2 FC1=CC=CC(CBr)=C1F NO18619 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.2 NC1=C(CO)C=CC=C1Br DY552981 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.2 NC1=C(CO)C=CC=C1Cl NO14362 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.2 NC1=CC=CC(CO)=C1Cl DY586503 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.2 NC1=CC=CC(CO)=C1F NO12522 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.2 NCC1=C(Br)C(F)=CC=C1 DY686413 [1,1,0,0,0,0|1,0,0]=3 539 B10R1.2 NCC1=C(F)C(Cl)=CC=C1 DY33194 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.2 NNC1=C(Br)C(Cl)=CC=C1 DY584586 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.2 NNC1=C(Cl)C(Cl)=CC=C1 DY541383 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.8 CC1=CC(C#N)=CC(Br)=C1 NO22163 [1,1,0,0,0,0|0,0,2]=4 543 B10R1.8 CC1=CC(C#N)=CC(Cl)=C1 DY584883 [1,1,0,0,0,0|0,0,2]=4 544 B10R1.8 CC1=CC(C#N)=CC(F)=C1 NO10740 [1,1,0,0,0,0|0,0,2]=4 545 B10R1.8 CC1=CC(C#N)=CC(O)=C1 NO15368 [1,1,0,0,0,0|0,0,2]=4 546 B10R1.8 CC1=CC(C)=CC(C#N)=C1 NO11028 [1,1,0,0,0,0|0,0,2]=4 547 B10R1.8 CC1=CC(C)=CC(C=O)=C1 NO21068 [1,1,0,0,0,0|1,0,1]=4 548 B10R1.8 CC1=CC(C)=CC(CBr)=C1 NO18923 [1,1,0,0,0,0|1,0,0]=3 549 B10R1.8 CC1=CC(C)=CC(NN)=C1 NO10557 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.8 CC1=CC(C=O)=CC(Br)=C1 NO12662 [1,1,0,0,0,0|1,0,1]=4 551 B10R1.8 CC1=CC(C=O)=CC(Cl)=C1 DY20818 [1,1,0,0,0,0|1,0,1]=4 552 B10R1.8 CC1=CC(C=O)=CC(F)=C1 NO10961 [1,1,0,0,0,0|1,0,1]=4 553 B10R1.8 CC1=CC(C=O)=CC(O)=C1 NO15684 [1,1,0,0,0,0|1,0,1]=4 554 B10R1.8 CC1=CC(CBr)=CC(Br)=C1 DY584778 [1,1,0,0,0,0|1,0,0]=3 555 B10R1.8 CC1=CC(CCl)=CC(C)=N1 DY657901 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.8 CC1=CC(CCl)=CC(C)=N1 DY712093 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.8 CC1=CC(CCl)=NC(C)=C1 NO17890 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.8 CC1=CC(CO)=CC(C)=N1 NO20117 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.8 CC1=CC(CO)=CC(Cl)=C1 DY451882 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.8 CC1=CC(CO)=CC(I)=C1 DY747043 [1,1,0,0,0,0|1,0,0]=3 561 B10R1.8 CC1=CC(NN)=NC(C)=C1 DY655831 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.8 CCC1=CC(F)=CC(F)=C1 NO20675 [1,1,0,0,0,0|1,0,0]=3 563 B10R1.8 CCC1=CC(N)=CC(Br)=C1 NO12529 [1,1,0,0,0,0|1,0,0]=3 564 B10R1.8 CCC1=NC(Cl)=NC(C)=C1 DY693334 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.8 COC1=CC(=O)OC(C)=C1 DY566517 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.8 COC1=CC(Br)=CC(Br)=C1 NO10386 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.8 COC1=CC(Br)=CC(Cl)=C1 NO12661 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.8 COC1=CC(Br)=CC(F)=C1 NO10395 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.8 COC1=CC(C)=CC(Br)=C1 NO20982 [1,1,0,0,0,0|1,0,0]=3 570 B10R1.8 COC1=CC(C)=CC(N)=C1 NO13172 [1,1,0,0,0,0|1,0,0]=3 571 B10R1.8 COC1=CC(Cl)=CC(Cl)=C1 DY20180 [1,1,0,0,0,0|2,0,0]=4 572 B10R1.8 COC1=CC(Cl)=NC(C)=C1 DY512931 [1,1,0,0,0,0|2,0,0]=4 573 B10R1.8 COC1=CC(F)=CC(F)=C1 DY20076 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.8 COC1=CC(N)=CC(Br)=C1 DY40874 [1,1,0,0,0,0|2,0,0]=4 575 B10R1.8 COC1=CC(N)=CC(F)=C1 NO12734 [1,1,0,0,0,0|2,0,0]=4 576 B10R1.8 COC1=CC(N)=CC(N)=C1 DY686929 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.8 COC1=CC(O)=CC(Cl)=C1 NO22226 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.8 COC1=CC(O)=CC(F)=C1 NO14749 [1,1,0,0,0,0|2,0,0]=4 579 B10R1.8 COC1=CC(O)=CC(I)=C1 DY430212 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.8 COC1=CC(O)=CC(O)=C1 DY541089 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.8 COC1=NC(C)=CC(Br)=C1 DY711373 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.8 COC1=NC(C)=CC(Cl)=C1 DY658371 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.8 FC1=CC(CBr)=CC(Cl)=C1 DY40531 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.8 FC1=CC(F)=CC(CBr)=C1 NO18723 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.8 FC1=CC(F)=CC(CCl)=C1 DY584373 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.8 NCC1=CC(Cl)=CC(Cl)=C1 NO19043 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.8 NCC1=CC(Cl)=CC(F)=C1 DY33218 [1,1,0,0,0,0|1,0,0]=3 588 B10R1.8 NCC1=CC(Cl)=NC(Cl)=C1 NO21172 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.8 NCC1=NC(Cl)=CC(Br)=C1 DY431845 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.8 NNC1=CC(Cl)=CC(Cl)=C1 NO19276 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.8 NNC1=CC(F)=CC(F)=C1 DY40995 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.8 OCC1=CC(Br)=CC(F)=C1 NO22159 [1,1,0,0,0,0|2,0,0]=4 593 B10R1.8 OCC1=CC(Br)=CC(I)=C1 DY107686 [1,1,0,0,0,0|2,0,0]=4 594 B10R1.8 OCC1=CC(Cl)=CC(Cl)=C1 NO20191 [1,1,0,0,0,0|2,0,0]=4 595 B10R1.30 BrCC1=C(Br)C=CC(I)=C1 DY584787 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 DY584786 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.30 CC1=C(CCl)C=C(F)C=C1 DY584262 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.30 CC1=C(CO)C=C(F)C=C1 DY452638 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.30 CC1=CC(C#N)=C(Cl)C=C1 NO21470 [1,1,0,0,0,0|0,0,2]=4 600 B10R1.30 CC1=CC(C#N)=C(F)C=C1 NO10737 [1,1,0,0,0,0|0,0,2]=4 601 B10R1.30 CC1=CC(C=O)=C(Br)C=C1 NO13222 [1,1,0,0,0,0|1,0,1]=4 602 B10R1.30 CC1=CC(CBr)=C(C)C=C1 DY584839 [1,1,0,0,0,0|1,0,0]=3 603 B10R1.30 CC1=CC(CN)=C(C)C=C1 DY20405 [1,1,0,0,0,0|0,0,0]=2 604 B10R1.30 CC1=CC(CO)=C(F)C=C1 DY450466 [1,1,0,0,0,0|1,0,0]=3 605 B10R1.30 CC1=CC(NN)=C(C)C=C1 NO20501 [1,1,0,0,0,0|1,0,0]=3 606 B10R1.30 CC1=CN=C(Cl)C(CCl)=C1 DY655318 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.30 CC1=NC=C(Br)C=C1CN DY656602 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.30 CCC1=NC(C)=CC=C1O NO13984 [1,1,0,0,0,0|1,0,0]=3 609 B10R1.30 CCC1=NC(C)=CN=C1C