0 B9R1.1 BrCC1=CC=C(Br)C=C1 NO19166 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.1 BrCC1=CC=C(I)C=C1 NO20172 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.1 BrCC1=CN=C(Br)C=C1 DY655150 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.1 C#CC1=CN=C(C)C=C1 DY606273 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.1 C#CC1=CN=C(O)C=C1 NO16476 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.1 C#CC1=NC=C(Br)C=C1 NO18607 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.1 C#CC1=NC=C(F)C=C1 NO19540 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.1 CC1=CC=C(C#N)C=C1 NO19807 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.1 CC1=CC=C(CBr)C=C1 NO22969 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.1 CC1=CC=C(CCl)C=C1 DY40603 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.1 CC1=CC=C(CN)C=C1 NO22970 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.1 CC1=CC=C(CN)N=N1 DY100078 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.1 CC1=CC=C(CO)C=C1 NO19704 [0,0,0,0,0,0|1,0,0]=1 13 B9R1.1 CC1=CC=C(CO)C=N1 DY21041 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.1 CC1=CC=C(NN)C=C1 NO19576 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.1 CC1=CN=C(C#N)C=C1 NO13787 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.1 CC1=CN=C(C=O)C=C1 NO19088 [0,0,0,0,0,0|2,0,2]=4 17 B9R1.1 CC1=CN=C(CN)C=C1 DY711847 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.1 CC1=CN=C(CN)C=C1 NO18319 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.1 CC1=CN=C(CO)C=N1 NO12383 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.1 CC1=NC=C(C#N)C=C1 NO14144 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.1 CC1=NC=C(C=O)C=C1 NO19116 [0,0,0,0,0,0|2,0,2]=4 22 B9R1.1 CC1=NC=C(CCl)C=C1 DY585961 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.1 CC1=NC=C(CO)C=N1 NO13969 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.1 CCC1=CC=C(Br)C=C1 NO10865 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.1 CCC1=CC=C(Cl)C=C1 DY584444 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.1 CCC1=CC=C(F)C=C1 DY20965 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.1 CCC1=CC=C(I)C=C1 DY20189 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.1 CCC1=CC=C(N)C=N1 DY515529 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.1 CCC1=CC=C(O)C=C1 DY20188 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.1 CCC1=CN=C(Br)C=C1 NO13124 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.1 CCC1=CN=C(C)C=C1 DY20566 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.1 CCC1=CN=C(N)C=C1 DY585943 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.1 CCC1=CN=C(N)N=C1 NO14255 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.1 CCC1=CN=C(O)C=C1 DY660020 [0,0,0,0,0,0|2,0,0]=2 35 B9R1.1 CCC1=NC=C(Br)C=C1 NO12376 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.1 CCC1=NC=C(Br)C=N1 NO13125 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.1 CCC1=NC=C(C)N=C1 DY710647 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.1 CCC1=NC=C(I)C=N1 DY693478 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.1 CNC1=CC=C(I)C=C1 NO22906 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.1 CNC1=NC=C(Br)C=C1 NO10304 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.1 CNC1=NC=C(F)C=C1 DY711535 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.1 COC1=CC=C(N)C=C1 DY584663 [0,0,0,0,0,0|3,0,0]=3 43 B9R1.1 COC1=CC=C(N)C=C1 NO18580 [0,0,0,0,0,0|3,0,0]=3 44 B9R1.1 COC1=CC=C(N)C=N1 NO19527 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.1 COC1=CC=C(O)C=C1 NO22939 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.1 COC1=CC=[N+]([O-])C=C1 NO18613 [0,0,0,0,0,0|3,0,1]=4 47 B9R1.1 COC1=CN=C(Br)C=C1 NO13470 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.1 COC1=CN=C(N)C=C1 NO17791 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.1 COC1=CNC(=O)C=C1 DY563727 [0,0,0,0,0,0|3,0,1]=4 50 B9R1.1 COC1=NC=C(Br)C=C1 DY716534 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.1 COC1=NC=C(Br)C=C1 NO22030 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.1 COC1=NC=C(C)C=C1 NO21644 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.1 COC1=NC=C(Cl)C=C1 NO17976 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.1 COC1=NC=C(I)C=C1 NO21641 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.1 CSC1=CC=C(I)C=C1 DY585121 [0,0,0,0,0,0|3,0,0]=3 56 B9R1.1 CSC1=CC=C(N)C=N1 DY547125 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.1 CSC1=CC=C(O)C=C1 DY20743 [0,0,0,0,0,0|2,0,0]=2 58 B9R1.1 CSC1=NC=C(Cl)C=C1 DY454120 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.1 CSC1=NC=C(O)C=N1 NO12580 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.1 ClC1=CN=C(CBr)C=C1 NO16112 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.1 ClC1=CN=C(CBr)C=C1 NO17526 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.1 ClCC1=CC=C(Br)C=C1 NO19167 [0,0,0,0,0,0|2,0,0]=2 63 B9R1.1 ClCC1=CC=C(Cl)C=C1 NO19806 [0,0,0,0,0,0|2,0,0]=2 64 B9R1.1 ClCC1=CC=C(Cl)N=N1 DY736472 [0,0,0,0,0,0|4,0,0]=4 65 B9R1.1 ClCC1=NC=C(Cl)C=C1 DY446951 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.1 FC1=CC=C(CBr)C=C1 NO19071 [0,0,0,0,0,0|2,0,0]=2 67 B9R1.1 FC1=NC=C(CBr)C=C1 NO13268 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.1 FCC1=CC=C(Br)C=C1 DY555441 [0,0,0,0,0,0|2,0,0]=2 69 B9R1.1 N#CC1=CC=C(Br)C=C1 NO19210 [0,0,0,0,0,0|2,0,1]=3 70 B9R1.1 N#CC1=CC=C(Cl)C=C1 NO19211 [0,0,0,0,0,0|2,0,1]=3 71 B9R1.1 N#CC1=CC=C(F)C=C1 NO18637 [0,0,0,0,0,0|2,0,1]=3 72 B9R1.1 N#CC1=CC=C(I)C=C1 NO22010 [0,0,0,0,0,0|2,0,1]=3 73 B9R1.1 N#CC1=CC=C(N)C=C1 NO13395 [0,0,0,0,0,0|2,0,1]=3 74 B9R1.1 N#CC1=CC=C(N)C=N1 NO19137 [0,0,0,0,0,0|3,0,1]=4 75 B9R1.1 N#CC1=CC=C(O)C=C1 NO15887 [0,0,0,0,0,0|1,0,1]=2 76 B9R1.1 N#CC1=CC=C(S)C=C1 DY551463 [0,0,0,0,0,0|1,1,1]=3 77 B9R1.1 N#CC1=CN=C(Br)C=C1 NO21835 [0,0,0,0,0,0|3,0,1]=4 78 B9R1.1 N#CC1=CN=C(Cl)C=C1 NO21850 [0,0,0,0,0,0|3,0,1]=4 79 B9R1.1 N#CC1=CN=C(F)C=C1 NO19603 [0,0,0,0,0,0|3,0,1]=4 80 B9R1.1 N#CC1=CN=C(N)C=C1 NO22991 [0,0,0,0,0,0|3,0,1]=4 81 B9R1.1 N#CC1=CN=C(O)C=C1 NO22258 [0,0,0,0,0,0|2,0,1]=3 82 B9R1.1 N#CC1=NC=C(Br)C=C1 NO22025 [0,0,0,0,0,0|3,0,1]=4 83 B9R1.1 N#CC1=NC=C(Cl)C=C1 NO22045 [0,0,0,0,0,0|3,0,1]=4 84 B9R1.1 N#CC1=NC=C(F)C=C1 NO12291 [0,0,0,0,0,0|3,0,1]=4 85 B9R1.1 N#CC1=NC=C(O)C=N1 NO15525 [0,0,0,0,0,0|3,0,1]=4 86 B9R1.1 NC1=CC=C(C=O)C=C1 DY20423 [0,0,0,0,0,0|1,0,2]=3 87 B9R1.1 NC1=NC=C(CO)C=N1 DY511503 [0,0,0,0,0,0|3,0,0]=3 88 B9R1.1 NCC1=CC=C(Br)C=C1 NO19587 [0,0,0,0,0,0|2,0,0]=2 89 B9R1.1 NCC1=CC=C(Br)N=C1 NO11090 [0,0,0,0,0,0|3,0,0]=3 90 B9R1.1 NCC1=CC=C(Cl)N=C1 NO16390 [0,0,0,0,0,0|3,0,0]=3 91 B9R1.1 NCC1=CC=C(F)C=C1 NO18721 [0,0,0,0,0,0|2,0,0]=2 92 B9R1.1 NCC1=CC=C(N)C=N1 NO10590 [0,0,0,0,0,0|3,0,0]=3 93 B9R1.1 NCC1=CC=C(O)C=C1 NO22886 [0,0,0,0,0,0|1,0,0]=1 94 B9R1.1 NCC1=CN=C(Cl)N=C1 DY516393 [0,0,0,0,0,0|4,0,0]=4 95 B9R1.1 NCC1=CN=C(N)N=C1 DY566541 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.1 NCC1=CNC(=O)C=C1 DY585975 [0,0,0,0,0,0|2,0,1]=3 97 B9R1.1 NCC1=NC=C(Cl)N=C1 DY504699 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.1 NCC1=NC=C(Cl)N=C1 DY532911 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.1 NCC1=NC=C(F)C=C1 DY430169 [0,0,0,0,0,0|3,0,0]=3 100 B9R1.1 NCC1=NC=C(F)C=C1 NO16554 [0,0,0,0,0,0|3,0,0]=3 101 B9R1.1 NCC1=NC=C(F)C=N1 DY692319 [0,0,0,0,0,0|4,0,0]=4 102 B9R1.1 NNC1=CC=C(Br)C=C1 NO15342 [0,0,0,0,0,0|3,0,0]=3 103 B9R1.1 NNC1=CC=C(Cl)C=C1 NO13495 [0,0,0,0,0,0|3,0,0]=3 104 B9R1.1 NNC1=CC=C(F)C=C1 NO22006 [0,0,0,0,0,0|3,0,0]=3 105 B9R1.1 NNC1=CC=C(N)C=N1 DY713641 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.1 NNC1=CN=C(Cl)C=C1 DY524685 [0,0,0,0,0,0|4,0,0]=4 107 B9R1.1 NNC1=NC=C(Br)C=C1 NO19995 [0,0,0,0,0,0|4,0,0]=4 108 B9R1.1 NNC1=NC=C(Cl)C=C1 NO20219 [0,0,0,0,0,0|4,0,0]=4 109 B9R1.1 NNC1=NC=C(F)C=C1 NO17301 [0,0,0,0,0,0|4,0,0]=4 110 B9R1.1 O=C1C=CC(CO)=CN1 NO19816 [0,0,0,0,0,0|1,0,1]=2 111 B9R1.1 O=CC1=CC=C(Br)C=C1 NO18612 [0,0,0,0,0,0|1,0,2]=3 112 B9R1.1 O=CC1=CC=C(Cl)C=C1 NO14843 [0,0,0,0,0,0|1,0,2]=3 113 B9R1.1 O=CC1=CC=C(F)C=C1 NO19072 [0,0,0,0,0,0|1,0,2]=3 114 B9R1.1 O=CC1=CC=C(I)C=C1 NO20133 [0,0,0,0,0,0|1,0,2]=3 115 B9R1.1 O=CC1=CC=C(O)C=C1 NO18686 [0,0,0,0,0,0|0,0,2]=2 116 B9R1.1 O=CC1=CN=C(Br)C=C1 NO13736 [0,0,0,0,0,0|2,0,2]=4 117 B9R1.1 O=CC1=CN=C(Cl)C=C1 NO13978 [0,0,0,0,0,0|2,0,2]=4 118 B9R1.1 O=CC1=CN=C(F)C=C1 NO19261 [0,0,0,0,0,0|2,0,2]=4 119 B9R1.1 O=CC1=CN=C(O)C=C1 NO13494 [0,0,0,0,0,0|1,0,2]=3 120 B9R1.1 O=CC1=NC=C(Cl)C=C1 NO18956 [0,0,0,0,0,0|2,0,2]=4 121 B9R1.1 O=CC1=NC=C(F)C=C1 NO20057 [0,0,0,0,0,0|2,0,2]=4 122 B9R1.1 O=CC1=NC=C(I)C=C1 DY585661 [0,0,0,0,0,0|2,0,2]=4 123 B9R1.1 O=CC1=NC=C(O)C=C1 NO12167 [0,0,0,0,0,0|1,0,2]=3 124 B9R1.1 OCC1=CC=C(Br)C=C1 NO19378 [0,0,0,0,0,0|1,0,0]=1 125 B9R1.1 OCC1=CC=C(Cl)C=C1 NO19353 [0,0,0,0,0,0|1,0,0]=1 126 B9R1.1 OCC1=CC=C(O)C=C1 NO19212 [0,0,0,0,0,0|0,0,0]=0 127 B9R1.1 OCC1=CN=C(Cl)C=C1 DY20657 [0,0,0,0,0,0|2,0,0]=2 128 B9R1.1 OCC1=NC=C(Br)C=C1 NO23005 [0,0,0,0,0,0|2,0,0]=2 129 B9R1.1 OCC1=NC=C(Cl)C=C1 NO21758 [0,0,0,0,0,0|2,0,0]=2 130 B9R1.1 OCC1=NC=C(Cl)N=C1 NO14569 [0,0,0,0,0,0|3,0,0]=3 131 B9R1.1 OCC1=NC=C(F)C=C1 NO10382 [0,0,0,0,0,0|2,0,0]=2 132 B9R1.1 OCC1=NC=C(F)C=N1 DY103703 [0,0,0,0,0,0|3,0,0]=3 133 B8R1.2 BrCC1=CC=CN=N1 NO15758 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.2 BrCC1=CC=NC=C1 NO22459 [1,0,0,0,0,0|2,0,0]=3 135 B8R1.2 BrCC1=CN=CN=C1 NO17938 [1,0,0,0,0,0|3,0,0]=4 136 B8R1.2 BrCC1=NC=CN=C1 DY710893 [1,0,0,0,0,0|3,0,0]=4 137 B8R1.2 C#CC1=CC=CC=C1 NO19127 [1,0,0,0,0,0|1,0,1]=3 138 B8R1.2 C#CC1=CC=NC=C1 DY544323 [1,0,0,0,0,0|2,0,1]=4 139 B8R1.2 C#CC1=NC=CC=C1 NO21539 [1,0,0,0,0,0|2,0,1]=4 140 B8R1.2 C=CC1=CC=CN=C1 DY507011 [1,0,0,0,0,0|2,0,1]=4 141 B8R1.2 CCC1=CC=CN=C1 NO22277 [1,0,0,0,0,0|2,0,0]=3 142 B8R1.2 CCC1=NC=CN=C1 NO21534 [1,0,0,0,0,0|3,0,0]=4 143 B8R1.2 CNC1=CC=CC=C1 NO11792 [1,0,0,0,0,0|2,0,0]=3 144 B8R1.2 CNC1=CC=CN=C1 NO13856 [1,0,0,0,0,0|3,0,0]=4 145 B8R1.2 COC1=CC=CN=C1 NO22348 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.2 COC1=CC=NC=C1 NO19206 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.2 COC1=CC=[C-]C=C1 DY747109 [1,0,0,0,0,0|2,0,1]=4 148 B8R1.2 COC1=NC=CC=C1 NO18780 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.2 ClCC1=CC=CN=C1 NO19291 [1,0,0,0,0,0|2,0,0]=3 150 B8R1.2 ClCC1=CC=CN=N1 NO16004 [1,0,0,0,0,0|3,0,0]=4 151 B8R1.2 ClCC1=NC=CC=C1 NO19289 [1,0,0,0,0,0|2,0,0]=3 152 B8R1.2 ClCC1=NC=CC=N1 NO20902 [1,0,0,0,0,0|3,0,0]=4 153 B8R1.2 ClSC1=CC=CC=C1 DY799077 [1,0,0,0,0,0|2,0,0]=3 154 B8R1.2 ICC1=CC=CC=C1 NO11000 [1,0,0,0,0,0|1,0,0]=2 155 B8R1.2 N#CC1=CN=CC=C1 NO22263 [1,0,0,0,0,0|2,0,1]=4 156 B8R1.2 N#CC1=NC=CC=C1 NO19642 [1,0,0,0,0,0|2,0,1]=4 157 B8R1.2 N#Cc1ccccc1 NO13696 [1,0,0,0,0,0|1,0,1]=3 158 B8R1.2 NCC1=CC=CN=C1 NO14226 [1,0,0,0,0,0|2,0,0]=3 159 B8R1.2 NCC1=CC=NC=C1 NO11906 [1,0,0,0,0,0|2,0,0]=3 160 B8R1.2 NCC1=CC=NC=C1 NO19023 [1,0,0,0,0,0|2,0,0]=3 161 B8R1.2 NCC1=CN=NC=C1 NO15014 [1,0,0,0,0,0|3,0,0]=4 162 B8R1.2 NCC1=CN=NC=C1 NO15515 [1,0,0,0,0,0|3,0,0]=4 163 B8R1.2 NCC1=NC=CC=C1 DY663911 [1,0,0,0,0,0|2,0,0]=3 164 B8R1.2 NCC1=NC=CC=N1 NO21304 [1,0,0,0,0,0|3,0,0]=4 165 B8R1.2 NCC1=NC=CN=C1 DY710323 [1,0,0,0,0,0|3,0,0]=4 166 B8R1.2 NCC1=NC=CN=C1 NO19691 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.2 NCC1=NC=CN=C1 NO20245 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.2 NNC1=CC=CC=C1 NO15210 [1,0,0,0,0,0|2,0,0]=3 169 B8R1.2 NNC1=CC=CN=C1 NO15491 [1,0,0,0,0,0|3,0,0]=4 170 B8R1.2 NNC1=CC=CN=C1 NO22308 [1,0,0,0,0,0|3,0,0]=4 171 B8R1.2 NNC1=CC=NC=C1 DY20777 [1,0,0,0,0,0|3,0,0]=4 172 B8R1.2 NNC1=NC=CC=C1 NO15589 [1,0,0,0,0,0|3,0,0]=4 173 B8R1.2 NNC1=NC=CC=C1 NO21573 [1,0,0,0,0,0|3,0,0]=4 174 B8R1.2 O=CC1=CC=NC=C1 DY458075 [1,0,0,0,0,0|1,0,2]=4 175 B8R1.2 O=CC1=CN=CC=C1 NO19090 [1,0,0,0,0,0|1,0,2]=4 176 B8R1.2 O=CC1=NC=CC=C1 NO18610 [1,0,0,0,0,0|1,0,2]=4 177 B8R1.2 OCC1=CC=CN=C1 NO22409 [1,0,0,0,0,0|1,0,0]=2 178 B8R1.2 OCC1=CC=CN=N1 NO21870 [1,0,0,0,0,0|2,0,0]=3 179 B8R1.2 OCC1=CC=NC=C1 NO19163 [1,0,0,0,0,0|1,0,0]=2 180 B8R1.2 OCC1=CN=CN=C1 DY444370 [1,0,0,0,0,0|2,0,0]=3 181 B8R1.2 OCC1=NC=CC=C1 NO19164 [1,0,0,0,0,0|1,0,0]=2 182 B8R1.2 OCC1=NC=CC=N1 NO19924 [1,0,0,0,0,0|2,0,0]=3 183 B8R1.2 OCC1=NC=CN=C1 NO21749 [1,0,0,0,0,0|2,0,0]=3 184 B8R1.2 OCC1=NC=NC=C1 NO11915 [1,0,0,0,0,0|2,0,0]=3 185 B8R1.3 BrC1=CC=C(Br)C=C1 DY41477 [1,0,0,0,0,0|2,0,0]=3 186 B8R1.3 BrC1=CC=C(I)C=C1 NO22911 [1,0,0,0,0,0|2,0,0]=3 187 B8R1.3 BrC1=CN=C(Br)C=C1 NO21792 [1,0,0,0,0,0|3,0,0]=4 188 B8R1.3 BrC1=CN=C(I)C=C1 NO22029 [1,0,0,0,0,0|3,0,0]=4 189 B8R1.3 BrC1=NC=C(I)C=C1 NO15803 [1,0,0,0,0,0|3,0,0]=4 190 B8R1.3 CC1=CC=C(Br)C=C1 DY20922 [1,0,0,0,0,0|1,0,0]=2 191 B8R1.3 CC1=CC=C(Br)N=N1 NO12937 [1,0,0,0,0,0|3,0,0]=4 192 B8R1.3 CC1=CC=C(Cl)N=N1 NO17682 [1,0,0,0,0,0|3,0,0]=4 193 B8R1.3 CC1=CC=C(N)C=C1 NO11898 [1,0,0,0,0,0|1,0,0]=2 194 B8R1.3 CC1=CC=C(N)C=N1 NO19519 [1,0,0,0,0,0|2,0,0]=3 195 B8R1.3 CC1=CN=C(Br)C=C1 NO21837 [1,0,0,0,0,0|2,0,0]=3 196 B8R1.3 CC1=CN=C(Br)N=C1 NO12207 [1,0,0,0,0,0|3,0,0]=4 197 B8R1.3 CC1=CN=C(C)C=C1 NO21154 [1,0,0,0,0,0|2,0,0]=3 198 B8R1.3 CC1=CN=C(Cl)C=C1 NO19287 [1,0,0,0,0,0|2,0,0]=3 199 B8R1.3 CC1=CN=C(Cl)C=N1 NO21471 [1,0,0,0,0,0|3,0,0]=4 200 B8R1.3 CC1=CN=C(Cl)N=C1 NO19723 [1,0,0,0,0,0|3,0,0]=4 201 B8R1.3 CC1=CN=C(F)C=C1 NO21872 [1,0,0,0,0,0|2,0,0]=3 202 B8R1.3 CC1=CN=C(N)C=C1 NO21820 [1,0,0,0,0,0|2,0,0]=3 203 B8R1.3 CC1=CN=C(N)C=N1 NO18361 [1,0,0,0,0,0|3,0,0]=4 204 B8R1.3 CC1=CN=C(N)N=C1 NO21761 [1,0,0,0,0,0|3,0,0]=4 205 B8R1.3 CC1=CN=C(O)C=C1 NO16275 [1,0,0,0,0,0|1,0,0]=2 206 B8R1.3 CC1=CN=C(O)C=N1 NO12289 [1,0,0,0,0,0|2,0,0]=3 207 B8R1.3 CC1=CN=C(S)N=C1 DY584327 [1,0,0,0,0,0|2,1,0]=4 208 B8R1.3 CC1=CNC(=O)C=C1 NO21591 [1,0,0,0,0,0|1,0,1]=3 209 B8R1.3 CC1=CNC(=S)N=C1 DY554409 [1,0,0,0,0,0|2,1,0]=4 210 B8R1.3 CC1=NC=C(Br)C=C1 NO22031 [1,0,0,0,0,0|2,0,0]=3 211 B8R1.3 CC1=NC=C(Cl)C=C1 DY568875 [1,0,0,0,0,0|2,0,0]=3 212 B8R1.3 CC1=NC=C(Cl)C=N1 NO10333 [1,0,0,0,0,0|3,0,0]=4 213 B8R1.3 CC1=NC=C(N)C=N1 NO14284 [1,0,0,0,0,0|3,0,0]=4 214 B8R1.3 CC1=NC=C(O)C=N1 NO10401 [1,0,0,0,0,0|2,0,0]=3 215 B8R1.3 CC1=NNC(=O)C=C1 DY736970 [1,0,0,0,0,0|2,0,1]=4 216 B8R1.3 CC1=NNC(=O)C=C1 NO19836 [1,0,0,0,0,0|2,0,1]=4 217 B8R1.3 ClC1=CC=C(Br)C=C1 NO22677 [1,0,0,0,0,0|2,0,0]=3 218 B8R1.3 ClC1=CC=C(I)C=C1 NO19235 [1,0,0,0,0,0|2,0,0]=3 219 B8R1.3 ClC1=CN=C(Br)C=C1 NO17275 [1,0,0,0,0,0|3,0,0]=4 220 B8R1.3 ClC1=CN=C(Cl)C=C1 NO13779 [1,0,0,0,0,0|3,0,0]=4 221 B8R1.3 ClC1=CN=C(I)C=C1 NO18901 [1,0,0,0,0,0|3,0,0]=4 222 B8R1.3 ClC1=NC=C(Br)C=C1 NO14919 [1,0,0,0,0,0|3,0,0]=4 223 B8R1.3 ClC1=NC=C(I)C=C1 NO17315 [1,0,0,0,0,0|3,0,0]=4 224 B8R1.3 FC1=CC=C(Cl)C=C1 NO20666 [1,0,0,0,0,0|2,0,0]=3 225 B8R1.3 FC1=CC=C(I)C=C1 NO22840 [1,0,0,0,0,0|2,0,0]=3 226 B8R1.3 FC1=CC=C(S)C=C1 DY20299 [1,0,0,0,0,0|1,1,0]=3 227 B8R1.3 FC1=CN=C(Br)C=C1 NO21836 [1,0,0,0,0,0|3,0,0]=4 228 B8R1.3 FC1=CN=C(Cl)C=C1 NO21851 [1,0,0,0,0,0|3,0,0]=4 229 B8R1.3 FC1=CN=C(I)C=C1 NO10383 [1,0,0,0,0,0|3,0,0]=4 230 B8R1.3 FC1=NC=C(Br)C=C1 NO22028 [1,0,0,0,0,0|3,0,0]=4 231 B8R1.3 FC1=NC=C(Cl)C=C1 NO17313 [1,0,0,0,0,0|3,0,0]=4 232 B8R1.3 FC1=NC=C(I)C=C1 NO17371 [1,0,0,0,0,0|3,0,0]=4 233 B8R1.3 IC1=CC=C(I)C=C1 NO19213 [1,0,0,0,0,0|2,0,0]=3 234 B8R1.3 NC1=CC=C(Br)N=C1 NO21910 [1,0,0,0,0,0|3,0,0]=4 235 B8R1.3 NC1=CC=C(Cl)C=C1 NO18588 [1,0,0,0,0,0|2,0,0]=3 236 B8R1.3 NC1=CC=C(Cl)N=C1 NO21849 [1,0,0,0,0,0|3,0,0]=4 237 B8R1.3 NC1=CC=C(F)N=C1 NO22740 [1,0,0,0,0,0|3,0,0]=4 238 B8R1.3 NC1=CC=C(I)C=C1 DY452056 [1,0,0,0,0,0|2,0,0]=3 239 B8R1.3 NC1=CC=C(N)C=C1 DY822026 [1,0,0,0,0,0|2,0,0]=3 240 B8R1.3 NC1=CC=C(N)C=C1 NO18589 [1,0,0,0,0,0|2,0,0]=3 241 B8R1.3 NC1=CC=C(O)C=N1 NO13087 [1,0,0,0,0,0|2,0,0]=3 242 B8R1.3 NC1=CC=C(O)C=N1 NO18367 [1,0,0,0,0,0|2,0,0]=3 243 B8R1.3 NC1=CN=C(N)C=C1 NO15186 [1,0,0,0,0,0|3,0,0]=4 244 B8R1.3 NC1=CN=C(O)C=C1 NO10211 [1,0,0,0,0,0|2,0,0]=3 245 B8R1.3 NC1=CN=C(O)C=C1 NO18129 [1,0,0,0,0,0|2,0,0]=3 246 B8R1.3 NC1=CNC(=O)C=C1 NO15177 [1,0,0,0,0,0|2,0,1]=4 247 B8R1.3 NC1=NC=C(Cl)C=C1 NO21816 [1,0,0,0,0,0|3,0,0]=4 248 B8R1.3 NC1=NC=C(F)C=C1 NO21818 [1,0,0,0,0,0|3,0,0]=4 249 B8R1.3 NC1=NC=C(I)C=C1 NO17736 [1,0,0,0,0,0|3,0,0]=4 250 B8R1.3 NC1=NC=C(O)C=N1 NO17222 [1,0,0,0,0,0|3,0,0]=4 251 B8R1.3 O=C1C=CC(O)=CN1 NO15928 [1,0,0,0,0,0|1,0,1]=3 252 B8R1.3 OC1=CC=C(Br)N=C1 NO14988 [1,0,0,0,0,0|2,0,0]=3 253 B8R1.3 OC1=CC=C(Cl)C=C1 NO22792 [1,0,0,0,0,0|1,0,0]=2 254 B8R1.3 OC1=CC=C(Cl)N=C1 NO21853 [1,0,0,0,0,0|2,0,0]=3 255 B8R1.3 OC1=CC=C(F)N=C1 NO14991 [1,0,0,0,0,0|2,0,0]=3 256 B8R1.3 OC1=CC=C(I)C=C1 DY20152 [1,0,0,0,0,0|1,0,0]=2 257 B8R1.3 OC1=CC=C(O)N=N1 NO13566 [1,0,0,0,0,0|2,0,0]=3 258 B8R1.3 OC1=CN=C(Cl)N=C1 NO14550 [1,0,0,0,0,0|3,0,0]=4 259 B8R1.3 OC1=CN=C(O)C=C1 NO21147 [1,0,0,0,0,0|1,0,0]=2 260 B8R1.3 OC1=NC=C(Br)C=C1 NO22706 [1,0,0,0,0,0|2,0,0]=3 261 B8R1.3 OC1=NC=C(Br)C=N1 NO15434 [1,0,0,0,0,0|3,0,0]=4 262 B8R1.3 OC1=NC=C(Br)N=C1 NO19024 [1,0,0,0,0,0|3,0,0]=4 263 B8R1.3 OC1=NC=C(Cl)N=C1 NO19402 [1,0,0,0,0,0|3,0,0]=4 264 B8R1.3 OC1=NC=C(I)C=C1 NO13623 [1,0,0,0,0,0|2,0,0]=3 265 B8R1.3 SC1=CC=C(Br)C=C1 DY20198 [1,0,0,0,0,0|1,1,0]=3 266 B8R1.3 SC1=CC=C(Cl)C=C1 DY822118 [1,0,0,0,0,0|1,1,0]=3 267 B8R1.3 SC1=CC=C(S)C=C1 DY563991 [1,0,0,0,0,0|0,2,0]=3 268 B8R1.3 SC1=NC=C(Cl)C=C1 DY659984 [1,0,0,0,0,0|2,1,0]=4 269 B8R1.3 [O-][N+]1=CC=C(Br)C=C1 NO22699 [1,0,0,0,0,0|2,0,1]=4 270 B10R1.1 BrCCC1=CC=C(Br)C=C1 DY531753 [0,1,0,0,0,0|2,0,0]=3 271 B10R1.1 CC#CC1=CC=C(Br)C=C1 DY788811 [0,1,0,0,0,0|2,0,1]=4 272 B10R1.1 CC1=CC=C(CC#N)C=C1 NO21709 [0,1,0,0,0,0|2,0,0]=3 273 B10R1.1 CC1=CC=C(CCBr)C=C1 NO19977 [0,1,0,0,0,0|2,0,0]=3 274 B10R1.1 CC1=CC=C(CCN)C=C1 NO18979 [0,1,0,0,0,0|2,0,0]=3 275 B10R1.1 CC1=CC=C(CNN)C=C1 NO20201 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.1 CC1=CN=C(CCN)C=C1 DY654264 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.1 CCCC1=CC=C(Br)C=C1 NO10896 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.1 CCNC1=CC=C(C)C=C1 DY822062 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.1 CCNC1=CC=C(Cl)C=C1 DY745663 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.1 CCNC1=NC=C(Br)C=C1 DY659768 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.1 CCOC1=CC=C(I)C=C1 NO22907 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.1 CCOC1=CC=C(N)C=C1 NO11879 [0,1,0,0,0,0|2,0,0]=3 283 B10R1.1 CCOC1=CC=C(O)C=C1 DY563859 [0,1,0,0,0,0|1,0,0]=2 284 B10R1.1 CCOC1=CN=C(N)C=C1 NO15063 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.1 CCOC1=NC=C(Br)C=C1 NO22026 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.1 CCOC1=NC=C(N)C=C1 NO14713 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.1 CNCC1=CC=C(Br)C=C1 NO19272 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.1 CNCC1=CC=C(C)C=C1 NO11795 [0,1,0,0,0,0|2,0,0]=3 289 B10R1.1 CNCC1=CC=C(Cl)C=C1 DY455886 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.1 CNCC1=CC=C(Cl)N=C1 DY511497 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.1 CNCC1=CC=C(F)C=C1 DY585104 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.1 COCC1=CC=C(O)C=N1 DY712897 [0,1,0,0,0,0|1,0,0]=2 293 B10R1.1 COCC1=NC=C(O)C=N1 DY693100 [0,1,0,0,0,0|2,0,0]=3 294 B10R1.1 CSCC1=CN=C(Cl)C=C1 DY606927 [0,1,0,0,0,0|2,1,0]=4 295 B10R1.1 CSCC1=NC=C(Br)C=C1 DY112104 [0,1,0,0,0,0|2,1,0]=4 296 B10R1.1 ClC1=CC=C(CCBr)C=C1 NO10835 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.1 ClCCC1=CN=C(Cl)C=C1 DY714175 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.1 FC1=CC=C(CCBr)C=C1 NO10866 [0,1,0,0,0,0|2,0,0]=3 299 B10R1.1 FC1=CC=C(CCCl)C=C1 DY584346 [0,1,0,0,0,0|2,0,0]=3 300 B10R1.1 N#CCC1=CC=C(Br)C=C1 NO20687 [0,1,0,0,0,0|2,0,0]=3 301 B10R1.1 N#CCC1=CC=C(Cl)C=C1 DY20790 [0,1,0,0,0,0|2,0,0]=3 302 B10R1.1 N#CCC1=CC=C(Cl)N=C1 NO19041 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.1 N#CCC1=CC=C(F)C=C1 NO14479 [0,1,0,0,0,0|2,0,0]=3 304 B10R1.1 N#CCC1=CC=C(O)C=C1 DY522681 [0,1,0,0,0,0|1,0,0]=2 305 B10R1.1 N#CCC1=NC=C(Br)C=C1 NO19461 [0,1,0,0,0,0|3,0,0]=4 306 B10R1.1 N#CCC1=NC=C(Cl)C=C1 NO15674 [0,1,0,0,0,0|3,0,0]=4 307 B10R1.1 NC1=CC=C(CCO)C=C1 NO13450 [0,1,0,0,0,0|1,0,0]=2 308 B10R1.1 NCCC1=CC=C(Br)C=C1 NO19296 [0,1,0,0,0,0|2,0,0]=3 309 B10R1.1 NCCC1=CC=C(F)C=C1 NO13766 [0,1,0,0,0,0|2,0,0]=3 310 B10R1.1 NNCC1=CC=C(Cl)C=C1 DY570291 [0,1,0,0,0,0|2,0,0]=3 311 B10R1.1 NNCC1=CC=C(Cl)C=C1 DY583979 [0,1,0,0,0,0|2,0,0]=3 312 B10R1.1 NNCC1=CC=C(F)C=C1 DY567861 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.1 NNCC1=CC=C(F)C=C1 NO17057 [0,1,0,0,0,0|2,0,0]=3 314 B10R1.1 O=C=NC1=CC=C(F)C=C1 DY33036 [0,1,0,0,0,0|1,0,2]=4 315 B10R1.1 O=CCC1=CC=C(Br)C=C1 NO18203 [0,1,0,0,0,0|1,0,1]=3 316 B10R1.1 OCCC1=CC=C(Br)C=C1 NO14491 [0,1,0,0,0,0|1,0,0]=2 317 B10R1.1 OCCC1=CC=C(Cl)C=C1 NO22791 [0,1,0,0,0,0|1,0,0]=2 318 B10R1.1 OCCC1=CC=C(Cl)N=C1 DY509192 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.1 OCCC1=CC=C(O)C=C1 NO20458 [0,1,0,0,0,0|0,0,0]=1 320 B10R1.3 C#CC1=CC=C(C=O)C=C1 NO21472 [0,1,0,0,0,0|1,0,2]=4 321 B10R1.3 C#CC1=CC=C(CN)C=C1 DY537105 [0,1,0,0,0,0|2,0,0]=3 322 B10R1.3 C#CC1=CC=C(OC)C=C1 NO21617 [0,1,0,0,0,0|1,0,1]=3 323 B10R1.3 C=CC1=CC=C(C#N)C=C1 DY549885 [0,1,0,0,0,0|2,0,1]=4 324 B10R1.3 C=CC1=CN=C(OC)C=C1 DY544047 [0,1,0,0,0,0|2,0,1]=4 325 B10R1.3 CCC1=CC=C(C#N)C=C1 DY585128 [0,1,0,0,0,0|2,0,0]=3 326 B10R1.3 CCC1=CC=C(CC)C=C1 DY822052 [0,1,0,0,0,0|2,0,0]=3 327 B10R1.3 CCC1=CC=C(CO)C=C1 DY450460 [0,1,0,0,0,0|1,0,0]=2 328 B10R1.3 CCC1=CC=C(NN)C=C1 NO16126 [0,1,0,0,0,0|2,0,0]=3 329 B10R1.3 COC1=CC=C(C#N)C=C1 NO19381 [0,1,0,0,0,0|1,0,1]=3 330 B10R1.3 COC1=CC=C(C=O)C=C1 NO18687 [0,1,0,0,0,0|0,0,2]=3 331 B10R1.3 COC1=CC=C(CBr)C=C1 DY545847 [0,1,0,0,0,0|1,0,0]=2 332 B10R1.3 COC1=CC=C(CF)C=C1 DY530067 [0,1,0,0,0,0|1,0,0]=2 333 B10R1.3 COC1=CC=C(CN)C=C1 NO18898 [0,1,0,0,0,0|1,0,0]=2 334 B10R1.3 COC1=CC=C(CN)C=N1 DY103395 [0,1,0,0,0,0|2,0,0]=3 335 B10R1.3 COC1=CC=C(CO)C=C1 NO22932 [0,1,0,0,0,0|0,0,0]=1 336 B10R1.3 COC1=CC=C(CO)C=N1 NO15243 [0,1,0,0,0,0|1,0,0]=2 337 B10R1.3 COC1=CC=C(NN)C=C1 NO19581 [0,1,0,0,0,0|2,0,0]=3 338 B10R1.3 COC1=CN=C(C=O)C=C1 NO10425 [0,1,0,0,0,0|1,0,2]=4 339 B10R1.3 COC1=CN=C(CCl)C=C1 NO12684 [0,1,0,0,0,0|2,0,0]=3 340 B10R1.3 COC1=CN=C(CO)C=N1 DY569169 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.3 COC1=CN=C(OC)C=C1 DY452356 [0,1,0,0,0,0|3,0,0]=4 342 B10R1.3 COC1=NC=C(C=O)C=C1 NO20322 [0,1,0,0,0,0|1,0,2]=4 343 B10R1.3 COC1=NC=C(CBr)C=C1 DY712957 [0,1,0,0,0,0|2,0,0]=3 344 B10R1.3 COC1=NC=C(CBr)C=C1 NO17111 [0,1,0,0,0,0|2,0,0]=3 345 B10R1.3 COC1=NC=C(CCl)C=C1 NO16575 [0,1,0,0,0,0|2,0,0]=3 346 B10R1.3 COC1=NC=C(CN)C=N1 NO16815 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.3 COC1=NC=C(NN)C=C1 NO16925 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.3 CSC1=CC=C(NN)C=C1 DY794649 [0,1,0,0,0,0|2,1,0]=4 349 B10R1.3 N#CC1=CC=C(C#N)C=C1 NO11975 [0,1,0,0,0,0|2,0,1]=4 350 B10R1.3 N#CC1=CC=C(C=O)C=C1 NO13468 [0,1,0,0,0,0|1,0,2]=4 351 B10R1.3 N#CC1=CC=C(CBr)C=C1 NO18792 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.3 N#CC1=CC=C(CCl)C=C1 NO17835 [0,1,0,0,0,0|2,0,0]=3 353 B10R1.3 N#CC1=CC=C(CN)C=C1 NO19851 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.3 N#CC1=CC=C(NN)C=C1 NO20304 [0,1,0,0,0,0|2,0,1]=4 355 B10R1.3 N#CC1=CN=C(CBr)C=C1 NO16043 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.3 N#CC1=CN=C(CCl)C=C1 NO16901 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.3 N#CC1=CN=C(CO)C=C1 NO16902 [0,1,0,0,0,0|2,0,0]=3 358 B10R1.3 NCC1=CC=C(CO)C=C1 NO18290 [0,1,0,0,0,0|1,0,0]=2 359 B10R1.3 O=CC1=CC=C(C=O)C=C1 NO11974 [0,1,0,0,0,0|0,0,3]=4 360 B10R1.3 O=CC1=CC=C(CBr)C=C1 DY41097 [0,1,0,0,0,0|1,0,1]=3 361 B10R1.3 O=CC1=CC=C(CCl)C=C1 DY569403 [0,1,0,0,0,0|1,0,1]=3 362 B10R1.3 O=CC1=CC=C(CO)C=C1 NO15415 [0,1,0,0,0,0|0,0,1]=2 363 B10R1.3 OCC1=CC=C(CBr)C=C1 NO20041 [0,1,0,0,0,0|1,0,0]=2 364 B10R1.3 OCC1=CC=C(CO)C=C1 NO20456 [0,1,0,0,0,0|0,0,0]=1 365 B10R1.13 C=C(C)C1=CC=C(C)C=C1 DY790917 [0,1,0,0,0,0|2,0,1]=4 366 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 NO19447 [0,1,0,0,0,0|1,0,2]=4 367 B10R1.13 CC(=O)C1=CC=C(C)C=C1 NO13558 [0,1,0,0,0,0|1,0,2]=4 368 B10R1.13 CC(=O)C1=CC=C(F)C=C1 NO14299 [0,1,0,0,0,0|1,0,2]=4 369 B10R1.13 CC(=O)C1=CC=C(N)C=C1 DY20162 [0,1,0,0,0,0|1,0,2]=4 370 B10R1.13 CC(=O)C1=CC=C(N)C=C1 DY795321 [0,1,0,0,0,0|1,0,2]=4 371 B10R1.13 CC(=O)C1=CC=C(O)C=C1 NO22884 [0,1,0,0,0,0|0,0,2]=3 372 B10R1.13 CC(=O)C1=CC=C(O)N=C1 NO12692 [0,1,0,0,0,0|1,0,2]=4 373 B10R1.13 CC(=O)c1ccc(I)cc1 DY433245 [0,1,0,0,0,0|1,0,2]=4 374 B10R1.13 CC(Br)C1=CC=C(F)C=C1 NO16140 [0,1,0,0,0,0|2,0,0]=3 375 B10R1.13 CC(C)C1=CC=C(Br)C=C1 NO19162 [0,1,0,0,0,0|2,0,0]=3 376 B10R1.13 CC(C)C1=CC=C(F)C=C1 DY584364 [0,1,0,0,0,0|2,0,0]=3 377 B10R1.13 CC(C)C1=CC=C(N)C=C1 NO22915 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.13 CC(C)C1=CC=C(N)C=N1 NO22406 [0,1,0,0,0,0|3,0,0]=4 379 B10R1.13 CC(C)C1=CC=C(O)C=C1 DY583593 [0,1,0,0,0,0|1,0,0]=2 380 B10R1.13 CC(C)C1=CN=C(N)C=C1 NO21752 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.13 CC(N)C1=CC=C(F)C=C1 DY40832 [0,1,0,0,0,0|2,0,0]=3 382 B10R1.13 CC(N)C1=CC=C(N)C=C1 NO22422 [0,1,0,0,0,0|2,0,0]=3 383 B10R1.13 CC(O)C1=CC=C(Br)C=C1 DY448036 [0,1,0,0,0,0|1,0,0]=2 384 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 DY549597 [0,1,0,0,0,0|1,0,0]=2 385 B10R1.13 CC(O)C1=CN=C(Cl)N=C1 DY516081 [0,1,0,0,0,0|3,0,0]=4 386 B10R1.13 CC(O)C1=NC=C(Br)C=C1 DY446891 [0,1,0,0,0,0|2,0,0]=3 387 B10R1.13 CC1=CC=C(B(O)O)C=C1 NO10128 [0,1,0,0,0,0|2,0,0]=3 388 B10R1.13 CC1=CC=C(B(O)O)C=N1 NO18413 [0,1,0,0,0,0|3,0,0]=4 389 B10R1.13 CC1=CC=C(C(=N)N)C=C1 NO20439 [0,1,0,0,0,0|2,0,1]=4 390 B10R1.13 CC1=CC=C(C(N)=O)C=C1 NO11895 [0,1,0,0,0,0|1,0,2]=4 391 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 NO11896 [0,1,0,0,0,0|2,0,1]=4 392 B10R1.13 CC1=CC=C([C@@H](C)N)C=N1 DY716654 [0,1,0,0,0,0|3,0,0]=4 393 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 DY545757 [0,1,0,0,0,0|2,0,0]=3 394 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 NO18822 [0,1,0,0,0,0|2,0,1]=4 395 B10R1.13 CC1=CN=C(C(=O)O)C=C1 NO10458 [0,1,0,0,0,0|2,0,1]=4 396 B10R1.13 CC1=CN=C(C(=O)O)C=C1 NO17310 [0,1,0,0,0,0|2,0,1]=4 397 B10R1.13 CC1=CN=C(C(C)N)C=C1 DY577449 [0,1,0,0,0,0|3,0,0]=4 398 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 DY511971 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.13 CC1=NC=C(C(=O)O)C=C1 NO20324 [0,1,0,0,0,0|2,0,1]=4 400 B10R1.13 CN(C)C1=CC=C(Br)C=C1 NO15132 [0,1,0,0,0,0|3,0,0]=4 401 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 DY20289 [0,1,0,0,0,0|3,0,0]=4 402 B10R1.13 CN(C)C1=CC=C(O)C=C1 NO16528 [0,1,0,0,0,0|2,0,0]=3 403 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 NO20256 [0,1,0,0,0,0|2,0,0]=3 404 B10R1.13 C[C@@H](N)C1=CC=C(N)C=C1 DY565797 [0,1,0,0,0,0|2,0,0]=3 405 B10R1.13 C[C@@H](N)C1=NC=C(Br)C=C1 DY621591 [0,1,0,0,0,0|3,0,0]=4 406 B10R1.13 C[C@H](N)C1=CC=C(Br)N=C1 DY651938 [0,1,0,0,0,0|3,0,0]=4 407 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 DY554067 [0,1,0,0,0,0|2,0,0]=3 408 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 DY541875 [0,1,0,0,0,0|1,0,0]=2 409 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 NO16980 [0,1,0,0,0,0|3,0,0]=4 410 B10R1.13 Cc1ccc(C(C)C)cc1 DY444976 [0,1,0,0,0,0|2,0,0]=3 411 B10R1.13 FC(F)C1=CN=C(Cl)C=C1 DY429162 [0,1,0,0,0,0|3,0,0]=4 412 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 DY21022 [0,1,0,0,0,0|2,0,1]=4 413 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 NO20283 [0,1,0,0,0,0|2,0,1]=4 414 B10R1.13 N=C(N)C1=CC=C(F)C=C1 NO18318 [0,1,0,0,0,0|2,0,1]=4 415 B10R1.13 N=C(N)C1=CC=C(N)C=C1 NO21974 [0,1,0,0,0,0|2,0,1]=4 416 B10R1.13 NC(=O)C1=CC=C(F)C=C1 NO10426 [0,1,0,0,0,0|1,0,2]=4 417 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 DY544419 [0,1,0,0,0,0|1,1,1]=4 418 B10R1.13 NC(=S)C1=CC=C(F)C=C1 DY584372 [0,1,0,0,0,0|1,1,1]=4 419 B10R1.13 NC(=S)C1=CC=C(O)C=C1 NO20343 [0,1,0,0,0,0|0,1,1]=3 420 B10R1.13 NC1=CC=C(B(O)O)C=C1 DY442888 [0,1,0,0,0,0|2,0,0]=3 421 B10R1.13 NC1=CC=C(B(O)O)C=C1 DY707539 [0,1,0,0,0,0|2,0,0]=3 422 B10R1.13 NC1=CC=C(B(O)O)C=C1 NO19513 [0,1,0,0,0,0|2,0,0]=3 423 B10R1.13 NC1=CC=C(B(O)O)C=N1 DY21015 [0,1,0,0,0,0|3,0,0]=4 424 B10R1.13 NC1=CC=C(C(F)F)C=C1 NO17592 [0,1,0,0,0,0|2,0,0]=3 425 B10R1.13 NC1=CC=C(C(F)F)N=C1 NO16709 [0,1,0,0,0,0|3,0,0]=4 426 B10R1.13 NC1=CN=C(C(=O)O)C=C1 NO19367 [0,1,0,0,0,0|2,0,1]=4 427 B10R1.13 NC1=NC=C(C(=O)O)C=C1 NO19354 [0,1,0,0,0,0|2,0,1]=4 428 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 DY433701 [0,1,0,0,0,0|1,0,2]=4 429 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 NO20082 [0,1,0,0,0,0|1,0,1]=3 430 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 NO15821 [0,1,0,0,0,0|1,0,1]=3 431 B10R1.13 O=C(O)C1=CC=C(I)C=C1 NO20135 [0,1,0,0,0,0|1,0,1]=3 432 B10R1.13 O=C(O)C1=CC=C(O)C=C1 NO22885 [0,1,0,0,0,0|0,0,1]=2 433 B10R1.13 O=C(O)C1=CC=C(O)N=N1 NO17550 [0,1,0,0,0,0|2,0,1]=4 434 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 NO22092 [0,1,0,0,0,0|2,0,1]=4 435 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 NO22101 [0,1,0,0,0,0|2,0,1]=4 436 B10R1.13 O=C(O)C1=CN=C(F)C=C1 NO18891 [0,1,0,0,0,0|2,0,1]=4 437 B10R1.13 O=C(O)C1=CN=C(O)C=C1 NO19189 [0,1,0,0,0,0|1,0,1]=3 438 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 NO22033 [0,1,0,0,0,0|2,0,1]=4 439 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 NO19376 [0,1,0,0,0,0|2,0,1]=4 440 B10R1.13 O=C(O)C1=NC=C(F)C=C1 NO10387 [0,1,0,0,0,0|2,0,1]=4 441 B10R1.13 O=C(O)C1=NC=C(I)C=C1 NO10412 [0,1,0,0,0,0|2,0,1]=4 442 B10R1.13 O=C(O)C1=NC=C(O)C=C1 NO22997 [0,1,0,0,0,0|1,0,1]=3 443 B10R1.13 O=C(O)C1=NC=C(O)N=C1 DY550083 [0,1,0,0,0,0|2,0,1]=4 444 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 DY40351 [0,1,0,0,0,0|1,0,2]=4 445 B10R1.13 O=C1C=CC(C(F)F)=CN1 DY432336 [0,1,0,0,0,0|2,0,1]=4 446 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 NO18786 [0,1,0,0,0,0|2,0,1]=4 447 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 NO22843 [0,1,0,0,0,0|2,0,1]=4 448 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 NO19234 [0,1,0,0,0,0|2,0,1]=4 449 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=N1 NO19719 [0,1,0,0,0,0|2,0,1]=4 450 