0 B9R1.6 CC(=O)C1=CC=CN=C1 NO18256 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.6 CC(=O)C1=CC=NC=C1 NO22535 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 CC(=O)C1=NC=CC=C1 NO18611 [0,0,0,0,0,0|0,0,0]=0 3 B9R1.6 CC(=O)C1=NC=CN=C1 NO19346 [0,0,0,0,0,0|1,0,0]=1 4 B9R1.6 CC(=O)C1C=CCCC1 DY430670 [0,0,0,0,0,0|1,0,3]=4 5 B9R1.6 CC(Br)C1=NC=CN=C1 DY710527 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.6 CC(C)C1=NC=CC=C1 NO21621 [0,0,0,0,0,0|1,0,1]=2 7 B9R1.6 CC(N)C1=CC=CC=C1 DY457042 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.6 CC(N)C1=CC=CN=N1 DY526767 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.6 CC(N)C1=NC=CN=C1 NO12997 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.6 CC(O)C1=NC=CC=C1 NO20801 [0,0,0,0,0,0|0,0,2]=2 11 B9R1.6 CN(C)C1=CC=NC=C1 NO13386 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.6 CS(=O)C1=CC=CC=C1 DY510356 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.6 CS(=O)C1=NC=CC=N1 DY693106 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 C[C@@H](N)C1=CC=CN=C1 DY553203 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.6 C[C@@H](N)C1=CC=CN=C1 DY621669 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.6 C[C@@H](O)C1=NC=CC=C1 DY20310 [0,0,0,0,0,0|0,0,2]=2 17 B9R1.6 C[C@@H](O)C1=NC=CC=N1 DY621675 [0,0,0,0,0,0|1,0,2]=3 18 B9R1.6 C[C@H](N)C1=CC=CN=C1 DY546027 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.6 C[C@H](N)C1=NC=CC=C1 NO15370 [0,0,0,0,0,0|1,0,1]=2 20 B9R1.6 C[C@H](O)C1=CC=CN=N1 DY586498 [0,0,0,0,0,0|1,0,2]=3 21 B9R1.6 C[PH](=O)C1=CC=CC=C1 NO16386 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.6 C[S@@](=O)C1=CC=CC=C1 DY621380 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.6 ClP(Cl)C1=CC=CC=C1 DY822051 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.6 N=C(N)C1=CC=CC=C1 NO14830 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.6 N=C(N)C1=CN=CC=C1 NO19487 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.6 N=C(N)C1=NC=CC=C1 NO19100 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.6 N=C(N)C1=NC=CC=N1 DY737510 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.6 N=C(N)C1=NC=CC=N1 NO21214 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.6 NC(=O)C1=CC=NC=C1 NO13721 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.6 NC(=O)C1=CN=CC=C1 DY583359 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.6 NC(=O)C1=CN=CN=C1 DY696178 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.6 NC(=O)C1=NC=CC=C1 NO11910 [0,0,0,0,0,0|1,0,0]=1 33 B9R1.6 NC(=O)C1=NC=CN=C1 NO13379 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.6 NC(=S)C1=CC=CN=N1 NO16975 [0,0,0,0,0,0|2,1,0]=3 35 B9R1.6 NC(=S)C1=CC=NC=C1 DY541407 [0,0,0,0,0,0|3,1,0]=4 36 B9R1.6 O=C(Br)C1=CC=CC=C1 DY585100 [0,0,0,0,0,0|2,0,0]=2 37 B9R1.6 O=C(Cl)C1=CC=CC=C1 DY40435 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.6 O=C(Cl)C1=NC=CC=C1 NO11857 [0,0,0,0,0,0|1,0,0]=1 39 B9R1.6 O=C(O)C1=CC=CN=C1 DY41633 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.6 O=C(O)C1=CC=CN=N1 NO19741 [0,0,0,0,0,0|2,0,0]=2 41 B9R1.6 O=C(O)C1=CN=CN=C1 NO17525 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.6 O=C(O)C1=NC=CC=C1 NO13384 [0,0,0,0,0,0|1,0,0]=1 43 B9R1.6 O=C(O)C1=NC=CN=C1 NO17531 [0,0,0,0,0,0|2,0,0]=2 44 B9R1.6 O=C([O-])C1=CC=CC=C1 DY558819 [0,0,0,0,0,0|2,0,0]=2 45 B9R1.6 O=C([O-])C1=NC=CC=C1 DY712843 [0,0,0,0,0,0|1,0,0]=1 46 B9R1.6 O=C([O-])C1=NC=CC=C1 DY714470 [0,0,0,0,0,0|1,0,0]=1 47 B9R1.6 O=S([O-])C1=NC=CC=C1 DY711577 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.6 O=S([O-])C1=NC=CC=N1 DY696185 [0,0,0,0,0,0|3,0,0]=3 49 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 NO22384 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.6 O=[N+]([O-])C1=CC=NC=C1 DY715232 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.6 O=[N+]([O-])C1=NC=CC=C1 DY525843 [0,0,0,0,0,0|2,0,0]=2 52 B9R1.6 O=[N+]([O-])C1=NC=CN=C1 DY710017 [0,0,0,0,0,0|3,0,0]=3 53 B9R1.6 O=[PH](O)C1=CC=CC=C1 DY532299 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.6 OB(O)C1=CC=CC=C1 NO19450 [0,0,0,0,0,0|3,0,1]=4 55 B9R1.6 OB(O)C1=NC=CC=C1 DY20201 [0,0,0,0,0,0|2,0,1]=3 56 B9R1.6 OB(O)C1=NC=NC=C1 DY20899 [0,0,0,0,0,0|3,0,1]=4 57 B8R1.2 BrCC1=CC=CN=N1 NO15758 [1,0,0,0,0,0|2,0,1]=4 58 B8R1.2 BrCC1=NC=CN=C1 DY710893 [1,0,0,0,0,0|2,0,1]=4 59 B8R1.2 C#CC1=CC=CC=C1 NO19127 [1,0,0,0,0,0|1,0,2]=4 60 B8R1.2 C#CC1=CC=CN=N1 DY102367 [1,0,0,0,0,0|1,0,2]=4 61 B8R1.2 C#CC1=NC=CC=C1 NO21539 [1,0,0,0,0,0|0,0,2]=3 62 B8R1.2 C#CC1=NC=CC=N1 NO12611 [1,0,0,0,0,0|1,0,2]=4 63 B8R1.2 C=CC1=CC=CN=C1 DY507011 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.2 CCC1=CC=CN=C1 NO22277 [1,0,0,0,0,0|2,0,1]=4 65 B8R1.2 CCC1=NC=CN=C1 NO21534 [1,0,0,0,0,0|1,0,1]=3 66 B8R1.2 CNC1=CC=CC=C1 NO11792 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.2 CNC1=CC=CN=C1 NO13856 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.2 COC1=CC=CN=C1 NO22348 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.2 COC1=CC=CN=N1 NO22347 [1,0,0,0,0,0|2,0,0]=3 70 B8R1.2 COC1=CC=NC=C1 NO19206 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.2 COC1=CC=[C-]C=C1 DY747109 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.2 COC1=NC=CC=C1 NO18780 [1,0,0,0,0,0|1,0,0]=2 73 B8R1.2 COC1=NC=CN=C1 NO17887 [1,0,0,0,0,0|2,0,0]=3 74 B8R1.2 CSC1=NC=CC=N1 DY573207 [1,0,0,0,0,0|2,0,0]=3 75 B8R1.2 CSC1=NC=CN=C1 DY541389 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.2 ClCC1=CC=CN=N1 NO16004 [1,0,0,0,0,0|2,0,1]=4 77 B8R1.2 ClCC1=NC=CC=C1 NO19289 [1,0,0,0,0,0|1,0,1]=3 78 B8R1.2 ClCC1=NC=CC=N1 NO20902 [1,0,0,0,0,0|2,0,1]=4 79 B8R1.2 ClSC1=CC=CC=C1 DY799077 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.2 ICC1=CC=CC=C1 NO11000 [1,0,0,0,0,0|2,0,1]=4 81 B8R1.2 N#CC1=NC=CC=C1 NO19642 [1,0,0,0,0,0|1,0,1]=3 82 B8R1.2 N#CC1=NC=CC=N1 NO17385 [1,0,0,0,0,0|2,0,1]=4 