DY710767 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.30 CNC1=CC(Br)=CC=C1N NO13254 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.30 COC1=C(Br)C=CC(Br)=C1 NO12737 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.30 COC1=C(Br)C=CC(C)=C1 DY20209 [1,1,0,0,0,0|1,0,0]=3 613 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 NO21371 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.30 COC1=C(Br)C=CC(F)=C1 NO10394 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.30 COC1=C(Br)C=CC(N)=C1 NO18102 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.30 COC1=C(Cl)C=CC(C)=C1 DY456622 [1,1,0,0,0,0|1,0,0]=3 617 B10R1.30 COC1=C(Cl)C=CC(I)=C1 DY20290 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.30 COC1=C(Cl)C=CC(N)=C1 NO22759 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.30 COC1=C(F)C=CC(Br)=C1 NO19804 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.30 COC1=C(F)C=CC(I)=C1 DY571347 [1,1,0,0,0,0|2,0,0]=4 621 B10R1.30 COC1=C(F)C=CC(N)=C1 NO10516 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.30 COC1=C(I)C=CC(Cl)=C1 DY20291 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.30 COC1=C(N)C=CC(Br)=C1 NO19178 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.30 COC1=C(N)C=CC(F)=C1 NO12096 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.30 COC1=C(N)C=CC(I)=C1 DY21014 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.30 COC1=C(N)C=CC(N)=C1 NO21132 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.30 COC1=C(O)C=CC(Br)=C1 NO22682 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.30 COC1=C(O)C=CC(C)=C1 NO16322 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.30 COC1=CC(C)=CN=C1O DY657387 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.30 COC1=NC(C)=CC=C1Br NO19284 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.30 CSC1=C(Br)C=CC(Br)=C1 DY453532 [1,1,0,0,0,0|2,0,0]=4 632 B10R1.30 CSC1=C(Br)C=CC(F)=C1 DY525105 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.30 CSC1=C(C)C=CC(Br)=C1 DY452878 [1,1,0,0,0,0|2,0,0]=4 634 B10R1.30 ClC1=C(CBr)C=C(I)C=C1 DY433851 [1,1,0,0,0,0|2,0,0]=4 635 B10R1.30 ClC1=CC(CBr)=C(Cl)C=C1 DY40541 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 NO16839 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.30 FC1=CC(CBr)=C(Br)C=C1 DY20074 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.30 NC1=C(CO)C=C(Br)C=C1 NO20119 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.30 NCC1=C(Br)C=CC(F)=C1 DY792813 [1,1,0,0,0,0|1,0,0]=3 640 B10R1.30 NCC1=C(Cl)C=CC(Br)=C1 NO12614 [1,1,0,0,0,0|1,0,0]=3 641 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 DY584885 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.30 NCC1=C(F)C=CC(Br)=C1 DY40802 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 NO20282 [1,1,0,0,0,0|1,0,0]=3 644 B10R1.30 NCC1=C(N)C=CC(Br)=C1 NO17921 [1,1,0,0,0,0|1,0,0]=3 645 B10R1.30 NCC1=C(O)C=CC(Br)=C1 NO18138 [1,1,0,0,0,0|1,0,0]=3 646 B10R1.30 NCC1=CC(Br)=NC=C1F DY650797 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.30 NCC1=NC(Cl)=CC=C1Br DY651043 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.30 NCC1=NC(Cl)=CC=C1Cl DY651001 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.30 NNC1=C(Br)C=CC(Br)=C1 NO16988 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.30 NNC1=C(Br)C=CC(F)=C1 DY40989 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.30 NNC1=C(F)C=CC(F)=C1 NO23013 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.30 OCC1=C(Br)C=CC(F)=C1 NO13914 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.30 OCC1=C(Cl)C=CC(F)=C1 NO21464 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.30 OCC1=C(I)C=CC(Br)=C1 DY537399 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.30 OCC1=CC(Br)=CC=C1O NO20280 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 NO18865 [1,1,0,0,0,0|1,0,1]=4 657 B10R1.113 CC(=O)C1=CC(C)=CN=C1 NO16656 [1,1,0,0,0,0|1,0,1]=4 658 B10R1.113 CC(=O)C1=CC(C)=NC=C1 NO18206 [1,1,0,0,0,0|1,0,1]=4 659 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 NO19798 [1,1,0,0,0,0|1,0,1]=4 660 B10R1.113 CC(=O)C1=CC(F)=CC=C1 NO19067 [1,1,0,0,0,0|1,0,1]=4 661 B10R1.113 CC(=O)C1=CC(N)=CC=C1 NO19441 [1,1,0,0,0,0|1,0,1]=4 662 B10R1.113 CC(=O)C1=CC(O)=CC=C1 NO18681 [1,1,0,0,0,0|1,0,1]=4 663 B10R1.113 CC(=O)C1=CC=CC(C)=C1 NO19159 [1,1,0,0,0,0|0,0,1]=3 664 B10R1.113 CC(=O)C1=NC(C)=CC=C1 NO18426 [1,1,0,0,0,0|1,0,1]=4 665 B10R1.113 CC(=O)C1=NC=CC(C)=C1 DY460044 [1,1,0,0,0,0|1,0,1]=4 666 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 DY454324 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.113 CC(C)C1=NC=CC(Br)=C1 DY579081 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.113 CC(N)C1=CC(Br)=CC=C1 DY447729 [1,1,0,0,0,0|1,0,0]=3 669 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 DY797607 [1,1,0,0,0,0|1,0,0]=3 670 B10R1.113 CC(O)C1=CC(N)=CC=C1 NO21787 [1,1,0,0,0,0|1,0,0]=3 671 B10R1.113 CC(O)C1=NC(Br)=CC=C1 NO14015 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.113 CC1=CC(B(O)O)=CC=C1 NO10529 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.113 CC1=CC(C(C)N)=NC=C1 DY561633 [1,1,0,0,0,0|1,0,0]=3 674 B10R1.113 CC1=CC(C(C)N)=NC=C1 DY605899 [1,1,0,0,0,0|1,0,0]=3 675 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 NO17345 [1,1,0,0,0,0|0,0,0]=2 676 B10R1.113 CC1=CC=CC(C(=N)N)=C1 NO20438 [1,1,0,0,0,0|0,0,1]=3 677 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 DY20748 [1,1,0,0,0,0|1,0,1]=4 678 B10R1.113 CC1=CC=CC(C(=O)O)=C1 NO19799 [1,1,0,0,0,0|1,0,1]=4 679 B10R1.113 CC1=CC=CC(C(N)=O)=N1 DY661291 [1,1,0,0,0,0|1,0,1]=4 680 B10R1.113 CC1=CC=CC([C@@H](C)N)=N1 DY511947 [1,1,0,0,0,0|1,0,0]=3 681 B10R1.113 CC1=NC(C(F)F)=CC=C1 DY503073 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.113 CC1=NC=CC(C(C)N)=C1 DY110560 [1,1,0,0,0,0|1,0,0]=3 683 B10R1.113 CN(C)C1=CC(N)=CC=C1 DY550845 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.113 CN(C)C1=CC(N)=CC=C1 DY584521 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.113 C[C@@H](N)C1=CC(F)=CC=C1 NO19312 [1,1,0,0,0,0|1,0,0]=3 686 B10R1.113 C[C@@H](N)C1=CC(F)=CN=C1 DY106300 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.113 C[C@@H](N)C1=CC(F)=CN=C1 DY621603 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.113 C[C@@H](N)C1=CC(F)=NC=C1 DY621477 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.113 C[C@@H](N)C1=CC=CC(O)=C1 DY558015 [1,1,0,0,0,0|1,0,0]=3 690 B10R1.113 C[C@@H](N)C1=NC(F)=CC=C1 DY716816 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.113 C[C@H](N)C1=CC(F)=CC=C1 NO19671 [1,1,0,0,0,0|1,0,0]=3 692 B10R1.113 C[C@H](N)C1=CC(F)=NC=C1 DY623626 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.113 FC(F)C1=CC(I)=CC=C1 DY584299 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.113 N=C(N)C1=CC(Cl)=CC=C1 DY746971 [1,1,0,0,0,0|1,0,1]=4 695 B10R1.113 N=C(N)C1=CC(F)=CC=C1 DY603586 [1,1,0,0,0,0|1,0,1]=4 696 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 NO22167 [1,1,0,0,0,0|1,0,1]=4 697 B10R1.172 C=CC1=CC=CC(CCl)=C1 DY822035 [1,1,0,0,0,0|0,0,2]=4 698 B10R1.172 CCC1=CC=CC(C=O)=C1 NO11688 [1,1,0,0,0,0|0,0,1]=3 699 B10R1.172 CCC1=NC(CC)=NC=C1 DY692656 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.172 CNC1=NC=CC(OC)=C1 DY714716 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.172 COC1=CC(CCl)=NC=C1 DY564207 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.172 COC1=CC(CN)=NC=C1 NO12102 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.172 COC1=CC(OC)=NC=C1 NO18092 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.172 COC1=CC=CC(C=O)=C1 NO19170 [1,1,0,0,0,0|1,0,1]=4 705 B10R1.172 COC1=CC=CC(CBr)=C1 DY576513 [1,1,0,0,0,0|1,0,0]=3 706 B10R1.172 COC1=CC=CC(CCl)=C1 DY10324 [1,1,0,0,0,0|1,0,0]=3 707 B10R1.172 COC1=CC=CC(CCl)=N1 NO16831 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.172 COC1=CC=CC(CN)=C1 NO19097 [1,1,0,0,0,0|0,0,0]=2 709 B10R1.172 COC1=CC=CC(CO)=C1 NO19269 [1,1,0,0,0,0|1,0,0]=3 710 B10R1.172 COC1=CC=CC(NN)=C1 NO19580 [1,1,0,0,0,0|1,0,0]=3 711 B10R1.172 COC1=CC=CC(NN)=N1 DY655837 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.172 COC1=CC=CC(OC)=C1 NO19845 [1,1,0,0,0,0|1,0,0]=3 713 B10R1.172 COC1=CN=CC(OC)=C1 NO17332 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.172 COC1=NC=CC(CN)=C1 NO16830 [1,1,0,0,0,0|1,0,0]=3 715 B10R1.172 COC1=NC=CC(CO)=C1 NO12823 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.172 ClCC1=CC=CC(CCl)=C1 DY20408 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.172 ClCC1=CC=CC(CCl)=N1 DY10384 [1,1,0,0,0,0|2,0,0]=4 718 B10R1.172 N#CC1=CC(CO)=CC=C1 NO22259 [1,1,0,0,0,0|0,0,2]=4 719 B10R1.172 N#CC1=CC(NN)=CC=C1 NO18806 [1,1,0,0,0,0|1,0,1]=4 720 B10R1.172 N#CC1=CC=CC(NN)=C1 DY20412 [1,1,0,0,0,0|1,0,1]=4 721 B10R1.172 N#CC1=NC(CN)=CC=C1 DY660549 [1,1,0,0,0,0|1,0,1]=4 722 B10R1.172 N#CC1=NC=CC(CN)=C1 DY657864 [1,1,0,0,0,0|1,0,1]=4 723 B10R1.172 NCC1=CC(C=O)=CN=C1 DY33471 [1,1,0,0,0,0|1,0,1]=4 724 B10R1.172 NCC1=CC=CC(CN)=N1 DY550317 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.172 OCC1=CC(CBr)=CC=C1 NO10867 [1,1,0,0,0,0|1,0,0]=3 726 B10R1.172 OCC1=CC=CC(CO)=N1 DY10441 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.172 OCC1=CC=CC(CO)=N1 DY663941 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 NO16721 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.176 CC1=C(Br)C=CC(C#N)=C1 NO20685 [1,1,0,0,0,0|0,0,2]=4 730 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 NO22664 [1,1,0,0,0,0|1,0,1]=4 731 B10R1.176 CC1=C(Br)C=CC(CN)=C1 DY525519 [1,1,0,0,0,0|0,0,0]=2 732 B10R1.176 CC1=C(Br)N=CC(CN)=C1 DY651722 [1,1,0,0,0,0|1,0,0]=3 733 B10R1.176 CC1=C(C)C=C(CO)C=C1 DY40706 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.176 CC1=C(C)C=C(NN)C=C1 NO20502 [1,1,0,0,0,0|1,0,0]=3 735 B10R1.176 CC1=C(C)N=C(CN)C=C1 DY651451 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.176 CC1=C(Cl)C=CC(C#N)=C1 NO22761 [1,1,0,0,0,0|0,0,2]=4 737 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 DY433419 [1,1,0,0,0,0|1,0,1]=4 738 B10R1.176 CC1=C(Cl)N=CC(CO)=C1 NO16130 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.176 CC1=C(F)C=C(NN)C=C1 NO22289 [1,1,0,0,0,0|2,0,0]=4 740 B10R1.176 CC1=C(F)C=CC(C#N)=C1 NO10743 [1,1,0,0,0,0|0,0,2]=4 741 B10R1.176 CC1=C(N)C=CC(C#N)=C1 NO20915 [1,1,0,0,0,0|0,0,2]=4 742 B10R1.176 CC1=C(O)C=CC(C#N)=C1 NO17416 [1,1,0,0,0,0|0,0,2]=4 743 B10R1.176 CC1=C(O)C=CC(C=O)=C1 NO20934 [1,1,0,0,0,0|1,0,1]=4 744 B10R1.176 CC1=C(O)C=CC(CN)=C1 DY445599 [1,1,0,0,0,0|0,0,0]=2 745 B10R1.176 CC1=NC(CO)=CC=C1O DY660681 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.176 CCC1=CC(C)=C(I)C=C1 DY575811 [1,1,0,0,0,0|0,0,0]=2 747 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 DY432619 [1,1,0,0,0,0|1,0,0]=3 748 B10R1.176 CCC1=CC(O)=C(N)C=C1 NO16266 [1,1,0,0,0,0|1,0,0]=3 749 B10R1.176 CCC1=CN=C(C)C(C)=N1 NO21048 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.176 CN1C=C(CN)C=CC1=O DY103927 [1,1,0,0,0,0|1,0,0]=3 751 B10R1.176 CNC1=CC(F)=C(Br)C=C1 DY584691 [1,1,0,0,0,0|2,0,0]=4 752 B10R1.176 CNC1=CC(F)=C(F)C=C1 DY686725 [1,1,0,0,0,0|2,0,0]=4 753 B10R1.176 COC1=CC(Br)=C(Br)C=C1 DY442365 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.176 COC1=CC(Br)=C(C)C=C1 NO16376 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.176 COC1=CC(Br)=C(F)C=C1 NO15238 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.176 COC1=CC(Br)=C(N)C=C1 NO21359 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.176 COC1=CC(C)=C(N)C=C1 NO13421 [1,1,0,0,0,0|1,0,0]=3 758 B10R1.176 COC1=CC(C)=C(O)C=C1 NO15470 [1,1,0,0,0,0|1,0,0]=3 759 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 