B10R1.13 O=[N+]([O-])C1=CN=C(O)C=C1 NO22717 [0,1,0,0,0,0|2,0,1]=4 451 B10R1.13 O=[PH](O)C1=CC=C(Br)C=C1 DY746683 [0,1,0,0,0,0|2,0,0]=3 452 B10R1.13 OB(O)C1=CC=C(Br)C=C1 NO19222 [0,1,0,0,0,0|2,0,0]=3 453 B10R1.13 OB(O)C1=CC=C(Br)N=C1 NO17585 [0,1,0,0,0,0|3,0,0]=4 454 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 NO19227 [0,1,0,0,0,0|2,0,0]=3 455 B10R1.13 OB(O)C1=CC=C(Cl)N=C1 NO17598 [0,1,0,0,0,0|3,0,0]=4 456 B10R1.13 OB(O)C1=CC=C(F)C=C1 NO23000 [0,1,0,0,0,0|2,0,0]=3 457 B10R1.13 OB(O)C1=CC=C(I)C=C1 NO22011 [0,1,0,0,0,0|2,0,0]=3 458 B10R1.13 OB(O)C1=CC=C(O)C=C1 NO19452 [0,1,0,0,0,0|1,0,0]=2 459 B10R1.13 OB(O)C1=CC=C(S)C=C1 DY20067 [0,1,0,0,0,0|1,1,0]=3 460 B10R1.13 OB(O)C1=CN=C(F)C=C1 DY20431 [0,1,0,0,0,0|3,0,0]=4 461 B10R1.13 OC1=CC=C(C(F)F)C=C1 NO15692 [0,1,0,0,0,0|1,0,0]=2 462 B10R1.25 C#CC1=C(Br)C=C(F)C=C1 DY788643 [0,1,0,0,0,0|2,0,1]=4 463 B10R1.25 C#CC1=C(F)C=C(F)C=C1 DY585106 [0,1,0,0,0,0|2,0,1]=4 464 B10R1.25 C#CC1=C(F)C=C(N)C=C1 DY33531 [0,1,0,0,0,0|2,0,1]=4 465 B10R1.25 C=CC1=C(O)C=C(O)C=C1 DY744937 [0,1,0,0,0,0|1,0,1]=3 466 B10R1.25 CC1=C(C#N)C=CC(Br)=C1 NO10708 [0,1,0,0,0,0|2,0,1]=4 467 B10R1.25 CC1=C(C#N)C=CC(F)=C1 DY20042 [0,1,0,0,0,0|2,0,1]=4 468 B10R1.25 CC1=C(C#N)C=CC(N)=C1 NO16661 [0,1,0,0,0,0|2,0,1]=4 469 B10R1.25 CC1=C(C=O)C=CC(Br)=C1 NO22653 [0,1,0,0,0,0|1,0,2]=4 470 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 NO20823 [0,1,0,0,0,0|1,0,2]=4 471 B10R1.25 CC1=C(C=O)C=CC(F)=C1 NO10809 [0,1,0,0,0,0|1,0,2]=4 472 B10R1.25 CC1=C(C=O)C=CC(O)=C1 NO20933 [0,1,0,0,0,0|0,0,2]=3 473 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 DY584433 [0,1,0,0,0,0|2,0,0]=3 474 B10R1.25 CC1=C(CN)C=NC(Br)=C1 DY715490 [0,1,0,0,0,0|3,0,0]=4 475 B10R1.25 CC1=C(CO)C=CC(O)=C1 DY449770 [0,1,0,0,0,0|0,0,0]=1 476 B10R1.25 CC1=CC(Br)=C(C#N)C=C1 NO21363 [0,1,0,0,0,0|2,0,1]=4 477 B10R1.25 CC1=CC(Br)=C(C=O)C=C1 NO20803 [0,1,0,0,0,0|1,0,2]=4 478 B10R1.25 CC1=CC(C)=C(C=O)C=C1 NO21114 [0,1,0,0,0,0|1,0,2]=4 479 B10R1.25 CC1=CC(C)=C(CBr)C=C1 NO21116 [0,1,0,0,0,0|2,0,0]=3 480 B10R1.25 CC1=CC(C)=C(CO)C=C1 DY744535 [0,1,0,0,0,0|1,0,0]=2 481 B10R1.25 CC1=CC(C)=C(NN)C=C1 NO20500 [0,1,0,0,0,0|3,0,0]=4 482 B10R1.25 CC1=CC(Cl)=C(C#N)C=C1 NO21450 [0,1,0,0,0,0|2,0,1]=4 483 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 NO21448 [0,1,0,0,0,0|1,0,2]=4 484 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 DY433989 [0,1,0,0,0,0|3,0,0]=4 485 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 NO20405 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.25 CC1=CC(F)=C(C#N)C=C1 NO10736 [0,1,0,0,0,0|2,0,1]=4 487 B10R1.25 CC1=CC(F)=C(CO)C=C1 DY451432 [0,1,0,0,0,0|1,0,0]=2 488 B10R1.25 CC1=CC(F)=CN=C1CN DY651571 [0,1,0,0,0,0|3,0,0]=4 489 B10R1.25 CC1=CC(N)=C(C#N)C=C1 NO20911 [0,1,0,0,0,0|2,0,1]=4 490 B10R1.25 CC1=CC(N)=C(CO)C=C1 NO21019 [0,1,0,0,0,0|1,0,0]=2 491 B10R1.25 CC1=CC(O)=C(C#N)C=C1 NO21585 [0,1,0,0,0,0|2,0,1]=4 492 B10R1.25 CC1=CC=C(CBr)C(Cl)=N1 DY585656 [0,1,0,0,0,0|3,0,0]=4 493 B10R1.25 CC1=CN=C(CCl)C(C)=C1 NO16524 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.25 CCC1=CN=C(C)C=C1N DY660014 [0,1,0,0,0,0|3,0,0]=4 495 B10R1.25 CCC1=CN=C(C)C=C1N DY711175 [0,1,0,0,0,0|3,0,0]=4 496 B10R1.25 CCN1C=CC(N)=CC1=O DY517107 [0,1,0,0,0,0|3,0,0]=4 497 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 NO20168 [0,1,0,0,0,0|3,0,0]=4 498 B10R1.25 COC1=C(Br)C=C(I)C=C1 DY41320 [0,1,0,0,0,0|3,0,0]=4 499 B10R1.25 COC1=C(Br)C=C(N)C=C1 DY20804 [0,1,0,0,0,0|3,0,0]=4 500 B10R1.25 COC1=C(Br)C=C(O)C=C1 NO18795 [0,1,0,0,0,0|2,0,0]=3 501 B10R1.25 COC1=C(C)C=C(Br)C=C1 NO22652 [0,1,0,0,0,0|3,0,0]=4 502 B10R1.25 COC1=C(C)C=C(N)C=C1 NO18714 [0,1,0,0,0,0|3,0,0]=4 503 B10R1.25 COC1=C(Cl)C=C(N)C=C1 NO14858 [0,1,0,0,0,0|3,0,0]=4 504 B10R1.25 COC1=C(F)C=C(C)C=C1 DY452440 [0,1,0,0,0,0|3,0,0]=4 505 B10R1.25 COC1=C(F)C=C(Cl)C=C1 DY584280 [0,1,0,0,0,0|3,0,0]=4 506 B10R1.25 COC1=C(F)C=C(N)C=C1 NO10515 [0,1,0,0,0,0|3,0,0]=4 507 B10R1.25 COC1=C(F)C=C(O)C=C1 NO22287 [0,1,0,0,0,0|2,0,0]=3 508 B10R1.25 COC1=C(I)C=C(Br)C=C1 NO17024 [0,1,0,0,0,0|3,0,0]=4 509 B10R1.25 COC1=C(I)C=C(N)C=C1 NO18915 [0,1,0,0,0,0|3,0,0]=4 510 B10R1.25 COC1=C(I)C=C(N)C=C1 NO19301 [0,1,0,0,0,0|3,0,0]=4 511 B10R1.25 COC1=C(N)C=C(Br)C=C1 NO10268 [0,1,0,0,0,0|3,0,0]=4 512 B10R1.25 COC1=C(N)C=C(C)C=C1 NO13548 [0,1,0,0,0,0|3,0,0]=4 513 B10R1.25 COC1=C(N)C=C(Cl)C=C1 DY745633 [0,1,0,0,0,0|3,0,0]=4 514 B10R1.25 COC1=C(N)C=C(I)C=C1 DY584281 [0,1,0,0,0,0|3,0,0]=4 515 B10R1.25 COC1=C(N)C=C(N)C=C1 NO21066 [0,1,0,0,0,0|3,0,0]=4 516 B10R1.25 COC1=C(O)C=C(C)C=C1 DY442401 [0,1,0,0,0,0|3,0,0]=4 517 B10R1.25 COC1=C(O)C=C(F)C=C1 NO15779 [0,1,0,0,0,0|3,0,0]=4 518 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 DY585122 [0,1,0,0,0,0|3,0,0]=4 519 B10R1.25 CSC1=C(Br)C=C(F)C=C1 DY452890 [0,1,0,0,0,0|3,0,0]=4 520 B10R1.25 CSC1=C(C)C=C(O)C=C1 DY20571 [0,1,0,0,0,0|2,0,0]=3 521 B10R1.25 ClC1=C(CBr)C=CC(Br)=C1 NO15047 [0,1,0,0,0,0|2,0,0]=3 522 B10R1.25 ClC1=CC(Cl)=C(CBr)C=C1 NO21097 [0,1,0,0,0,0|2,0,0]=3 523 B10R1.25 ClC1=CC(I)=C(CBr)C=C1 DY584761 [0,1,0,0,0,0|2,0,0]=3 524 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 NO19427 [0,1,0,0,0,0|2,0,0]=3 525 B10R1.25 FC1=C(CCl)C=CC(Cl)=C1 DY585180 [0,1,0,0,0,0|2,0,0]=3 526 B10R1.25 FC1=CC(Br)=C(CBr)C=C1 NO20064 [0,1,0,0,0,0|2,0,0]=3 527 B10R1.25 FC1=CC(Br)=CN=C1CCl DY659480 [0,1,0,0,0,0|3,0,0]=4 528 B10R1.25 FC1=CC(F)=C(CBr)C=C1 DY40543 [0,1,0,0,0,0|2,0,0]=3 529 B10R1.25 FC1=CC(F)=C(CCl)C=C1 DY40591 [0,1,0,0,0,0|2,0,0]=3 530 B10R1.25 N#CC1=C(Br)C=C(Br)C=C1 DY584356 [0,1,0,0,0,0|2,0,1]=4 531 B10R1.25 N#CC1=C(Br)C=C(F)C=C1 NO19659 [0,1,0,0,0,0|2,0,1]=4 532 B10R1.25 N#CC1=C(Br)C=C(I)C=C1 DY744859 [0,1,0,0,0,0|2,0,1]=4 533 B10R1.25 N#CC1=C(Br)C=C(N)C=C1 NO15118 [0,1,0,0,0,0|2,0,1]=4 534 B10R1.25 N#CC1=C(Br)C=C(O)C=C1 DY744097 [0,1,0,0,0,0|1,0,1]=3 535 B10R1.25 N#CC1=C(Cl)C=C(Cl)C=C1 NO19664 [0,1,0,0,0,0|2,0,1]=4 536 B10R1.25 N#CC1=C(Cl)C=C(F)C=C1 NO10185 [0,1,0,0,0,0|2,0,1]=4 537 B10R1.25 N#CC1=C(Cl)C=C(O)C=C1 DY20251 [0,1,0,0,0,0|1,0,1]=3 538 B10R1.25 N#CC1=C(F)C=C(Br)C=C1 NO19661 [0,1,0,0,0,0|2,0,1]=4 539 B10R1.25 N#CC1=C(F)C=C(Cl)C=C1 NO10187 [0,1,0,0,0,0|2,0,1]=4 540 B10R1.25 N#CC1=C(F)C=C(F)C=C1 NO21106 [0,1,0,0,0,0|2,0,1]=4 541 B10R1.25 N#CC1=C(F)C=C(I)C=C1 DY429408 [0,1,0,0,0,0|2,0,1]=4 542 B10R1.25 N#CC1=C(F)C=C(N)C=C1 NO22548 [0,1,0,0,0,0|2,0,1]=4 543 B10R1.25 N#CC1=C(F)C=C(O)C=C1 NO20032 [0,1,0,0,0,0|1,0,1]=3 544 B10R1.25 N#CC1=C(I)C=C(Cl)C=C1 DY584899 [0,1,0,0,0,0|2,0,1]=4 545 B10R1.25 N#CC1=C(I)C=C(F)C=C1 NO16014 [0,1,0,0,0,0|2,0,1]=4 546 B10R1.25 N#CC1=C(N)C=C(F)C=C1 NO21248 [0,1,0,0,0,0|2,0,1]=4 547 B10R1.25 N#CC1=C(O)C=C(Br)C=C1 NO22646 [0,1,0,0,0,0|2,0,1]=4 548 B10R1.25 N#CC1=C(O)C=C(Cl)C=C1 NO14584 [0,1,0,0,0,0|2,0,1]=4 549 B10R1.25 N#CC1=C(O)C=C(O)C=C1 DY10369 [0,1,0,0,0,0|1,0,1]=3 550 B10R1.25 NC1=C(C=O)C=CC(Br)=C1 NO21241 [0,1,0,0,0,0|1,0,2]=4 551 B10R1.25 NC1=C(C=O)C=CC(Cl)=C1 NO17491 [0,1,0,0,0,0|1,0,2]=4 552 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 DY40814 [0,1,0,0,0,0|2,0,0]=3 553 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 DY585043 [0,1,0,0,0,0|2,0,0]=3 554 B10R1.25 NCC1=C(F)C=C(F)C=C1 NO10473 [0,1,0,0,0,0|2,0,0]=3 555 B10R1.25 NCC1=NC=C(F)C=C1Cl DY651055 [0,1,0,0,0,0|3,0,0]=4 556 B10R1.25 NNC1=C(Cl)C=C(Cl)C=C1 NO23006 [0,1,0,0,0,0|3,0,0]=4 557 B10R1.25 NNC1=C(Cl)C=C(F)C=C1 NO19087 [0,1,0,0,0,0|3,0,0]=4 558 B10R1.25 NNC1=C(Cl)C=C(I)C=C1 NO17119 [0,1,0,0,0,0|3,0,0]=4 559 B10R1.25 NNC1=C(F)C=C(Br)C=C1 NO18334 [0,1,0,0,0,0|3,0,0]=4 560 B10R1.25 NNC1=C(F)C=C(F)C=C1 NO23012 [0,1,0,0,0,0|3,0,0]=4 561 B10R1.25 O=CC1=C(Br)C=C(Br)C=C1 NO16310 [0,1,0,0,0,0|1,0,2]=4 562 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 NO10226 [0,1,0,0,0,0|1,0,2]=4 563 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 NO19853 [0,1,0,0,0,0|1,0,2]=4 564 B10R1.25 O=CC1=C(Br)C=C(O)C=C1 NO16052 [0,1,0,0,0,0|0,0,2]=3 565 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 NO18762 [0,1,0,0,0,0|1,0,2]=4 566 B10R1.25 O=CC1=C(Cl)C=C(Cl)C=C1 DY33212 [0,1,0,0,0,0|1,0,2]=4 567 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 NO10260 [0,1,0,0,0,0|1,0,2]=4 568 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 NO10340 [0,1,0,0,0,0|0,0,2]=3 569 B10R1.25 O=CC1=C(F)C=C(Br)C=C1 NO10231 [0,1,0,0,0,0|1,0,2]=4 570 B10R1.25 O=CC1=C(F)C=C(Cl)C=C1 DY20030 [0,1,0,0,0,0|1,0,2]=4 571 B10R1.25 O=CC1=C(F)C=C(F)C=C1 NO18760 [0,1,0,0,0,0|1,0,2]=4 572 B10R1.25 O=CC1=C(F)C=C(O)C=C1 NO10365 [0,1,0,0,0,0|0,0,2]=3 573 B10R1.25 O=CC1=C(I)C=C(O)C=C1 NO16844 [0,1,0,0,0,0|0,0,2]=3 574 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 NO20081 [0,1,0,0,0,0|1,0,2]=4 575 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 NO20105 [0,1,0,0,0,0|1,0,2]=4 576 B10R1.25 O=CC1=C(O)C=C(F)C=C1 NO20130 [0,1,0,0,0,0|1,0,2]=4 577 B10R1.25 O=CC1=C(O)C=C(O)C=C1 NO19428 [0,1,0,0,0,0|0,0,2]=3 578 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 NO21073 [0,1,0,0,0,0|1,0,0]=2 579 B10R1.25 OCC1=C(Br)C=C(Cl)N=C1 DY651241 [0,1,0,0,0,0|2,0,0]=3 580 B10R1.25 OCC1=C(Br)C=C(F)C=C1 DY452398 [0,1,0,0,0,0|1,0,0]=2 581 B10R1.25 OCC1=C(Br)C=C(I)C=C1 DY584784 [0,1,0,0,0,0|1,0,0]=2 582 B10R1.25 OCC1=C(F)C=C(O)C=C1 NO13215 [0,1,0,0,0,0|0,0,0]=1 583 B10R1.25 OCC1=C(O)C=C(Br)C=C1 NO10248 [0,1,0,0,0,0|1,0,0]=2 584 B10R1.25 OCC1=CN=C(Cl)N=C1Cl NO17162 [0,1,0,0,0,0|3,0,0]=4 585 B10R1.25 OCC1=NC=C(Cl)C=C1Br DY432496 [0,1,0,0,0,0|2,0,0]=3 586 B10R1.25 OCC1=NC=C(Cl)C=C1F DY104426 [0,1,0,0,0,0|2,0,0]=3 587 B10R1.25 OCC1=NC=C(F)C=C1Cl DY116262 [0,1,0,0,0,0|2,0,0]=3 588 B10R1.176 BrCC1=CN=C(Br)C(Br)=C1 DY652986 [0,1,0,0,0,0|3,0,0]=4 589 B10R1.176 C#CC1=CC(F)=C(F)C=C1 DY822090 [0,1,0,0,0,0|2,0,1]=4 590 B10R1.176 C=CC1=CC(F)=C(F)C=C1 NO19052 [0,1,0,0,0,0|2,0,1]=4 591 B10R1.176 CC1=C(Br)C=C(C#N)C=C1 DY40627 [0,1,0,0,0,0|2,0,1]=4 592 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 NO16721 [0,1,0,0,0,0|2,0,0]=3 593 B10R1.176 CC1=C(Br)C=CC(C#N)=C1 NO20685 [0,1,0,0,0,0|2,0,1]=4 594 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 NO22664 [0,1,0,0,0,0|1,0,2]=4 595 B10R1.176 CC1=C(Br)C=CC(CN)=C1 DY525519 [0,1,0,0,0,0|2,0,0]=3 596 B10R1.176 CC1=C(Br)N=CC(CN)=C1 DY651722 [0,1,0,0,0,0|3,0,0]=4 597 B10R1.176 CC1=C(C)C=C(CO)C=C1 DY40706 [0,1,0,0,0,0|1,0,0]=2 598 B10R1.176 CC1=C(C)C=C(NN)C=C1 NO20502 [0,1,0,0,0,0|3,0,0]=4 599 B10R1.176 CC1=C(C)N=C(CN)C=C1 DY651451 [0,1,0,0,0,0|3,0,0]=4 600 B10R1.176 CC1=C(Cl)C=CC(C#N)=C1 NO22761 [0,1,0,0,0,0|2,0,1]=4 601 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 DY433419 [0,1,0,0,0,0|1,0,2]=4 602 B10R1.176 CC1=C(Cl)N=CC(CO)=C1 NO16130 [0,1,0,0,0,0|2,0,0]=3 603 B10R1.176 CC1=C(F)C=C(C#N)C=C1 NO21928 [0,1,0,0,0,0|2,0,1]=4 604 B10R1.176 CC1=C(F)C=C(NN)C=C1 NO22289 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.176 CC1=C(F)C=CC(C#N)=C1 NO10743 [0,1,0,0,0,0|2,0,1]=4 606 B10R1.176 CC1=C(N)C=C(C#N)C=C1 NO15246 [0,1,0,0,0,0|2,0,1]=4 607 B10R1.176 CC1=C(N)C=CC(C#N)=C1 NO20915 [0,1,0,0,0,0|2,0,1]=4 608 B10R1.176 CC1=C(O)C=C(C#N)C=C1 NO10986 [0,1,0,0,0,0|2,0,1]=4 609 B10R1.176 CC1=C(O)C=CC(C#N)=C1 NO17416 [0,1,0,0,0,0|1,0,1]=3 610 B10R1.176 CC1=C(O)C=CC(C=O)=C1 NO20934 [0,1,0,0,0,0|0,0,2]=3 611 B10R1.176 CC1=C(O)C=CC(CN)=C1 DY445599 [0,1,0,0,0,0|1,0,0]=2 612 B10R1.176 CC1=NC(CO)=CC=C1O DY660681 [0,1,0,0,0,0|1,0,0]=2 613 B10R1.176 CCC1=CC(C)=C(I)C=C1 DY575811 [0,1,0,0,0,0|2,0,0]=3 614 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 DY432619 [0,1,0,0,0,0|2,0,0]=3 615 B10R1.176 CCC1=CC(O)=C(N)C=C1 NO16266 [0,1,0,0,0,0|2,0,0]=3 616 B10R1.176 CN1C=C(CN)C=CC1=O DY103927 [0,1,0,0,0,0|2,0,1]=4 617 B10R1.176 CNC1=CC(F)=C(Br)C=C1 DY584691 [0,1,0,0,0,0|3,0,0]=4 618 B10R1.176 CNC1=CC(F)=C(F)C=C1 DY686725 [0,1,0,0,0,0|3,0,0]=4 619 B10R1.176 COC1=CC(Br)=C(Br)C=C1 DY442365 [0,1,0,0,0,0|3,0,0]=4 620 B10R1.176 COC1=CC(Br)=C(C)C=C1 NO16376 [0,1,0,0,0,0|3,0,0]=4 621 B10R1.176 COC1=CC(Br)=C(F)C=C1 NO15238 [0,1,0,0,0,0|3,0,0]=4 622 B10R1.176 COC1=CC(Br)=C(N)C=C1 NO21359 [0,1,0,0,0,0|3,0,0]=4 623 B10R1.176 COC1=CC(C)=C(N)C=C1 NO13421 [0,1,0,0,0,0|3,0,0]=4 624 B10R1.176 COC1=CC(C)=C(O)C=C1 NO15470 [0,1,0,0,0,0|2,0,0]=3 625 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 NO14601 [0,1,0,0,0,0|3,0,0]=4 626 B10R1.176 COC1=CC(Cl)=C(N)C=C1 NO14656 [0,1,0,0,0,0|3,0,0]=4 627 B10R1.176 COC1=CC(Cl)=C(O)C=C1 NO20293 [0,1,0,0,0,0|2,0,0]=3 628 B10R1.176 COC1=CC(F)=C(Br)C=C1 DY460476 [0,1,0,0,0,0|3,0,0]=4 629 B10R1.176 COC1=CC(F)=C(Br)C=C1 NO10396 [0,1,0,0,0,0|3,0,0]=4 630 B10R1.176 COC1=CC(F)=C(C)C=C1 NO10872 [0,1,0,0,0,0|3,0,0]=4 631 B10R1.176 COC1=CC(I)=C(N)C=C1 DY20577 [0,1,0,0,0,0|3,0,0]=4 632 B10R1.176 COC1=CC(N)=C(Br)C=C1 NO18386 [0,1,0,0,0,0|3,0,0]=4 633 B10R1.176 COC1=CC(N)=C(C)C=C1 NO14868 [0,1,0,0,0,0|3,0,0]=4 634 B10R1.176 COC1=CC(N)=C(Cl)C=C1 NO13990 [0,1,0,0,0,0|3,0,0]=4 635 B10R1.176 COC1=CC(N)=C(F)C=C1 NO12726 [0,1,0,0,0,0|3,0,0]=4 636 B10R1.176 COC1=CC(N)=C(I)C=C1 NO15023 [0,1,0,0,0,0|3,0,0]=4 637 B10R1.176 COC1=CC(N)=C(O)C=C1 NO21254 [0,1,0,0,0,0|2,0,0]=3 638 B10R1.176 COC1=CC(O)=C(Br)C=C1 NO21376 [0,1,0,0,0,0|3,0,0]=4 639 B10R1.176 COC1=CC(O)=C(Cl)C=C1 DY442395 [0,1,0,0,0,0|3,0,0]=4 640 B10R1.176 COC1=CC(O)=C(N)C=C1 NO21584 [0,1,0,0,0,0|3,0,0]=4 641 B10R1.176 COC1=CC(S)=C(N)C=C1 DY797031 [0,1,0,0,0,0|3,0,0]=4 642 B10R1.176 COC1=CC=C(O)C(C)=N1 DY661236 [0,1,0,0,0,0|3,0,0]=4 643 B10R1.176 CSC1=CC(F)=C(F)C=C1 DY452068 [0,1,0,0,0,0|3,0,0]=4 644 B10R1.176 ClC1=C(Cl)C=C(CBr)C=C1 NO18826 [0,1,0,0,0,0|2,0,0]=3 645 B10R1.176 FC1=C(Cl)C=C(CBr)C=C1 DY20082 [0,1,0,0,0,0|2,0,0]=3 646 B10R1.176 FC1=C(Cl)C=CC(CBr)=C1 NO19666 [0,1,0,0,0,0|2,0,0]=3 647 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 DY40585 [0,1,0,0,0,0|2,0,0]=3 648 B10R1.176 FC1=C(F)C=C(CCl)C=C1 DY433089 [0,1,0,0,0,0|2,0,0]=3 649 B10R1.176 FC1=C(I)C=CC(CBr)=C1 DY584601 [0,1,0,0,0,0|2,0,0]=3 650 B10R1.176 FC1=NC=C(CBr)C=C1Cl DY430835 [0,1,0,0,0,0|3,0,0]=4 651 B10R1.176 N#CC1=CC(Br)=C(F)C=C1 NO10167 [0,1,0,0,0,0|2,0,1]=4 652 B10R1.176 N#CC1=CC(Br)=C(I)C=C1 DY500205 [0,1,0,0,0,0|2,0,1]=4 653 B10R1.176 N#CC1=CC(Br)=C(O)C=C1 NO10311 [0,1,0,0,0,0|1,0,1]=3 654 B10R1.176 N#CC1=CC(Cl)=C(Br)C=C1 DY20651 [0,1,0,0,0,0|2,0,1]=4 655 B10R1.176 N#CC1=CC(Cl)=C(Cl)C=C1 DY20181 [0,1,0,0,0,0|2,0,1]=4 656 B10R1.176 N#CC1=CC(Cl)=C(F)C=C1 NO19686 [0,1,0,0,0,0|2,0,1]=4 657 B10R1.176 N#CC1=CC(Cl)=C(I)C=C1 DY769701 [0,1,0,0,0,0|2,0,1]=4 658 B10R1.176 N#CC1=CC(Cl)=C(O)C=C1 NO18887 [0,1,0,0,0,0|1,0,1]=3 659 B10R1.176 N#CC1=CC(F)=C(Br)C=C1 NO10168 [0,1,0,0,0,0|2,0,1]=4 660 B10R1.176 N#CC1=CC(F)=C(Cl)C=C1 NO10189 [0,1,0,0,0,0|2,0,1]=4 661 B10R1.176 N#CC1=CC(F)=C(F)C=C1 NO19727 [0,1,0,0,0,0|2,0,1]=4 662 B10R1.176 N#CC1=CC(F)=C(N)C=C1 NO10361 [0,1,0,0,0,0|2,0,1]=4 663 B10R1.176 N#CC1=CC(F)=C(O)C=C1 NO14303 [0,1,0,0,0,0|1,0,1]=3 664 B10R1.176 N#CC1=CC(I)=C(N)C=C1 NO12308 [0,1,0,0,0,0|2,0,1]=4 665 B10R1.176 N#CC1=CC(N)=C(Cl)C=C1 NO14834 [0,1,0,0,0,0|2,0,1]=4 666 B10R1.176 N#CC1=CC(N)=C(F)C=C1 NO16164 [0,1,0,0,0,0|2,0,1]=4 667 B10R1.176 N#CC1=CC(N)=C(I)C=C1 NO16821 [0,1,0,0,0,0|2,0,1]=4 668 B10R1.176 N#CC1=CC(N)=C(N)C=C1 NO20303 [0,1,0,0,0,0|2,0,1]=4 669 