83 B8R1.2 N#CC1=NC=CN=C1 NO17380 [1,0,0,0,0,0|2,0,1]=4 84 B8R1.2 N#CC1=NC=NC=C1 NO12430 [1,0,0,0,0,0|2,0,1]=4 85 B8R1.2 N#Cc1ccccc1 NO13696 [1,0,0,0,0,0|2,0,1]=4 86 B8R1.2 NCC1=NC=CC=C1 DY663911 [1,0,0,0,0,0|1,0,1]=3 87 B8R1.2 NCC1=NC=CC=N1 NO21304 [1,0,0,0,0,0|2,0,1]=4 88 B8R1.2 NCC1=NC=CN=C1 DY710323 [1,0,0,0,0,0|2,0,1]=4 89 B8R1.2 NCC1=NC=CN=C1 NO19691 [1,0,0,0,0,0|2,0,1]=4 90 B8R1.2 NCC1=NC=CN=C1 NO20245 [1,0,0,0,0,0|2,0,1]=4 91 B8R1.2 NNC1=CC=CC=C1 NO15210 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.2 NNC1=NC=CC=C1 NO15589 [1,0,0,0,0,0|2,0,0]=3 93 B8R1.2 NNC1=NC=CC=C1 NO21573 [1,0,0,0,0,0|2,0,0]=3 94 B8R1.2 O=CC1=CC=NC=C1 DY458075 [1,0,0,0,0,0|2,0,0]=3 95 B8R1.2 O=CC1=CN=CC=C1 NO19090 [1,0,0,0,0,0|2,0,0]=3 96 B8R1.2 O=CC1=CN=CN=C1 NO19643 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.2 O=CC1=NC=CC=C1 NO18610 [1,0,0,0,0,0|0,0,0]=1 98 B8R1.2 O=CC1=NC=CN=C1 NO18375 [1,0,0,0,0,0|1,0,0]=2 99 B8R1.2 OCC1=CC=CN=N1 NO21870 [1,0,0,0,0,0|1,0,2]=4 100 B8R1.2 OCC1=NC=CC=C1 NO19164 [1,0,0,0,0,0|0,0,2]=3 101 B8R1.2 OCC1=NC=CC=N1 NO19924 [1,0,0,0,0,0|1,0,2]=4 102 B8R1.2 OCC1=NC=CN=C1 NO21749 [1,0,0,0,0,0|1,0,2]=4 103 B8R1.2 OCC1=NC=NC=C1 NO11915 [1,0,0,0,0,0|1,0,2]=4 104 B10R1.13 C=C(C)C1=CC=C(C)C=C1 DY790917 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 NO19447 [0,1,0,0,0,0|1,0,0]=2 106 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 NO17999 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.13 CC(=O)C1=CC=C(C)C=C1 NO13558 [0,1,0,0,0,0|1,0,0]=2 108 B10R1.13 CC(=O)C1=CC=C(C)N=N1 DY112296 [0,1,0,0,0,0|1,0,0]=2 109 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 NO19687 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.13 CC(=O)C1=CC=C(F)C=C1 NO14299 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.13 CC(=O)C1=CC=C(F)N=C1 NO16982 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.13 CC(=O)C1=CC=C(N)C=C1 DY20162 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.13 CC(=O)C1=CC=C(N)C=C1 DY795321 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.13 CC(=O)C1=CC=C(O)C=C1 NO22884 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.13 CC(=O)C1=CC=C(O)N=C1 NO12692 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.13 CC(=O)C1=CN=C(C)C=C1 DY428167 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.13 CC(=O)C1=CN=C(N)N=C1 NO17494 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 NO16977 [0,1,0,0,0,0|0,0,0]=1 119 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 NO17050 [0,1,0,0,0,0|1,0,0]=2 120 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 NO16979 [0,1,0,0,0,0|0,0,0]=1 121 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 NO14519 [0,1,0,0,0,0|1,0,0]=2 122 B10R1.13 CC(=O)c1ccc(I)cc1 DY433245 [0,1,0,0,0,0|1,0,0]=2 123 B10R1.13 CC(Br)C1=CC=C(F)C=C1 NO16140 [0,1,0,0,0,0|2,0,1]=4 124 B10R1.13 CC(C)C1=CC=C(Br)C=C1 NO19162 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.13 CC(C)C1=CC=C(Cl)N=N1 NO15951 [0,1,0,0,0,0|2,0,1]=4 126 B10R1.13 CC(C)C1=CC=C(F)C=C1 DY584364 [0,1,0,0,0,0|2,0,1]=4 127 B10R1.13 CC(C)C1=CC=C(N)C=C1 NO22915 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.13 CC(C)C1=CC=C(N)C=N1 NO22406 [0,1,0,0,0,0|1,0,1]=3 129 B10R1.13 CC(C)C1=CC=C(N)N=N1 DY736754 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.13 CC(C)C1=CC=C(O)C=C1 DY583593 [0,1,0,0,0,0|2,0,1]=4 131 B10R1.13 CC(C)C1=NC=C(N)C=N1 DY586310 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.13 CC(N)C1=CC=C(F)C=C1 DY40832 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.13 CC(N)C1=CC=C(N)C=C1 NO22422 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.13 CC(O)C1=CC=C(Br)C=C1 DY448036 [0,1,0,0,0,0|1,0,2]=4 135 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 DY549597 [0,1,0,0,0,0|1,0,2]=4 136 B10R1.13 CC(O)C1=NC=C(Br)C=C1 DY446891 [0,1,0,0,0,0|0,0,2]=3 137 B10R1.13 CC1=CC=C(C(=N)N)C=C1 NO20439 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.13 CC1=CC=C(C(=O)O)N=N1 DY565125 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.13 CC1=CC=C(C(N)=O)C=C1 NO11895 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 NO11896 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 DY545757 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 NO18822 [0,1,0,0,0,0|3,0,0]=4 143 B10R1.13 CC1=CN=C(C(=N)N)C=C1 DY711541 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.13 CC1=CN=C(C(=N)N)N=C1 DY104180 [0,1,0,0,0,0|3,0,0]=4 145 B10R1.13 CC1=CN=C(C(=O)O)C=C1 NO10458 [0,1,0,0,0,0|1,0,0]=2 146 B10R1.13 CC1=CN=C(C(=O)O)C=C1 NO17310 [0,1,0,0,0,0|1,0,0]=2 147 B10R1.13 CC1=CN=C(C(=O)O)C=N1 NO19370 [0,1,0,0,0,0|2,0,0]=3 148 B10R1.13 CC1=CN=C(C(=O)O)N=C1 NO21764 [0,1,0,0,0,0|2,0,0]=3 149 B10R1.13 CC1=CN=C(C(C)N)C=C1 DY577449 [0,1,0,0,0,0|1,0,1]=3 150 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 DY511971 [0,1,0,0,0,0|1,0,1]=3 151 B10R1.13 CC1=CN=C([N+](=O)[O-])C=C1 NO21713 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.13 CC1=NC=C(C(=O)O)C=C1 NO20324 [0,1,0,0,0,0|3,0,0]=4 153 B10R1.13 CC1=NC=C(C(N)=O)C=C1 NO18427 [0,1,0,0,0,0|3,0,0]=4 154 B10R1.13 CN(C)C1=CC=C(Br)C=C1 NO15132 [0,1,0,0,0,0|3,0,0]=4 155 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 DY20289 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.13 CN(C)C1=CC=C(Cl)N=N1 DY568605 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.13 CN(C)C1=CC=C(O)C=C1 NO16528 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.13 CN(C)C1=NC=C(I)C=C1 NO16969 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.13 CN(C)C1=NC=C(I)N=C1 DY710809 [0,1,0,0,0,0|3,0,0]=4 160 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 NO20256 [0,1,0,0,0,0|2,0,1]=4 161 B10R1.13 C[C@@H](N)C1=CC=C(N)C=C1 DY565797 [0,1,0,0,0,0|2,0,1]=4 162 B10R1.13 C[C@@H](N)C1=NC=C(Br)C=C1 DY621591 [0,1,0,0,0,0|1,0,1]=3 163 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 