NO14601 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.176 COC1=CC(Cl)=C(N)C=C1 NO14656 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.176 COC1=CC(Cl)=C(O)C=C1 NO20293 [1,1,0,0,0,0|2,0,0]=4 762 B10R1.176 COC1=CC(F)=C(Br)C=C1 DY460476 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.176 COC1=CC(F)=C(Br)C=C1 NO10396 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.176 COC1=CC(F)=C(C)C=C1 NO10872 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.176 COC1=CC(I)=C(N)C=C1 DY20577 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.176 COC1=CC(N)=C(Br)C=C1 NO18386 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.176 COC1=CC(N)=C(C)C=C1 NO14868 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.176 COC1=CC(N)=C(Cl)C=C1 NO13990 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.176 COC1=CC(N)=C(F)C=C1 NO12726 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.176 COC1=CC(N)=C(I)C=C1 NO15023 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.176 COC1=CC(N)=C(O)C=C1 NO21254 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.176 COC1=CC(O)=C(Br)C=C1 NO21376 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.176 COC1=CC(O)=C(Cl)C=C1 DY442395 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.176 COC1=CC(O)=C(N)C=C1 NO21584 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.176 COC1=CC(S)=C(N)C=C1 DY797031 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.176 COC1=CC=C(Br)C(C)=N1 NO13578 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.176 COC1=CC=C(N)C(C)=N1 DY20014 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.176 COC1=CC=C(N)C(C)=N1 NO19107 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.176 COC1=CC=C(O)C(C)=N1 DY661236 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.176 COC1=NC=C(F)C(C)=C1 DY660038 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.176 CSC1=CC(F)=C(F)C=C1 DY452068 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.176 ClC1=C(Cl)C=C(CBr)C=C1 NO18826 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.176 FC1=C(Cl)C=C(CBr)C=C1 DY20082 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.176 FC1=C(Cl)C=CC(CBr)=C1 NO19666 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 DY40585 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.176 FC1=C(F)C=C(CCl)C=C1 DY433089 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.176 FC1=C(I)C=CC(CBr)=C1 DY584601 [1,1,0,0,0,0|2,0,0]=4 788 B10R1.176 NCC1=CC(Br)=C(F)C=C1 DY584425 [1,1,0,0,0,0|1,0,0]=3 789 B10R1.176 NCC1=CC(Br)=C(F)N=C1 DY651547 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.176 NCC1=NC(Cl)=C(Cl)C=C1 DY536751 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.176 NNC1=CC(Cl)=C(Cl)C=C1 NO19870 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.176 NNC1=CC(F)=C(Br)C=C1 DY542625 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.176 NNC1=CC(F)=C(F)C=C1 DY20003 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.176 NNC1=CC(F)=C(F)C=C1 DY610770 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.176 NNC1=CC(F)=C(F)C=C1 NO23015 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.176 OCC1=CC(Br)=C(O)C=C1 NO21356 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 NO18809 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.176 OCC1=CC(F)=C(Br)C=C1 NO20190 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.176 OCC1=CC(F)=C(Cl)C=C1 DY40694 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.176 OCC1=CC(F)=C(F)C=C1 NO19362 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.176 OCC1=CC(F)=C(I)C=C1 DY585015 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.176 OCC1=CC(I)=C(Br)C=C1 DY584846 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.176 OCC1=CC(O)=C(Br)C=C1 NO16027 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.1 BrCCC1=CC=C(Br)C=C1 DY531753 [1,1,0,0,0,0|1,0,0]=3 805 B10R1.1 CC1=CC=C(CC#N)C=C1 NO21709 [1,1,0,0,0,0|0,0,2]=4 806 B10R1.1 CC1=CC=C(CCBr)C=C1 NO19977 [1,1,0,0,0,0|1,0,0]=3 807 B10R1.1 CC1=CC=C(CCN)C=C1 NO18979 [1,1,0,0,0,0|0,0,0]=2 808 B10R1.1 CC1=CC=C(CNN)C=C1 NO20201 [1,1,0,0,0,0|1,0,0]=3 809 B10R1.1 CC1=CN=C(CCN)C=C1 DY654264 [1,1,0,0,0,0|1,0,0]=3 810 B10R1.1 CCCC1=CC=C(Br)C=C1 NO10896 [1,1,0,0,0,0|1,0,0]=3 811 B10R1.1 CCNC1=CC=C(C)C=C1 DY822062 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.1 CCNC1=CC=C(Cl)C=C1 DY745663 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.1 CCOC1=CC=C(I)C=C1 NO22907 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.1 CCOC1=CC=C(N)C=C1 NO11879 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.1 CCOC1=CC=C(O)C=C1 DY563859 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.1 CNCC1=CC=C(Br)C=C1 NO19272 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.1 CNCC1=CC=C(C)C=C1 NO11795 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.1 CNCC1=CC=C(Cl)C=C1 DY455886 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.1 CNCC1=CC=C(F)C=C1 DY585104 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.1 ClC1=CC=C(CCBr)C=C1 NO10835 [1,1,0,0,0,0|1,0,0]=3 821 B10R1.1 ClCCC1=CN=C(Cl)C=C1 DY714175 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.1 FC1=CC=C(CCBr)C=C1 NO10866 [1,1,0,0,0,0|1,0,0]=3 823 B10R1.1 FC1=CC=C(CCCl)C=C1 DY584346 [1,1,0,0,0,0|1,0,0]=3 824 B10R1.1 N#CCC1=CC=C(Br)C=C1 NO20687 [1,1,0,0,0,0|0,0,2]=4 825 B10R1.1 N#CCC1=CC=C(Cl)C=C1 DY20790 [1,1,0,0,0,0|0,0,2]=4 826 B10R1.1 N#CCC1=CC=C(F)C=C1 NO14479 [1,1,0,0,0,0|0,0,2]=4 827 B10R1.1 N#CCC1=CC=C(O)C=C1 DY522681 [1,1,0,0,0,0|0,0,2]=4 828 B10R1.1 NC1=CC=C(CCO)C=C1 NO13450 [1,1,0,0,0,0|1,0,0]=3 829 B10R1.1 NCCC1=CC=C(Br)C=C1 NO19296 [1,1,0,0,0,0|0,0,0]=2 830 B10R1.1 NCCC1=CC=C(F)C=C1 NO13766 [1,1,0,0,0,0|0,0,0]=2 831 B10R1.1 NNCC1=CC=C(Cl)C=C1 DY570291 [1,1,0,0,0,0|1,0,0]=3 832 