B10R1.176 N#CC1=CC(N)=C(O)C=C1 NO21247 [0,1,0,0,0,0|1,0,1]=3 670 B10R1.176 N#CC1=CC(O)=C(F)C=C1 NO20043 [0,1,0,0,0,0|2,0,1]=4 671 B10R1.176 N#CC1=CC(O)=C(N)C=C1 NO22562 [0,1,0,0,0,0|2,0,1]=4 672 B10R1.176 N#CC1=CC(O)=C(O)C=C1 DY20147 [0,1,0,0,0,0|1,0,1]=3 673 B10R1.176 NCC1=CC(Br)=C(F)C=C1 DY584425 [0,1,0,0,0,0|2,0,0]=3 674 B10R1.176 NCC1=CC(Br)=C(F)N=C1 DY651547 [0,1,0,0,0,0|3,0,0]=4 675 B10R1.176 NCC1=NC(Cl)=C(Cl)C=C1 DY536751 [0,1,0,0,0,0|3,0,0]=4 676 B10R1.176 NNC1=CC(Cl)=C(Cl)C=C1 NO19870 [0,1,0,0,0,0|3,0,0]=4 677 B10R1.176 NNC1=CC(F)=C(Br)C=C1 DY542625 [0,1,0,0,0,0|3,0,0]=4 678 B10R1.176 NNC1=CC(F)=C(F)C=C1 DY20003 [0,1,0,0,0,0|3,0,0]=4 679 B10R1.176 NNC1=CC(F)=C(F)C=C1 DY610770 [0,1,0,0,0,0|3,0,0]=4 680 B10R1.176 NNC1=CC(F)=C(F)C=C1 NO23015 [0,1,0,0,0,0|3,0,0]=4 681 B10R1.176 O=C1C=C(CO)OC=C1O NO11536 [0,1,0,0,0,0|1,0,0]=2 682 B10R1.176 O=C1CC(CO)=NC=C1O DY711589 [0,1,0,0,0,0|1,0,1]=3 683 B10R1.176 O=CC1=CC(Br)=C(Cl)C=C1 NO12700 [0,1,0,0,0,0|1,0,2]=4 684 B10R1.176 O=CC1=CC(Br)=C(F)C=C1 NO10229 [0,1,0,0,0,0|1,0,2]=4 685 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 DY20184 [0,1,0,0,0,0|0,0,2]=3 686 B10R1.176 O=CC1=CC(Cl)=C(Br)C=C1 NO12259 [0,1,0,0,0,0|1,0,2]=4 687 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 NO19889 [0,1,0,0,0,0|1,0,2]=4 688 B10R1.176 O=CC1=CC(Cl)=C(F)C=C1 DY20026 [0,1,0,0,0,0|1,0,2]=4 689 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 NO10232 [0,1,0,0,0,0|1,0,2]=4 690 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 NO10264 [0,1,0,0,0,0|1,0,2]=4 691 B10R1.176 O=CC1=CC(F)=C(F)C=C1 NO14168 [0,1,0,0,0,0|1,0,2]=4 692 B10R1.176 O=CC1=CC(F)=C(I)C=C1 NO10296 [0,1,0,0,0,0|1,0,2]=4 693 B10R1.176 O=CC1=CC(F)=C(O)C=C1 NO10367 [0,1,0,0,0,0|0,0,2]=3 694 B10R1.176 O=CC1=CC(I)=C(F)C=C1 DY20286 [0,1,0,0,0,0|1,0,2]=4 695 B10R1.176 O=CC1=CC(O)=C(Cl)C=C1 NO15259 [0,1,0,0,0,0|1,0,2]=4 696 B10R1.176 O=CC1=CC(O)=C(F)C=C1 DY41115 [0,1,0,0,0,0|1,0,2]=4 697 B10R1.176 O=CC1=CC(O)=C(I)C=C1 DY584669 [0,1,0,0,0,0|1,0,2]=4 698 B10R1.176 O=CC1=CC(O)=C(O)C=C1 NO18720 [0,1,0,0,0,0|0,0,2]=3 699 B10R1.176 OCC1=CC(Br)=C(O)C=C1 NO21356 [0,1,0,0,0,0|0,0,0]=1 700 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 NO18809 [0,1,0,0,0,0|1,0,0]=2 701 B10R1.176 OCC1=CC(F)=C(Br)C=C1 NO20190 [0,1,0,0,0,0|1,0,0]=2 702 B10R1.176 OCC1=CC(F)=C(Cl)C=C1 DY40694 [0,1,0,0,0,0|1,0,0]=2 703 B10R1.176 OCC1=CC(F)=C(F)C=C1 NO19362 [0,1,0,0,0,0|1,0,0]=2 704 B10R1.176 OCC1=CC(F)=C(I)C=C1 DY585015 [0,1,0,0,0,0|1,0,0]=2 705 B10R1.176 OCC1=CC(I)=C(Br)C=C1 DY584846 [0,1,0,0,0,0|1,0,0]=2 706 B10R1.176 OCC1=CC(O)=C(Br)C=C1 NO16027 [0,1,0,0,0,0|1,0,0]=2 707 B10R1.176 OCC1=CC(S)=C(O)C=N1 DY716738 [0,1,0,0,0,0|1,0,0]=2 708 B10R1.176 OCC1=NC(Br)=C(Cl)C=C1 DY651716 [0,1,0,0,0,0|2,0,0]=3 709 B10R2.31 BrC1=CC=C2CCC2=C1 DY505107 [0,0,0,1,0,0|2,0,0]=3 710 B10R2.31 NC1=CC=C2CCC2=C1 DY686977 [0,0,0,1,0,0|2,0,0]=3 711 B8R1.1 CC1=CC(CO)=NN1 NO17779 [0,0,0,0,1,0|3,0,0]=4 712 B8R1.1 CC1=CNC(CO)=C1 DY717969 [0,0,0,0,1,0|2,0,0]=3 713 B8R1.1 CC1=CSC(CO)=N1 DY520509 [0,0,0,0,1,0|3,0,0]=4 714 B8R1.1 CCC1=CC(C)=CS1 DY447443 [0,0,0,0,1,0|3,0,0]=4 715 B8R1.1 CN1C=C(CO)C=N1 NO19818 [0,0,0,0,1,0|3,0,0]=4 716 B8R1.1 CN1C=NC(CO)=C1 NO18049 [0,0,0,0,1,0|3,0,0]=4 717 B8R1.1 ClCC1=CC=C(Cl)S1 NO17500 [0,0,0,0,1,0|3,0,0]=4 718 B8R1.1 NC1=NC=C(CO)S1 DY517203 [0,0,0,0,1,0|3,0,0]=4 719 B8R1.1 NCC1=CC=C(Br)O1 DY432586 [0,0,0,0,1,0|3,0,0]=4 720 B8R1.1 NCC1=CC=C(Br)O1 DY759704 [0,0,0,0,1,0|3,0,0]=4 721 B8R1.1 O=C1C=C[C@@H](CO)O1 DY20390 [0,0,0,0,1,0|1,0,2]=4 722 B8R1.1 OCC1=CC=C(Br)O1 NO15423 [0,0,0,0,1,0|2,0,0]=3 723 B8R1.1 OCC1=CN=C(Br)O1 DY772959 [0,0,0,0,1,0|3,0,0]=4 724 B8R1.1 OCC1=CN=C(Br)S1 NO18424 [0,0,0,0,1,0|3,0,0]=4 725 B8R1.1 OCC1=CSC(Br)=N1 NO15600 [0,0,0,0,1,0|3,0,0]=4 726 B8R1.1 OCC1=CSC(Cl)=N1 DY785710 [0,0,0,0,1,0|3,0,0]=4 727 B7R1.3 BrC1=CC=CN=C1 NO19218 [2,0,0,0,0,0|2,0,0]=4 728 B7R1.3 BrC1=CC=NC=C1 NO13376 [2,0,0,0,0,0|2,0,0]=4 729 B7R1.3 BrC1=NC=CC=C1 NO17815 [2,0,0,0,0,0|2,0,0]=4 730 B7R1.3 CC1=CC=CN=N1 NO22374 [2,0,0,0,0,0|2,0,0]=4 731 B7R1.3 CC1=CN=CN=C1 NO18851 [2,0,0,0,0,0|2,0,0]=4 732 B7R1.3 CC1=CN=NC=C1 NO22983 [2,0,0,0,0,0|2,0,0]=4 733 B7R1.3 CC1=NC=NC=C1 NO19795 [2,0,0,0,0,0|2,0,0]=4 734 B7R1.3 C[N+]1=CC=CC=C1 NO17683 [2,0,0,0,0,0|1,0,0]=3 735 B7R1.3 ClC1=CC=NC=C1 DY715154 [2,0,0,0,0,0|2,0,0]=4 736 B7R1.3 ClC1=CC=NC=C1 NO13378 [2,0,0,0,0,0|2,0,0]=4 737 B7R1.3 ClC1=NC=CC=C1 DY20672 [2,0,0,0,0,0|2,0,0]=4 738 B7R1.3 FC1=CC=CC=C1 DY41489 [2,0,0,0,0,0|1,0,0]=3 739 B7R1.3 FC1=CC=CN=C1 DY20006 [2,0,0,0,0,0|2,0,0]=4 740 B7R1.3 FC1=NC=CC=C1 DY20005 [2,0,0,0,0,0|2,0,0]=4 741 B7R1.3 IC1=CC=CC=C1 NO19958 [2,0,0,0,0,0|1,0,0]=3 742 B7R1.3 IC1=NC=CC=C1 NO14565 [2,0,0,0,0,0|2,0,0]=4 743 B7R1.3 NC1=CC=CN=C1 NO19073 [2,0,0,0,0,0|2,0,0]=4 744 B7R1.3 NC1=CC=NC=C1 DY20017 [2,0,0,0,0,0|2,0,0]=4 745 B7R1.3 O=C1C=CC=CN1 NO18724 [2,0,0,0,0,0|1,0,1]=4 746 B7R1.3 O=c1ccocc1 DY460890 [2,0,0,0,0,0|1,0,1]=4 747 B7R1.3 OC1=CC=CN=C1 NO17813 [2,0,0,0,0,0|1,0,0]=3 748 B7R1.3 OC1=CC=NC=C1 NO19216 [2,0,0,0,0,0|1,0,0]=3 749 B7R1.3 OC1=CN=CN=C1 NO10407 [2,0,0,0,0,0|2,0,0]=4 750 B7R1.3 OC1=CN=NC=C1 DY538881 [2,0,0,0,0,0|2,0,0]=4 751 B7R1.3 OC1=CN=NC=C1 NO17666 [2,0,0,0,0,0|2,0,0]=4 752 B7R1.3 OC1=NC=CC=C1 NO21602 [2,0,0,0,0,0|1,0,0]=3 753 B7R1.3 OC1=NC=CC=N1 NO14246 [2,0,0,0,0,0|2,0,0]=4 754 B7R1.3 OC1=NC=CC=N1 NO16090 [2,0,0,0,0,0|2,0,0]=4 755 B7R1.3 OC1=NC=CN=C1 NO21601 [2,0,0,0,0,0|2,0,0]=4 756 B7R1.3 OC1=NC=NC=C1 DY737960 [2,0,0,0,0,0|2,0,0]=4 757 B7R1.3 OC1=NC=NC=C1 NO15728 [2,0,0,0,0,0|2,0,0]=4 758 B7R1.3 [15NH2]C1=CC=CC=C1 DY454761 [2,0,0,0,0,0|1,0,0]=3 759 B7R1.3 [Hg+]C1=CC=CC=C1 DY822438 [2,0,0,0,0,0|1,0,0]=3 760 B9R1.2 BrCC1=CC=CC(Br)=C1 NO19344 [1,1,0,0,0,0|1,0,0]=3 761 B9R1.2 C#CC1=CC(F)=CC=C1 NO20642 [1,1,0,0,0,0|1,0,1]=4 762 B9R1.2 C#CC1=CC=CC(N)=C1 NO10819 [1,1,0,0,0,0|1,0,1]=4 763 B9R1.2 CC1=CC(CCl)=NC=C1 NO15442 [1,1,0,0,0,0|2,0,0]=4 764 B9R1.2 CC1=CC(CN)=CC=C1 NO19644 [1,1,0,0,0,0|1,0,0]=3 765 B9R1.2 CC1=CC(CO)=NC=C1 NO11126 [1,1,0,0,0,0|1,0,0]=3 766 B9R1.2 CC1=CC(NN)=CC=C1 NO19574 [1,1,0,0,0,0|2,0,0]=4 767 B9R1.2 CC1=CC=CC(C#N)=C1 NO19778 [1,1,0,0,0,0|1,0,1]=4 768 B9R1.2 CC1=CC=CC(C=O)=C1 DY41127 [1,1,0,0,0,0|0,0,2]=4 769 B9R1.2 CC1=CC=CC(CCl)=N1 DY547749 [1,1,0,0,0,0|2,0,0]=4 770 B9R1.2 CC1=CC=CC(CN)=N1 NO18414 [1,1,0,0,0,0|2,0,0]=4 771 B9R1.2 CC1=CC=CC(CO)=N1 DY20920 [1,1,0,0,0,0|1,0,0]=3 772 B9R1.2 CC1=CN=CC(CCl)=C1 NO14445 [1,1,0,0,0,0|2,0,0]=4 773 B9R1.2 CC1=CN=CC(CO)=C1 DY452566 [1,1,0,0,0,0|1,0,0]=3 774 B9R1.2 CC1=CN=CC(CO)=N1 NO15787 [1,1,0,0,0,0|2,0,0]=4 775 B9R1.2 CCC1=CC(C)=CN=C1 DY657240 [1,1,0,0,0,0|2,0,0]=4 776 B9R1.2 CCC1=CC=CC(Br)=N1 NO15322 [1,1,0,0,0,0|2,0,0]=4 777 B9R1.2 CCC1=CC=CC(Cl)=C1 DY584271 [1,1,0,0,0,0|1,0,0]=3 778 B9R1.2 CCC1=CN=CC(Br)=C1 NO11907 [1,1,0,0,0,0|2,0,0]=4 779 B9R1.2 CCC1=NC=CC(Br)=C1 DY658183 [1,1,0,0,0,0|2,0,0]=4 780 B9R1.2 CNC1=CC(Br)=CC=C1 NO22185 [1,1,0,0,0,0|2,0,0]=4 781 B9R1.2 CNC1=CC(Cl)=CC=C1 DY20486 [1,1,0,0,0,0|2,0,0]=4 782 B9R1.2 CNC1=CC(I)=CC=C1 DY563655 [1,1,0,0,0,0|2,0,0]=4 783 B9R1.2 CNC1=CC(N)=CC=C1 NO16640 [1,1,0,0,0,0|2,0,0]=4 784 B9R1.2 CNC1=CC=CC(O)=C1 DY442233 [1,1,0,0,0,0|2,0,0]=4 785 B9R1.2 COC1=CC=CC(Cl)=C1 NO19894 [1,1,0,0,0,0|2,0,0]=4 786 B9R1.2 COC1=CC=CC(F)=C1 NO19929 [1,1,0,0,0,0|2,0,0]=4 787 B9R1.2 COC1=CC=CC(N)=C1 NO19943 [1,1,0,0,0,0|2,0,0]=4 788 B9R1.2 COC1=CC=CC(O)=C1 NO18747 [1,1,0,0,0,0|2,0,0]=4 789 B9R1.2 CSC1=CC(N)=CC=C1 DY20570 [1,1,0,0,0,0|2,0,0]=4 790 B9R1.2 ClC1=CC=CC(CBr)=C1 NO22235 [1,1,0,0,0,0|1,0,0]=3 791 B9R1.2 ClC1=NC=CC(CBr)=C1 DY657889 [1,1,0,0,0,0|2,0,0]=4 792 B9R1.2 ClCC1=CC(Br)=CC=C1 DY40579 [1,1,0,0,0,0|1,0,0]=3 793 B9R1.2 ClCc1cccc(I)c1 DY585080 [1,1,0,0,0,0|1,0,0]=3 794 B9R1.2 FC1=CC=CC(CBr)=N1 DY500445 [1,1,0,0,0,0|2,0,0]=4 795 B9R1.2 FC1=CC=CC(CCl)=C1 NO19068 [1,1,0,0,0,0|1,0,0]=3 796 B9R1.2 FCC1=CC(Br)=NC=C1 DY512247 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.2 N#CC1=CC(Br)=CC=C1 NO19865 [1,1,0,0,0,0|1,0,1]=4 798 B9R1.2 N#CC1=CC(Cl)=CC=C1 NO19319 [1,1,0,0,0,0|1,0,1]=4 799 B9R1.2 N#CC1=CC(F)=CC=C1 DY20044 [1,1,0,0,0,0|1,0,1]=4 800 B9R1.2 N#CC1=CC(N)=CC=C1 NO13394 [1,1,0,0,0,0|1,0,1]=4 801 B9R1.2 N#CC1=CC(O)=CC=C1 NO19377 [1,1,0,0,0,0|1,0,1]=4 802 B9R1.2 NC1=CC(CBr)=CN=C1 DY659222 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.2 NC1=CC(CO)=NC=C1 DY33483 [1,1,0,0,0,0|1,0,0]=3 804 B9R1.2 NC1=CC(CO)=NC=N1 DY121194 [1,1,0,0,0,0|2,0,0]=4 805 B9R1.2 NC1=CC=CC(CO)=C1 NO18821 [1,1,0,0,0,0|0,0,0]=2 806 B9R1.2 NC1=CC=CC(CO)=N1 NO16612 [1,1,0,0,0,0|1,0,0]=3 807 B9R1.2 NC1=CN=CC(CO)=C1 NO22079 [1,1,0,0,0,0|1,0,0]=3 808 B9R1.2 NC1=NC=CC(CO)=C1 NO17807 [1,1,0,0,0,0|1,0,0]=3 809 B9R1.2 NCC1=CC(Br)=CC=C1 NO19652 [1,1,0,0,0,0|1,0,0]=3 810 B9R1.2 NCC1=CC(Br)=NC=C1 NO17247 [1,1,0,0,0,0|2,0,0]=4 811 B9R1.2 NCC1=CC(Cl)=CC=C1 DY33134 [1,1,0,0,0,0|1,0,0]=3 812 B9R1.2 NCC1=CC(Cl)=NC=C1 NO16037 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.2 NCC1=CC(I)=CC=C1 DY584527 [1,1,0,0,0,0|1,0,0]=3 814 B9R1.2 NCC1=CC(I)=CC=C1 NO22330 [1,1,0,0,0,0|1,0,0]=3 815 B9R1.2 NCC1=CC=CC(=O)N1 DY582837 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.2 NCC1=CC=CC(O)=C1 DY745447 [1,1,0,0,0,0|1,0,0]=3 817 B9R1.2 NCC1=NC(Br)=CC=C1 NO10635 [1,1,0,0,0,0|2,0,0]=4 818 B9R1.2 NCC1=NC(Cl)=CC=C1 DY527445 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.2 NCC1=NC(F)=CC=C1 NO13193 [1,1,0,0,0,0|2,0,0]=4 820 B9R1.2 NCC1=NC=CC(Br)=C1 NO12824 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.2 NCC1=NC=CC(Br)=C1 NO15559 [1,1,0,0,0,0|2,0,0]=4 822 B9R1.2 NNC1=CC(Br)=CC=C1 NO19465 [1,1,0,0,0,0|2,0,0]=4 823 B9R1.2 NNC1=CC(Cl)=CC=C1 NO19479 [1,1,0,0,0,0|2,0,0]=4 824 B9R1.2 NNC1=CC(F)=CC=C1 NO19485 [1,1,0,0,0,0|2,0,0]=4 825 B9R1.2 O=C1C=CNC(CO)=C1 DY654576 [1,1,0,0,0,0|1,0,0]=3 826 B9R1.2 O=CC1=CC(Br)=CC=C1 NO18958 [1,1,0,0,0,0|0,0,2]=4 827 B9R1.2 O=CC1=CC(Cl)=CC=C1 DY20579 [1,1,0,0,0,0|0,0,2]=4 828 B9R1.2 O=CC1=CC(F)=CC=C1 NO22298 [1,1,0,0,0,0|0,0,2]=4 829 B9R1.2 O=CC1=CC(I)=CC=C1 NO20132 [1,1,0,0,0,0|0,0,2]=4 830 B9R1.2 O=CC1=CC(O)=CC=C1 DY20422 [1,1,0,0,0,0|0,0,2]=4 831 B9R1.2 OCC1=CC(Br)=CN=C1 NO18272 [1,1,0,0,0,0|1,0,0]=3 832 B9R1.2 OCC1=CC(Br)=NC=C1 NO19256 [1,1,0,0,0,0|1,0,0]=3 833 B9R1.2 OCC1=CC(F)=CC=C1 NO19069 [1,1,0,0,0,0|0,0,0]=2 834 B9R1.2 OCC1=CC(F)=CN=C1 DY430713 [1,1,0,0,0,0|1,0,0]=3 835 B9R1.2 OCC1=NC(Br)=CC=C1 NO23004 [1,1,0,0,0,0|1,0,0]=3 836 B9R1.2 OCC1=NC(Cl)=CC=C1 NO10667 [1,1,0,0,0,0|1,0,0]=3 837 B9R1.2 OCC1=NC(Cl)=CC=C1 NO19907 [1,1,0,0,0,0|1,0,0]=3 838 B9R1.2 OCC1=NC(Cl)=CN=C1 NO16124 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.2 OCC1=NC(Cl)=NC=C1 DY550299 [1,1,0,0,0,0|2,0,0]=4 840 B9R1.2 OCC1=NC=CC(Br)=C1 NO18696 [1,1,0,0,0,0|1,0,0]=3 841 B9R1.2 OCC1=NC=CC(Cl)=C1 DY20517 [1,1,0,0,0,0|1,0,0]=3 842 B9R1.2 OCC1=NC=CC(O)=C1 NO17612 [1,1,0,0,0,0|1,0,0]=3 843 B9R1.2 [O-][n+]1cccc(CO)c1 DY567759 [1,1,0,0,0,0|1,0,0]=3 844 B9R1.6 CC(C)C1=NC=CC=C1 NO21621 [1,1,0,0,0,0|2,0,0]=4 845 B9R1.6 CC(N)C1=CC=CC=C1 DY457042 [1,1,0,0,0,0|1,0,0]=3 846 B9R1.6 CC(O)C1=CN=CN=C1 DY572325 [1,1,0,0,0,0|2,0,0]=4 847 B9R1.6 CC(O)C1=NC=CC=C1 NO20801 [1,1,0,0,0,0|1,0,0]=3 848 B9R1.6 CS(=O)C1=CC=CC=C1 DY510356 [1,1,0,0,0,0|1,0,1]=4 849 B9R1.6 C[C@@H](N)C1=CC=CN=C1 DY553203 [1,1,0,0,0,0|2,0,0]=4 850 B9R1.6 C[C@@H](N)C1=CC=CN=C1 DY621669 [1,1,0,0,0,0|2,0,0]=4 851 B9R1.6 C[C@@H](O)C1=NC=CC=C1 DY20310 [1,1,0,0,0,0|1,0,0]=3 852 B9R1.6 C[C@@H](O)C1=NC=CC=N1 DY621675 [1,1,0,0,0,0|2,0,0]=4 853 B9R1.6 C[C@H](N)C1=CC=CN=C1 DY546027 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.6 C[C@H](N)C1=NC=CC=C1 NO15370 [1,1,0,0,0,0|2,0,0]=4 855 B9R1.6 C[C@H](O)C1=CC=CN=N1 DY586498 [1,1,0,0,0,0|2,0,0]=4 856 B9R1.6 C[PH](=O)C1=CC=CC=C1 NO16386 [1,1,0,0,0,0|1,0,1]=4 857 B9R1.6 C[S@@](=O)C1=CC=CC=C1 DY621380 [1,1,0,0,0,0|1,0,1]=4 858 B9R1.6 ClP(Cl)C1=CC=CC=C1 DY822051 [1,1,0,0,0,0|2,0,0]=4 859 B9R1.6 N=C(N)C1=CC=CC=C1 NO14830 [1,1,0,0,0,0|1,0,1]=4 860 B9R1.6 O=C(Br)C1=CC=CC=C1 DY585100 [1,1,0,0,0,0|0,0,2]=4 861 B9R1.6 O=C(Cl)C1=CC=CC=C1 DY40435 [1,1,0,0,0,0|0,0,2]=4 862 B9R1.6 O=C(O)C1=CC=CN=C1 DY41633 [1,1,0,0,0,0|1,0,1]=4 863 B9R1.6 O=C(O)C1=NC=CC=C1 NO13384 [1,1,0,0,0,0|1,0,1]=4 864 B9R1.6 O=C([O-])C1=CC=CC=C1 DY558819 [1,1,0,0,0,0|0,0,2]=4 865 B9R1.6 O=[PH](O)C1=CC=CC=C1 DY532299 [1,1,0,0,0,0|1,0,0]=3 866 B9R1.6 OB(O)C1=CC=CC=C1 NO19450 [1,1,0,0,0,0|1,0,0]=3 867 B9R1.6 OB(O)C1=CC=CN=C1 NO17797 [1,1,0,0,0,0|2,0,0]=4 868 B9R1.6 OB(O)C1=CC=NC=C1 NO22018 [1,1,0,0,0,0|2,0,0]=4 869 B9R1.6 OB(O)C1=NC=CC=C1 DY20201 [1,1,0,0,0,0|2,0,0]=4 870 B9R1.8 BrCCC1=CC=CN=C1 DY608158 [1,1,0,0,0,0|2,0,0]=4 871 B9R1.8 C#CCC1=CC=CC=C1 DY501873 [1,1,0,0,0,0|1,0,0]=3 872 B9R1.8 CCCC1=CC=CN=C1 NO22402 [1,1,0,0,0,0|2,0,0]=4 873 B9R1.8 CNCC1=CC=CC=C1 DY10559 [1,1,0,0,0,0|1,0,0]=3 874 B9R1.8 CNCC1=CC=CC=C1 DY20323 [1,1,0,0,0,0|1,0,0]=3 875 B9R1.8 CNCC1=CC=CC=C1 DY21006 [1,1,0,0,0,0|1,0,0]=3 876 B9R1.8 CNCC1=CC=CN=C1 NO18846 [1,1,0,0,0,0|2,0,0]=4 877 B9R1.8 CNCC1=CC=NC=C1 DY712153 [1,1,0,0,0,0|2,0,0]=4 878 B9R1.8 CNCC1=NC=CC=C1 DY501242 [1,1,0,0,0,0|2,0,0]=4 879 B9R1.8 CNCC1=NC=CC=C1 DY663671 [1,1,0,0,0,0|2,0,0]=4 880 B9R1.8 COCC1=NC=CC=C1 NO20909 [1,1,0,0,0,0|1,0,0]=3 881 B9R1.8 ClCCC1=CC=NC=C1 NO17913 [1,1,0,0,0,0|2,0,0]=4 882 B9R1.8 ClCSC1=CC=CC=C1 DY797799 [1,1,0,0,0,0|1,0,0]=3 883 B9R1.8 N#CCC1=CC=CN=C1 NO18407 [1,1,0,0,0,0|2,0,0]=4 884 B9R1.8 N#CCC1=CC=NC=C1 NO20239 [1,1,0,0,0,0|2,0,0]=4 885 B9R1.8 N#CCC1=NC=CC=C1 NO18926 [1,1,0,0,0,0|2,0,0]=4 886 B9R1.8 N#C[Se]C1=CC=CC=C1 DY822031 [1,1,0,0,0,0|1,0,1]=4 887 B9R1.8 NCCC1=CC=CN=C1 NO21892 [1,1,0,0,0,0|2,0,0]=4 888 B9R1.8 NCCC1=NC=CC=C1 NO14064 [1,1,0,0,0,0|2,0,0]=4 889 B9R1.8 NNCC1=CC=CC=C1 NO11006 [1,1,0,0,0,0|1,0,0]=3 890 B9R1.8 NNCC1=CC=CC=C1 NO12127 [1,1,0,0,0,0|1,0,0]=3 891 B9R1.8 NNCC1=CC=NC=C1 DY518961 [1,1,0,0,0,0|2,0,0]=4 892 B9R1.8 NNCC1=NC=CC=C1 DY578445 [1,1,0,0,0,0|2,0,0]=4 893 B9R1.8 NOCC1=CC=CC=C1 NO14063 [1,1,0,0,0,0|0,0,0]=2 894 B9R1.8 OCCC1=CN=CN=C1 NO12401 [1,1,0,0,0,0|2,0,0]=4 895 B9R1.8 ONCC1=CC=CC=C1 DY563853 [1,1,0,0,0,0|0,0,0]=2 896 B9R1.8 ONCC1=CC=CC=C1 NO11753 [1,1,0,0,0,0|0,0,0]=2 897 B9R1.15 BrCC1=C(Br)C=CC=C1 DY20808 [1,1,0,0,0,0|1,0,0]=3 898 B9R1.15 BrCC1=C(Br)C=NC=C1 DY656944 [1,1,0,0,0,0|2,0,0]=4 899 B9R1.15 BrCC1=C(I)C=CC=C1 DY40561 [1,1,0,0,0,0|1,0,0]=3 900 B9R1.15 C#CC1=C(Cl)C=CC=C1 NO20629 [1,1,0,0,0,0|1,0,1]=4 901 B9R1.15 C#CC1=C(N)C=CC=C1 NO21537 [1,1,0,0,0,0|1,0,1]=4 902 B9R1.15 C#CC1=C(O)C=CC=C1 NO21538 [1,1,0,0,0,0|1,0,1]=4 903 B9R1.15 C=CC1=C(Br)C=CC=C1 NO18853 [1,1,0,0,0,0|1,0,1]=4 904 B9R1.15 C=CC1=C(Cl)C=CC=C1 NO19873 [1,1,0,0,0,0|1,0,1]=4 905 B9R1.15 CC1=C(CBr)C=CC=C1 NO14791 [1,1,0,0,0,0|1,0,0]=3 906 B9R1.15 CC1=C(CBr)C=NC=C1 DY656650 [1,1,0,0,0,0|2,0,0]=4 907 B9R1.15 CC1=C(CBr)C=NC=C1 NO17496 [1,1,0,0,0,0|2,0,0]=4 908 B9R1.15 CC1=C(CN)C=NC=C1 NO20204 [1,1,0,0,0,0|2,0,0]=4 909 B9R1.15 CC1=C(NN)C=CC=C1 DY788973 [1,1,0,0,0,0|2,0,0]=4 910 B9R1.15 CC1=C(NN)C=CC=C1 NO19575 [1,1,0,0,0,0|2,0,0]=4 911 B9R1.15 CC1=CC=CC=C1C=O NO19114 [1,1,0,0,0,0|0,0,2]=4 912 B9R1.15 CC1=CC=CN=C1CCl NO15725 [1,1,0,0,0,0|2,0,0]=4 913 B9R1.15 CC1=CC=CN=C1CO NO19225 [1,1,0,0,0,0|1,0,0]=3 914 B9R1.15 CC1=NC=CC=C1CBr DY520989 [1,1,0,0,0,0|2,0,0]=4 915 B9R1.15 CC1=NC=CC=C1CO NO20145 [1,1,0,0,0,0|1,0,0]=3 916 B9R1.15 CCC1=C(Br)C=CC=C1 NO20980 [1,1,0,0,0,0|1,0,0]=3 917 B9R1.15 CCC1=C(C)C=CC=C1 NO21536 [1,1,0,0,0,0|1,0,0]=3 918 B9R1.15 CCC1=C(I)C=CC=C1 DY534201 [1,1,0,0,0,0|1,0,0]=3 919 B9R1.15 CCC1=C(N)C=NC=C1 DY658535 [1,1,0,0,0,0|2,0,0]=4 920 B9R1.15 CCC1=CC=CN=C1C DY522489 [1,1,0,0,0,0|2,0,0]=4 921 B9R1.15 CNC1=C(Br)C=CC=C1 DY584260 [1,1,0,0,0,0|2,0,0]=4 922 B9R1.15 CNC1=C(F)C=CC=C1 NO13895 [1,1,0,0,0,0|2,0,0]=4 923 B9R1.15 CNC1=CC=CC=C1N NO22302 [1,1,0,0,0,0|2,0,0]=4 924 B9R1.15 COC1=C(Br)C=CC=C1 NO19150 [1,1,0,0,0,0|2,0,0]=4 925 B9R1.15 COC1=C(C)C=CC=C1 DY561483 [1,1,0,0,0,0|2,0,0]=4 926 B9R1.15 COC1=C(F)C=CC=C1 NO19904 [1,1,0,0,0,0|2,0,0]=4 927 B9R1.15 COC1=C(N)C=CC=C1 NO11812 [1,1,0,0,0,0|2,0,0]=4 928 B9R1.15 ClC1=C(CBr)C=CC=C1 NO19190 [1,1,0,0,0,0|1,0,0]=3 929 B9R1.15 ClC1=CC=CN=C1CBr DY116292 [1,1,0,0,0,0|2,0,0]=4 930 B9R1.15 ClCC1=C(Br)C=CC=C1 DY584533 [1,1,0,0,0,0|1,0,0]=3 931 B9R1.15 ClCC1=C(Cl)C=CC=C1 NO19964 [1,1,0,0,0,0|1,0,0]=3 932 B9R1.15 ClCC1=NC=CC=C1Br DY656902 [1,1,0,0,0,0|2,0,0]=4 933 B9R1.15 FC1=C(CBr)C=CC=C1 NO21562 [1,1,0,0,0,0|1,0,0]=3 934 B9R1.15 N#CC1=C(Br)C=CC=C1 DY20182 [1,1,0,0,0,0|1,0,1]=4 935 B9R1.15 N#CC1=C(F)C=CC=C1 NO18285 [1,1,0,0,0,0|1,0,1]=4 936 B9R1.15 N#CC1=C(I)C=CC=C1 NO21883 [1,1,0,0,0,0|1,0,1]=4 937 B9R1.15 N#CC1=C(N)C=CC=C1 NO13393 [1,1,0,0,0,0|1,0,1]=4 938 B9R1.15 N#CC1=C(O)C=CC=C1 NO19191 [1,1,0,0,0,0|1,0,1]=4 939 B9R1.15 NC1=C(C=O)C=CC=C1 DY20756 [1,1,0,0,0,0|0,0,2]=4 940 B9R1.15 NC1=C(CO)C=CC=C1 NO19122 [1,1,0,0,0,0|0,0,0]=2 941 B9R1.15 NC1=NC=CC=C1CO NO13983 [1,1,0,0,0,0|1,0,0]=3 942 B9R1.15 NCC1=C(Br)C=CC=C1 NO19534 [1,1,0,0,0,0|1,0,0]=3 943 B9R1.15 NCC1=C(Br)C=CN=C1 DY651253 [1,1,0,0,0,0|2,0,0]=4 944 B9R1.15 NCC1=C(Br)C=NC=C1 NO17629 [1,1,0,0,0,0|2,0,0]=4 945 B9R1.15 NCC1=C(F)C=CC=C1 DY40826 [1,1,0,0,0,0|1,0,0]=3 946 B9R1.15 NCC1=C(N)C=CC=C1 DY40796 [1,1,0,0,0,0|1,0,0]=3 947 B9R1.15 NCC1=C(N)C=NC=C1 DY574167 [1,1,0,0,0,0|2,0,0]=4 948 B9R1.15 NCC1=C(O)C=CC=C1 NO20889 [1,1,0,0,0,0|1,0,0]=3 949 B9R1.15 NCC1=C(O)C=CN=C1 DY656620 [1,1,0,0,0,0|2,0,0]=4 950 B9R1.15 NCC1=CC=CN=C1F DY538641 [1,1,0,0,0,0|2,0,0]=4 951 B9R1.15 NCC1=NC=CC=C1Br DY713191 [1,1,0,0,0,0|2,0,0]=4 952 B9R1.15 NCC1=NC=CC=C1N DY654384 [1,1,0,0,0,0|2,0,0]=4 953 B9R1.15 NNC1=C(Br)C=CC=C1 NO19466 [1,1,0,0,0,0|2,0,0]=4 954 B9R1.15 NNC1=C(Cl)C=CC=C1 NO19478 [1,1,0,0,0,0|2,0,0]=4 955 B9R1.15 NNC1=C(F)C=CC=C1 NO23033 [1,1,0,0,0,0|2,0,0]=4 956 B9R1.15 O=CC1=C(F)C=CC=C1 DY794301 [1,1,0,0,0,0|0,0,2]=4 957 B9R1.15 O=CC1=C(F)C=CC=C1 NO21560 [1,1,0,0,0,0|0,0,2]=4 958 B9R1.15 O=CC1=C(I)C=CC=C1 NO20131 [1,1,0,0,0,0|0,0,2]=4 959 B9R1.15 O=CC1=C(O)C=CC=C1 DY41121 [1,1,0,0,0,0|0,0,2]=4 960 B9R1.15 OCC1=C(Br)C=CC=C1 NO18828 [1,1,0,0,0,0|0,0,0]=2 961 B9R1.15 OCC1=C(Br)C=NC=C1 NO12881 [1,1,0,0,0,0|1,0,0]=3 962 B9R1.15 OCC1=C(Cl)C=CC=C1 NO21494 [1,1,0,0,0,0|0,0,0]=2 963 B9R1.15 OCC1=C(Cl)C=CN=C1 NO17105 [1,1,0,0,0,0|1,0,0]=3 964 B9R1.15 OCC1=C(F)C=NC=C1 DY452008 [1,1,0,0,0,0|1,0,0]=3 965 B9R1.15 OCC1=C(I)C=CC=C1 NO19102 [1,1,0,0,0,0|0,0,0]=2 966 B9R1.15 OCC1=C(O)C=CC=C1 NO16243 [1,1,0,0,0,0|0,0,0]=2 967 B9R1.15 OCC1=CC=CN=C1Cl NO14328 [1,1,0,0,0,0|1,0,0]=3 968 B9R1.15 OCC1=CC=CN=C1F NO18697 [1,1,0,0,0,0|1,0,0]=3 969 B9R1.15 OCC1=NC=CC=C1Cl NO17318 [1,1,0,0,0,0|1,0,0]=3 970 B9R1.15 OCC1=NC=CC=C1O DY20200 [1,1,0,0,0,0|1,0,0]=3 971 B9R1.69 BrC1=C(I)C=C(I)C=C1 DY584301 [1,1,0,0,0,0|2,0,0]=4 972 B9R1.69 CC1=C(Br)C=C(Br)C=C1 DY33103 [1,1,0,0,0,0|1,0,0]=3 973 B9R1.69 CC1=C(Br)C=C(F)C=C1 DY20047 [1,1,0,0,0,0|1,0,0]=3 974 B9R1.69 CC1=C(Br)C=C(I)C=C1 NO21358 [1,1,0,0,0,0|1,0,0]=3 975 B9R1.69 CC1=C(Br)C=C(N)C=C1 NO10506 [1,1,0,0,0,0|1,0,0]=3 976 B9R1.69 CC1=C(Br)C=C(N)C=N1 NO18819 [1,1,0,0,0,0|2,0,0]=4 977 B9R1.69 CC1=C(Br)C=C(O)C=C1 NO12184 [1,1,0,0,0,0|0,0,0]=2 978 B9R1.69 CC1=C(Br)C=CC(Br)=C1 NO21137 [1,1,0,0,0,0|2,0,0]=4 979 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 NO20166 [1,1,0,0,0,0|2,0,0]=4 980 B9R1.69 CC1=C(Br)C=CC(F)=C1 NO10390 [1,1,0,0,0,0|2,0,0]=4 981 B9R1.69 CC1=C(Br)C=CC(N)=C1 NO15448 [1,1,0,0,0,0|2,0,0]=4 982 B9R1.69 CC1=C(Br)C=CC(O)=C1 NO20279 [1,1,0,0,0,0|1,0,0]=3 983 B9R1.69 CC1=C(Br)C=CC(O)=N1 NO18359 [1,1,0,0,0,0|2,0,0]=4 984 B9R1.69 CC1=C(C)C=C(S)C=C1 DY535125 [1,1,0,0,0,0|0,1,0]=3 985 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 NO22639 [1,1,0,0,0,0|1,0,0]=3 986 B9R1.69 CC1=C(Cl)C=C(Cl)C=C1 NO21102 [1,1,0,0,0,0|1,0,0]=3 987 B9R1.69 CC1=C(Cl)C=C(F)C=C1 NO10409 [1,1,0,0,0,0|1,0,0]=3 988 B9R1.69 CC1=C(Cl)C=C(I)C=C1 DY451264 [1,1,0,0,0,0|1,0,0]=3 989 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 NO19135 [1,1,0,0,0,0|2,0,0]=4 990 B9R1.69 CC1=C(Cl)C=CC(I)=C1 NO20194 [1,1,0,0,0,0|2,0,0]=4 991 B9R1.69 CC1=C(Cl)N=C(N)C=C1 NO21753 [1,1,0,0,0,0|2,0,0]=4 992 B9R1.69 CC1=C(Cl)N=CC(O)=C1 NO15214 [1,1,0,0,0,0|2,0,0]=4 993 B9R1.69 CC1=C(F)C=C(Br)C=C1 NO14669 [1,1,0,0,0,0|1,0,0]=3 994 B9R1.69 CC1=C(F)C=C(Cl)C=C1 DY41507 [1,1,0,0,0,0|1,0,0]=3 995 B9R1.69 CC1=C(F)C=C(F)C=C1 NO19066 [1,1,0,0,0,0|1,0,0]=3 996 B9R1.69 CC1=C(F)C=C(N)C=C1 DY20039 [1,1,0,0,0,0|1,0,0]=3 997 B9R1.69 CC1=C(F)C=C(O)C=C1 NO10481 [1,1,0,0,0,0|0,0,0]=2 998 B9R1.69 CC1=C(F)C=CC(Cl)=C1 NO14434 [1,1,0,0,0,0|2,0,0]=4 999 B9R1.69 CC1=C(F)C=CC(F)=C1 NO19928 [1,1,0,0,0,0|2,0,0]=4 1000 B9R1.69 CC1=C(F)C=CC(I)=C1 NO10424 [1,1,0,0,0,0|2,0,0]=4 1001 B9R1.69 CC1=C(F)C=CC(N)=C1 NO10514 [1,1,0,0,0,0|2,0,0]=4 1002 B9R1.69 CC1=C(F)C=CC(O)=C1 NO10483 [1,1,0,0,0,0|1,0,0]=3 1003 B9R1.69 CC1=C(I)C=C(Br)C=C1 DY41501 [1,1,0,0,0,0|1,0,0]=3 1004 B9R1.69 CC1=C(I)C=CC(Br)=C1 NO10398 [1,1,0,0,0,0|2,0,0]=4 1005 B9R1.69 CC1=C(I)C=CC(O)=C1 NO22901 [1,1,0,0,0,0|1,0,0]=3 1006 B9R1.69 CC1=C(N)C=C(Br)C=C1 NO14257 [1,1,0,0,0,0|1,0,0]=3 1007 B9R1.69 CC1=C(N)C=C(I)C=C1 NO20374 [1,1,0,0,0,0|1,0,0]=3 1008 B9R1.69 CC1=C(N)C=CC(Br)=C1 NO15106 [1,1,0,0,0,0|2,0,0]=4 1009 B9R1.69 CC1=C(N)C=CC(Cl)=C1 NO16371 [1,1,0,0,0,0|2,0,0]=4 1010 B9R1.69 CC1=C(N)C=CC(F)=C1 NO10513 [1,1,0,0,0,0|2,0,0]=4 1011 B9R1.69 CC1=C(N)C=CC(I)=C1 NO20371 [1,1,0,0,0,0|2,0,0]=4 1012 B9R1.69 CC1=C(N)C=CC(N)=C1 NO18566 [1,1,0,0,0,0|2,0,0]=4 1013 B9R1.69 CC1=C(N)C=CC(O)=C1 NO14087 [1,1,0,0,0,0|1,0,0]=3 1014 B9R1.69 CC1=C(O)C=C(Br)C=C1 NO10275 [1,1,0,0,0,0|1,0,0]=3 1015 B9R1.69 CC1=C(O)C=C(F)C=C1 NO10484 [1,1,0,0,0,0|1,0,0]=3 1016 B9R1.69 CC1=C(O)C=C(I)C=C1 DY451996 [1,1,0,0,0,0|1,0,0]=3 1017 B9R1.69 CC1=C(O)C=C(O)C=C1 NO20391 [1,1,0,0,0,0|0,0,0]=2 1018 B9R1.69 CC1=C(O)C=CC(Br)=C1 DY20395 [1,1,0,0,0,0|1,0,0]=3 1019 B9R1.69 CC1=C(O)C=CC(Cl)=C1 NO20290 [1,1,0,0,0,0|1,0,0]=3 1020 B9R1.69 CC1=C(O)C=CC(F)=C1 NO10482 [1,1,0,0,0,0|1,0,0]=3 1021 B9R1.69 CC1=C(S)C=CC(F)=C1 DY584410 [1,1,0,0,0,0|1,1,0]=4 1022 B9R1.69 CC1=CC(Br)=C(Br)C=C1 DY41513 [1,1,0,0,0,0|1,0,0]=3 1023 B9R1.69 CC1=CC(Br)=C(C)C=C1 NO21410 [1,1,0,0,0,0|1,0,0]=3 1024 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 NO20167 [1,1,0,0,0,0|1,0,0]=3 1025 B9R1.69 CC1=CC(Br)=C(F)C=C1 DY20046 [1,1,0,0,0,0|1,0,0]=3 1026 B9R1.69 CC1=CC(Br)=C(N)C=C1 NO19777 [1,1,0,0,0,0|1,0,0]=3 1027 B9R1.69 CC1=CC(Br)=CN=C1O NO18541 [1,1,0,0,0,0|2,0,0]=4 1028 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 NO19979 [1,1,0,0,0,0|1,0,0]=3 1029 B9R1.69 CC1=CC(Cl)=C(Cl)C=C1 NO21935 [1,1,0,0,0,0|1,0,0]=3 1030 B9R1.69 CC1=CC(Cl)=C(O)C=C1 NO20292 [1,1,0,0,0,0|0,0,0]=2 1031 B9R1.69 CC1=CC(Cl)=CN=C1O DY20516 [1,1,0,0,0,0|2,0,0]=4 1032 B9R1.69 CC1=CC(Cl)=[N+]([O-])C=C1 DY655422 [1,1,0,0,0,0|1,0,1]=4 1033 B9R1.69 CC1=CC(F)=C(Br)C=C1 NO10392 [1,1,0,0,0,0|1,0,0]=3 1034 B9R1.69 CC1=CC(F)=C(C)C=C1 DY433527 [1,1,0,0,0,0|1,0,0]=3 1035 B9R1.69 CC1=CC(F)=C(C)C=C1 NO13237 [1,1,0,0,0,0|1,0,0]=3 1036 B9R1.69 CC1=CC(F)=C(Cl)C=C1 NO22757 [1,1,0,0,0,0|1,0,0]=3 1037 B9R1.69 CC1=CC(F)=C(F)C=C1 NO19897 [1,1,0,0,0,0|1,0,0]=3 1038 B9R1.69 CC1=CC(I)=C(F)C=C1 DY555255 [1,1,0,0,0,0|1,0,0]=3 1039 B9R1.69 CC1=CC(I)=C(N)C=C1 NO10517 [1,1,0,0,0,0|1,0,0]=3 1040 B9R1.69 CC1=CC(N)=C(Br)C=C1 NO18349 [1,1,0,0,0,0|1,0,0]=3 1041 B9R1.69 CC1=CC(N)=C(Cl)C=C1 NO20365 [1,1,0,0,0,0|1,0,0]=3 1042 B9R1.69 CC1=CC(N)=C(F)C=C1 NO10510 [1,1,0,0,0,0|1,0,0]=3 1043 B9R1.69 CC1=CC(N)=C(I)C=C1 NO20372 [1,1,0,0,0,0|1,0,0]=3 1044 B9R1.69 CC1=CC(O)=C(Br)C=C1 NO16357 [1,1,0,0,0,0|1,0,0]=3 1045 B9R1.69 CC1=CC(O)=C(C)C=C1 NO19431 [1,1,0,0,0,0|1,0,0]=3 1046 B9R1.69 CC1=CC(O)=C(N)C=C1 NO14086 [1,1,0,0,0,0|1,0,0]=3 1047 B9R1.69 CC1=CC(O)=NC=C1Br NO13793 [1,1,0,0,0,0|2,0,0]=4 1048 B9R1.69 CC1=CC(S)=C(N)C=C1 DY793311 [1,1,0,0,0,0|1,0,0]=3 1049 B9R1.69 CC1=CC=C(Br)C(Br)=N1 NO14048 [1,1,0,0,0,0|2,0,0]=4 1050 B9R1.69 CC1=CC=C(Br)C(C)=N1 NO20363 [1,1,0,0,0,0|2,0,0]=4 1051 B9R1.69 CC1=CC=C(Br)C(Cl)=N1 NO13860 [1,1,0,0,0,0|2,0,0]=4 1052 B9R1.69 CC1=CC=C(Br)C(N)=N1 NO19460 [1,1,0,0,0,0|2,0,0]=4 1053 B9R1.69 CC1=CC=C(Br)N=C1N DY443537 [1,1,0,0,0,0|2,0,0]=4 1054 B9R1.69 CC1=CC=C(C)C(Cl)=N1 NO16816 [1,1,0,0,0,0|2,0,0]=4 1055 B9R1.69 CC1=CC=C(C)C(N)=N1 NO16045 [1,1,0,0,0,0|2,0,0]=4 1056 B9R1.69 CC1=CC=C(Cl)C(Br)=N1 DY585662 [1,1,0,0,0,0|2,0,0]=4 1057 B9R1.69 CC1=CC=C(Cl)C(Cl)=N1 NO21017 [1,1,0,0,0,0|2,0,0]=4 1058 B9R1.69 CC1=CC=C(Cl)N=C1Br NO16574 [1,1,0,0,0,0|2,0,0]=4 1059 B9R1.69 CC1=CC=C(Cl)N=C1Cl NO15124 [1,1,0,0,0,0|2,0,0]=4 1060 B9R1.69 CC1=CC=C(Cl)N=C1I DY660983 [1,1,0,0,0,0|2,0,0]=4 1061 B9R1.69 CC1=CC=C(F)C(Br)=N1 NO14229 [1,1,0,0,0,0|2,0,0]=4 1062 B9R1.69 CC1=CC=C(F)C(Cl)=N1 NO14228 [1,1,0,0,0,0|2,0,0]=4 1063 B9R1.69 CC1=CC=C(F)C=C1N NO20370 [1,1,0,0,0,0|1,0,0]=3 1064 B9R1.69 CC1=CC=C(I)C(N)=N1 NO13037 [1,1,0,0,0,0|2,0,0]=4 1065 B9R1.69 CC1=CC=C(N)C(Br)=N1 NO19459 [1,1,0,0,0,0|2,0,0]=4 1066 B9R1.69 CC1=CC=C(N)C(C)=N1 NO19572 [1,1,0,0,0,0|2,0,0]=4 1067 B9R1.69 CC1=CC=C(N)C(Cl)=N1 NO19471 [1,1,0,0,0,0|2,0,0]=4 1068 B9R1.69 CC1=CC=C(N)C(F)=N1 DY551829 [1,1,0,0,0,0|2,0,0]=4 1069 B9R1.69 CC1=CC=C(N)C(N)=C1 NO21925 [1,1,0,0,0,0|1,0,0]=3 1070 B9R1.69 CC1=CC=C(O)C(Br)=N1 NO21385 [1,1,0,0,0,0|1,0,0]=3 1071 B9R1.69 CC1=CC=C(O)C(Cl)=N1 NO21487 [1,1,0,0,0,0|1,0,0]=3 1072 B9R1.69 CC1=CC=C(O)C(I)=N1 NO21614 [1,1,0,0,0,0|1,0,0]=3 1073 B9R1.69 CC1=CC=C(O)C(N)=N1 DY431086 [1,1,0,0,0,0|1,0,0]=3 1074 B9R1.69 CC1=CC=C(O)C(O)=C1 NO14435 [1,1,0,0,0,0|0,0,0]=2 1075 B9R1.69 CC1=CN=C(Br)C(Br)=C1 NO18938 [1,1,0,0,0,0|2,0,0]=4 1076 B9R1.69 CC1=CN=C(Br)C(C)=C1 DY20801 [1,1,0,0,0,0|2,0,0]=4 1077 B9R1.69 CC1=CN=C(Br)C(F)=C1 DY20932 [1,1,0,0,0,0|2,0,0]=4 1078 B9R1.69 CC1=CN=C(Br)C(I)=C1 DY33513 [1,1,0,0,0,0|2,0,0]=4 1079 B9R1.69 CC1=CN=C(Br)C(N)=C1 DY20317 [1,1,0,0,0,0|2,0,0]=4 1080 B9R1.69 CC1=CN=C(Br)C=C1N NO16645 [1,1,0,0,0,0|2,0,0]=4 1081 B9R1.69 CC1=CN=C(C)C(C)=C1 NO20999 [1,1,0,0,0,0|2,0,0]=4 1082 B9R1.69 CC1=CN=C(C)C(N)=C1 DY578583 [1,1,0,0,0,0|2,0,0]=4 1083 B9R1.69 CC1=CN=C(C)C=C1Cl NO15163 [1,1,0,0,0,0|2,0,0]=4 1084 B9R1.69 CC1=CN=C(Cl)C(Br)=C1 NO13831 [1,1,0,0,0,0|2,0,0]=4 1085 B9R1.69 CC1=CN=C(Cl)C(F)=C1 NO19037 [1,1,0,0,0,0|2,0,0]=4 1086 B9R1.69 CC1=CN=C(Cl)C(I)=C1 NO21432 [1,1,0,0,0,0|2,0,0]=4 1087 B9R1.69 CC1=CN=C(Cl)C(N)=C1 NO19472 [1,1,0,0,0,0|2,0,0]=4 1088 B9R1.69 CC1=CN=C(Cl)C=C1Cl DY20301 [1,1,0,0,0,0|2,0,0]=4 1089 B9R1.69 CC1=CN=C(Cl)C=C1N NO14350 [1,1,0,0,0,0|2,0,0]=4 1090 B9R1.69 CC1=CN=C(F)C(Br)=C1 NO13828 [1,1,0,0,0,0|2,0,0]=4 1091 B9R1.69 CC1=CN=C(F)C(I)=C1 NO13746 [1,1,0,0,0,0|2,0,0]=4 1092 B9R1.69 CC1=CN=C(F)C=C1I NO18758 [1,1,0,0,0,0|2,0,0]=4 1093 B9R1.69 CC1=CN=C(I)C(Br)=C1 DY656926 [1,1,0,0,0,0|2,0,0]=4 1094 B9R1.69 CC1=CN=C(N)C(Br)=C1 NO19456 [1,1,0,0,0,0|2,0,0]=4 1095 B9R1.69 CC1=CN=C(N)C(C)=C1 DY427372 [1,1,0,0,0,0|2,0,0]=4 1096 B9R1.69 CC1=CN=C(N)C(I)=C1 DY715448 [1,1,0,0,0,0|2,0,0]=4 1097 B9R1.69 CC1=CN=C(N)C(N)=C1 NO12089 [1,1,0,0,0,0|2,0,0]=4 1098 B9R1.69 CC1=CN=C(N)C=C1Br DY712393 [1,1,0,0,0,0|2,0,0]=4 1099 B9R1.69 CC1=CN=C(O)C(Br)=C1 NO13830 [1,1,0,0,0,0|1,0,0]=3 1100 B9R1.69 CC1=CN=C(O)C(C)=N1 NO12599 [1,1,0,0,0,0|2,0,0]=4 1101 B9R1.69 CC1=CN=C(O)C=C1N DY582459 [1,1,0,0,0,0|1,0,0]=3 1102 B9R1.69 CC1=CNC(=O)C(N)=C1 NO21574 [1,1,0,0,0,0|1,0,1]=4 1103 B9R1.69 CC1=CNC(=O)C=C1Br DY658226 [1,1,0,0,0,0|1,0,1]=4 1104 B9R1.69 CC1=C[N+]([O-])=C(Br)C=C1 NO16262 [1,1,0,0,0,0|2,0,0]=4 1105 B9R1.69 CC1=NC(Br)=CC=C1O NO15297 [1,1,0,0,0,0|2,0,0]=4 1106 B9R1.69 CC1=NC(F)=CC=C1O DY452518 [1,1,0,0,0,0|2,0,0]=4 1107 B9R1.69 CC1=NC(I)=CC=C1O DY431760 [1,1,0,0,0,0|2,0,0]=4 1108 B9R1.69 CC1=NC=C(Br)C=C1Br NO13993 [1,1,0,0,0,0|2,0,0]=4 1109 B9R1.69 CC1=NC=C(Br)C=C1N NO10276 [1,1,0,0,0,0|2,0,0]=4 1110 B9R1.69 CC1=NC=C(Br)C=C1O NO15115 [1,1,0,0,0,0|2,0,0]=4 1111 B9R1.69 CC1=NC=C(Cl)C(Cl)=C1 DY711085 [1,1,0,0,0,0|2,0,0]=4 1112 B9R1.69 CC1=NC=C(F)C(Br)=C1 NO16271 [1,1,0,0,0,0|2,0,0]=4 1113 B9R1.69 CC1=NC=C(O)C(C)=N1 NO16008 [1,1,0,0,0,0|2,0,0]=4 1114 B9R1.69 CN1C=CC(=O)C(O)=C1 NO17435 [1,1,0,0,0,0|1,0,1]=4 1115 B9R1.69 CN1C=CC(Br)=CC1=O NO12571 [1,1,0,0,0,0|2,0,0]=4 1116 B9R1.69 CN1C=CC(I)=CC1=O DY442287 [1,1,0,0,0,0|2,0,0]=4 1117 B9R1.69 ClC1=C(Br)C=C(Br)C=C1 DY584370 [1,1,0,0,0,0|2,0,0]=4 1118 B9R1.69 ClC1=C(Br)C=CC(I)=C1 NO12748 [1,1,0,0,0,0|2,0,0]=4 1119 B9R1.69 ClC1=C(Cl)C=C(Br)C=C1 NO18812 [1,1,0,0,0,0|2,0,0]=4 1120 B9R1.69 ClC1=CC(Br)=C(I)C=C1 NO21351 [1,1,0,0,0,0|2,0,0]=4 1121 B9R1.69 ClC1=CC(Cl)=C(Br)C=C1 NO18636 [1,1,0,0,0,0|2,0,0]=4 1122 B9R1.69 ClC1=CC(I)=C(Br)C=C1 NO20652 [1,1,0,0,0,0|2,0,0]=4 1123 B9R1.69 ClC1=CC(I)=C(Cl)C=C1 DY546969 [1,1,0,0,0,0|2,0,0]=4 1124 B9R1.69 FC1=C(Br)C=C(Br)C=C1 DY20168 [1,1,0,0,0,0|2,0,0]=4 1125 B9R1.69 FC1=C(Br)C=C(Cl)C=C1 NO18841 [1,1,0,0,0,0|2,0,0]=4 1126 B9R1.69 FC1=C(Br)C=CC(Br)=C1 NO18653 [1,1,0,0,0,0|2,0,0]=4 1127 B9R1.69 FC1=C(Br)C=CC(I)=C1 NO18663 [1,1,0,0,0,0|2,0,0]=4 1128 B9R1.69 FC1=C(Cl)C=C(Br)C=C1 NO19184 [1,1,0,0,0,0|2,0,0]=4 1129 B9R1.69 FC1=C(Cl)C=CC(Br)=C1 NO19182 [1,1,0,0,0,0|2,0,0]=4 1130 B9R1.69 FC1=C(Cl)C=CC(I)=C1 NO18849 [1,1,0,0,0,0|2,0,0]=4 1131 B9R1.69 FC1=C(I)C=C(Br)C=C1 NO22852 [1,1,0,0,0,0|2,0,0]=4 1132 B9R1.69 FC1=C(I)C=C(Cl)C=C1 DY508694 [1,1,0,0,0,0|2,0,0]=4 1133 B9R1.69 FC1=C(I)C=CC(Br)=C1 NO22850 [1,1,0,0,0,0|2,0,0]=4 1134 B9R1.69 FC1=CC(Br)=C(Cl)C=C1 NO18847 [1,1,0,0,0,0|2,0,0]=4 1135 B9R1.69 FC1=CC(Br)=C(F)C=C1 NO19044 [1,1,0,0,0,0|2,0,0]=4 1136 B9R1.69 FC1=CC(Br)=C(I)C=C1 NO18665 [1,1,0,0,0,0|2,0,0]=4 1137 B9R1.69 FC1=CC(Cl)=C(Cl)C=C1 DY33048 [1,1,0,0,0,0|2,0,0]=4 1138 B9R1.69 FC1=CC(Cl)=C(F)C=C1 DY41471 [1,1,0,0,0,0|2,0,0]=4 1139 B9R1.69 FC1=CC(F)=C(F)C=C1 DY41495 [1,1,0,0,0,0|2,0,0]=4 1140 B9R1.69 FC1=CC(F)=C(S)C=C1 DY41404 [1,1,0,0,0,0|1,1,0]=4 1141 B9R1.69 FC1=CC(I)=C(Cl)C=C1 DY433497 [1,1,0,0,0,0|2,0,0]=4 1142 B9R1.69 FC1=CC=C(Br)C=C1F DY452314 [1,1,0,0,0,0|2,0,0]=4 1143 B9R1.69 Fc1ccc(I)c(Cl)c1 NO19647 [1,1,0,0,0,0|2,0,0]=4 1144 B9R1.69 IC1=CC(I)=C(I)C=C1 DY822105 [1,1,0,0,0,0|2,0,0]=4 1145 B9R1.69 NC1=C(Br)C=C(F)C=C1 DY40868 [1,1,0,0,0,0|2,0,0]=4 1146 B9R1.69 NC1=C(Br)C=C(I)C=C1 NO21357 [1,1,0,0,0,0|2,0,0]=4 1147 B9R1.69 NC1=C(Br)C=C(O)C=C1 DY41139 [1,1,0,0,0,0|1,0,0]=3 1148 B9R1.69 NC1=C(Br)C=CC(Br)=C1 NO18980 [1,1,0,0,0,0|2,0,0]=4 1149 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 NO18496 [1,1,0,0,0,0|2,0,0]=4 1150 B9R1.69 NC1=C(Br)C=CC(F)=C1 