DY554067 [0,1,0,0,0,0|2,0,1]=4 164 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 DY541875 [0,1,0,0,0,0|2,0,1]=4 165 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 NO16980 [0,1,0,0,0,0|1,0,1]=3 166 B10R1.13 Cc1ccc(C(C)C)cc1 DY444976 [0,1,0,0,0,0|2,0,1]=4 167 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 DY21022 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 NO20283 [0,1,0,0,0,0|3,0,0]=4 169 B10R1.13 N=C(N)C1=CC=C(F)C=C1 NO18318 [0,1,0,0,0,0|3,0,0]=4 170 B10R1.13 N=C(N)C1=CC=C(N)C=C1 NO21974 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.13 N=C(N)C1=NC=C(F)C=C1 DY509402 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.13 N=C(N)C1=NC=C(F)C=C1 DY586633 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.13 N=C(N)C1=NC=C(N)C=C1 DY585873 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.13 NC(=O)C1=CC=C(F)C=C1 NO10426 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 DY41603 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.13 NC(=O)C1=NC=C(Br)C=N1 NO15436 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.13 NC(=O)C1=NC=C(Cl)C=N1 DY694890 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.13 NC(=O)C1=NC=C(Cl)N=C1 NO10571 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.13 NC(=O)C1=NC=C(F)C=C1 NO16336 [0,1,0,0,0,0|1,0,0]=2 180 B10R1.13 NC(=O)C1=NC=C(N)C=C1 NO10223 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.13 NC(=O)C1=NNC(=O)C=C1 DY562677 [0,1,0,0,0,0|2,0,0]=3 182 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 DY544419 [0,1,0,0,0,0|2,1,0]=4 183 B10R1.13 NC(=S)C1=CC=C(F)C=C1 DY584372 [0,1,0,0,0,0|2,1,0]=4 184 B10R1.13 NC(=S)C1=CC=C(O)C=C1 NO20343 [0,1,0,0,0,0|2,1,0]=4 185 B10R1.13 NC1=CC=C(C(F)F)N=C1 NO16709 [0,1,0,0,0,0|2,0,1]=4 186 B10R1.13 NC1=CC=C([N+](=O)[O-])N=C1 NO10210 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.13 NC1=CN=C(C(=O)O)C=C1 NO19367 [0,1,0,0,0,0|1,0,0]=2 188 B10R1.13 NC1=CN=C(C(=O)O)C=N1 NO14292 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.13 NC1=NC=C(C(=O)O)C=C1 NO19354 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 DY433701 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.13 O=C(Cl)C1=NC=C(Br)C=C1 DY454348 [0,1,0,0,0,0|1,0,0]=2 192 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 NO20082 [0,1,0,0,0,0|2,0,0]=3 193 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 NO15821 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.13 O=C(O)C1=CC=C(I)C=C1 NO20135 [0,1,0,0,0,0|2,0,0]=3 195 B10R1.13 O=C(O)C1=CC=C(O)C=C1 NO22885 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.13 O=C(O)C1=CC=C(O)N=N1 NO17550 [0,1,0,0,0,0|2,0,0]=3 197 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 NO22092 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 NO22101 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.13 O=C(O)C1=CN=C(F)C=C1 NO18891 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.13 O=C(O)C1=CN=C(O)C=C1 NO19189 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 NO22033 [0,1,0,0,0,0|1,0,0]=2 202 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 NO14223 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 NO12377 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 NO19376 [0,1,0,0,0,0|1,0,0]=2 205 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 NO14727 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 NO10354 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.13 O=C(O)C1=NC=C(F)C=C1 NO10387 [0,1,0,0,0,0|1,0,0]=2 208 B10R1.13 O=C(O)C1=NC=C(I)C=C1 NO10412 [0,1,0,0,0,0|1,0,0]=2 209 B10R1.13 O=C(O)C1=NC=C(O)C=C1 NO22997 [0,1,0,0,0,0|1,0,0]=2 210 B10R1.13 O=C(O)C1=NC=C(O)N=C1 DY550083 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 DY40351 [0,1,0,0,0,0|2,0,0]=3 212 B10R1.13 O=C1C=CC(C(=O)O)N=N1 NO17837 [0,1,0,0,0,0|2,0,1]=4 213 B10R1.13 O=C1C=NC(C(=O)[O-])=CN1 DY710329 [0,1,0,0,0,0|2,0,0]=3 214 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 NO18786 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 NO22843 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 NO19234 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=N1 NO19719 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)C=N1 DY576927 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.13 O=[N+]([O-])C1=NC=C(Br)C=C1 NO17285 [0,1,0,0,0,0|2,0,0]=3 220 B10R1.13 O=[N+]([O-])C1=NC=C(Cl)C=C1 NO17336 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.13 O=[N+]([O-])C1=NC=C(F)C=C1 NO20058 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.13 O=[PH](O)C1=CC=C(Br)C=C1 DY746683 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.15 C#CC(=O)C1=CC=CC=C1 DY551139 [0,1,0,0,0,0|1,0,1]=3 224 B10R1.15 C#CC(O)C1=NC=CC=C1 DY717033 [0,1,0,0,0,0|0,0,3]=4 225 B10R1.15 C=C(CBr)C1=CC=CC=C1 NO20091 [0,1,0,0,0,0|2,0,0]=3 226 B10R1.15 CC(CN)C1=CC=CC=C1 DY822021 [0,1,0,0,0,0|2,0,1]=4 227 B10R1.15 CCC(=O)C1=CC=NC=C1 DY584353 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.15 CCC(C)C1=CC=CC=C1 NO11947 [0,1,0,0,0,0|2,0,1]=4 229 B10R1.15 CCC(C)C1=NC=CN=C1 DY710905 [0,1,0,0,0,0|2,0,1]=4 230 B10R1.15 CCC(O)C1=CC=CC=C1 DY580677 [0,1,0,0,0,0|1,0,2]=4 231 B10R1.15 CCS(=O)C1=CC=CC=C1 DY746839 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.15 CC[C@H](N)C1=CC=CC=C1 DY20337 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.15 CN(C=O)C1=CC=CC=C1 NO11793 [0,1,0,0,0,0|2,0,0]=3 234 B10R1.15 CN(C=O)C1=NC=CC=C1 DY566547 [0,1,0,0,0,0|1,0,0]=2 235 B10R1.15 COC(=O)C1=CC=NC=C1 NO18945 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.15 COC(=O)C1=CN=CC=C1 NO19425 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.15 COC(=O)C1=CN=NC=C1 NO13474 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.15 COC(=O)C1=NC=CC=C1 NO19684 [0,1,0,0,0,0|0,0,0]=1 239 B10R1.15 COC(=O)C1=NC=CC=N1 NO19792 [0,1,0,0,0,0|1,0,0]=2 240 B10R1.15 COC(=O)C1=NC=NC=C1 DY444562 [0,1,0,0,0,0|1,0,0]=2 241 B10R1.15 COS(=O)C1=CC=CC=C1 DY566439 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 NO10909 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.15 C\C(=C/Br)C1=CC=NC=C1 DY111870 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.15 NC(CO)C1=CC=CC=C1 NO15860 [0,1,0,0,0,0|2,0,1]=4 245 B10R1.15 NC(CO)C1=NC=CC=C1 DY111155 [0,1,0,0,0,0|1,0,1]=3 246 B10R1.15 NC(CO)C1=NC=CC=C1 DY509906 [0,1,0,0,0,0|1,0,1]=3 247 B10R1.15 NCC(=O)C1=CC=CC=C1 NO10874 [0,1,0,0,0,0|1,0,0]=2 248 B10R1.15 NC[C@H](O)C1=CC=CC=C1 NO20485 [0,1,0,0,0,0|1,0,2]=4 249 B10R1.15 NNC(=O)C1=CC=CC=C1 NO10971 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.15 NNC(=O)C1=CN=CC=C1 NO19488 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.15 NNC(=O)C1=NC=CC=C1 DY524445 [0,1,0,0,0,0|1,0,0]=2 252 B10R1.15 NNC(=S)C1=CC=CC=C1 DY721675 [0,1,0,0,0,0|2,1,0]=4 253 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 NO10553 [0,1,0,0,0,0|2,0,1]=4 254 B10R1.15 N[C@H](CO)C1=CC=CC=C1 NO10555 [0,1,0,0,0,0|2,0,1]=4 255 B10R1.15 N[C@H](CO)C1=NC=CC=C1 DY624391 [0,1,0,0,0,0|1,0,1]=3 256 B10R1.15 N\C(=N/O)C1=NC=CN=C1 DY512415 [0,1,0,0,0,0|2,0,1]=4 257 B10R1.15 O=C(CBr)C1=CC=CC=C1 NO19274 [0,1,0,0,0,0|1,0,0]=2 258 B10R1.15 O=C(CBr)C1=CC=NC=C1 NO20175 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.15 O=C(CBr)C1=NC=CC=N1 DY115988 [0,1,0,0,0,0|1,0,0]=2 260 B10R1.15 O=C(CBr)C1=NC=NC=C1 DY574023 [0,1,0,0,0,0|1,0,0]=2 261 B10R1.15 O=C(CCl)C1=NC=CN=C1 DY579657 [0,1,0,0,0,0|1,0,0]=2 262 B10R1.15 O=NN(O)C1=CC=CC=C1 DY791781 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.15 O=NN([O-])c1ccccc1 DY822384 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.15 OC(CBr)C1=CC=CC=C1 NO18840 [0,1,0,0,0,0|1,0,2]=4 265 B10R1.15 OC[C@@H](O)c1ccccc1 DY459384 [0,1,0,0,0,0|1,0,2]=4 266 B10R1.15 O[C@@H](CBr)C1=CC=CC=C1 DY608146 [0,1,0,0,0,0|1,0,2]=4 267 B10R1.15 O\N=C(/Cl)C1=NC=CC=C1 NO14803 [0,1,0,0,0,0|1,0,1]=3 268 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 NO12052 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.28 C[Si](C)(C)C1=NC=NC=C1 DY737966 [0,1,0,0,0,0|2,1,0]=4 270 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 NO11135 [0,1,0,0,0,0|2,1,0]=4 271 B10R1.28 FC(F)(F)C1=NC=CC=C1 NO19017 [0,1,0,0,0,0|2,0,1]=4 272 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 NO10507 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.28 O=S(=O)(Cl)C1=NC=CC=C1 DY790371 [0,1,0,0,0,0|2,0,0]=3 274 B10R1.28 O=S(=O)(F)C1=CC=CC=C1 DY459528 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 NO19698 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 NO18866 [0,1,0,0,0,0|1,0,0]=2 277 B10R1.61 CC(=O)C1=C(C)C=CC=C1 NO19710 [0,1,0,0,0,0|1,0,0]=2 278 B10R1.61 CC(=O)C1=C(F)C=CC=C1 NO15490 [0,1,0,0,0,0|1,0,0]=2 279 B10R1.61 CC(=O)C1=C(N)C=CC=C1 NO19948 [0,1,0,0,0,0|1,0,0]=2 280 B10R1.61 CC(=O)C1=C(O)C=CC=C1 DY790197 [0,1,0,0,0,0|1,0,0]=2 281 B10R1.61 CC(=O)C1=C(O)C=CC=C1 NO15026 [0,1,0,0,0,0|1,0,0]=2 282 B10R1.61 CC(=O)C1=CC=CN=C1Br NO18506 [0,1,0,0,0,0|2,0,0]=3 283 B10R1.61 CC(=O)C1=CC=CN=C1C DY652208 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.61 CC(=O)C1=CC=CN=C1Cl NO18365 [0,1,0,0,0,0|2,0,0]=3 285 B10R1.61 CC(=O)C1=CN=CN=C1C NO17792 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.61 CC(=O)C1=NC=CC=C1Br NO16209 [0,1,0,0,0,0|0,0,0]=1 287 B10R1.61 CC(=O)C1=NC=CC=C1F NO16198 [0,1,0,0,0,0|0,0,0]=1 288 B10R1.61 CC(=O)C1=NC=CC=C1O NO14450 [0,1,0,0,0,0|0,0,0]=1 289 B10R1.61 CC(=O)C1=NC=CN=C1N NO15534 [0,1,0,0,0,0|1,0,0]=2 290 B10R1.61 CC(=O)C1=NC=NC=C1Br DY115898 [0,1,0,0,0,0|1,0,0]=2 291 B10R1.61 CC(=O)c1ccncc1N DY509612 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.61 CC(C)C1=C(Br)C=CC=C1 NO19988 [0,1,0,0,0,0|2,0,1]=4 293 B10R1.61 CC1=C(C(=O)O)C=CC=C1 NO19823 [0,1,0,0,0,0|2,0,0]=3 294 B10R1.61 CC1=C(C(=O)O)C=CC=N1 NO18975 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.61 CC1=C(C(=O)O)C=CN=C1 NO22360 [0,1,0,0,0,0|3,0,0]=4 296 B10R1.61 CC1=C(C(C)N)C=CC=C1 DY788943 [0,1,0,0,0,0|2,0,1]=4 297 B10R1.61 CC1=C(C(N)=O)C=CC=N1 NO22408 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.61 CC1=C(C(N)=S)C=CC=C1 DY559011 [0,1,0,0,0,0|2,1,0]=4 299 B10R1.61 CC1=C([C@H](C)O)C=CC=C1 DY822244 [0,1,0,0,0,0|1,0,2]=4 300 B10R1.61 CC1=CC=CN=C1C(=O)O NO19680 [0,1,0,0,0,0|1,0,0]=2 301 B10R1.61 CC1=CC=CN=C1C(C)N DY604773 [0,1,0,0,0,0|1,0,1]=3 302 B10R1.61 CC1=CC=CN=C1C(N)=O DY657435 [0,1,0,0,0,0|1,0,0]=2 303 B10R1.61 CC1=CC=NC=C1C(=O)O NO22976 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.61 CC1=CC=NC=C1C(=O)O NO22977 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.61 CC1=NC=CN=C1C(=O)O NO19744 [0,1,0,0,0,0|2,0,0]=3 306 B10R1.61 CC1=NC=CN=C1N(C)C DY710281 [0,1,0,0,0,0|3,0,0]=4 307 B10R1.61 CN(C)C1=C(Br)C=CC=C1 DY20183 [0,1,0,0,0,0|3,0,0]=4 308 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 DY20288 [0,1,0,0,0,0|3,0,0]=4 309 B10R1.61 CN(C)C1=C(F)C=CC=C1 DY20285 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.61 CN(C)C1=C(O)C=CC=C1 NO14782 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.61 CN(C)C1=CC=CC=C1N NO14204 [0,1,0,0,0,0|3,0,0]=4 312 B10R1.61 CN(C)C1=NC=CC=C1N DY606531 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.61 CN(C)C1=NC=CN=C1N NO21223 [0,1,0,0,0,0|3,0,0]=4 314 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 DY516003 [0,1,0,0,0,0|2,0,1]=4 315 B10R1.61 C[C@@H](N)C1=NC=CC=C1Br DY621531 [0,1,0,0,0,0|1,0,1]=3 316 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 NO13547 [0,1,0,0,0,0|1,0,2]=4 317 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 DY459372 [0,1,0,0,0,0|1,0,2]=4 318 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 NO20301 [0,1,0,0,0,0|2,0,1]=4 319 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 NO20318 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 NO15513 [0,1,0,0,0,0|1,0,2]=4 321 