B10R1.1 NNCC1=CC=C(Cl)C=C1 DY583979 [1,1,0,0,0,0|1,0,0]=3 833 B10R1.1 NNCC1=CC=C(F)C=C1 DY567861 [1,1,0,0,0,0|1,0,0]=3 834 B10R1.1 NNCC1=CC=C(F)C=C1 NO17057 [1,1,0,0,0,0|1,0,0]=3 835 B10R1.1 O=CCC1=CC=C(Br)C=C1 NO18203 [1,1,0,0,0,0|1,0,1]=4 836 B10R1.1 OCCC1=CC=C(Br)C=C1 NO14491 [1,1,0,0,0,0|1,0,0]=3 837 B10R1.1 OCCC1=CC=C(Cl)C=C1 NO22791 [1,1,0,0,0,0|1,0,0]=3 838 B10R1.1 OCCC1=CC=C(Cl)N=C1 DY509192 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.1 OCCC1=CC=C(O)C=C1 NO20458 [1,1,0,0,0,0|1,0,0]=3 840 B10R1.4 CC1=NC=CC=C1CCN DY653840 [1,1,0,0,0,0|1,0,0]=3 841 B10R1.4 CCOC1=C(Br)C=CC=C1 DY20149 [1,1,0,0,0,0|2,0,0]=4 842 B10R1.4 CCOC1=C(F)C=CC=C1 DY452620 [1,1,0,0,0,0|2,0,0]=4 843 B10R1.4 CNCC1=C(Br)C=CC=C1 DY455892 [1,1,0,0,0,0|2,0,0]=4 844 B10R1.4 N#CCC1=C(Br)C=CC=C1 NO10707 [1,1,0,0,0,0|0,0,2]=4 845 B10R1.4 N#CCC1=C(Cl)C=CC=C1 NO21495 [1,1,0,0,0,0|0,0,2]=4 846 B10R1.4 N#CCC1=C(F)C=CC=C1 NO20772 [1,1,0,0,0,0|0,0,2]=4 847 B10R1.4 N#CCC1=C(N)C=CC=C1 NO20914 [1,1,0,0,0,0|0,0,2]=4 848 B10R1.4 NCCC1=C(Br)C=CC=C1 NO15138 [1,1,0,0,0,0|0,0,0]=2 849 B10R1.4 NCCC1=C(F)C=CC=C1 NO14793 [1,1,0,0,0,0|0,0,0]=2 850 B10R1.4 NCCC1=C(N)C=CC=C1 DY584423 [1,1,0,0,0,0|0,0,0]=2 851 B10R1.4 NCCC1=C(N)C=CC=C1 NO15970 [1,1,0,0,0,0|0,0,0]=2 852 B10R1.4 NCCC1=CC=CN=C1Cl DY585655 [1,1,0,0,0,0|1,0,0]=3 853 B10R1.4 NNCC1=C(F)C=CC=C1 NO20134 [1,1,0,0,0,0|1,0,0]=3 854 B10R1.4 OCCC1=C(Br)C=CC=C1 NO21407 [1,1,0,0,0,0|1,0,0]=3 855 B10R1.4 OCCC1=C(I)C=CC=C1 DY545007 [1,1,0,0,0,0|1,0,0]=3 856 B10R1.15 C#CC(O)C1=CC=CC=C1 DY460116 [1,1,0,0,0,0|1,0,1]=4 857 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 DY565311 [1,1,0,0,0,0|1,0,1]=4 858 B10R1.15 C=C(CBr)C1=CC=CC=C1 NO20091 [1,1,0,0,0,0|1,0,1]=4 859 B10R1.15 CC(CN)C1=CC=CC=C1 DY822021 [1,1,0,0,0,0|0,0,0]=2 860 B10R1.15 CC(NN)C1=CC=CN=C1 DY656338 [1,1,0,0,0,0|2,0,0]=4 861 B10R1.15 CCC(C)C1=CC=CC=C1 NO11947 [1,1,0,0,0,0|1,0,0]=3 862 B10R1.15 CCC(O)C1=CC=CC=C1 DY580677 [1,1,0,0,0,0|1,0,0]=3 863 B10R1.15 CCS(=O)C1=CC=CC=C1 DY746839 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.15 CC[C@H](N)C1=CC=CC=C1 DY20337 [1,1,0,0,0,0|1,0,0]=3 865 B10R1.15 CC[C@H](N)C1=CC=NC=C1 DY623825 [1,1,0,0,0,0|2,0,0]=4 866 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 NO10909 [1,1,0,0,0,0|0,0,0]=2 867 B10R1.15 NC(CO)C1=CC=CC=C1 NO15860 [1,1,0,0,0,0|1,0,0]=3 868 B10R1.15 NC(CO)C1=CC=CN=C1 DY654840 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.15 NC(CO)C1=NC=CC=C1 DY111155 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.15 NC(CO)C1=NC=CC=C1 DY509906 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.15 NCC(=O)C1=CC=CC=C1 NO10874 [1,1,0,0,0,0|0,0,1]=3 872 B10R1.15 NC[C@H](O)C1=CC=CC=C1 NO20485 [1,1,0,0,0,0|0,0,0]=2 873 B10R1.15 NNC(=O)C1=CC=CC=C1 NO10971 [1,1,0,0,0,0|1,0,1]=4 874 B10R1.15 NNC(=S)C1=CC=CC=C1 DY721675 [1,1,0,0,0,0|1,0,1]=4 875 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 NO10553 [1,1,0,0,0,0|1,0,0]=3 876 B10R1.15 N[C@H](CO)C1=CC=CC=C1 NO10555 [1,1,0,0,0,0|1,0,0]=3 877 B10R1.15 N[C@H](CO)C1=NC=CC=C1 DY624391 [1,1,0,0,0,0|2,0,0]=4 878 B10R1.15 O=C(CBr)C1=CC=CC=C1 NO19274 [1,1,0,0,0,0|1,0,1]=4 879 B10R1.15 OC(CBr)C1=CC=CC=C1 NO18840 [1,1,0,0,0,0|1,0,0]=3 880 B10R1.15 OC[C@@H](O)c1ccccc1 DY459384 [1,1,0,0,0,0|1,0,0]=3 881 B10R1.15 O[C@@H](CBr)C1=CC=CC=C1 DY608146 [1,1,0,0,0,0|1,0,0]=3 882 B10R1.17 BrCCCC1=CC=CN=C1 DY604503 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.17 BrCCOC1=CC=CC=C1 DY20150 [1,1,0,0,0,0|1,0,0]=3 884 B10R1.17 CCCC[N+]1=CC=CC=C1 DY538095 [1,1,0,0,0,0|2,0,0]=4 885 B10R1.17 CCOCC1=CC=NC=C1 DY657931 [1,1,0,0,0,0|2,0,0]=4 886 B10R1.17 CNCCC1=CC=CC=N1 DY455430 [1,1,0,0,0,0|1,0,0]=3 887 B10R1.17 ClCCCC1=CC=CN=C1 DY656440 [1,1,0,0,0,0|2,0,0]=4 888 B10R1.17 ClC\C=C\C1=CC=CC=C1 DY41818 [1,1,0,0,0,0|1,0,1]=4 889 B10R1.17 ClC\C=C\C1=CC=CC=C1 DY539883 [1,1,0,0,0,0|1,0,1]=4 890 B10R1.17 N#C[Se]CC1=CC=CC=C1 DY822032 [1,1,0,0,0,0|0,0,2]=4 891 B10R1.17 NCCCC1=CC=NC=C1 DY425564 [1,1,0,0,0,0|1,0,0]=3 892 B10R1.17 NCCCC1=NC=CC=N1 DY737570 [1,1,0,0,0,0|2,0,0]=4 893 B10R1.17 NCCNC1=CC=NC=C1 DY657683 [1,1,0,0,0,0|1,0,0]=3 894 B10R1.17 NCCNC1=NC=CC=C1 NO11746 [1,1,0,0,0,0|1,0,0]=3 895 B10R1.17 NCCOC1=CC=CC=C1 NO20484 [1,1,0,0,0,0|0,0,0]=2 896 B10R1.17 NCCOC1=CC=CN=C1 NO16368 [1,1,0,0,0,0|1,0,0]=3 897 B10R1.17 NCCOC1=NC=CN=C1 DY508970 [1,1,0,0,0,0|2,0,0]=4 898 B10R1.17 NNCCc1ccccc1 DY527511 [1,1,0,0,0,0|0,0,0]=2 899 B10R1.17 O=C=NCC1=CC=CC=C1 DY585959 [1,1,0,0,0,0|1,0,1]=4 900 B10R1.17 O=CCCC1=CC=CN=C1 DY585487 [1,1,0,0,0,0|2,0,0]=4 901 B10R1.17 O=CCSC1=CC=CC=C1 DY566091 [1,1,0,0,0,0|1,0,1]=4 902 B10R1.17 OCCCC1=CC=NC=C1 NO22019 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.17 OC\C=C\C1=CC=CC=C1 DY503697 [1,1,0,0,0,0|1,0,1]=4 904 B10R1.18 CC(C)NC1=CC=CC=C1 NO11787 [1,1,0,0,0,0|2,0,0]=4 905 B10R1.18 CC(N)CC1=NC=CC=C1 DY652737 [1,1,0,0,0,0|1,0,0]=3 906 B10R1.18 N=C(N)CC1=CC=CN=C1 DY610010 [1,1,0,0,0,0|1,0,1]=4 907 B10R1.18 NC(=O)NC1=CC=CC=C1 NO10533 [1,1,0,0,0,0|1,0,1]=4 908 B10R1.18 O=S([O-])CC1=CC=CC=C1 DY745429 [1,1,0,0,0,0|2,0,0]=4 909 B10R1.14 CC1=CN(C(C)CN)N=C1 DY609133 [0,1,0,0,1,0|2,0,0]=4 910 B10R1.14 CC[C@@H](N)C1=CC=C(C)O1 DY555831 [0,1,0,0,1,0|2,0,0]=4 911 B10R1.14 CC[C@H](N)C1=CC=C(C)O1 NO16467 [0,1,0,0,1,0|2,0,0]=4 912 B10R1.16 CC1=NN(CCCN)C=C1 DY646735 [0,1,0,0,1,0|2,0,0]=4 913 B10R1.16 CC1=NOC(CCCN)=C1 DY502929 [0,1,0,0,1,0|2,0,0]=4 914 B10R1.54 CC1=CC(CC(C)N)=NO1 DY763058 [0,1,0,0,1,0|2,0,0]=4 915 B10R1.131 CC1=C(Cl)SC(CCN)=N1 DY602431 [0,1,0,0,1,0|2,0,0]=4 916 B10R1.149 CC1=C(C(O)CN)SC=C1 DY107758 [0,1,0,0,1,0|1,0,0]=3 917 B10R1.187 CN1N=CC(Br)=C1CCN DY645964 [0,1,0,0,1,0|2,0,0]=4 918 B12R1.25 FC1=CC=CC(CCCBr)=C1Cl DY748747 [0,2,0,0,0,0|2,0,0]=4 919 B12R1.224 CC1=CC=CC(CC(=O)O)=C1Br DY585070 [0,2,0,0,0,0|1,0,1]=4 920 B12R1.224 CC1=CC=CC(CC(=O)O)=C1O