NO22951 [1,1,0,0,0,0|2,0,0]=4 1151 B9R1.69 NC1=C(Br)C=CC(I)=C1 DY822107 [1,1,0,0,0,0|2,0,0]=4 1152 B9R1.69 NC1=C(Br)C=CC(O)=C1 NO14504 [1,1,0,0,0,0|1,0,0]=3 1153 B9R1.69 NC1=C(Cl)C=C(Cl)C=C1 NO21094 [1,1,0,0,0,0|2,0,0]=4 1154 B9R1.69 NC1=C(Cl)C=C(O)C=C1 DY10180 [1,1,0,0,0,0|1,0,0]=3 1155 B9R1.69 NC1=C(Cl)C=C(O)C=C1 NO18805 [1,1,0,0,0,0|1,0,0]=3 1156 B9R1.69 NC1=C(Cl)C=C(O)C=N1 DY660825 [1,1,0,0,0,0|2,0,0]=4 1157 B9R1.69 NC1=C(Cl)C=CC(Br)=C1 NO15250 [1,1,0,0,0,0|2,0,0]=4 1158 B9R1.69 NC1=C(Cl)C=CC(Cl)=C1 NO21140 [1,1,0,0,0,0|2,0,0]=4 1159 B9R1.69 NC1=C(Cl)C=CC(F)=C1 NO22962 [1,1,0,0,0,0|2,0,0]=4 1160 B9R1.69 NC1=C(Cl)C=CC(I)=C1 DY822106 [1,1,0,0,0,0|2,0,0]=4 1161 B9R1.69 NC1=C(F)C=C(Br)C=C1 NO22953 [1,1,0,0,0,0|2,0,0]=4 1162 B9R1.69 NC1=C(F)C=C(Cl)C=C1 NO22965 [1,1,0,0,0,0|2,0,0]=4 1163 B9R1.69 NC1=C(F)C=C(F)C=C1 NO19091 [1,1,0,0,0,0|2,0,0]=4 1164 B9R1.69 NC1=C(F)C=C(I)C=C1 NO19120 [1,1,0,0,0,0|2,0,0]=4 1165 B9R1.69 NC1=C(F)C=C(O)C=C1 NO23017 [1,1,0,0,0,0|1,0,0]=3 1166 B9R1.69 NC1=C(F)C=CC(Br)=C1 NO22955 [1,1,0,0,0,0|2,0,0]=4 1167 B9R1.69 NC1=C(F)C=CC(Cl)=C1 DY30003 [1,1,0,0,0,0|2,0,0]=4 1168 B9R1.69 NC1=C(F)C=CC(F)=C1 NO22979 [1,1,0,0,0,0|2,0,0]=4 1169 B9R1.69 NC1=C(F)C=CC(I)=C1 NO19543 [1,1,0,0,0,0|2,0,0]=4 1170 B9R1.69 NC1=C(F)C=CC(O)=C1 NO19712 [1,1,0,0,0,0|1,0,0]=3 1171 B9R1.69 NC1=C(I)C=C(Br)C=C1 NO22647 [1,1,0,0,0,0|2,0,0]=4 1172 B9R1.69 NC1=C(I)C=C(Cl)C=C1 NO15394 [1,1,0,0,0,0|2,0,0]=4 1173 B9R1.69 NC1=C(I)C=C(F)C=C1 NO19121 [1,1,0,0,0,0|2,0,0]=4 1174 B9R1.69 NC1=C(I)C=C(I)C=C1 DY796137 [1,1,0,0,0,0|2,0,0]=4 1175 B9R1.69 NC1=C(I)C=CC(Cl)=C1 NO18421 [1,1,0,0,0,0|2,0,0]=4 1176 B9R1.69 NC1=C(I)C=CC(F)=C1 NO22986 [1,1,0,0,0,0|2,0,0]=4 1177 B9R1.69 NC1=C(I)C=CC(I)=C1 DY822103 [1,1,0,0,0,0|2,0,0]=4 1178 B9R1.69 NC1=C(N)C=C(S)C=C1 DY565749 [1,1,0,0,0,0|1,1,0]=4 1179 B9R1.69 NC1=C(O)C=C(Br)C=C1 NO21272 [1,1,0,0,0,0|2,0,0]=4 1180 B9R1.69 NC1=C(O)C=C(Cl)C=C1 NO19300 [1,1,0,0,0,0|2,0,0]=4 1181 B9R1.69 NC1=C(O)C=C(F)C=C1 NO23016 [1,1,0,0,0,0|2,0,0]=4 1182 B9R1.69 NC1=C(O)C=C(O)C=C1 NO22592 [1,1,0,0,0,0|1,0,0]=3 1183 B9R1.69 NC1=C(O)C=CC(Br)=C1 NO14311 [1,1,0,0,0,0|1,0,0]=3 1184 B9R1.69 NC1=C(O)C=CC(Cl)=C1 NO16374 [1,1,0,0,0,0|1,0,0]=3 1185 B9R1.69 NC1=C(O)C=NC(Cl)=C1 DY432273 [1,1,0,0,0,0|2,0,0]=4 1186 B9R1.69 NC1=C(S)C=CC(Cl)=C1 DY500643 [1,1,0,0,0,0|1,1,0]=4 1187 B9R1.69 NC1=CC(Br)=C(Cl)C=C1 NO22147 [1,1,0,0,0,0|2,0,0]=4 1188 B9R1.69 NC1=CC(Br)=C(F)C=C1 NO15522 [1,1,0,0,0,0|2,0,0]=4 1189 B9R1.69 NC1=CC(Br)=C(I)C=C1 DY575307 [1,1,0,0,0,0|2,0,0]=4 1190 B9R1.69 NC1=CC(Br)=CN=C1O NO14285 [1,1,0,0,0,0|2,0,0]=4 1191 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 NO18864 [1,1,0,0,0,0|2,0,0]=4 1192 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 NO21929 [1,1,0,0,0,0|2,0,0]=4 1193 B9R1.69 NC1=CC(Cl)=C(F)C=C1 NO19039 [1,1,0,0,0,0|2,0,0]=4 1194 B9R1.69 NC1=CC(Cl)=C(O)C=C1 NO19309 [1,1,0,0,0,0|1,0,0]=3 1195 B9R1.69 NC1=CC(F)=C(Br)C=C1 NO22954 [1,1,0,0,0,0|2,0,0]=4 1196 B9R1.69 NC1=CC(F)=C(Cl)C=C1 NO22968 [1,1,0,0,0,0|2,0,0]=4 1197 B9R1.69 NC1=CC(F)=C(I)C=C1 NO22985 [1,1,0,0,0,0|2,0,0]=4 1198 B9R1.69 NC1=CC(F)=C(O)C=N1 DY660813 [1,1,0,0,0,0|2,0,0]=4 1199 B9R1.69 NC1=CC(N)=C(Cl)C=C1 NO14655 [1,1,0,0,0,0|2,0,0]=4 1200 B9R1.69 NC1=CC(N)=C(F)C=C1 NO23032 [1,1,0,0,0,0|2,0,0]=4 1201 B9R1.69 NC1=CC(N)=C(O)C=C1 NO16325 [1,1,0,0,0,0|1,0,0]=3 1202 B9R1.69 NC1=CC(O)=C(F)C=C1 NO13999 [1,1,0,0,0,0|2,0,0]=4 1203 B9R1.69 NC1=CC(O)=CN=C1O DY656872 [1,1,0,0,0,0|1,0,0]=3 1204 B9R1.69 NC1=CC=C(Br)C=C1N NO19462 [1,1,0,0,0,0|2,0,0]=4 1205 B9R1.69 NC1=CC=C(Cl)C=C1N NO23029 [1,1,0,0,0,0|2,0,0]=4 1206 B9R1.69 NC1=CC=C(F)C=C1N NO19484 [1,1,0,0,0,0|2,0,0]=4 1207 B9R1.69 NC1=CN=C(O)C(I)=C1 DY715736 [1,1,0,0,0,0|2,0,0]=4 1208 B9R1.69 NC1=NC(Br)=CC=C1O NO15126 [1,1,0,0,0,0|2,0,0]=4 1209 B9R1.69 NC1=NC(Cl)=CC=C1O DY528201 [1,1,0,0,0,0|2,0,0]=4 1210 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 NO15632 [1,1,0,0,0,0|1,0,0]=3 1211 B9R1.69 OC1=C(Br)C=C(F)C=C1 DY10138 [1,1,0,0,0,0|1,0,0]=3 1212 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 NO21372 [1,1,0,0,0,0|2,0,0]=4 1213 B9R1.69 OC1=C(Br)C=CC(F)=C1 DY20075 [1,1,0,0,0,0|2,0,0]=4 1214 B9R1.69 OC1=C(Br)C=CC(I)=C1 NO13046 [1,1,0,0,0,0|2,0,0]=4 1215 B9R1.69 OC1=C(Cl)C=C(F)C=C1 NO13904 [1,1,0,0,0,0|1,0,0]=3 1216 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 DY20037 [1,1,0,0,0,0|2,0,0]=4 1217 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 NO21143 [1,1,0,0,0,0|2,0,0]=4 1218 B9R1.69 OC1=C(Cl)C=CC(F)=C1 NO22918 [1,1,0,0,0,0|2,0,0]=4 1219 B9R1.69 OC1=C(F)C=C(Br)C=C1 NO22908 [1,1,0,0,0,0|1,0,0]=3 1220 B9R1.69 OC1=C(F)C=C(F)C=C1 NO19015 [1,1,0,0,0,0|1,0,0]=3 1221 B9R1.69 OC1=C(F)C=CC(Br)=C1 NO22910 [1,1,0,0,0,0|2,0,0]=4 1222 B9R1.69 OC1=C(F)C=CC(Cl)=C1 NO22920 [1,1,0,0,0,0|2,0,0]=4 1223 B9R1.69 OC1=C(F)C=CC(I)=C1 NO12536 [1,1,0,0,0,0|2,0,0]=4 1224 B9R1.69 OC1=C(I)C=C(Cl)C=C1 NO22744 [1,1,0,0,0,0|1,0,0]=3 1225 B9R1.69 OC1=C(I)C=C(F)C=C1 NO13176 [1,1,0,0,0,0|1,0,0]=3 1226 B9R1.69 OC1=C(I)C=C(I)C=C1 DY584396 [1,1,0,0,0,0|1,0,0]=3 1227 B9R1.69 OC1=C(I)C=CC(Br)=C1 DY442822 [1,1,0,0,0,0|2,0,0]=4 1228 B9R1.69 OC1=C(I)C=CC(Cl)=C1 NO10328 [1,1,0,0,0,0|2,0,0]=4 1229 B9R1.69 OC1=CC(Br)=C(Cl)C=C1 NO22149 [1,1,0,0,0,0|1,0,0]=3 1230 B9R1.69 OC1=CC(Br)=C(F)C=C1 NO22905 [1,1,0,0,0,0|1,0,0]=3 1231 B9R1.69 OC1=CC(Br)=C(F)N=C1 NO22132 [1,1,0,0,0,0|2,0,0]=4 1232 B9R1.69 OC1=CC(Cl)=C(Br)C=C1 DY20176 [1,1,0,0,0,0|1,0,0]=3 1233 B9R1.69 OC1=CC(Cl)=C(Cl)N=C1 NO21014 [1,1,0,0,0,0|2,0,0]=4 1234 B9R1.69 OC1=CC(F)=C(Br)C=C1 NO22909 [1,1,0,0,0,0|1,0,0]=3 1235 B9R1.69 OC1=CC(F)=C(Cl)C=C1 NO22919 [1,1,0,0,0,0|1,0,0]=3 1236 B9R1.69 OC1=CC(F)=C(Cl)N=C1 NO15035 [1,1,0,0,0,0|2,0,0]=4 1237 B9R1.69 OC1=CC(F)=C(F)C=C1 NO22926 [1,1,0,0,0,0|1,0,0]=3 1238 B9R1.69 OC1=CC(F)=C(I)C=C1 NO15852 [1,1,0,0,0,0|1,0,0]=3 1239 B9R1.69 OC1=CC(F)=C(O)C=C1 DY20784 [1,1,0,0,0,0|0,0,0]=2 1240 B9R1.69 OC1=CC(I)=C(F)C=C1 DY442383 [1,1,0,0,0,0|1,0,0]=3 1241 B9R1.69 OC1=CC(O)=C(Br)C=C1 NO22703 [1,1,0,0,0,0|1,0,0]=3 1242 B9R1.69 OC1=CC(O)=C(F)C=C1 NO22989 [1,1,0,0,0,0|1,0,0]=3 1243 B9R1.69 OC1=CC=C(Br)C=C1O NO22676 [1,1,0,0,0,0|1,0,0]=3 1244 B9R1.69 OC1=CC=C(Br)N=C1Br NO21158 [1,1,0,0,0,0|2,0,0]=4 1245 B9R1.69 OC1=CC=C(Cl)C=C1O DY584662 [1,1,0,0,0,0|1,0,0]=3 1246 B9R1.69 OC1=CC=C(F)N=C1I DY540615 [1,1,0,0,0,0|2,0,0]=4 1247 B9R1.69 OC1=CN=C(Br)C(Cl)=C1 NO21336 [1,1,0,0,0,0|2,0,0]=4 1248 B9R1.69 OC1=CN=C(F)C(Cl)=C1 NO13933 [1,1,0,0,0,0|2,0,0]=4 1249 B9R1.69 OC1=NC(Cl)=C(Cl)C=C1 DY431738 [1,1,0,0,0,0|2,0,0]=4 1250 B9R1.69 OC1=NC=C(Br)C=C1Br NO21965 [1,1,0,0,0,0|2,0,0]=4 1251 B9R1.69 OC1=NC=C(Cl)C(I)=C1 DY21156 [1,1,0,0,0,0|2,0,0]=4 1252 B9R1.69 OC1=NC=C(Cl)C=C1Br NO13641 [1,1,0,0,0,0|2,0,0]=4 1253 B9R1.69 OC1=NC=C(F)C=C1Br DY20706 [1,1,0,0,0,0|2,0,0]=4 1254 B9R1.69 SC1=C(Cl)C=CC(Cl)=C1 DY561891 [1,1,0,0,0,0|2,0,0]=4 1255 B9R1.69 SC1=CC(Cl)=C(Cl)C=C1 DY585101 [1,1,0,0,0,0|1,1,0]=4 1256 B9R1.7 OCCC1=CC=C(Br)S1 DY447413 [0,1,0,0,1,0|2,0,0]=4 1257 B9R1.21 N#CC1=CC=C(CO)S1 DY787144 [0,1,0,0,1,0|2,0,0]=4 1258 B9R1.21 NCC1=CC=C(CO)O1 DY577929 [0,1,0,0,1,0|2,0,0]=4 1259 B9R1.21 O=CC1=CC=C(CO)N1 NO16660 [0,1,0,0,1,0|1,0,1]=4 1260 B9R1.21 O=CC1=CC=C(CO)O1 NO15585 [0,1,0,0,1,0|1,0,1]=4 1261 B9R1.21 OCC1=CC=C(CO)O1 NO10151 [0,1,0,0,1,0|1,0,0]=3 1262 B9R1.22 OCC1=C(Br)SC(Br)=C1 DY787138 [0,1,0,0,1,0|2,0,0]=4 1263 B9R1.35 CC(O)C1=CSC(Cl)=C1 DY519891 [0,1,0,0,1,0|2,0,0]=4 1264 B9R1.35 C[C@@H](O)C1=CC(Br)=CS1 DY786652 [0,1,0,0,1,0|2,0,0]=4 1265 B11R1.1 BrCCOc1ccc(Br)cc1 DY452404 [0,2,0,0,0,0|2,0,0]=4 1266 B11R1.1 CCCCC1=CC=C(C)C=C1 DY791931 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.1 CCOCC1=CC=C(N)C=C1 DY575247 [0,2,0,0,0,0|1,0,0]=3 1268 B11R1.1 CCOCC1=CC=C(O)C=C1 NO16541 [0,2,0,0,0,0|0,0,0]=2 1269 B11R1.1 CCOCC1=CN=C(Br)C=C1 DY716528 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.1 CNCCC1=CC=C(Cl)C=C1 DY794949 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.1 COCOC1=CC=C(C)C=C1 DY449074 [0,2,0,0,0,0|1,0,0]=3 1272 B11R1.1 COCOC1=CC=C(Cl)C=C1 DY449092 [0,2,0,0,0,0|1,0,0]=3 1273 B11R1.1 COCOC1=CC=C(F)C=C1 DY449098 [0,2,0,0,0,0|1,0,0]=3 1274 B11R1.1 COCOC1=NC=C(Br)C=C1 DY659492 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.1 ClC1=CC=C(OCCBr)C=C1 DY20815 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.1 N#CCSC1=CC=C(F)C=C1 DY792519 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.1 NCCCC1=CC=C(F)C=C1 DY501891 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.1 OCCCC1=CC=C(Cl)C=C1 DY797043 [0,2,0,0,0,0|1,0,0]=3 1279 B11R1.1 OCCCC1=CC=C(O)C=C1 DY502467 [0,2,0,0,0,0|0,0,0]=2 1280 B11R1.1 OCCSC1=NC=C(Cl)C=C1 DY653586 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 DY10315 [0,2,0,0,0,0|1,0,1]=4 1282 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 NO22844 [0,2,0,0,0,0|1,0,1]=4 1283 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 DY433485 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 DY798087 [0,2,0,0,0,0|2,0,0]=4 1285 B11R1.20 CC(C)NC1=CC=C(F)C=C1 NO22842 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.20 CC(C)OC1=CC=C(N)C=C1 NO10912 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 DY797913 [0,2,0,0,0,0|1,0,0]=3 1288 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 NO21084 [0,2,0,0,0,0|1,0,0]=3 1289 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 NO14692 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.20 FC(F)Oc1ccc(Br)cc1 NO19168 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 NO21002 [0,2,0,0,0,0|1,0,0]=3 1292 B11R1.20 NC1=CC=C(OC(F)F)C=C1 NO13962 [0,2,0,0,0,0|2,0,0]=4 1293 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 NO20812 [0,2,0,0,0,0|1,0,0]=3 1294 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 NO10817 [0,2,0,0,0,0|1,0,0]=3 1295 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 NO20852 [0,2,0,0,0,0|1,0,0]=3 1296 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 NO13319 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 NO14073 [0,2,0,0,0,0|2,0,0]=4 1298 B11R1.20 O=C(O)CC1=NC=C(O)C=C1 DY512037 [0,2,0,0,0,0|1,0,0]=3 1299 B11R1.22 CC(CO)C1=CC=C(Br)C=C1 DY454677 [0,2,0,0,0,0|1,0,0]=3 1300 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 DY563697 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 NO22698 [0,2,0,0,0,0|2,0,0]=4 1302 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 NO22795 [0,2,0,0,0,0|2,0,0]=4 1303 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 NO22846 [0,2,0,0,0,0|2,0,0]=4 1304 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 DY584618 [0,2,0,0,0,0|2,0,0]=4 1305 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 NO15690 [0,2,0,0,0,0|1,0,0]=3 1306 B11R1.22 CCC(=O)C1=CC=C(S)C=C1 DY747823 [0,2,0,0,0,0|1,1,0]=4 1307 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 NO18281 [0,2,0,0,0,0|2,0,0]=4 1308 B11R1.22 CCC(N)C1=CC=C(O)C=C1 DY605123 [0,2,0,0,0,0|1,0,0]=3 1309 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 DY621657 [0,2,0,0,0,0|2,0,0]=4 1310 B11R1.22 CC[C@H](O)C1=CC=C(F)C=C1 DY623735 [0,2,0,0,0,0|1,0,0]=3 1311 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 NO15303 [0,2,0,0,0,0|1,0,1]=4 1312 B11R1.22 COC(=O)C1=CC=C(F)C=C1 NO20841 [0,2,0,0,0,0|1,0,1]=4 1313 B11R1.22 COC(=O)C1=CC=C(I)C=C1 NO20853 [0,2,0,0,0,0|1,0,1]=4 1314 B11R1.22 COC(=O)C1=CC=C(N)C=C1 NO20990 [0,2,0,0,0,0|1,0,1]=4 1315 B11R1.22 COC(=O)C1=CC=C(O)C=C1 NO19446 [0,2,0,0,0,0|0,0,1]=3 1316 B11R1.22 COC(=O)C1=NC=C(O)C=C1 NO10406 [0,2,0,0,0,0|1,0,1]=4 1317 B11R1.22 C[C@H](CO)C1=CC=C(F)C=C1 DY624193 [0,2,0,0,0,0|1,0,0]=3 1318 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 NO10839 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 DY570813 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 NO20894 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.22 NCC(O)C1=CC=C(F)C=C1 DY746641 [0,2,0,0,0,0|1,0,0]=3 1322 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 DY507920 [0,2,0,0,0,0|1,0,0]=3 1323 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 DY584553 [0,2,0,0,0,0|1,0,1]=4 1324 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 NO19445 [0,2,0,0,0,0|2,0,0]=4 1325 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 NO20678 [0,2,0,0,0,0|2,0,0]=4 1326 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 NO10771 [0,2,0,0,0,0|1,0,0]=3 1327 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 NO14324 [0,2,0,0,0,0|2,0,0]=4 1328 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 DY41236 [0,2,0,0,0,0|2,0,0]=4 1329 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 NO18120 [0,2,0,0,0,0|0,0,2]=4 1330 B11R1.22 O\N=C(/Cl)C1=CC=C(Br)C=C1 DY574899 [0,2,0,0,0,0|1,0,1]=4 1331 B11R1.81 CCOC1=C(C)C=C(O)C=N1 DY715682 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.81 CCOC1=C(N)C=C(C)C=C1 DY584348 [0,2,0,0,0,0|2,0,0]=4 1333 B11R1.81 CCOC1=C(O)C=C(Cl)C=C1 DY451090 [0,2,0,0,0,0|2,0,0]=4 1334 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 DY822069 [0,2,0,0,0,0|2,0,0]=4 1335 B11R1.81 N#CCC1=C(Br)C=C(Cl)C=C1 DY40754 [0,2,0,0,0,0|2,0,0]=4 1336 B11R1.81 N#CCC1=C(Br)C=C(F)C=C1 NO13698 [0,2,0,0,0,0|2,0,0]=4 1337 B11R1.81 N#CCC1=C(Cl)C=C(Cl)C=C1 NO15393 [0,2,0,0,0,0|2,0,0]=4 1338 B11R1.81 N#CCC1=C(Cl)C=C(F)C=C1 NO20640 [0,2,0,0,0,0|2,0,0]=4 1339 B11R1.81 N#CCC1=C(F)C=C(Br)C=C1 NO22644 [0,2,0,0,0,0|2,0,0]=4 1340 B11R1.81 N#CCC1=C(F)C=C(F)C=C1 NO10683 [0,2,0,0,0,0|2,0,0]=4 1341 B11R1.81 NOCC1=C(Cl)C=C(Cl)C=C1 DY557865 [0,2,0,0,0,0|1,0,0]=3 1342 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 DY584702 [0,2,0,0,0,0|1,0,0]=3 1343 B11R1.83 C#CC1=CC=C(CC#N)C=C1 DY550389 [0,2,0,0,0,0|2,0,0]=4 1344 B11R1.83 C#CC1=CC=C(OCC)C=C1 NO11063 [0,2,0,0,0,0|1,0,1]=4 1345 B11R1.83 C#CCC1=CC=C(OC)C=C1 DY519381 [0,2,0,0,0,0|1,0,0]=3 1346 B11R1.83 C=CCC1=CC=C(OC)C=C1 DY521667 [0,2,0,0,0,0|1,0,0]=3 1347 B11R1.83 CC#CC1=CC=C(OC)C=C1 DY788841 [0,2,0,0,0,0|1,0,1]=4 1348 B11R1.83 CCC1=CC=C(CNN)C=C1 DY610819 [0,2,0,0,0,0|2,0,0]=4 1349 B11R1.83 CCC1=CN=C(CCO)C=C1 NO10373 [0,2,0,0,0,0|2,0,0]=4 1350 B11R1.83 CCCC1=CC=C(CN)C=C1 NO10109 [0,2,0,0,0,0|2,0,0]=4 1351 B11R1.83 CCCC1=CC=C(CO)C=C1 DY584401 [0,2,0,0,0,0|1,0,0]=3 1352 B11R1.83 CCOC1=CC=C(C=O)C=C1 NO22818 [0,2,0,0,0,0|0,0,2]=4 1353 B11R1.83 CCOC1=CC=C(CO)C=C1 NO22820 [0,2,0,0,0,0|0,0,0]=2 1354 B11R1.83 CNCC1=CC=C(OC)C=C1 NO18429 [0,2,0,0,0,0|1,0,0]=3 1355 B11R1.83 CNCC1=CC=C(OC)N=C1 DY536517 [0,2,0,0,0,0|2,0,0]=4 1356 B11R1.83 COC1=CC=C(CC#N)C=C1 NO13459 [0,2,0,0,0,0|1,0,0]=3 1357 B11R1.83 COC1=CC=C(CNN)C=C1 NO20199 [0,2,0,0,0,0|1,0,0]=3 1358 B11R1.83 COC1=CC=C(CON)C=C1 NO20566 [0,2,0,0,0,0|0,0,0]=2 1359 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 NO10928 [0,2,0,0,0,0|1,0,1]=4 1360 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 NO10929 [0,2,0,0,0,0|1,0,1]=4 1361 B11R1.83 N#CC1=CC=C(CCBr)C=C1 NO12532 [0,2,0,0,0,0|2,0,0]=4 1362 B11R1.83 N#CC1=CC=C(CCN)C=C1 NO22808 [0,2,0,0,0,0|2,0,0]=4 1363 B11R1.83 N#CC1=CC=C(CCO)C=C1 NO22434 [0,2,0,0,0,0|1,0,0]=3 1364 B11R1.83 O=CC1=CC=C(CCO)C=C1 NO16581 [0,2,0,0,0,0|0,0,1]=3 1365 B11R1.192 CC1=C(Br)C=C(CC#N)C=C1 DY584714 [0,2,0,0,0,0|2,0,0]=4 