B10R1.61 C[C@H](O)C1=C(N)C=CC=C1 DY548415 [0,1,0,0,0,0|1,0,2]=4 322 B10R1.61 N=C(N)C1=C(F)C=CC=C1 DY455898 [0,1,0,0,0,0|3,0,0]=4 323 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 NO20174 [0,1,0,0,0,0|2,0,0]=3 324 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 NO12247 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.61 NC(=O)C1=C(Br)N=CC=C1 NO21404 [0,1,0,0,0,0|3,0,0]=4 326 B10R1.61 NC(=O)C1=C(N)C=NC=C1 NO22071 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.61 NC(=O)C1=C(N)N=CC=C1 NO22407 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.61 NC(=O)C1=C(O)C=CC=C1 NO11941 [0,1,0,0,0,0|2,0,0]=3 329 B10R1.61 NC(=O)C1=CC=CN=C1Cl NO19049 [0,1,0,0,0,0|3,0,0]=4 330 B10R1.61 NC(=O)C1=CN=CC=C1Cl NO22796 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.61 NC(=O)C1=NC=CC=C1N NO18340 [0,1,0,0,0,0|1,0,0]=2 332 B10R1.61 NC(=O)C1=NC=CN=C1Cl NO15991 [0,1,0,0,0,0|2,0,0]=3 333 B10R1.61 NC(=O)C1=NC=CN=C1N NO14571 [0,1,0,0,0,0|2,0,0]=3 334 B10R1.61 NC1=C(C(=O)O)C=CC=N1 NO21827 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.61 NC1=C(C(=O)O)C=CN=C1 NO21908 [0,1,0,0,0,0|3,0,0]=4 336 B10R1.61 NC1=CC=CN=C1C(=O)O NO17409 [0,1,0,0,0,0|1,0,0]=2 337 B10R1.61 NC1=CC=CN=C1C(=O)O NO19360 [0,1,0,0,0,0|1,0,0]=2 338 B10R1.61 NC1=CC=CN=C1[N+](=O)[O-] NO22747 [0,1,0,0,0,0|2,0,0]=3 339 B10R1.61 NC1=CC=NC=C1C(=O)O NO21982 [0,1,0,0,0,0|3,0,0]=4 340 B10R1.61 NC1=NC=CN=C1C(=O)O NO22108 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.61 NC1=NC=CN=C1[N+](=O)[O-] DY710125 [0,1,0,0,0,0|3,0,0]=4 342 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 NO19188 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.61 O=C(Cl)C1=CC=CN=C1Br DY452578 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 NO16216 [0,1,0,0,0,0|2,0,0]=3 345 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 NO22916 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 NO22912 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 NO16220 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 NO18848 [0,1,0,0,0,0|3,0,0]=4 349 B10R1.61 O=C(O)C1=C(F)C=CC=C1 NO10366 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.61 O=C(O)C1=C(F)C=CN=C1 DY20553 [0,1,0,0,0,0|3,0,0]=4 351 B10R1.61 O=C(O)C1=C(F)C=NC=C1 NO19033 [0,1,0,0,0,0|3,0,0]=4 352 B10R1.61 O=C(O)C1=C(F)N=CC=C1 NO18890 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.61 O=C(O)C1=C(I)C=CC=C1 NO20137 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.61 O=C(O)C1=C(O)C=NC=C1 NO22995 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.61 O=C(O)C1=C(S)C=CC=C1 DY40297 [0,1,0,0,0,0|2,0,0]=3 356 B10R1.61 O=C(O)C1=CC=CC=C1O DY576081 [0,1,0,0,0,0|2,0,0]=3 357 B10R1.61 O=C(O)C1=CC=CNC1=O NO19183 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.61 O=C(O)C1=CN=CC=C1Br DY10387 [0,1,0,0,0,0|3,0,0]=4 359 B10R1.61 O=C(O)C1=CN=CC=C1Br DY658256 [0,1,0,0,0,0|3,0,0]=4 360 B10R1.61 O=C(O)C1=CN=CC=C1Cl NO18850 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.61 O=C(O)C1=CN=CC=C1O NO15271 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.61 O=C(O)C1=COC=CC1=O DY741979 [0,1,0,0,0,0|3,0,0]=4 363 B10R1.61 O=C(O)C1=NC=CC=C1Br NO22914 [0,1,0,0,0,0|1,0,0]=2 364 B10R1.61 O=C(O)C1=NC=CC=C1Cl NO15072 [0,1,0,0,0,0|1,0,0]=2 365 B10R1.61 O=C(O)C1=NC=CC=C1F NO18754 [0,1,0,0,0,0|1,0,0]=2 366 B10R1.61 O=C(O)C1=NC=CC=C1I NO12162 [0,1,0,0,0,0|1,0,0]=2 367 B10R1.61 O=C(O)C1=NC=CC=C1O NO22996 [0,1,0,0,0,0|1,0,0]=2 368 B10R1.61 O=C(O)C1=NC=CN=C1Br NO12631 [0,1,0,0,0,0|2,0,0]=3 369 B10R1.61 O=C(O)C1=NC=CN=C1Cl NO17325 [0,1,0,0,0,0|2,0,0]=3 370 B10R1.61 O=C(O)C1=NC=CN=C1I NO14926 [0,1,0,0,0,0|2,0,0]=3 371 B10R1.61 O=C(O)C1=NC=CN=C1O NO17542 [0,1,0,0,0,0|2,0,0]=3 372 B10R1.61 O=C(O)C1=NC=NC=C1Br NO19718 [0,1,0,0,0,0|2,0,0]=3 373 B10R1.61 O=C([O-])C1=CC=CC=C1O DY560055 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.61 O=C([O-])C1=CC=CC=C1O DY822576 [0,1,0,0,0,0|2,0,0]=3 375 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 NO22913 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 NO21724 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Br NO14952 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.61 O=[N+]([O-])C1=NC=CC=C1F NO14954 [0,1,0,0,0,0|2,0,0]=3 379 B10R1.61 O=[N+]([O-])C1=NC=CC=C1O NO21934 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.61 O=[N+]([O-])c1ccccc1I DY41585 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.61 OB(O)C1=NC=CC=C1Cl DY822218 [0,1,0,0,0,0|2,0,1]=4 382 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 NO18865 [0,1,0,0,0,0|1,0,0]=2 383 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 NO18282 [0,1,0,0,0,0|2,0,0]=3 384 B10R1.113 CC(=O)C1=CC(C)=CN=C1 NO16656 [0,1,0,0,0,0|2,0,0]=3 385 B10R1.113 CC(=O)C1=CC(C)=NC=C1 NO18206 [0,1,0,0,0,0|2,0,0]=3 386 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 NO19798 [0,1,0,0,0,0|1,0,0]=2 387 B10R1.113 CC(=O)C1=CC(F)=CC=C1 NO19067 [0,1,0,0,0,0|1,0,0]=2 388 B10R1.113 CC(=O)C1=CC(N)=CC=C1 NO19441 [0,1,0,0,0,0|1,0,0]=2 389 B10R1.113 CC(=O)C1=CC(N)=NC=C1 DY554193 [0,1,0,0,0,0|2,0,0]=3 390 B10R1.113 CC(=O)C1=CC(O)=CC=C1 NO18681 [0,1,0,0,0,0|1,0,0]=2 391 B10R1.113 CC(=O)C1=CC=CC(C)=C1 NO19159 [0,1,0,0,0,0|1,0,0]=2 392 B10R1.113 CC(=O)C1=NC(C)=CC=C1 NO18426 [0,1,0,0,0,0|0,0,0]=1 393 B10R1.113 CC(=O)C1=NC(F)=CC=C1 DY556983 [0,1,0,0,0,0|0,0,0]=1 394 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 DY446933 [0,1,0,0,0,0|0,0,0]=1 395 B10R1.113 CC(=O)C1=NC=CC(C)=C1 DY460044 [0,1,0,0,0,0|0,0,0]=1 396 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 DY441210 [0,1,0,0,0,0|0,0,0]=1 397 B10R1.113 CC(C)C1=CC(N)=NC=N1 DY425906 [0,1,0,0,0,0|2,0,1]=4 398 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 DY454324 [0,1,0,0,0,0|1,0,1]=3 399 B10R1.113 CC(C)C1=NC=CC(Br)=C1 DY579081 [0,1,0,0,0,0|1,0,1]=3 400 B10R1.113 CC(N)C1=CC(Br)=CC=C1 DY447729 [0,1,0,0,0,0|2,0,1]=4 