DY584718 [0,2,0,0,0,0|1,0,1]=4 921 B12R1.280 COCC1=CC=CC(OC)=C1Br DY449290 [0,2,0,0,0,0|2,0,0]=4 922 B12R1.542 COC1=C(CC#N)C=CC=C1C DY585057 [0,2,0,0,0,0|0,0,2]=4 923 B12R1.542 COC1=C(CON)C=CC=C1C DY521109 [0,2,0,0,0,0|1,0,0]=3 924 B12R1.10 CC1=CC(C(F)(F)CO)=CC=C1 DY579651 [0,2,0,0,0,0|1,0,0]=3 925 B12R1.13 CCN(CC)C1=CC(C)=CC=C1 DY455343 [0,2,0,0,0,0|2,0,0]=4 926 B12R1.13 CCN(CC)C1=CC(C)=CC=C1 DY798783 [0,2,0,0,0,0|2,0,0]=4 927 B12R1.17 CC1=CC=CC(C(N)CCO)=C1 DY788349 [0,2,0,0,0,0|1,0,0]=3 928 B12R1.17 CCOC(=O)C1=CC(C)=CC=C1 DY790947 [0,2,0,0,0,0|1,0,1]=4 929 B12R1.17 CNCC(O)C1=CC=CC(O)=C1 DY526923 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.17 CNC[C@H](O)c1cccc(O)c1 DY562101 [0,2,0,0,0,0|1,0,0]=3 931 B12R1.17 NC(CCO)C1=CC(Cl)=CC=C1 NO19263 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.225 CC(C)[C@@H](N)C1=CC(Cl)=CC=C1 DY511899 [0,2,0,0,0,0|2,0,0]=4 933 B12R1.225 CC1=CC(C(F)C(=O)O)=CC=C1 DY525255 [0,2,0,0,0,0|1,0,1]=4 934 B12R1.225 CC1=CC=CC([C@H](C)C(=O)O)=C1 DY586092 [0,2,0,0,0,0|1,0,1]=4 935 B12R1.354 CC1=CC(C(=O)NN)=C(N)C=C1 DY793923 [0,2,0,0,0,0|1,0,1]=4 936 B12R1.354 NCC(=O)C1=C(F)C=CC(F)=C1 NO17892 [0,2,0,0,0,0|1,0,1]=4 937 B12R1.367 CCC(N)C1=CC(C)=C(C)C=C1 DY609145 [0,2,0,0,0,0|1,0,0]=3 938 B12R1.367 NCC(=O)C1=CC(O)=C(O)C=C1 DY461310 [0,2,0,0,0,0|1,0,1]=4 939 B12R1.367 NCC(O)c1ccc(O)c(O)c1 DY557481 [0,2,0,0,0,0|1,0,0]=3 940 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 DY797643 [0,2,0,0,0,0|1,0,0]=3 941 B12R1.367 N[C@H](CO)C1=CC(F)=C(F)C=C1 DY624373 [0,2,0,0,0,0|2,0,0]=4 942 B12R1.435 CCC(=O)C1=CC(OC)=CC=C1 NO22346 [0,2,0,0,0,0|1,0,1]=4 943 B12R1.435 CC[C@@H](N)C1=CC=CC(C#N)=C1 DY622185 [0,2,0,0,0,0|1,0,1]=4 944 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 NO11021 [0,2,0,0,0,0|1,0,1]=4 945 B12R1.28 CC1=CC=CC(OCCCO)=N1 DY713221 [0,2,0,0,0,0|2,0,0]=4 946 B12R1.28 NCCCOC1=CC(Cl)=CC=C1 DY425612 [0,2,0,0,0,0|1,0,0]=3 947 B12R1.50 N[C@H](CO)CC1=CC(Cl)=CC=C1 DY624403 [0,2,0,0,0,0|1,0,0]=3 948 B12R1.50 O=C(CBr)CC1=CC(S)=CC=C1 DY748993 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.100 O=CCCC1=CC(Cl)=CC(Cl)=C1 DY582471 [0,2,0,0,0,0|2,0,0]=4 950 B12R1.226 CC1=CC=CC(OCC(=O)O)=C1 DY457048 [0,2,0,0,0,0|1,0,1]=4 951 B12R1.226 O=C(O)CCC1=CC(Br)=CC=C1 NO21658 [0,2,0,0,0,0|2,0,0]=4 952 B12R1.226 O=C(O)CCC1=CC(Cl)=CC=C1 NO13948 [0,2,0,0,0,0|2,0,0]=4 953 B12R1.374 BrCCOC1=C(Br)C=CC(Br)=C1 DY106792 [0,2,0,0,0,0|2,0,0]=4 954 B12R1.374 COCOC1=C(Br)C=CC(C)=C1 DY449014 [0,2,0,0,0,0|2,0,0]=4 955 B12R1.374 FC1=CC(CCCBr)=C(Cl)C=C1 DY748735 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.382 C#CCCC1=CC(OC)=CC=C1 DY569085 [0,2,0,0,0,0|1,0,0]=3 957 B12R1.382 CSC1=CC=CC(CCC#N)=C1 DY748681 [0,2,0,0,0,0|0,0,1]=3 958 B12R1.382 N#CCCC1=CC(CO)=CC=C1 DY748957 [0,2,0,0,0,0|0,0,1]=3 959 B12R1.382 O=CC1=CC(OCCO)=CC=C1 DY796785 [0,2,0,0,0,0|1,0,1]=4 960 B12R1.385 CC1=C(O)C=C(NCCO)C=C1 NO21891 [0,2,0,0,0,0|2,0,0]=4 961 B12R1.385 FC1=C(Cl)C=CC(CCCBr)=C1 DY748723 [0,2,0,0,0,0|2,0,0]=4 962 B12R1.385 FC1=C(I)C=CC(CCCCl)=C1 DY748729 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.385 O=CCCC1=CC(Br)=C(F)C=C1 DY513777 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.385 OCCCC1=CC(F)=C(F)C=C1 DY547239 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.41 CCOC1=CC(F)=CC(CO)=C1 DY451018 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.41 COC1=CC(CC#N)=CC(F)=C1 NO15069 [0,2,0,0,0,0|0,0,2]=4 967 B12R1.44 CCCC1=CC(F)=C(O)C(F)=C1 DY822093 [0,2,0,0,0,0|2,0,0]=4 968 B12R1.44 CCOC1=CC(C)=C(Br)C(C)=C1 DY452326 [0,2,0,0,0,0|2,0,0]=4 969 B12R1.44 COCC1=CC(C)=C(Br)C(C)=C1 DY452710 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.19 CC1=C(C)C=C(CC(=O)O)C=C1 DY21107 [0,2,0,0,0,0|1,0,1]=4 971 B12R1.19 CC1=C(F)C=CC(CC(=O)O)=C1 DY585037 [0,2,0,0,0,0|1,0,1]=4 972 B12R1.19 CC1=C(N)C=NC(CC(C)C)=C1 NO18107 [0,2,0,0,0,0|2,0,0]=4 973 B12R1.19 CC1=C(O)C=CC(CC(=O)O)=C1 DY584932 [0,2,0,0,0,0|1,0,1]=4 974 B12R1.127 CC1=CC(CC(=O)O)=C(Br)C=C1 DY584750 [0,2,0,0,0,0|1,0,1]=4 975 B12R1.127 CC1=CC(CC(=O)O)=C(C)C=C1 NO11111 [0,2,0,0,0,0|1,0,1]=4 976 B12R1.438 COC1=CC=CC(CC(=O)Cl)=C1 DY584620 [0,2,0,0,0,0|1,0,1]=4 977 B12R1.438 COC1=CC=CC(CC(C)=O)=C1 NO22343 [0,2,0,0,0,0|1,0,1]=4 978 B12R1.438 CSC1=CC=CC(NC(=N)N)=C1 DY568503 [0,2,0,0,0,0|1,0,1]=4 979 B12R1.438 FC(F)OC1=CC=CC(CBr)=C1 DY40549 [0,2,0,0,0,0|2,0,0]=4 980 B12R1.438 O=C(O)CC1=CC(CBr)=CC=C1 NO15773 [0,2,0,0,0,0|1,0,1]=4 981 B12R1.270 COC1=CC(CC#N)=C(Br)C=C1 NO16492 [0,2,0,0,0,0|0,0,2]=4 982 B12R1.270 COC1=CC(CC#N)=C(F)C=C1 NO15575 [0,2,0,0,0,0|0,0,2]=4 983 B12R1.278 CCOC1=CC=CC(CNC)=C1 DY614616 [0,2,0,0,0,0|2,0,0]=4 984 B12R1.279 NCCC1=CC=CC(C(N)=O)=C1 DY747001 [0,2,0,0,0,0|0,0,1]=3 985 B12R1.279 NNCC1=CC([N+](=O)[O-])=CC=C1 DY557775 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.286 COC1=C(Br)C=CC(CC#N)=C1 DY584398 [0,2,0,0,0,0|0,0,2]=4 987 B12R1.286 COC1=C(C)C=CC(CC#N)=C1 NO22339 [0,2,0,0,0,0|0,0,2]=4 988 B12R1.288 COC1=C(C)C=C(CC#N)C=C1 DY585027 [0,2,0,0,0,0|0,0,2]=4 989 B12R1.288 COC1=C(C)C=C(CCN)C=N1 DY111257 [0,2,0,0,0,0|1,0,0]=3 990 B10R1.245 CC1=CC=CC(C)=C1CN NO21184 [0,0,1,1,0,0|0,0,2]=4 991 B10R2.31 BrC1=CC=C2CCC2=C1 DY505107 [1,0,0,1,0,0|1,0,0]=3 992 B10R2.31 NC1=CC=C2CCC2=C1 DY686977 [1,0,0,1,0,0|1,0,0]=3 993 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 DY20326 [1,0,0,1,0,0|1,0,0]=3 994 B10R2.7 C1=CC2=C(C=C1)CSC2 DY114506 [1,0,0,1,0,0|2,0,0]=4 995 B10R2.7 C1=CC2=C(C=C1)OCC2 NO20929 [1,0,0,1,0,0|1,0,0]=3 996 B10R2.7 C1=CC2=NCCN2C=C1 DY760292 [1,0,0,1,0,0|1,0,1]=4 997 B10R2.7 C1=CC=C2CC=CC2=C1 DY20914 [1,0,0,1,0,0|1,0,1]=4 998 B10R2.7 C1=CC=C2CNCC2=C1 NO11516 [1,0,0,1,0,0|2,0,0]=4 999 B10R2.7 C1=CC=C2NC=CC2=C1 NO11496 [1,0,0,1,0,0|0,0,2]=4 1000 B10R2.7 C1=CC=C2NCCC2=C1 NO19084 [1,0,0,1,0,0|0,0,0]=2 1001 B10R2.7 C1=CC=C2NN=CC2=C1 