1366 B11R1.192 CC1=C(F)C=CC(CC#N)=C1 DY40778 [0,2,0,0,0,0|2,0,0]=4 1367 B11R1.192 CCOC1=CC(Cl)=C(Br)C=C1 NO16022 [0,2,0,0,0,0|2,0,0]=4 1368 B11R1.192 CNCC1=CC(Cl)=C(Cl)C=C1 NO11711 [0,2,0,0,0,0|2,0,0]=4 1369 B11R1.192 CNCC1=CC=C(O)C(O)=C1 DY502761 [0,2,0,0,0,0|1,0,0]=3 1370 B11R1.192 FC1=C(F)C=C(CCBr)C=C1 DY584641 [0,2,0,0,0,0|2,0,0]=4 1371 B11R1.192 Fc1ccc(C[Zn]Br)cc1F DY794193 [0,2,0,0,0,0|2,0,0]=4 1372 B11R1.192 N#CCC1=CC(Cl)=C(Cl)C=C1 NO20633 [0,2,0,0,0,0|2,0,0]=4 1373 B11R1.192 N#CCC1=CC(Cl)=C(F)C=C1 NO18657 [0,2,0,0,0,0|2,0,0]=4 1374 B11R1.192 N#CCC1=CC(F)=C(Br)C=C1 NO15044 [0,2,0,0,0,0|2,0,0]=4 1375 B11R1.192 NCCC1=CC(Cl)=C(Cl)C=C1 NO21933 [0,2,0,0,0,0|2,0,0]=4 1376 B11R1.192 NCCC1=CC(F)=C(F)C=C1 DY584648 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.192 NCCC1=CC=C(O)C(O)=C1 NO15345 [0,2,0,0,0,0|1,0,0]=3 1378 B11R1.192 O=CCC1=CC(O)=C(O)C=C1 DY745117 [0,2,0,0,0,0|0,0,1]=3 1379 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 NO21932 [0,2,0,0,0,0|1,0,0]=3 1380 B11R1.192 OCCC1=CC(Cl)=C(F)C=C1 DY584825 [0,2,0,0,0,0|1,0,0]=3 1381 B11R1.192 OCCC1=CC(F)=C(Cl)C=C1 DY584900 [0,2,0,0,0,0|1,0,0]=3 1382 B11R1.192 O\N=C\c1ccc(Cl)c(Cl)c1 DY796131 [0,2,0,0,0,0|1,0,1]=4 1383 B11R1.3 C#Cc1ccc(C(=O)O)cc1 NO17809 [0,2,0,0,0,0|1,0,1]=4 1384 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 DY20903 [0,2,0,0,0,0|1,0,1]=4 1385 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 DY425378 [0,2,0,0,0,0|1,0,1]=4 1386 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 NO12193 [0,2,0,0,0,0|1,0,1]=4 1387 B11R1.3 CC(C)C1=CC=C(CBr)C=C1 NO14001 [0,2,0,0,0,0|2,0,0]=4 1388 B11R1.3 CC(N)C1=CC=C(CO)C=C1 DY554631 [0,2,0,0,0,0|1,0,0]=3 1389 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 NO13406 [0,2,0,0,0,0|1,0,0]=3 1390 B11R1.3 CCC1=CC=C(C(C)O)C=C1 DY456730 [0,2,0,0,0,0|1,0,0]=3 1391 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 DY561459 [0,2,0,0,0,0|1,1,0]=4 1392 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 DY441036 [0,2,0,0,0,0|2,0,0]=4 1393 B11R1.3 CN(C)C1=CC=C(CN)C=C1 DY549927 [0,2,0,0,0,0|2,0,0]=4 1394 B11R1.3 CN(C)C1=CC=C(CO)C=C1 DY530991 [0,2,0,0,0,0|1,0,0]=3 1395 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 DY20232 [0,2,0,0,0,0|1,0,1]=4 1396 B11R1.3 COC1=CC=C(B(O)O)C=C1 NO10530 [0,2,0,0,0,0|1,0,0]=3 1397 B11R1.3 COC1=CC=C(B(O)O)C=N1 NO19514 [0,2,0,0,0,0|2,0,0]=4 1398 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 DY20515 [0,2,0,0,0,0|0,0,2]=4 1399 B11R1.3 COC1=CC=C(C(=O)O)C=C1 DY500002 [0,2,0,0,0,0|0,0,1]=3 1400 B11R1.3 COC1=CC=C(N(C)C)C=C1 DY20811 [0,2,0,0,0,0|2,0,0]=4 1401 B11R1.3 COC1=CC=C([C@@H](C)N)C=C1 NO13954 [0,2,0,0,0,0|1,0,0]=3 1402 B11R1.3 COC1=CC=C([C@@H](C)N)C=N1 DY621627 [0,2,0,0,0,0|2,0,0]=4 1403 B11R1.3 COC1=CN=C(C(=O)O)C=C1 NO18937 [0,2,0,0,0,0|1,0,1]=4 1404 B11R1.3 COC1=NC=C(C(=O)O)C=C1 NO10490 [0,2,0,0,0,0|1,0,1]=4 1405 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 DY517671 [0,2,0,0,0,0|0,1,1]=4 1406 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 DY623711 [0,2,0,0,0,0|1,1,0]=4 1407 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 NO17346 [0,2,0,0,0,0|2,0,0]=4 1408 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 NO10987 [0,2,0,0,0,0|1,0,0]=3 1409 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 NO20162 [0,2,0,0,0,0|1,0,1]=4 1410 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 NO21997 [0,2,0,0,0,0|1,0,1]=4 1411 B11R1.3 N#CC1=CC=C(C(Cl)Cl)C=C1 DY584340 [0,2,0,0,0,0|2,0,0]=4 1412 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 NO15778 [0,2,0,0,0,0|1,0,1]=4 1413 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 DY20325 [0,2,0,0,0,0|1,0,0]=3 1414 B11R1.3 NCC1=CC=C(C(F)F)C=C1 DY585427 [0,2,0,0,0,0|2,0,0]=4 1415 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 DY534705 [0,2,0,0,0,0|1,0,1]=4 1416 B11R1.3 NCC1=NC=C(C(=O)O)C=C1 DY570705 [0,2,0,0,0,0|2,0,0]=4 1417 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 NO10519 [0,2,0,0,0,0|1,0,1]=4 1418 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 NO14658 [0,2,0,0,0,0|1,0,1]=4 1419 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 DY10316 [0,2,0,0,0,0|1,0,0]=3 1420 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 NO20829 [0,2,0,0,0,0|1,0,0]=3 1421 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 NO20945 [0,2,0,0,0,0|0,0,0]=2 1422 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 NO20792 [0,2,0,0,0,0|0,0,2]=4 1423 B11R1.3 O=[N+]([O-])C1=CC=C(CBr)C=C1 DY789207 [0,2,0,0,0,0|1,0,1]=4 1424 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 NO19205 [0,2,0,0,0,0|0,0,1]=3 1425 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 NO20345 [0,2,0,0,0,0|1,0,0]=3 1426 B11R1.3 OCC1=CC=C(B(O)O)C=C1 NO20400 [0,2,0,0,0,0|0,0,0]=2 1427 B11R1.3 [C@@H](C)(N)C1=CC=C(OC)C=C1 DY20521 [0,2,0,0,0,0|1,0,0]=3 1428 B11R1.279 COC1=C(C)C=C(C=O)C=C1 NO10892 [0,2,0,0,0,0|0,0,2]=4 1429 B11R1.279 COC1=C(Cl)C=C(CBr)C=C1 NO22687 [0,2,0,0,0,0|1,0,0]=3 1430 B11R1.279 COC1=C(Cl)C=C(CN)C=C1 DY746923 [0,2,0,0,0,0|1,0,0]=3 1431 B11R1.279 COC1=C(Cl)C=C(CN)C=C1 NO20430 [0,2,0,0,0,0|1,0,0]=3 1432 B11R1.279 COC1=C(F)C=C(C#N)C=C1 DY433110 [0,2,0,0,0,0|1,0,1]=4 1433 B11R1.279 COC1=C(O)C=C(C#N)C=C1 NO14799 [0,2,0,0,0,0|1,0,1]=4 1434 B11R1.279 COC1=C(O)C=C(C=O)C=C1 NO15324 [0,2,0,0,0,0|0,0,2]=4 1435 B11R1.279 COC1=CC(Br)=C(C#N)C=C1 NO13234 [0,2,0,0,0,0|1,0,1]=4 1436 B11R1.279 COC1=CC(Br)=C(CBr)C=C1 DY584808 [0,2,0,0,0,0|1,0,0]=3 1437 B11R1.279 COC1=CC(Cl)=C(C#N)C=C1 NO21446 [0,2,0,0,0,0|1,0,1]=4 1438 B11R1.279 COC1=CC(Cl)=C(NN)C=C1 DY103360 [0,2,0,0,0,0|2,0,0]=4 1439 B11R1.279 COC1=CC(F)=C(C#N)C=C1 NO10749 [0,2,0,0,0,0|1,0,1]=4 1440 B11R1.279 COC1=CC(F)=C(C=O)C=C1 NO10812 [0,2,0,0,0,0|0,0,2]=4 1441 B11R1.279 COC1=CC(F)=C(NN)C=C1 NO15976 [0,2,0,0,0,0|2,0,0]=4 1442 B11R1.279 COC1=CC(F)=C(OC)C=C1 NO20541 [0,2,0,0,0,0|2,0,0]=4 1443 B11R1.279 COC1=CC(N)=C(C#N)C=C1 NO17220 [0,2,0,0,0,0|1,0,1]=4 1444 B11R1.279 COC1=CC(N)=C(OC)C=C1 NO21148 [0,2,0,0,0,0|2,0,0]=4 1445 B11R1.279 COC1=CC(O)=C(C#N)C=C1 NO14796 [0,2,0,0,0,0|1,0,1]=4 1446 B11R1.279 COC1=CC(O)=C(C=O)C=C1 NO20937 [0,2,0,0,0,0|0,0,2]=4 1447 B11R1.279 COC1=CC(O)=C(OC)C=C1 NO21149 [0,2,0,0,0,0|2,0,0]=4 1448 B11R1.279 COC1=CC=C(CN)C(C)=N1 DY651818 [0,2,0,0,0,0|2,0,0]=4 1449 B11R1.279 COC1=CC=C(CO)C(C)=N1 DY451786 [0,2,0,0,0,0|1,0,0]=3 1450 B11R1.279 COC1=COC(CO)=CC1=O DY564165 [0,2,0,0,0,0|1,0,0]=3 1451 B11R1.279 CSC1=C(F)C=C(CO)C=C1 DY451408 [0,2,0,0,0,0|0,1,0]=3 1452 B11R1.279 N#CC1=CC(Br)=C(CBr)C=C1 DY40519 [0,2,0,0,0,0|2,0,0]=4 1453 B11R1.279 N#CC1=CC(Cl)=C(CBr)C=C1 DY584430 [0,2,0,0,0,0|2,0,0]=4 1454 B11R1.279 N#CC1=NC=C(CO)C=C1Cl DY657132 [0,2,0,0,0,0|2,0,0]=4 1455 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 NO19038 [0,2,0,0,0,0|2,0,0]=4 1456 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 NO20810 [0,2,0,0,0,0|2,0,0]=4 1457 B11R1.19 CC(C)(C)C1=CC=C(O)C=C1 NO16411 [0,2,0,0,0,0|1,0,0]=3 1458 B11R1.19 CC(C)(C)C1=CC=C(O)C=N1 DY567285 [0,2,0,0,0,0|2,0,0]=4 1459 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 DY789711 [0,2,0,0,0,0|2,0,0]=4 1460 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 NO14403 [0,2,0,0,0,0|1,0,0]=3 1461 B11R1.19 CC(C)(O)C1=CC=C(N)N=C1 DY21168 [0,2,0,0,0,0|2,0,0]=4 1462 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 NO16019 [0,2,0,0,0,0|2,0,0]=4 1463 B11R1.19 CC(C)(O)C1=NC=C(Cl)C=C1 DY711187 [0,2,0,0,0,0|2,0,0]=4 1464 B11R1.19 CC(F)(F)C1=CC=C(Cl)C=C1 DY560391 [0,2,0,0,0,0|2,0,0]=4 1465 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 DY111070 [0,2,0,0,0,0|2,0,0]=4 1466 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 DY20805 [0,2,0,0,0,0|2,0,0]=4 1467 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 DY532677 [0,2,0,0,0,0|2,0,0]=4 1468 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 DY580023 [0,2,0,0,0,0|2,0,0]=4 1469 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 DY621020 [0,2,0,0,0,0|2,0,0]=4 1470 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 DY668445 [0,2,0,0,0,0|2,0,0]=4 1471 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 NO12653 [0,2,0,0,0,0|2,0,0]=4 1472 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 NO20393 [0,2,0,0,0,0|1,0,1]=4 1473 B11R1.19 Cc1ccc(S(=O)(=O)O)cc1 DY436139 [0,2,0,0,0,0|2,0,0]=4 1474 B11R1.19 FC(F)(F)C1=CC=C(Br)C=C1 NO14293 [0,2,0,0,0,0|2,0,0]=4 1475 B11R1.19 FC1=CC=C(C(F)(F)F)C=C1 NO19920 [0,2,0,0,0,0|2,0,0]=4 1476 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 NO10421 [0,2,0,0,0,0|2,0,0]=4 1477 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 NO18679 [0,2,0,0,0,0|2,0,0]=4 1478 B11R1.19 Nc1ccc([As](=O)(O)O)cc1 DY822391 [0,2,0,0,0,0|2,0,0]=4 1479 B11R1.19 O=S(=O)(O)C1=CC=C(Cl)C=C1 NO19082 [0,2,0,0,0,0|2,0,0]=4 1480 B11R1.19 OC1=CC=C(C(F)(F)F)C=C1 NO20124 [0,2,0,0,0,0|1,0,0]=3 1481 B11R1.19 OC1=CN=C(C(F)(F)F)C=C1 DY10242 [0,2,0,0,0,0|2,0,0]=4 1482 B11R1.19 OC1=NC=C(C(F)(F)F)C=C1 NO18876 [0,2,0,0,0,0|2,0,0]=4 1483 B11R1.21 CC(=O)C1=CC(Br)=C(O)C=C1 DY584978 [0,2,0,0,0,0|0,0,2]=4 1484 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 NO10813 [0,2,0,0,0,0|0,0,2]=4 1485 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 NO10863 [0,2,0,0,0,0|0,0,2]=4 1486 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 NO20811 [0,2,0,0,0,0|1,0,1]=4 1487 B11R1.21 CC1=C(C)C=C(B(O)O)C=C1 NO20467 [0,2,0,0,0,0|2,0,0]=4 1488 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 NO21076 [0,2,0,0,0,0|1,0,1]=4 1489 B11R1.21 CC1=C(Cl)C=C(B(O)O)C=C1 DY20279 [0,2,0,0,0,0|2,0,0]=4 1490 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 NO20828 [0,2,0,0,0,0|1,0,1]=4 1491 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 DY623686 [0,2,0,0,0,0|2,0,0]=4 1492 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 NO19324 [0,2,0,0,0,0|1,0,1]=4 1493 B11R1.21 CC1=C(F)C=C(B(O)O)C=C1 NO20351 [0,2,0,0,0,0|2,0,0]=4 1494 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 NO21927 [0,2,0,0,0,0|1,0,1]=4 1495 B11R1.21 CC1=C(F)C=CC(B(O)O)=C1 NO20353 [0,2,0,0,0,0|2,0,0]=4 1496 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 NO14298 [0,2,0,0,0,0|1,0,1]=4 1497 B11R1.21 CC1=C(F)C=CC([C@@H](C)N)=C1 DY621573 [0,2,0,0,0,0|2,0,0]=4 1498 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 NO21937 [0,2,0,0,0,0|1,0,1]=4 1499 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 NO21906 [0,2,0,0,0,0|1,0,1]=4 1500 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 NO21001 [0,2,0,0,0,0|1,0,1]=4 1501 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 NO20943 [0,2,0,0,0,0|1,0,1]=4 1502 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 DY20541 [0,2,0,0,0,0|2,0,0]=4 1503 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 NO20947 [0,2,0,0,0,0|0,0,1]=3 1504 B11R1.21 CC1=C(O)N=CC(B(O)O)=C1 DY651806 [0,2,0,0,0,0|2,0,0]=4 1505 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(F)C=C1 DY501669 [0,2,0,0,0,0|2,0,0]=4 1506 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 NO14514 [0,2,0,0,0,0|2,0,0]=4 1507 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 DY585920 [0,2,0,0,0,0|1,0,0]=3 1508 B11R1.21 FC(F)C1=CC(Br)=C(Cl)C=C1 DY432572 [0,2,0,0,0,0|2,0,0]=4 1509 B11R1.21 NC(=O)C1=CC(O)=C(O)C=C1 DY796257 [0,2,0,0,0,0|0,0,2]=4 1510 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 DY40225 [0,2,0,0,0,0|1,0,1]=4 1511 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 NO20206 [0,2,0,0,0,0|1,0,1]=4 1512 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 NO20228 [0,2,0,0,0,0|1,0,1]=4 1513 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 NO10439 [0,2,0,0,0,0|1,0,1]=4 1514 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 DY10142 [0,2,0,0,0,0|1,0,1]=4 1515 B11R1.21 NC1=C(I)C=CC(C(=O)O)=C1 DY31156 [0,2,0,0,0,0|1,0,1]=4 1516 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 NO20381 [0,2,0,0,0,0|1,0,1]=4 1517 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 NO20332 [0,2,0,0,0,0|1,0,1]=4 1518 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 NO10491 [0,2,0,0,0,0|0,0,1]=3 1519 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl DY20248 [0,2,0,0,0,0|1,0,1]=4 1520 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 NO13169 [0,2,0,0,0,0|1,0,1]=4 1521 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 NO19835 [0,2,0,0,0,0|1,0,1]=4 1522 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 NO21914 [0,2,0,0,0,0|1,0,1]=4 1523 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 NO16354 [0,2,0,0,0,0|1,0,1]=4 1524 B11R1.21 O=C(O)C1=CC(Br)=C(O)C=C1 DY791505 [0,2,0,0,0,0|0,0,1]=3 1525 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 NO14672 [0,2,0,0,0,0|1,0,1]=4 1526 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 NO19962 [0,2,0,0,0,0|1,0,1]=4 1527 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 NO20110 [0,2,0,0,0,0|0,0,1]=3 1528 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 NO21990 [0,2,0,0,0,0|1,0,1]=4 1529 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 NO19967 [0,2,0,0,0,0|1,0,1]=4 1530 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 NO22285 [0,2,0,0,0,0|1,0,1]=4 1531 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 DY434062 [0,2,0,0,0,0|1,0,1]=4 1532 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 NO12746 [0,2,0,0,0,0|1,0,1]=4 1533 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 NO22662 [0,2,0,0,0,0|1,0,1]=4 1534 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 NO20111 [0,2,0,0,0,0|1,0,1]=4 1535 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 NO18380 [0,2,0,0,0,0|1,0,1]=4 1536 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 NO20259 [0,2,0,0,0,0|0,0,1]=3 1537 B11R1.21 O=C(O)C1=CC=C(O)C(=O)N1 NO17670 [0,2,0,0,0,0|1,0,1]=4 1538 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(O)C=C1 NO18789 [0,2,0,0,0,0|1,0,1]=4 1539 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(O)C=C1 NO18855 [0,2,0,0,0,0|1,0,1]=4 1540 B11R1.21 O=[N+]([O-])C1=CC=C(O)C(O)=C1 DY549081 [0,2,0,0,0,0|1,0,1]=4 1541 B11R1.21 OB(O)C1=CC(Cl)=C(Cl)C=C1 NO18935 [0,2,0,0,0,0|2,0,0]=4 1542 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 NO18946 [0,2,0,0,0,0|2,0,0]=4 1543 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 NO13191 [0,2,0,0,0,0|1,0,0]=3 1544 B11R1.21 OB(O)C1=CC(F)=C(F)C=C1 NO18957 [0,2,0,0,0,0|2,0,0]=4 1545 B11R1.21 OB(O)C1=CC(F)=C(O)C=C1 DY441708 [0,2,0,0,0,0|1,0,0]=3 1546 B11R1.21 OB(O)C1=CC(F)=C(O)N=C1 DY114150 [0,2,0,0,0,0|2,0,0]=4 1547 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 NO16283 [0,2,0,0,0,0|2,0,0]=4 1548 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 NO21355 [0,2,0,0,0,0|0,0,2]=4 1549 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 NO20824 [0,2,0,0,0,0|0,0,2]=4 1550 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 NO16419 [0,2,0,0,0,0|0,0,2]=4 1551 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 NO19678 [0,2,0,0,0,0|0,0,2]=4 1552 B11R1.166 CC(C)C1=C(I)C=C(Cl)C=C1 DY450586 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.166 CC(N)C1=C(Cl)C=C(Cl)C=C1 DY600215 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.166 