401 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 DY797607 [0,1,0,0,0,0|1,0,2]=4 402 B10R1.113 CC(O)C1=CC(N)=CC=C1 NO21787 [0,1,0,0,0,0|1,0,2]=4 403 B10R1.113 CC(O)C1=NC(Br)=CC=C1 NO14015 [0,1,0,0,0,0|0,0,2]=3 404 B10R1.113 CC1=CC(C(=O)O)=CN=C1 NO20319 [0,1,0,0,0,0|3,0,0]=4 405 B10R1.113 CC1=CC(C(=O)O)=NC=C1 NO22984 [0,1,0,0,0,0|1,0,0]=2 406 B10R1.113 CC1=CC(C(C)N)=NC=C1 DY561633 [0,1,0,0,0,0|1,0,1]=3 407 B10R1.113 CC1=CC(C(C)N)=NC=C1 DY605899 [0,1,0,0,0,0|1,0,1]=3 408 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 NO17345 [0,1,0,0,0,0|2,0,1]=4 409 B10R1.113 CC1=CC=CC(B(O)O)=N1 DY106708 [0,1,0,0,0,0|2,0,1]=4 410 B10R1.113 CC1=CC=CC(C(=N)N)=C1 NO20438 [0,1,0,0,0,0|3,0,0]=4 411 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 DY20748 [0,1,0,0,0,0|2,0,0]=3 412 B10R1.113 CC1=CC=CC(C(=O)O)=C1 NO19799 [0,1,0,0,0,0|2,0,0]=3 413 B10R1.113 CC1=CC=CC(C(=O)O)=N1 NO16317 [0,1,0,0,0,0|1,0,0]=2 414 B10R1.113 CC1=CC=CC(C(N)=O)=N1 DY661291 [0,1,0,0,0,0|1,0,0]=2 415 B10R1.113 CC1=CC=CC([C@@H](C)N)=N1 DY511947 [0,1,0,0,0,0|1,0,1]=3 416 B10R1.113 CC1=NC(C(=N)N)=NC=C1 DY444358 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.113 CC1=NC(C(=O)O)=CN=C1 DY10465 [0,1,0,0,0,0|2,0,0]=3 418 B10R1.113 CC1=NC(C(F)F)=CC=C1 DY503073 [0,1,0,0,0,0|2,0,1]=4 419 B10R1.113 CC1=NC=CC(C(=O)O)=C1 NO19546 [0,1,0,0,0,0|3,0,0]=4 420 B10R1.113 CC1=NC=CC(C(=O)O)=N1 NO19716 [0,1,0,0,0,0|2,0,0]=3 421 B10R1.113 CN(C)C1=CC(N)=CC=C1 DY550845 [0,1,0,0,0,0|3,0,0]=4 422 B10R1.113 CN(C)C1=CC(N)=CC=C1 DY584521 [0,1,0,0,0,0|3,0,0]=4 423 B10R1.113 CN(C)C1=NC=CC(Br)=C1 NO14905 [0,1,0,0,0,0|2,0,0]=3 424 B10R1.113 CN(C)C1=NC=NC(Cl)=C1 NO14205 [0,1,0,0,0,0|3,0,0]=4 425 B10R1.113 CN(C)C1=NC=NC(N)=C1 DY443403 [0,1,0,0,0,0|3,0,0]=4 426 B10R1.113 C[C@@H](N)C1=CC(F)=CC=C1 NO19312 [0,1,0,0,0,0|2,0,1]=4 427 B10R1.113 C[C@@H](N)C1=CC=CC(O)=C1 DY558015 [0,1,0,0,0,0|2,0,1]=4 428 B10R1.113 C[C@@H](N)C1=NC(F)=CC=C1 DY716816 [0,1,0,0,0,0|1,0,1]=3 429 B10R1.113 C[C@H](N)C1=CC(F)=CC=C1 NO19671 [0,1,0,0,0,0|2,0,1]=4 430 B10R1.113 FC(F)C1=NC=CC(Br)=C1 NO17095 [0,1,0,0,0,0|2,0,1]=4 431 B10R1.113 N=C(N)C1=CC(Cl)=CC=C1 DY746971 [0,1,0,0,0,0|3,0,0]=4 432 B10R1.113 N=C(N)C1=CC(F)=CC=C1 DY603586 [0,1,0,0,0,0|3,0,0]=4 433 B10R1.113 N=C(N)C1=NC(Cl)=CC=C1 DY712849 [0,1,0,0,0,0|2,0,0]=3 434 B10R1.113 N=C(N)C1=NC(N)=CC=C1 DY585876 [0,1,0,0,0,0|2,0,0]=3 435 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 NO22167 [0,1,0,0,0,0|2,0,0]=3 436 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 DY547053 [0,1,0,0,0,0|3,0,0]=4 437 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 NO17785 [0,1,0,0,0,0|3,0,0]=4 438 B10R1.113 NC(=O)C1=CC(N)=CN=C1 NO15231 [0,1,0,0,0,0|3,0,0]=4 439 B10R1.113 NC(=O)C1=CC(O)=CN=C1 DY501915 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 NO19001 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.113 NC(=O)C1=NC(Br)=CN=C1 DY511665 [0,1,0,0,0,0|2,0,0]=3 442 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 DY20489 [0,1,0,0,0,0|1,0,0]=2 443 B10R1.113 NC(=S)C1=NC(N)=CC=C1 DY660844 [0,1,0,0,0,0|1,1,0]=3 444 B10R1.113 NC1=CC(B(O)O)=NC=C1 DY651235 [0,1,0,0,0,0|2,0,1]=4 445 B10R1.113 NC1=CC(C(=O)O)=CN=C1 NO22022 [0,1,0,0,0,0|3,0,0]=4 446 B10R1.113 NC1=CC(C(=O)O)=NC=C1 NO15431 [0,1,0,0,0,0|1,0,0]=2 447 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 NO22379 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.113 NC1=CC=CC(C(=O)O)=C1 NO13396 [0,1,0,0,0,0|2,0,0]=3 449 B10R1.113 NC1=CC=CC(C(=O)O)=N1 NO19355 [0,1,0,0,0,0|1,0,0]=2 450 B10R1.113 NC1=CN=CC(C(=O)O)=N1 NO12628 [0,1,0,0,0,0|2,0,0]=3 451 B10R1.113 NC1=NC([N+](=O)[O-])=CC=C1 NO18013 [0,1,0,0,0,0|2,0,0]=3 452 B10R1.113 NC1=NC=CC(C(=O)O)=C1 DY603321 [0,1,0,0,0,0|3,0,0]=4 453 B10R1.113 NC1=NC=CC(C(=O)O)=C1 NO23021 [0,1,0,0,0,0|3,0,0]=4 454 B10R1.113 NC1=NC=CC(C(=O)O)=N1 DY10396 [0,1,0,0,0,0|2,0,0]=3 455 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 DY454240 [0,1,0,0,0,0|3,0,0]=4 456 B10R1.113 O=C(Cl)C1=NC(Cl)=NC=C1 DY525765 [0,1,0,0,0,0|2,0,0]=3 457 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 NO15122 [0,1,0,0,0,0|2,0,0]=3 458 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 DY20488 [0,1,0,0,0,0|3,0,0]=4 459 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 NO14882 [0,1,0,0,0,0|2,0,0]=3 460 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 NO18845 [0,1,0,0,0,0|3,0,0]=4 461 B10R1.113 O=C(O)C1=CC(F)=CC=C1 NO10368 [0,1,0,0,0,0|2,0,0]=3 462 B10R1.113 O=C(O)C1=CC(F)=NC=C1 NO18886 [0,1,0,0,0,0|3,0,0]=4 463 B10R1.113 O=C(O)C1=CC(I)=CC=C1 NO10375 [0,1,0,0,0,0|2,0,0]=3 464 B10R1.113 O=C(O)C1=CC(O)=CC=C1 NO19800 [0,1,0,0,0,0|2,0,0]=3 465 B10R1.113 O=C(O)C1=CC(S)=CC=C1 DY20304 [0,1,0,0,0,0|2,0,0]=3 466 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 NO22040 [0,1,0,0,0,0|3,0,0]=4 467 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 NO18852 [0,1,0,0,0,0|3,0,0]=4 468 B10R1.113 O=C(O)C1=CN=CC(F)=C1 NO22934 [0,1,0,0,0,0|3,0,0]=4 469 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 NO22087 [0,1,0,0,0,0|1,0,0]=2 470 B10R1.113 O=C(O)C1=NC(Br)=NC=C1 DY443368 [0,1,0,0,0,0|2,0,0]=3 471 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 NO21854 [0,1,0,0,0,0|1,0,0]=2 472 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 NO12423 [0,1,0,0,0,0|2,0,0]=3 473 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 NO17265 [0,1,0,0,0,0|2,0,0]=3 474 B10R1.113 O=C(O)C1=NC(F)=CC=C1 NO14295 [0,1,0,0,0,0|1,0,0]=2 475 B10R1.113 O=C(O)C1=NC(O)=CC=C1 NO22114 [0,1,0,0,0,0|1,0,0]=2 476 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 NO14963 [0,1,0,0,0,0|1,0,0]=2 477 B10R1.113 O=C(O)C1=NC=CC(F)=C1 NO17501 [0,1,0,0,0,0|1,0,0]=2 478 B10R1.113 O=C(O)C1=NC=CC(I)=C1 NO17506 [0,1,0,0,0,0|1,0,0]=2 479 B10R1.113 O=C(O)C1=NC=CC(O)=C1 NO22894 [0,1,0,0,0,0|1,0,0]=2 480 B10R1.113 O=C(O)C1=NC=NC(O)=C1 NO17537 [0,1,0,0,0,0|2,0,0]=3 