NO11488 [1,0,0,1,0,0|1,0,1]=4 1002 B10R2.7 C1=CN=C2CCCC2=C1 NO14838 [1,0,0,1,0,0|2,0,0]=4 1003 B10R2.7 C1=CN=C2CCNC2=C1 DY107728 [1,0,0,1,0,0|1,0,0]=3 1004 B10R2.7 C1=NC=C2NCCC2=C1 DY570663 [1,0,0,1,0,0|1,0,0]=3 1005 B10R2.320 BrC1CC2=CC=CC=C21 DY539943 [1,0,0,1,0,0|1,0,0]=3 1006 B12R2.82 CC1=CC=C2C=CNC2=C1C DY727339 [0,1,0,1,0,0|0,0,2]=4 1007 B12R2.82 CC1=CC=C2NC=CC2=C1Br NO16082 [0,1,0,1,0,0|0,0,2]=4 1008 B12R2.82 CC1=CC=C2NN=CC2=C1I DY761372 [0,1,0,1,0,0|1,0,1]=4 1009 B12R2.82 FC1=C2CCNC2=CC=C1Br NO17575 [0,1,0,1,0,0|1,0,0]=3 1010 B12R2.82 OC1=C(Br)C2=C(C=C1)OCC2 DY751405 [0,1,0,1,0,0|2,0,0]=4 1011 B12R2.202 CC1=CC=CC2=C1N=C(N)N2 DY606549 [0,1,0,1,0,0|1,0,1]=4 1012 B12R2.202 CC1=CC=CC2=C1NC(=O)O2 DY753109 [0,1,0,1,0,0|1,0,1]=4 1013 B12R2.202 CC1=CC=CC2=C1NC(Cl)=N2 DY528267 [0,1,0,1,0,0|1,0,1]=4 1014 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 NO14679 [0,1,0,1,0,0|1,0,1]=4 1015 B12R2.202 O=C1CC2=CC=CC(Cl)=C2N1 DY10111 [0,1,0,1,0,0|1,0,1]=4 1016 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 DY10168 [0,1,0,1,0,0|1,0,1]=4 1017 B12R2.1081 BrC1=C2CCCCC2=CC=C1 DY768527 [0,1,0,1,0,0|2,0,0]=4 1018 B12R2.1081 BrC1=C2CCCNC2=CC=C1 NO18620 [0,1,0,1,0,0|2,0,0]=4 1019 B12R2.1081 BrC1=C2CCCOC2=CC=C1 DY677682 [0,1,0,1,0,0|2,0,0]=4 1020 B12R2.1081 BrC1=C2CCNCC2=CC=C1 NO19342 [0,1,0,1,0,0|2,0,0]=4 1021 B12R2.1081 BrC1=C2CNCCC2=CC=C1 NO12481 [0,1,0,1,0,0|1,0,0]=3 1022 B12R2.1081 BrC1=C2CNCCC2=CC=C1 NO15449 [0,1,0,1,0,0|1,0,0]=3 1023 B12R2.1081 BrC1=C2OCCCC2=CC=C1 DY551733 [0,1,0,1,0,0|2,0,0]=4 1024 B12R2.1081 CC1=C2NCCCC2=CC=C1 DY784858 [0,1,0,1,0,0|0,0,0]=2 1025 B12R2.1081 ClC1=C2CCCNC2=CC=C1 NO19411 [0,1,0,1,0,0|2,0,0]=4 1026 B12R2.1081 ClC1=C2CNCCC2=CC=C1 NO17691 [0,1,0,1,0,0|1,0,0]=3 1027 B12R2.1081 FC1=C2CCNCC2=CC=C1 NO19337 [0,1,0,1,0,0|2,0,0]=4 1028 B12R2.1081 FC1=CC=CC2=C1NCCO2 DY443372 [0,1,0,1,0,0|1,0,0]=3 1029 B12R2.1081 NC1=C2CNCCC2=CC=C1 DY580317 [0,1,0,1,0,0|1,0,0]=3 1030 B12R2.1081 OC1=CC=CC2=C1OCCO2 NO12196 [0,1,0,1,0,0|2,0,0]=4 1031 B12R2.80 NC1CC1C2=CC(Cl)=CC=C2 DY744457 [0,1,0,1,0,0|1,0,0]=3 1032 B12R2.132 CC1=CC=C2NC=C(I)C2=C1 DY727435 [0,1,0,1,0,0|0,0,2]=4 1033 B12R2.132 CC1=CC=C2NN=C(Br)C2=C1 DY553479 [0,1,0,1,0,0|1,0,1]=4 1034 B12R2.132 NC1CCC2=CC=C(Br)C=C21 DY579057 [0,1,0,1,0,0|2,0,0]=4 1035 B12R2.132 NC1CCC2=CC=C(F)C=C21 DY530697 [0,1,0,1,0,0|2,0,0]=4 1036 B12R2.132 NC1COC2=C1C=C(Br)C=C2 DY577467 [0,1,0,1,0,0|2,0,0]=4 1037 B12R2.132 NC1COC2=C1C=C(F)C=C2 DY431482 [0,1,0,1,0,0|2,0,0]=4 1038 B12R2.132 N[C@@H]1CCC2=CC=C(O)C=C21 DY104168 [0,1,0,1,0,0|2,0,0]=4 1039 B12R2.132 N[C@@H]1COC2=C1C=C(Br)C=C2 DY625417 [0,1,0,1,0,0|2,0,0]=4 1040 B12R2.132 OC1CCC2=CC=C(F)C=C21 DY447461 [0,1,0,1,0,0|2,0,0]=4 1041 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 NO14012 [0,1,0,1,0,0|1,0,1]=4 1042 B12R2.196 CC1=C2CC[C@H](N)C2=CC=C1 DY625369 [0,1,0,1,0,0|1,0,0]=3 1043 B12R2.196 CC1=CC=CC2=C1OC[C@@H]2N DY622563 [0,1,0,1,0,0|1,0,0]=3 1044 B12R2.196 NC1CCC2=C(F)C=CC=C21 NO18746 [0,1,0,1,0,0|2,0,0]=4 1045 B12R2.196 N[C@@H]1CCC2=C(Br)C=CC=C21 NO14533 [0,1,0,1,0,0|2,0,0]=4 1046 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 NO14534 [0,1,0,1,0,0|2,0,0]=4 1047 B12R2.1282 CC1=CC=CC(C2(N)CC2)=C1 DY557103 [0,1,0,1,0,0|1,0,0]=3 1048 B12R2.2313 FC1=CC=CC(C2CCN2)=C1 DY586321 [0,1,0,1,0,0|1,0,0]=3 1049 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 NO10787 [0,1,0,1,0,0|1,0,0]=3 1050 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 NO15185 [0,1,0,1,0,0|1,0,0]=3 1051 B12R2.24 BrC1=CC2=C(C=C1)OCCN2 NO15468 [0,1,0,1,0,0|2,0,0]=4 1052 B12R2.24 BrC1=CC2=C(C=C1)OCCO2 NO10776 [0,1,0,1,0,0|2,0,0]=4 1053 B12R2.24 BrC1=CC=C2CCCCC2=C1 NO16753 [0,1,0,1,0,0|2,0,0]=4 1054 B12R2.24 BrC1=CC=C2CCCNC2=C1 DY784852 [0,1,0,1,0,0|2,0,0]=4 1055 B12R2.24 BrC1=CC=C2CCCNC2=C1 NO18621 [0,1,0,1,0,0|2,0,0]=4 1056 B12R2.24 BrC1=CC=C2CCNCC2=C1 NO19606 [0,1,0,1,0,0|2,0,0]=4 1057 B12R2.24 BrC1=CC=C2CCOCC2=C1 NO16547 [0,1,0,1,0,0|2,0,0]=4 1058 B12R2.24 BrC1=CC=C2CNCCC2=C1 NO10618 [0,1,0,1,0,0|1,0,0]=3 1059 B12R2.24 BrC1=CC=C2CNCCC2=C1 NO17620 [0,1,0,1,0,0|1,0,0]=3 1060 B12R2.24 BrC1=CC=C2COCCC2=C1 DY441107 [0,1,0,1,0,0|2,0,0]=4 1061 B12R2.24 BrC1=CC=C2NCCCC2=C1 NO19737 [0,1,0,1,0,0|1,0,0]=3 1062 B12R2.24 BrC1=CC=C2OCCCC2=C1 NO19916 [0,1,0,1,0,0|2,0,0]=4 1063 B12R2.24 BrC1=NC2=C(C=C1)CNCC2 DY100126 [0,1,0,1,0,0|2,0,0]=4 1064 B12R2.24 BrC1=NC2=C(C=C1)NCCO2 DY511035 [0,1,0,1,0,0|2,0,0]=4 1065 B12R2.24 CC1=CC2=C(C=N1)OCCO2 DY681045 [0,1,0,1,0,0|2,0,0]=4 1066 B12R2.24 CC1=CC=C2CCCCC2=C1 NO10746 [0,1,0,1,0,0|1,0,0]=3 1067 B12R2.24 CC1=CC=C2CCNCC2=C1 DY553959 [0,1,0,1,0,0|1,0,0]=3 1068 B12R2.24 CC1=CC=C2CCNCC2=C1 NO18155 [0,1,0,1,0,0|1,0,0]=3 1069 B12R2.24 CC1=CC=C2CNCCC2=C1 DY431469 [0,1,0,1,0,0|0,0,0]=2 1070 B12R2.24 CC1=NC2=C(C=C1)OCCN2 DY679869 [0,1,0,1,0,0|2,0,0]=4 1071 B12R2.24 ClC1=CC=C2CNCCC2=C1 DY549387 [0,1,0,1,0,0|1,0,0]=3 1072 B12R2.24 ClC1=CC=C2NCCCC2=C1 NO14585 [0,1,0,1,0,0|1,0,0]=3 1073 B12R2.24 ClC1=CC=C2NCCNC2=C1 DY744199 [0,1,0,1,0,0|1,0,0]=3 1074 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 NO12512 [0,1,0,1,0,0|2,0,0]=4 1075 B12R2.24 ClC1=NC2=C(C=C1)NCCN2 NO12186 [0,1,0,1,0,0|2,0,0]=4 1076 B12R2.24 FC1=CC=C2CNCCC2=C1 DY572409 [0,1,0,1,0,0|1,0,0]=3 1077 B12R2.24 FC1=CC=C2OCCCC2=C1 DY584315 [0,1,0,1,0,0|2,0,0]=4 1078 B12R2.24 IC1=CC=C2CCCNC2=C1 DY450838 [0,1,0,1,0,0|2,0,0]=4 1079 B12R2.24 NC1=CC2=C(C=C1)CCCC2 DY541887 [0,1,0,1,0,0|2,0,0]=4 1080 B12R2.24 NC1=CC=C2CCCNC2=C1 DY526875 [0,1,0,1,0,0|2,0,0]=4 1081 B12R2.24 OC1=CC2=C(C=C1)CCCC2 NO13514 [0,1,0,1,0,0|2,0,0]=4 1082 B12R2.24 OC1=CC2=C(C=C1)NCCO2 DY442455 [0,1,0,1,0,0|1,0,0]=3 1083 B12R2.24 OC1=CC=C2CCCNC2=C1 NO10898 [0,1,0,1,0,0|2,0,0]=4 1084 B12R2.24 OC1=CC=C2CCNCC2=C1 NO17696 [0,1,0,1,0,0|2,0,0]=4 1085 B12R2.24 OC1=CC=C2CNCCC2=C1 NO18391 [0,1,0,1,0,0|1,0,0]=3 