CC(O)C1=C(Cl)C=C(Cl)C=C1 DY40730 [0,2,0,0,0,0|1,0,0]=3 1555 B11R1.166 CC1=C(B(O)O)C=CC(Cl)=C1 NO10504 [0,2,0,0,0,0|2,0,0]=4 1556 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 NO15606 [0,2,0,0,0,0|1,0,1]=4 1557 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 NO22749 [0,2,0,0,0,0|1,0,1]=4 1558 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 NO21999 [0,2,0,0,0,0|1,0,1]=4 1559 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 NO18188 [0,2,0,0,0,0|1,0,1]=4 1560 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 NO12971 [0,2,0,0,0,0|0,0,1]=3 1561 B11R1.166 CC1=CC(Br)=C(B(O)O)C=C1 DY451780 [0,2,0,0,0,0|2,0,0]=4 1562 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 NO21362 [0,2,0,0,0,0|1,0,1]=4 1563 B11R1.166 CC1=CC(C)=C(B(O)O)C=C1 NO20463 [0,2,0,0,0,0|2,0,0]=4 1564 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 NO21071 [0,2,0,0,0,0|1,0,1]=4 1565 B11R1.166 CC1=CC(Cl)=C(B(O)O)C=C1 NO13719 [0,2,0,0,0,0|2,0,0]=4 1566 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 NO21449 [0,2,0,0,0,0|1,0,1]=4 1567 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 NO20350 [0,2,0,0,0,0|2,0,0]=4 1568 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 NO20842 [0,2,0,0,0,0|1,0,1]=4 1569 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 DY534207 [0,2,0,0,0,0|1,0,1]=4 1570 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 NO13976 [0,2,0,0,0,0|1,0,1]=4 1571 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 DY115738 [0,2,0,0,0,0|2,0,0]=4 1572 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 NO20948 [0,2,0,0,0,0|1,0,1]=4 1573 B11R1.166 CC1=CC(O)=CC=C1[N+](=O)[O-] NO20328 [0,2,0,0,0,0|1,0,1]=4 1574 B11R1.166 C[C@@H](N)C1=C(F)C=C(Cl)C=C1 DY575031 [0,2,0,0,0,0|2,0,0]=4 1575 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 DY572097 [0,2,0,0,0,0|2,0,0]=4 1576 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 NO20180 [0,2,0,0,0,0|1,0,1]=4 1577 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 NO20207 [0,2,0,0,0,0|1,0,1]=4 1578 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 NO21253 [0,2,0,0,0,0|1,0,1]=4 1579 B11R1.166 NC1=C([N+](=O)[O-])C=CC(O)=C1 DY30063 [0,2,0,0,0,0|1,0,1]=4 1580 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 NO10414 [0,2,0,0,0,0|1,0,1]=4 1581 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 NO20227 [0,2,0,0,0,0|1,0,1]=4 1582 B11R1.166 NC1=CC(N)=C(B(O)O)C=C1 DY707701 [0,2,0,0,0,0|2,0,0]=4 1583 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 NO22593 [0,2,0,0,0,0|1,0,1]=4 1584 B11R1.166 Nc1ccc(C(=O)O)c(O)c1 DY538767 [0,2,0,0,0,0|1,0,1]=4 1585 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 NO21072 [0,2,0,0,0,0|1,0,1]=4 1586 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 NO19824 [0,2,0,0,0,0|1,0,1]=4 1587 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 NO21353 [0,2,0,0,0,0|1,0,1]=4 1588 B11R1.166 O=C(O)C1=C(Br)C=C(I)C=C1 NO15275 [0,2,0,0,0,0|1,0,1]=4 1589 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 NO10220 [0,2,0,0,0,0|1,0,1]=4 1590 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 NO14611 [0,2,0,0,0,0|1,0,1]=4 1591 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 NO20109 [0,2,0,0,0,0|0,0,1]=3 1592 B11R1.166 O=C(O)C1=C(Cl)N=C(O)C=C1 NO19029 [0,2,0,0,0,0|1,0,1]=4 1593 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 NO21987 [0,2,0,0,0,0|1,0,1]=4 1594 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 DY40267 [0,2,0,0,0,0|1,0,1]=4 1595 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 NO10370 [0,2,0,0,0,0|0,0,1]=3 1596 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 NO22743 [0,2,0,0,0,0|1,0,1]=4 1597 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 NO14997 [0,2,0,0,0,0|1,0,1]=4 1598 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 NO14628 [0,2,0,0,0,0|1,0,1]=4 1599 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 NO14175 [0,2,0,0,0,0|1,0,1]=4 1600 B11R1.166 O=C(O)C1=C(O)C=C(I)C=C1 DY530661 [0,2,0,0,0,0|1,0,1]=4 1601 B11R1.166 O=C(O)C1=CN=C(O)C=C1Cl NO15170 [0,2,0,0,0,0|1,0,1]=4 1602 B11R1.166 O=[N+]([O-])C1=C(F)C=C(O)C=C1 NO22937 [0,2,0,0,0,0|1,0,1]=4 1603 B11R1.166 O=[N+]([O-])C1=C(I)C=C(O)C=C1 NO14969 [0,2,0,0,0,0|1,0,1]=4 1604 B11R1.166 OB(O)C1=C(Cl)C=C(Cl)C=C1 NO15602 [0,2,0,0,0,0|2,0,0]=4 1605 B11R1.166 OB(O)C1=C(Cl)C=C(F)C=C1 DY20275 [0,2,0,0,0,0|2,0,0]=4 1606 B11R1.166 OB(O)C1=C(F)C=C(Cl)C=C1 DY20270 [0,2,0,0,0,0|2,0,0]=4 1607 B11R1.166 OB(O)C1=C(F)C=C(F)C=C1 NO22948 [0,2,0,0,0,0|2,0,0]=4 1608 B11R1.37 CCC1=C(CO)C=C(Br)C=C1 DY584341 [0,2,0,0,0,0|2,0,0]=4 1609 B11R1.37 CCC1=C(CO)C=CC(Br)=C1 DY452560 [0,2,0,0,0,0|1,0,0]=3 1610 B11R1.37 COC1=C(C#N)C=CC(O)=C1 DY442317 [0,2,0,0,0,0|1,0,1]=4 1611 B11R1.37 COC1=C(CBr)C=CC(Br)=C1 DY585097 [0,2,0,0,0,0|2,0,0]=4 1612 B11R1.37 COC1=C(CBr)C=CC(F)=C1 DY585074 [0,2,0,0,0,0|2,0,0]=4 1613 B11R1.37 COC1=C(CN)C=CC(F)=C1 NO12735 [0,2,0,0,0,0|2,0,0]=4 1614 B11R1.37 COC1=NC(Br)=CC=C1CO NO17509 [0,2,0,0,0,0|2,0,0]=4 1615 B11R1.37 N#CC1=C(C#N)C=C(O)C=C1 DY457906 [0,2,0,0,0,0|1,0,1]=4 1616 B11R1.37 N#CC1=C(CBr)C=CC(F)=C1 DY584790 [0,2,0,0,0,0|2,0,0]=4 1617 B11R1.277 CC1=CC(C#N)=C(C)C=C1O NO19365 [0,2,0,0,0,0|1,0,1]=4 1618 B11R1.277 CC1=CC(C=O)=C(C)C=C1O NO19366 [0,2,0,0,0,0|0,0,2]=4 1619 B11R1.277 CC1=CC(C=O)=C(O)C=C1O DY553023 [0,2,0,0,0,0|0,0,2]=4 1620 B11R1.277 CC1=CC(F)=C(CO)C=C1Br DY451318 [0,2,0,0,0,0|1,0,0]=3 1621 B11R1.277 CCC1=CC(Cl)=C(Cl)C=C1F DY747979 [0,2,0,0,0,0|2,0,0]=4 1622 B11R1.277 COC1=CC(C)=C(O)C=C1Br DY446820 [0,2,0,0,0,0|2,0,0]=4 1623 B11R1.277 FC1=CC(Br)=C(CBr)C=C1F DY584785 [0,2,0,0,0,0|2,0,0]=4 1624 B11R1.277 FC1=CC(CCl)=C(Br)C=C1Br DY108952 [0,2,0,0,0,0|2,0,0]=4 1625 B11R1.277 FC1=CC(F)=C(CBr)C=C1F DY30148 [0,2,0,0,0,0|2,0,0]=4 1626 B11R1.277 FCC1=CC(Cl)=C(F)C=C1F DY748789 [0,2,0,0,0,0|2,0,0]=4 1627 B11R1.277 N#CC1=C(Cl)C=C(O)C(Cl)=C1 DY584843 [0,2,0,0,0,0|1,0,1]=4 1628 B11R1.277 N#CC1=C(F)C=C(O)C(Br)=C1 DY529167 [0,2,0,0,0,0|1,0,1]=4 1629 B11R1.277 N#CC1=C(F)C=C(O)C(Cl)=C1 DY585048 [0,2,0,0,0,0|1,0,1]=4 1630 B11R1.277 O=CC1=C(F)C=C(O)C(Cl)=C1 DY450046 [0,2,0,0,0,0|0,0,2]=4 1631 B11R1.277 OCC1=C(Cl)C=C(Br)C(Cl)=C1 DY108376 [0,2,0,0,0,0|1,0,0]=3 1632 B11R1.278 CC1=C(CO)C=CC(Br)=C1F DY448198 [0,2,0,0,0,0|1,0,0]=3 1633 B11R1.278 CC1=C(CO)C=CC(Cl)=C1F DY449242 [0,2,0,0,0,0|1,0,0]=3 1634 B11R1.278 CC1=C(O)C=CC(C=O)=C1O NO15354 [0,2,0,0,0,0|0,0,2]=4 1635 B11R1.278 CC1=NC=C(CO)C(C)=C1O DY659252 [0,2,0,0,0,0|2,0,0]=4 1636 B11R1.278 FC1=C(Br)C=CC(CBr)=C1F DY584777 [0,2,0,0,0,0|2,0,0]=4 1637 B11R1.278 FC1=C(Br)C=CC(CCl)=C1F DY584776 [0,2,0,0,0,0|2,0,0]=4 1638 B11R1.278 FC1=C(Cl)C=CC(CCl)=C1F DY584775 [0,2,0,0,0,0|2,0,0]=4 1639 B11R1.278 FC1=C(F)C(Cl)=C(CCl)C=C1 DY584780 [0,2,0,0,0,0|2,0,0]=4 1640 B11R1.278 FCC1=C(F)C(F)=C(Cl)C=C1 DY748771 [0,2,0,0,0,0|2,0,0]=4 1641 B11R1.278 FCC1=CC=C(F)C(Cl)=C1Cl DY748807 [0,2,0,0,0,0|2,0,0]=4 1642 B11R1.278 N#CC1=C(F)C(F)=C(O)C=C1 NO19831 [0,2,0,0,0,0|1,0,1]=4 1643 B11R1.278 NCC1=C(F)C(F)=C(F)C=C1 DY584934 [0,2,0,0,0,0|2,0,0]=4 1644 B11R1.278 O=CC1=C(F)C(F)=C(O)C=C1 NO21025 [0,2,0,0,0,0|0,0,2]=4 1645 B11R1.278 O=CC1=C(O)C(O)=C(O)C=C1 NO20987 [0,2,0,0,0,0|0,0,2]=4 1646 B11R1.278 OCC1=C(F)C(Br)=C(F)C=C1 DY448444 [0,2,0,0,0,0|1,0,0]=3 1647 B11R1.464 CC1=C(CO)C(Cl)=NC(Cl)=C1 DY650689 [0,2,0,0,0,0|2,0,0]=4 1648 B11R1.464 CC1=CC(F)=CC(C)=C1CO DY450256 [0,2,0,0,0,0|1,0,0]=3 1649 B11R1.464 CC1=CC(F)=CC(F)=C1CBr DY110266 [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.464 CC1=CC(F)=CC(F)=C1CO DY584955 [0,2,0,0,0,0|1,0,0]=3 1651 B11R1.464 CC1=CC(O)=CC(C)=C1C#N NO22864 [0,2,0,0,0,0|1,0,1]=4 1652 B11R1.464 CC1=CC(O)=CC(C)=C1C=O NO15683 [0,2,0,0,0,0|0,0,2]=4 1653 B11R1.464 CCC1=C(I)C=C(I)C=C1F DY747919 [0,2,0,0,0,0|2,0,0]=4 1654 B11R1.464 CCN1C(=O)C=C(O)C=C1C DY716234 [0,2,0,0,0,0|2,0,0]=4 1655 B11R1.464 FC1=C(CBr)C(Cl)=CC(Br)=C1 DY30239 [0,2,0,0,0,0|2,0,0]=4 1656 B11R1.464 FC1=CC(Br)=CC(F)=C1CBr DY20666 [0,2,0,0,0,0|2,0,0]=4 1657 B11R1.464 FC1=CC(Cl)=CC(F)=C1CBr NO22734 [0,2,0,0,0,0|2,0,0]=4 1658 B11R1.464 FCC1=C(I)C=C(F)C=C1I DY748777 [0,2,0,0,0,0|2,0,0]=4 1659 B11R1.464 N#CC1=C(Br)C=C(O)C=C1Br DY584801 [0,2,0,0,0,0|1,0,1]=4 1660 B11R1.464 NC1=C(CO)C(F)=CC(F)=C1 NO18240 [0,2,0,0,0,0|1,0,0]=3 1661 B11R1.464 NCC1=C(F)C=C(Br)C=C1F NO17608 [0,2,0,0,0,0|2,0,0]=4 1662 B11R1.464 O=CC1=C(F)C=C(O)C=C1F NO12808 [0,2,0,0,0,0|0,0,2]=4 1663 B11R1.464 OCC1=C(Cl)C=C(Cl)C=C1Cl NO12665 [0,2,0,0,0,0|1,0,0]=3 1664 B11R1.464 OCC1=C(F)C=C(Br)C=C1F NO22632 [0,2,0,0,0,0|1,0,0]=3 1665 B11R1.464 OCC1=C(F)C=C(O)C=C1F NO14505 [0,2,0,0,0,0|0,0,0]=2 1666 B11R1.14 CC1=C(Br)C=C(CO)C=C1Br DY448048 [0,2,0,0,0,0|1,0,0]=3 1667 B11R1.14 CC1=C(Cl)C=C(CCl)C=C1Cl DY109894 [0,2,0,0,0,0|2,0,0]=4 1668 B11R1.14 CC1=CC(C#N)=CC(C)=C1O NO21714 [0,2,0,0,0,0|1,0,1]=4 1669 B11R1.14 CC1=CC(C#N)=CC(Cl)=C1O DY531639 [0,2,0,0,0,0|1,0,1]=4 1670 B11R1.14 CC1=CC(C=O)=CC(C)=C1O NO21079 [0,2,0,0,0,0|0,0,2]=4 1671 B11R1.14 CC1=CC(CBr)=CC(C)=C1F DY584408 [0,2,0,0,0,0|2,0,0]=4 1672 B11R1.14 CC1=CC(CBr)=CC(Cl)=C1Cl DY109888 [0,2,0,0,0,0|2,0,0]=4 1673 B11R1.14 CC1=CC(CN)=CC(Cl)=C1Cl DY109882 [0,2,0,0,0,0|2,0,0]=4 1674 B11R1.14 CC1=CC(CO)=CC(Cl)=C1Cl DY109876 [0,2,0,0,0,0|1,0,0]=3 1675 B11R1.14 CCC1=CC(F)=C(O)C(F)=C1 DY822092 [0,2,0,0,0,0|1,0,0]=3 1676 B11R1.14 COC1=CC(C)=C(O)C(C)=C1 DY451282 [0,2,0,0,0,0|2,0,0]=4 1677 B11R1.14 FC1=CC(CBr)=CC(Br)=C1Br DY108946 [0,2,0,0,0,0|2,0,0]=4 1678 B11R1.14 FC1=CC(CBr)=CC(F)=C1F NO18877 [0,2,0,0,0,0|2,0,0]=4 1679 B11R1.14 FC1=CC(CCl)=CC(Br)=C1Br DY108958 [0,2,0,0,0,0|2,0,0]=4 1680 B11R1.14 FC1=CC(CCl)=CC(Br)=C1F DY108448 [0,2,0,0,0,0|2,0,0]=4 1681 B11R1.14 FCC1=CC(I)=C(F)C(I)=C1 DY748801 [0,2,0,0,0,0|2,0,0]=4 1682 B11R1.14 NCC1=CC(F)=C(F)C(F)=C1 DY40844 [0,2,0,0,0,0|2,0,0]=4 1683 B11R1.14 O=CC1=CC(Br)=C(O)C(Cl)=C1 DY453568 [0,2,0,0,0,0|0,0,2]=4 1684 B11R1.14 O=CC1=CC(Br)=C(O)C(F)=C1 NO16316 [0,2,0,0,0,0|0,0,2]=4 1685 B11R1.14 O=CC1=CC(Cl)=C(O)C(Cl)=C1 NO19903 [0,2,0,0,0,0|0,0,2]=4 1686 B11R1.14 O=CC1=CC(O)=C(O)C(O)=C1 NO21918 [0,2,0,0,0,0|0,0,2]=4 1687 B11R1.280 C=CC1=CC(OC)=C(O)C=C1 NO21640 [0,2,0,0,0,0|1,0,1]=4 1688 B11R1.280 COC1=C(Br)C=CC(CO)=C1 NO21375 [0,2,0,0,0,0|1,0,0]=3 1689 B11R1.280 COC1=C(Cl)C=CC(CO)=C1 NO17422 [0,2,0,0,0,0|1,0,0]=3 1690 B11R1.280 COC1=C(O)C=CC(C=O)=C1 NO13553 [0,2,0,0,0,0|0,0,2]=4 1691 B11R1.280 COC1=C(O)C=CC(CN)=C1 NO22873 [0,2,0,0,0,0|1,0,0]=3 1692 B11R1.280 COC1=CC(C=O)=C(O)C=C1 NO20949 [0,2,0,0,0,0|2,0,0]=4 1693 B11R1.280 COC1=CC(OC)=C(O)C=C1 NO21112 [0,2,0,0,0,0|2,0,0]=4 1694 B11R1.280 N#CC1=C(F)C=CC(CBr)=C1 DY40537 [0,2,0,0,0,0|2,0,0]=4 1695 B11R1.280 N#CC1=CC(C=O)=C(O)C=C1 DY20826 [0,2,0,0,0,0|1,0,1]=4 1696 B11R1.280 O=CC1=C(O)C=CC(CCl)=C1 DY584447 [0,2,0,0,0,0|1,0,0]=3 1697 B9R1.3 CC1=C(O)C=CC=C1O DY20744 [0,0,1,1,0,0|0,0,2]=4 1698 B9R1.3 NC1=C(O)C=CC=C1O NO21312 [0,0,1,1,0,0|1,0,1]=4 1699 B9R1.3 OC1=CC=CC(O)=C1Br DY443180 [0,0,1,1,0,0|1,0,1]=4 1700 B9R1.3 OC1=CC=CC(O)=C1Cl NO19075 [0,0,1,1,0,0|1,0,1]=4 1701 B9R1.3 OC1=CC=CC(O)=C1F DY433390 [0,0,1,1,0,0|1,0,1]=4 1702 B9R1.3 OC1=CC=CC(O)=C1I DY443433 [0,0,1,1,0,0|1,0,1]=4 1703 B9R2.50 C1=CC=C2CCC2=C1 NO19267 [1,0,0,1,0,0|1,0,0]=3 1704 B11R2.34 BrC1=CC=C(C2CC2)C=C1 NO22811 [0,1,0,1,0,0|2,0,0]=4 1705 B11R2.34 CC1=CC=C(C2CC2)C=C1 DY789057 [0,1,0,1,0,0|2,0,0]=4 1706 B11R2.34 FC1=CC=C(C2CO2)C=C1 DY534555 [0,1,0,1,0,0|1,0,0]=3 1707 B11R2.34 NC1=CC=C(C2CC2)C=C1 DY548169 [0,1,0,1,0,0|2,0,0]=4 1708 B11R2.34 NC1=CC=C(C2CC2)C=C1 NO17100 [0,1,0,1,0,0|2,0,0]=4 1709 B11R2.34 OC1=NC=C(C2CC2)C=C1 DY508466 [0,1,0,1,0,0|2,0,0]=4 1710 B11R2.36 BrC1=CC2=C(C=C1)C=NO2 NO13230 [0,1,0,1,0,0|1,0,1]=4 1711 B11R2.36 BrC1=CC2=C(C=C1)N=CO2 NO14721 [0,1,0,1,0,0|1,0,1]=4 1712 B11R2.36 BrC1=CC2=C(C=C1)OCC2 DY20389 [0,1,0,1,0,0|2,0,0]=4 1713 B11R2.36 BrC1=CC2=NON=C2C=C1 NO10249 [0,1,0,1,0,0|2,0,0]=4 1714 B11R2.36 BrC1=CC=C2CCNC2=C1 NO17623 [0,1,0,1,0,0|2,0,0]=4 1715 B11R2.36 BrC1=CC=C2CNCC2=C1 DY20658 [0,1,0,1,0,0|2,0,0]=4 1716 B11R2.36 BrC1=CC=C2CNCC2=C1 NO14408 [0,1,0,1,0,0|2,0,0]=4 1717 B11R2.36 BrC1=CC=C2NCCC2=C1 NO10836 [0,1,0,1,0,0|2,0,0]=4 1718 B11R2.36 Brc1ccc2c(c1)OCO2 NO19789 [0,1,0,1,0,0|1,0,0]=3 1719 B11R2.36 CC1=CC=C2CNCC2=C1 DY431420 [0,1,0,1,0,0|2,0,0]=4 1720 B11R2.36 ClC1=CC=C2CCNC2=C1 NO19407 [0,1,0,1,0,0|2,0,0]=4 1721 B11R2.36 ClC1=CC=C2CNCC2=C1 NO15340 [0,1,0,1,0,0|2,0,0]=4 1722 B11R2.36 ClC1=CC=C2NCCC2=C1 DY20079 [0,1,0,1,0,0|2,0,0]=4 1723 B11R2.36 ClC1=CC=C2NCCC2=C1 DY630382 [0,1,0,1,0,0|2,0,0]=4 1724 B11R2.36 FC1=CC=C2CCCC2=C1 NO16751 [0,1,0,1,0,0|2,0,0]=4 1725 B11R2.36 FC1=CC=C2CCNC2=C1 DY443334 [0,1,0,1,0,0|2,0,0]=4 1726 B11R2.36 FC1=CC=C2CNCC2=C1 DY459041 [0,1,0,1,0,0|2,0,0]=4 1727 B11R2.36 FC1=CC=C2CNCC2=C1 NO15207 [0,1,0,1,0,0|2,0,0]=4 1728 B11R2.36 NC1=CC2=C(C=C1)C=NO2 NO12165 [0,1,0,1,0,0|1,0,1]=4 1729 B11R2.36 NC1=CC2=C(C=C1)CCO2 DY561471 [0,1,0,1,0,0|1,0,0]=3 1730 B11R2.36 NC1=CC2=C(C=C1)N=CO2 NO20506 [0,1,0,1,0,0|1,0,1]=4 1731 B11R2.36 NC1=CC2=C(C=C1)OCO2 NO20315 [0,1,0,1,0,0|1,0,0]=3 1732 B11R2.36 NC1=CC=C2CNCC2=C1 DY20849 [0,1,0,1,0,0|2,0,0]=4 1733 B11R2.36 NC1=CC=C2CNCC2=C1 DY555549 [0,1,0,1,0,0|2,0,0]=4 1734 B11R2.36 NC1=CC=C2NCCC2=C1 DY630744 [0,1,0,1,0,0|2,0,0]=4 1735 B11R2.36 OC1=CC2=C(C=C1)C=NO2 NO12459 [0,1,0,1,0,0|0,0,1]=3 1736 B11R2.36 OC1=CC2=C(C=C1)CCO2 NO16031 [0,1,0,1,0,0|0,0,0]=2 1737 B11R2.36 OC1=CC2=C(C=C1)N=CS2 NO10613 [0,1,0,1,0,0|0,1,1]=4 1738 B11R2.36 OC1=CC2=C(C=CO2)C=C1 NO20605 [0,1,0,1,0,0|0,0,1]=3 1739 B11R2.36 OC1=CC2=NON=C2C=C1 DY681780 [0,1,0,1,0,0|1,0,0]=3 1740 B11R2.36 OC1=CC2=NSN=C2C=C1 DY681792 [0,1,0,1,0,0|1,1,0]=4 1741 B11R2.36 OC1=CC=C2C=NNC2=C1 NO20712 [0,1,0,1,0,0|1,0,1]=4 1742 B11R2.36 OC1=CC=C2CCNC2=C1 DY630750 [0,1,0,1,0,0|1,0,0]=3 1743 B11R2.36 OC1=CC=C2CNCC2=C1 DY446903 [0,1,0,1,0,0|1,0,0]=3 1744 B11R2.36 OC1=CC=C2NC=CC2=C1 NO20861 [0,1,0,1,0,0|1,0,1]=4 1745 B11R2.36 OC1=CC=C2NN=CC2=C1 NO20711 [0,1,0,1,0,0|2,0,0]=4 1746 B7R1.1 ClCC1=CC=CO1 NO13429 [1,0,0,0,1,0|2,0,0]=4 1747 B7R1.1 NCC1=CC=CN1 NO14874 [1,0,0,0,1,0|2,0,0]=4 1748 B7R1.1 NCC1=CC=CS1 NO22783 [1,0,0,0,1,0|2,0,0]=4 1749 B7R1.1 NCC1=CSC=C1 NO22417 [1,0,0,0,1,0|2,0,0]=4 1750 B7R1.1 OCC1=CC=NO1 NO15343 [1,0,0,0,1,0|2,0,0]=4 1751 B7R1.1 OCC1=CN=CS1 NO16191 [1,0,0,0,1,0|2,0,0]=4 1752 B7R1.1 OCC1=CNN=C1 NO20094 [1,0,0,0,1,0|2,0,0]=4 1753 B7R1.1 OCC1=COC=C1 NO22303 [1,0,0,0,1,0|1,0,0]=3 1754 B7R1.1 OCC1=CSC=C1 NO18039 [1,0,0,0,1,0|1,0,0]=3 1755 B7R1.1 OCC1=CSC=N1 NO22892 [1,0,0,0,1,0|2,0,0]=4 1756 B7R1.1 OCN1C=CC=N1 NO11902 [1,0,0,0,1,0|2,0,0]=4 1757 B7R1.1 OCN1C=CN=C1 DY726289 [1,0,0,0,1,0|2,0,0]=4 1758 B7R1.2 CC1=CC(Br)=CS1 NO22736 [1,0,0,0,1,0|2,0,0]=4 1759 B7R1.2 CC1=CC(N)=CS1 DY786994 [1,0,0,0,1,0|2,0,0]=4 1760 B7R1.2 CC1=CC=C(Br)O1 DY513585 [1,0,0,0,1,0|2,0,0]=4 1761 B7R1.2 CC1=CC=C(Br)S1 NO22735 [1,0,0,0,1,0|2,0,0]=4 1762 B7R1.2 CC1=CC=C(C)N1 NO21153 [1,0,0,0,1,0|2,0,0]=4 1763 B7R1.2 CC1=CC=C(Cl)S1 DY451354 [1,0,0,0,1,0|2,0,0]=4 1764 B7R1.2 CC1=CC=C(I)S1 DY530097 [1,0,0,0,1,0|2,0,0]=4 1765 B7R1.2 CC1=CC=C(N)S1 DY787300 [1,0,0,0,1,0|2,0,0]=4 1766 B7R1.2 CC1=CC=C(N)S1 DY787384 [1,0,0,0,1,0|2,0,0]=4 1767 B7R1.2 CN1C=CC(N)=C1 NO17699 [1,0,0,0,1,0|2,0,0]=4