481 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 DY430296 [0,1,0,0,0,0|1,0,0]=2 482 B10R1.113 O=C1C=COC(C(=O)O)=C1 DY556845 [0,1,0,0,0,0|2,0,0]=3 483 B10R1.113 O=C1C=NC=C(C(=O)O)N1 NO17150 [0,1,0,0,0,0|2,0,1]=4 484 B10R1.113 O=C1N=CC=C(C(=O)O)N1 NO12225 [0,1,0,0,0,0|2,0,1]=4 485 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 NO20650 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=N1 NO13936 [0,1,0,0,0,0|2,0,0]=3 487 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=C1 NO20664 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=N1 NO21489 [0,1,0,0,0,0|2,0,0]=3 489 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 NO20684 [0,1,0,0,0,0|3,0,0]=4 490 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 NO22383 [0,1,0,0,0,0|3,0,0]=4 491 B10R1.113 O=[N+]([O-])C1=NC=CC(O)=C1 NO21711 [0,1,0,0,0,0|2,0,0]=3 492 B10R2.6 C1=CC(N2CC2)=NC=N1 DY737558 [0,0,0,1,0,0|3,0,0]=4 493 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 DY20326 [0,0,0,1,0,0|1,0,2]=4 494 B10R2.320 BrC1CC2=CC=CC=C21 DY539943 [0,0,0,1,0,0|2,0,1]=4 495 B8R1.7 CC(=O)C1=CC=CO1 NO18634 [0,0,0,0,1,0|1,0,0]=2 496 B8R1.7 CC(=O)C1=CC=CS1 NO19387 [0,0,0,0,1,0|1,0,0]=2 497 B8R1.7 CC(=O)C1=CC=NO1 NO15344 [0,0,0,0,1,0|2,0,0]=3 498 B8R1.7 CC(=O)C1=CNC=N1 NO20378 [0,0,0,0,1,0|1,0,0]=2 499 B8R1.7 CC(=O)C1=CSC=N1 NO13244 [0,0,0,0,1,0|1,0,0]=2 500 B8R1.7 CC(=O)C1=NC=CO1 NO20443 [0,0,0,0,1,0|1,0,0]=2 501 B8R1.7 CC(=O)C1=NC=CS1 NO22755 [0,0,0,0,1,0|1,0,0]=2 502 B8R1.7 CC(=O)C1=NNC=C1 NO13441 [0,0,0,0,1,0|1,0,0]=2 503 B8R1.7 CC(=O)C1=NOC=C1 DY116141 [0,0,0,0,1,0|1,0,0]=2 504 B8R1.7 CC(C)C1=CNC=C1 DY447203 [0,0,0,0,1,0|2,0,1]=4 505 B8R1.7 CC(C)C1=NC=CN1 NO21624 [0,0,0,0,1,0|2,0,1]=4 506 B8R1.7 CC(N)C1=CC=CN1 DY717705 [0,0,0,0,1,0|1,0,2]=4 507 B8R1.7 CC(N)C1=CC=CS1 DY585951 [0,0,0,0,1,0|2,0,1]=4 508 B8R1.7 CC(N)C1=NC=CS1 DY446644 [0,0,0,0,1,0|2,0,1]=4 509 B8R1.7 CC(N)C1=NC=CS1 DY608600 [0,0,0,0,1,0|2,0,1]=4 510 B8R1.7 CC(O)C1=CNC=N1 DY563913 [0,0,0,0,1,0|1,0,2]=4 511 B8R1.7 CC(O)C1=CSC=C1 DY786664 [0,0,0,0,1,0|1,0,2]=4 512 B8R1.7 CC(O)[C-]1C=CC=C1 DY460596 [0,0,0,0,1,0|0,0,3]=4 513 B8R1.7 C[C@@H](O)C1=CC=CO1 DY621645 [0,0,0,0,1,0|1,0,2]=4 514 B8R1.7 C[C@@H](O)C1=CC=CS1 DY621687 [0,0,0,0,1,0|1,0,2]=4 515 B8R1.7 N=C(N)C1=CC=CO1 DY609169 [0,0,0,0,1,0|3,0,0]=4 516 B8R1.7 N=C(N)C1=NC=CS1 NO15638 [0,0,0,0,1,0|3,0,0]=4 517 B8R1.7 N=C(N)N1C=CC=N1 DY735319 [0,0,0,0,1,0|3,0,0]=4 518 B8R1.7 N=C(N)N1C=CC=N1 NO20721 [0,0,0,0,1,0|3,0,0]=4 519 B8R1.7 NC(=O)C1=CC=NO1 DY773817 [0,0,0,0,1,0|3,0,0]=4 520 B8R1.7 NC(=O)C1=CN=CS1 DY785098 [0,0,0,0,1,0|3,0,0]=4 521 B8R1.7 NC(=O)C1=NC=CN1 NO15603 [0,0,0,0,1,0|2,0,0]=3 522 B8R1.7 NC(=O)C1=NNC=C1 NO12173 [0,0,0,0,1,0|2,0,0]=3 523 B8R1.7 NC(=S)C1=NC=CS1 DY796833 [0,0,0,0,1,0|2,1,0]=4 524 B8R1.7 O=C(Cl)C1=CSC=C1 DY786748 [0,0,0,0,1,0|2,0,0]=3 525 B8R1.7 O=C(O)C1=CC=CN1 NO17766 [0,0,0,0,1,0|1,0,1]=3 526 B8R1.7 O=C(O)C1=CC=CO1 NO16202 [0,0,0,0,1,0|2,0,0]=3 527 B8R1.7 O=C(O)C1=CC=NO1 NO15566 [0,0,0,0,1,0|3,0,0]=4 528 B8R1.7 O=C(O)C1=CN=CS1 NO15551 [0,0,0,0,1,0|3,0,0]=4 529 B8R1.7 O=C(O)C1=CNC=C1 NO16294 [0,0,0,0,1,0|2,0,0]=3 530 B8R1.7 O=C(O)C1=CNC=N1 NO19657 [0,0,0,0,1,0|2,0,0]=3 531 B8R1.7 O=C(O)C1=CNN=C1 NO19027 [0,0,0,0,1,0|3,0,0]=4 532 B8R1.7 O=C(O)C1=CNN=N1 NO20475 [0,0,0,0,1,0|3,0,0]=4 533 B8R1.7 O=C(O)C1=COC=C1 NO14540 [0,0,0,0,1,0|2,0,0]=3 534 B8R1.7 O=C(O)C1=CSC=C1 NO22727 [0,0,0,0,1,0|2,0,0]=3 535 B8R1.7 O=C(O)C1=CSC=N1 NO10126 [0,0,0,0,1,0|2,0,0]=3 536 B8R1.7 O=C(O)C1=CSN=C1 NO22713 [0,0,0,0,1,0|3,0,0]=4 537 B8R1.7 O=C(O)C1=NC=CN1 NO19852 [0,0,0,0,1,0|2,0,0]=3 538 B8R1.7 O=C(O)C1=NC=CS1 DY425486 [0,0,0,0,1,0|2,0,0]=3 539 B8R1.7 O=C(O)C1=NN=CC1 DY585442 [0,0,0,0,1,0|2,0,1]=4 540 B8R1.7 O=C(O)C1=NNC=C1 NO18779 [0,0,0,0,1,0|2,0,0]=3 541 B8R1.7 O=C(O)C1=NOC=C1 NO18235 [0,0,0,0,1,0|2,0,0]=3 542 B8R1.7 O=C(O)C1=NON=C1 NO20479 [0,0,0,0,1,0|3,0,0]=4 543 B8R1.7 O=C(O)C1=NSC=C1 DY113170 [0,0,0,0,1,0|2,0,0]=3 544 B8R1.7 O=[N+]([O-])C1=CC=CN1 NO13256 [0,0,0,0,1,0|2,0,1]=4 545 B8R1.7 O=[N+]([O-])C1=CNC=C1 NO22386 [0,0,0,0,1,0|3,0,0]=4 546 B8R1.7 O=[N+]([O-])C1=NC=CN1 NO14315 [0,0,0,0,1,0|3,0,0]=4 547 B10R1.18 BrC(Br)=CC1=CC=CC=C1 NO16193 [0,0,0,0,0,1|3,0,0]=4 548 B10R1.18 CC(=O)CC1=CC=CN=C1 DY567891 [0,0,0,0,0,1|2,0,0]=3 549 B10R1.18 CC(=O)CC1=CC=NC=C1 NO20988 [0,0,0,0,0,1|2,0,0]=3 550 B10R1.18 CC(=O)CC1=NC=CC=C1 NO20802 [0,0,0,0,0,1|0,0,0]=1 551 B10R1.18 CC(C)NC1=CC=CC=C1 NO11787 [0,0,0,0,0,1|2,0,1]=4 552 B10R1.18 CC(C)NC1=NC=CC=N1 DY696047 [0,0,0,0,0,1|2,0,1]=4 553 B10R1.18 CC(N)CC1=NC=CC=C1 DY652737 [0,0,0,0,0,1|1,0,1]=3 554 B10R1.18 CC(O)CC1=NC=CN=C1 DY709807 [0,0,0,0,0,1|1,0,2]=4 555 B10R1.18 FC(F)OC1=NC=CC=C1 DY116213 [0,0,0,0,0,1|2,0,1]=4 556 B10R1.18 NC(=O)CC1=NC=CC=N1 NO17323 [0,0,0,0,0,1|2,0,0]=3 557 B10R1.18 NC(=O)NC1=CC=CC=C1 NO10533 [0,0,0,0,0,1|2,0,0]=3 558 B10R1.18 O=C(Cl)OC1=CC=CC=C1 NO18823 [0,0,0,0,0,1|2,0,0]=3 559 B10R1.18 O=C(O)CC1=CC=CN=C1 NO20325 [0,0,0,0,0,1|3,0,0]=4 560 B10R1.18 O=C(O)CC1=CC=NC=C1 NO20327 [0,0,0,0,0,1|3,0,0]=4 561 B10R1.18 O=C([O-])CC1=NC=CC=C1 DY716949 [0,0,0,0,0,1|1,0,0]=2 562 B10R1.18 O=C([O-])CC1=NC=CC=N1 DY564507 [0,0,0,0,0,1|2,0,0]=3 563 B10R1.18 O=S([O-])CC1=CC=CC=C1 DY745429 [0,0,0,0,0,1|3,0,0]=4 564 B10R1.18 O=[N+]([O-])SC1=CC=CC=C1 DY791007 [0,0,0,0,0,1|3,0,0]=4 565 B7R0.4 C\C=C\C=C\C(=O)[O-] NO11961 [1,0,1,0,0,0|1,0,1]=4 566 B7R1.3 BrC1=NC=CC=C1 NO17815 [2,0,0,0,0,0|1,0,0]=3 567 B7R1.3 BrC1=NC=CC=N1 NO13369 [2,0,0,0,0,0|2,0,0]=4 568 B7R1.3 BrC1=NC=CN=C1 NO15000 [2,0,0,0,0,0|2,0,0]=4 569 B7R1.3 CC1=CC=CN=N1 NO22374 [2,0,0,0,0,0|1,0,0]=3 570 B7R1.3 CC1=NC=NC=C1 NO19795 [2,0,0,0,0,0|1,0,0]=3 571 B7R1.3 C[N+]1=CC=CC=C1 NO17683 [2,0,0,0,0,0|2,0,0]=4 572 B7R1.3 ClC1=NC=CC=C1 DY20672 [2,0,0,0,0,0|1,0,0]=3 573 B7R1.3 ClC1=NC=CC=N1 DY10446 [2,0,0,0,0,0|2,0,0]=4 574 B7R1.3 ClC1=NC=CC=N1 DY693436 [2,0,0,0,0,0|2,0,0]=4 575 B7R1.3 