1086 B12R2.203 CC1=C2C(=CC=C1)C=NN2C NO17810 [0,1,0,1,0,0|1,0,1]=4 1087 B12R2.203 NC1CCC2=CC=CC(F)=C21 DY741805 [0,1,0,1,0,0|1,0,0]=3 1088 B12R2.203 O=C1CCC2=CC=CC(F)=C12 NO15500 [0,1,0,1,0,0|2,0,0]=4 1089 B12R2.203 OC1CCC2=CC=CC(Br)=C21 DY510501 [0,1,0,1,0,0|2,0,0]=4 1090 B12R2.203 OC1CSC2=C1C(Br)=CC=C2 DY569607 [0,1,0,1,0,0|2,0,0]=4 1091 B12R2.612 CC1=CC=C2C(=C1)NN=C2N DY762398 [0,1,0,1,0,0|1,0,1]=4 1092 B12R2.612 CN1CCC2=CC(F)=CC=C21 DY630394 [0,1,0,1,0,0|1,0,0]=3 1093 B12R2.612 CN1CCC2=CC(N)=CC=C21 DY629369 [0,1,0,1,0,0|1,0,0]=3 1094 B12R2.612 ClC1CCC2=CC(Br)=CC=C21 NO16081 [0,1,0,1,0,0|2,0,0]=4 1095 B12R2.612 NC1CCC2=CC(F)=CC=C21 DY431475 [0,1,0,1,0,0|1,0,0]=3 1096 B12R2.612 N[C@@H]1CCC2=CC(Cl)=CC=C21 DY572883 [0,1,0,1,0,0|1,0,0]=3 1097 B12R2.612 N[C@@H]1COC2=C1C=CC(Br)=C2 DY625465 [0,1,0,1,0,0|1,0,0]=3 1098 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 NO21498 [0,1,0,1,0,0|2,0,0]=4 1099 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 NO22043 [0,1,0,1,0,0|2,0,0]=4 1100 B12R2.612 O=C1CCC2=CC(F)=CC=C12 DY10164 [0,1,0,1,0,0|2,0,0]=4 1101 B12R2.612 O=C1CCC2=CC(O)=CC=C12 NO11017 [0,1,0,1,0,0|2,0,0]=4 1102 B12R2.612 OC1COC2=C1C=CC(Br)=C2 DY586466 [0,1,0,1,0,0|2,0,0]=4 1103 B12R2.612 O[C@H]1COC2=C1C=CC(Br)=C2 DY586465 [0,1,0,1,0,0|2,0,0]=4 1104 B12R2.246 CC1=C2NN=CC2=CC(Br)=C1 NO18022 [0,1,0,1,0,0|1,0,1]=4 1105 B12R2.246 CC1=CC(C)=C2NN=CC2=C1 DY762392 [0,1,0,1,0,0|1,0,1]=4 1106 B12R2.246 CC1=CC(N)=C2NC=CC2=C1 DY726919 [0,1,0,1,0,0|0,0,2]=4 1107 B12R2.246 CC1=CC(N)=C2NCCC2=C1 DY741895 [0,1,0,1,0,0|0,0,0]=2 1108 B12R2.246 OC1=CC(Br)=CC2=C1CCC2 DY532533 [0,1,0,1,0,0|2,0,0]=4 1109 B12R2.606 CC1=CC2=C(C=C1)SC(N)=N2 NO10859 [0,1,0,1,0,0|1,0,1]=4 1110 B12R2.606 CC1=CC=C2NC(=O)CC2=C1 NO15472 [0,1,0,1,0,0|0,0,1]=3 1111 B12R2.606 CC1=CC=C2NC(C)=CC2=C1 NO10011 [0,1,0,1,0,0|0,0,2]=4 1112 B12R2.606 NC1CC2=CC=C(Br)C=C2C1 DY447233 [0,1,0,1,0,0|1,0,0]=3 1113 B12R2.606 NC1CC2=CC=C(Br)C=C2C1 NO18236 [0,1,0,1,0,0|1,0,0]=3 1114 B12R2.606 NC1CC2=CC=C(I)C=C2C1 DY21023 [0,1,0,1,0,0|1,0,0]=3 1115 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 NO22042 [0,1,0,1,0,0|1,0,1]=4 1116 B12R2.606 O=C1CC2=CC(Cl)=CC=C2N1 NO22052 [0,1,0,1,0,0|1,0,1]=4 1117 B12R2.606 OC1CC2=CC=C(Br)C=C2C1 NO12609 [0,1,0,1,0,0|2,0,0]=4 1118 B12R2.221 CC1=C2C=CCC2=C(C)C=C1 DY20297 [0,1,0,1,0,0|1,0,1]=4 1119 B12R2.221 CC1=C2NC=CC2=C(Cl)C=C1 NO22779 [0,1,0,1,0,0|0,0,2]=4 1120 B12R2.221 CC1=C2NC=CC2=C(F)C=C1 DY731389 [0,1,0,1,0,0|0,0,2]=4 1121 B12R2.221 OC1=C2CCOC2=C(F)C=C1 DY459005 [0,1,0,1,0,0|2,0,0]=4 1122 B12R2.43 N#CC1=CC(C2CC2)=CC=C1 DY757555 [0,1,0,1,0,0|1,0,1]=4 1123 B12R2.43 NCC1=CC(C2CC2)=CC=C1 NO16620 [0,1,0,1,0,0|1,0,0]=3 1124 B12R2.43 NCC1=CC(C2CC2)=CN=C1 DY651565 [0,1,0,1,0,0|2,0,0]=4 1125 B12R2.44 BrCC1=CC=C2NN=CC2=C1 DY762518 [0,1,0,1,0,0|1,0,1]=4 1126 B12R2.44 C#CC1=CC=C2CCCC2=C1 DY517785 [0,1,0,1,0,0|1,0,1]=4 1127 B12R2.44 COC1=CC2=C(C=C1)NN=N2 DY678018 [0,1,0,1,0,0|2,0,0]=4 1128 B12R2.44 COC1=CC=C2CCNC2=C1 DY20447 [0,1,0,1,0,0|2,0,0]=4 1129 B12R2.44 COC1=CC=C2CNCC2=C1 NO12707 [0,1,0,1,0,0|2,0,0]=4 1130 B12R2.44 COC1=CC=C2NCCC2=C1 DY456370 [0,1,0,1,0,0|0,0,0]=2 1131 B12R2.44 COC1=CC=C2NCCC2=C1 NO17324 [0,1,0,1,0,0|0,0,0]=2 1132 B12R2.44 ClCC1=CC2=C(C=C1)OCC2 DY796377 [0,1,0,1,0,0|1,0,0]=3 1133 B12R2.44 O=CC1=CC2=C(C=C1)OCC2 NO21622 [0,1,0,1,0,0|1,0,1]=4 1134 B12R2.44 O=CC1=CC=C2CCCC2=C1 DY547221 [0,1,0,1,0,0|1,0,1]=4 1135 B12R2.315 BrCC1=CC=CC2=C1OCO2 NO15539 [0,1,0,1,0,0|2,0,0]=4 1136 B12R2.315 COC1=C2CCNC2=CC=C1 DY570405 [0,1,0,1,0,0|2,0,0]=4 1137 B12R2.315 COC1=C2CNCC2=CC=C1 NO17395 [0,1,0,1,0,0|2,0,0]=4 1138 B12R2.315 COC1=C2NCCC2=CC=C1 DY549339 [0,1,0,1,0,0|0,0,0]=2 1139 B12R2.315 COC1=CC=CC2=C1NC=N2 DY545673 [0,1,0,1,0,0|1,0,1]=4 1140 B12R2.315 ClCC1=C2NN=CC2=CC=C1 DY581937 [0,1,0,1,0,0|1,0,1]=4 1141 B12R2.315 O=CC1=CC=CC2=C1CCC2 DY744601 [0,1,0,1,0,0|1,0,1]=4 1142 B12R2.315 OCC1=C2CCNC2=CC=C1 NO13211 [0,1,0,1,0,0|2,0,0]=4 1143 B12R2.100 CC1=C(Br)C=C2NC=CC2=C1 NO10653 [0,1,0,1,0,0|0,0,2]=4 1144 B12R2.100 CC1=C(Cl)C=C2CCNC2=C1 DY630376 [0,1,0,1,0,0|1,0,0]=3 1145 B12R2.100 CC1=C(F)C=C2NC=CC2=C1 DY528891 [0,1,0,1,0,0|0,0,2]=4 1146 B12R2.100 CC1=C(O)C=C2NN=CC2=C1 DY505371 [0,1,0,1,0,0|1,0,1]=4 1147 B12R2.100 CC1=CC2=C(C=C1C)NC=N2 DY20410 [0,1,0,1,0,0|1,0,1]=4 1148 B12R2.100 FC1=C(F)C=C2NCCC2=C1 NO12554 [0,1,0,1,0,0|1,0,0]=3 1149 B8R1.1 CC1=CC(CN)=NO1 DY504243 [1,0,0,0,1,0|2,0,0]=4 1150 B8R1.1 CC1=CNC(CO)=C1 DY717969 [1,0,0,0,1,0|2,0,0]=4 1151 B8R1.1 CC1=NC=C(CN)S1 DY564495 [1,0,0,0,1,0|2,0,0]=4 1152 B8R1.1 CCC1=CC(C)=CS1 DY447443 [1,0,0,0,1,0|1,0,0]=3 1153 B8R1.1 CCC1=NC=C(C)N1 DY580743 [1,0,0,0,1,0|2,0,0]=4 1154 B8R1.1 CC[N+]1=CN(C)C=C1 DY565521 [1,0,0,0,1,0|2,0,0]=4 1155 B8R1.1 CN1C=C(CN)C=N1 DY553167 [1,0,0,0,1,0|2,0,0]=4 1156 B8R1.1 NCC1=CC=C(Br)O1 DY432586 [1,0,0,0,1,0|2,0,0]=4 1157 B8R1.1 NCC1=CC=C(Br)O1 DY759704 [1,0,0,0,1,0|2,0,0]=4 1158 B8R1.11 CC1=C(CN)SC=C1 DY609391 [1,0,0,0,1,0|1,0,0]=3 1159 B8R1.11 CC1=NOC=C1CN DY773325 [1,0,0,0,1,0|2,0,0]=4 1160 B8R1.11 CCC1=NNC=C1C DY647288 [1,0,0,0,1,0|2,0,0]=4 1161 B8R1.11 CCN1C=CN=C1C DY540057 [1,0,0,0,1,0|2,0,0]=4 1162 B8R1.11 CN1C=CC=C1CN DY717975 [1,0,0,0,1,0|1,0,0]=3 1163 B8R1.11 CN1C=NC=C1CN DY725329 [1,0,0,0,1,0|2,0,0]=4 1164 B8R1.8 NCCC1=CC=CN1 DY717219 [1,0,0,0,1,0|1,0,0]=3 1165 B8R1.8 NCCC1=CN=CS1 DY785962 [1,0,0,0,1,0|2,0,0]=4 1166 B8R1.8 NCCC1=CNC=N1 DY557493 [1,0,0,0,1,0|2,0,0]=4 1167 B8R1.8 NCCC1=CNC=N1 NO18264 [1,0,0,0,1,0|2,0,0]=4 1168 B8R1.8 NCCC1=CSC=C1 NO22098 [1,0,0,0,1,0|1,0,0]=3 1169 B8R1.8 NCCC1=NC=CN1 DY725263 [1,0,0,0,1,0|2,0,0]=4 1170 B8R1.8 NCCN1C=CC=N1 DY501807 [1,0,0,0,1,0|2,0,0]=4 1171 B8R1.8 NNCC1=CC=CS1 DY607641 [1,0,0,0,1,0|2,0,0]=4 1172 B8R1.8 OCCC1=CC=CS1 NO14939 [1,0,0,0,1,0|2,0,0]=4 1173 B8R1.8 OCCC1=CSC=C1 NO20858 [1,0,0,0,1,0|2,0,0]=4