ClC1=NC=CN=C1 NO15454 [2,0,0,0,0,0|2,0,0]=4 576 B7R1.3 FC1=CC=CC=C1 DY41489 [2,0,0,0,0,0|2,0,0]=4 577 B7R1.3 FC1=CC=CN=N1 DY736850 [2,0,0,0,0,0|2,0,0]=4 578 B7R1.3 FC1=NC=CC=C1 DY20005 [2,0,0,0,0,0|1,0,0]=3 579 B7R1.3 FC1=NC=CC=N1 DY429402 [2,0,0,0,0,0|2,0,0]=4 580 B7R1.3 IC1=CC=CC=C1 NO19958 [2,0,0,0,0,0|2,0,0]=4 581 B7R1.3 IC1=NC=CC=C1 NO14565 [2,0,0,0,0,0|1,0,0]=3 582 B7R1.3 IC1=NC=CC=N1 NO14968 [2,0,0,0,0,0|2,0,0]=4 583 B7R1.3 IC1=NC=CN=C1 DY425096 [2,0,0,0,0,0|2,0,0]=4 584 B7R1.3 NC1=CC=CN=N1 NO18539 [2,0,0,0,0,0|2,0,0]=4 585 B7R1.3 NC1=CC=CN=N1 NO19775 [2,0,0,0,0,0|2,0,0]=4 586 B7R1.3 NC1=NC=CC=N1 NO13370 [2,0,0,0,0,0|2,0,0]=4 587 B7R1.3 NC1=NC=CN=C1 NO16102 [2,0,0,0,0,0|2,0,0]=4 588 B7R1.3 NC1=NC=NC=C1 DY696160 [2,0,0,0,0,0|2,0,0]=4 589 B7R1.3 NC1=NC=NC=C1 NO19707 [2,0,0,0,0,0|2,0,0]=4 590 B7R1.3 O=C1C=CC=CN1 NO18724 [2,0,0,0,0,0|0,0,1]=3 591 B7R1.3 O=C1C=CC=NN1 NO19793 [2,0,0,0,0,0|1,0,1]=4 592 B7R1.3 O=C1C=CN=CN1 NO19105 [2,0,0,0,0,0|1,0,1]=4 593 B7R1.3 O=c1ccocc1 DY460890 [2,0,0,0,0,0|2,0,0]=4 594 B7R1.3 OC1=NC=CC=C1 NO21602 [2,0,0,0,0,0|0,0,1]=3 595 B7R1.3 OC1=NC=CC=N1 NO14246 [2,0,0,0,0,0|1,0,1]=4 596 B7R1.3 OC1=NC=CC=N1 NO16090 [2,0,0,0,0,0|1,0,1]=4 597 B7R1.3 OC1=NC=CN=C1 NO21601 [2,0,0,0,0,0|1,0,1]=4 598 B7R1.3 OC1=NC=NC=C1 DY737960 [2,0,0,0,0,0|1,0,1]=4 599 B7R1.3 OC1=NC=NC=C1 NO15728 [2,0,0,0,0,0|1,0,1]=4 600 B7R1.3 SC1=CC=CN=N1 DY546327 [2,0,0,0,0,0|1,1,0]=4 601 B7R1.3 [15NH2]C1=CC=CC=C1 DY454761 [2,0,0,0,0,0|2,0,0]=4 602 B7R1.3 [Hg+]C1=CC=CC=C1 DY822438 [2,0,0,0,0,0|2,0,0]=4 603 B9R0.2 C\C=C\C=C\C=C\C(=O)O DY512841 [0,1,1,0,0,0|2,0,0]=4 604 B9R1.1 C#CC1=NC=C(Br)C=C1 NO18607 [1,1,0,0,0,0|0,0,2]=4 605 B9R1.1 C#CC1=NC=C(F)C=C1 NO19540 [1,1,0,0,0,0|0,0,2]=4 606 B9R1.1 C=CC1=CC=C(Cl)N=N1 DY736538 [1,1,0,0,0,0|1,0,1]=4 607 B9R1.1 CC1=CN=C(C#N)C=C1 NO13787 [1,1,0,0,0,0|1,0,1]=4 608 B9R1.1 CC1=CN=C(C=O)C=C1 NO19088 [1,1,0,0,0,0|0,0,0]=2 609 B9R1.1 CC1=CN=C(C=O)C=N1 NO12781 [1,1,0,0,0,0|1,0,0]=3 610 B9R1.1 CC1=CN=C(CN)C=C1 DY711847 [1,1,0,0,0,0|1,0,1]=4 611 B9R1.1 CC1=CN=C(CN)C=C1 NO18319 [1,1,0,0,0,0|1,0,1]=4 612 B9R1.1 CC1=NC=C(C=O)C=C1 NO19116 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.1 CCC1=CC=C(Br)C=C1 NO10865 [1,1,0,0,0,0|1,0,1]=4 614 B9R1.1 CCC1=CC=C(Cl)C=C1 DY584444 [1,1,0,0,0,0|1,0,1]=4 615 B9R1.1 CCC1=CC=C(F)C=C1 DY20965 [1,1,0,0,0,0|1,0,1]=4 616 B9R1.1 CCC1=CC=C(I)C=C1 DY20189 [1,1,0,0,0,0|1,0,1]=4 617 B9R1.1 CCC1=CC=C(N)C=N1 DY515529 [1,1,0,0,0,0|0,0,1]=3 618 B9R1.1 CCC1=CC=C(O)C=C1 DY20188 [1,1,0,0,0,0|1,0,1]=4 619 B9R1.1 CCC1=NC=C(Br)C=C1 NO12376 [1,1,0,0,0,0|0,0,1]=3 620 B9R1.1 CCC1=NC=C(Br)C=N1 NO13125 [1,1,0,0,0,0|1,0,1]=4 621 B9R1.1 CCC1=NC=C(C)N=C1 DY710647 [1,1,0,0,0,0|1,0,1]=4 622 B9R1.1 CCC1=NC=C(I)C=N1 DY693478 [1,1,0,0,0,0|1,0,1]=4 623 B9R1.1 CNC1=CC=C(Cl)N=N1 NO10696 [1,1,0,0,0,0|2,0,0]=4 624 B9R1.1 CNC1=CC=C(I)C=C1 NO22906 [1,1,0,0,0,0|2,0,0]=4 625 B9R1.1 CNC1=NC=C(Br)C=C1 NO10304 [1,1,0,0,0,0|1,0,0]=3 626 B9R1.1 CNC1=NC=C(F)C=C1 DY711535 [1,1,0,0,0,0|1,0,0]=3 627 B9R1.1 COC1=CC=C(Br)N=N1 NO14617 [1,1,0,0,0,0|2,0,0]=4 628 B9R1.1 COC1=CC=C(Cl)N=N1 NO17689 [1,1,0,0,0,0|2,0,0]=4 629 B9R1.1 COC1=CC=C(N)C=C1 DY584663 [1,1,0,0,0,0|2,0,0]=4 630 B9R1.1 COC1=CC=C(N)C=C1 NO18580 [1,1,0,0,0,0|2,0,0]=4 631 B9R1.1 COC1=CC=C(N)C=N1 NO19527 [1,1,0,0,0,0|1,0,0]=3 632 B9R1.1 COC1=CC=C(N)N=N1 NO22091 [1,1,0,0,0,0|2,0,0]=4 633 B9R1.1 COC1=CC=C(O)C=C1 NO22939 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.1 COC1=CN=C(Br)C=N1 NO21377 [1,1,0,0,0,0|2,0,0]=4 635 B9R1.1 COC1=CN=C(Cl)C=N1 NO14927 [1,1,0,0,0,0|2,0,0]=4 636 B9R1.1 COC1=CN=C(N)C=N1 NO19706 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.1 COC1=NC=C(Br)C=C1 DY716534 [1,1,0,0,0,0|1,0,0]=3 638 B9R1.1 COC1=NC=C(Br)C=C1 NO22030 [1,1,0,0,0,0|1,0,0]=3 639 B9R1.1 COC1=NC=C(Br)C=N1 NO17652 [1,1,0,0,0,0|2,0,0]=4 640 B9R1.1 COC1=NC=C(C)C=C1 NO21644 [1,1,0,0,0,0|1,0,0]=3 641 B9R1.1 COC1=NC=C(Cl)C=C1 NO17976 [1,1,0,0,0,0|1,0,0]=3 642 B9R1.1 COC1=NC=C(Cl)C=N1 DY552357 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.1 COC1=NC=C(F)C=N1 DY694914 [1,1,0,0,0,0|2,0,0]=4 644 B9R1.1 COC1=NC=C(I)C=C1 NO21641 [1,1,0,0,0,0|1,0,0]=3 645 B9R1.1 COC1=NC=C(N)C=N1 NO21652 [1,1,0,0,0,0|2,0,0]=4 646 B9R1.1 CSC1=CC=C(I)C=C1 DY585121 [1,1,0,0,0,0|2,0,0]=4 647 B9R1.1 CSC1=CC=C(N)C=N1 DY547125 [1,1,0,0,0,0|1,0,0]=3 648 B9R1.1 CSC1=CC=C(O)C=C1 DY20743 [1,1,0,0,0,0|2,0,0]=4 649 B9R1.1 CSC1=CN=C(C)C=N1 DY710851 [1,1,0,0,0,0|2,0,0]=4 650 B9R1.1 CSC1=NC=C(Br)C=N1 NO18002 [1,1,0,0,0,0|2,0,0]=4 651 B9R1.1 CSC1=NC=C(Cl)C=C1 DY454120 [1,1,0,0,0,0|1,0,0]=3 652 B9R1.1 CSC1=NC=C(O)C=N1 NO12580 [1,1,0,0,0,0|2,0,0]=4 653 B9R1.1 ClC1=CN=C(CBr)C=C1 NO16112 [1,1,0,0,0,0|1,0,1]=4 654 B9R1.1 ClC1=CN=C(CBr)C=C1 NO17526 [1,1,0,0,0,0|1,0,1]=4 655 B9R1.1 ClCC1=NC=C(Cl)C=C1 DY446951 [1,1,0,0,0,0|1,0,1]=4 656 B9R1.1 N#CC1=CC=C(N)C=N1 NO19137 [1,1,0,0,0,0|1,0,1]=4 657 B9R1.1 N#CC1=NC=C(Br)C=C1 NO22025 [1,1,0,0,0,0|1,0,1]=4 658 B9R1.1 N#CC1=NC=C(Cl)C=C1 NO22045 [1,1,0,0,0,0|1,0,1]=4 659 B9R1.1 N#CC1=NC=C(F)C=C1 NO12291 [1,1,0,0,0,0|1,0,1]=4 660 B9R1.1 NC1=CC=C(C=O)C=C1 DY20423 [1,1,0,0,0,0|1,0,0]=3 661 B9R1.1 NCC1=CC=C(N)C=N1 NO10590 [1,1,0,0,0,0|1,0,1]=4 662 B9R1.1 NCC1=NC=C(F)C=C1 DY430169 [1,1,0,0,0,0|1,0,1]=4 663 B9R1.1 NCC1=NC=C(F)C=C1 NO16554 [1,1,0,0,0,0|1,0,1]=4 664 B9R1.1 NNC1=CC=C(N)C=N1 DY713641 [1,1,0,0,0,0|2,0,0]=4 665 B9R1.1 NNC1=NC=C(Br)C=C1 NO19995 [1,1,0,0,0,0|2,0,0]=4 666 B9R1.1 NNC1=NC=C(Cl)C=C1 NO20219 [1,1,0,0,0,0|2,0,0]=4 667 B9R1.1 NNC1=NC=C(F)C=C1 NO17301 [1,1,0,0,0,0|2,0,0]=4 668 B9R1.1 O=CC1=CC=C(Br)C=C1 NO18612 [1,1,0,0,0,0|1,0,0]=3 669 B9R1.1 O=CC1=CC=C(Cl)C=C1 NO14843 [1,1,0,0,0,0|1,0,0]=3 670 B9R1.1 O=CC1=CC=C(Cl)N=N1 DY444424 [1,1,0,0,0,0|1,0,0]=3 671 B9R1.1 O=CC1=CC=C(F)C=C1 NO19072 [1,1,0,0,0,0|1,0,0]=3 672 B9R1.1 O=CC1=CC=C(I)C=C1 NO20133 [1,1,0,0,0,0|1,0,0]=3 673 B9R1.1 O=CC1=CC=C(O)C=C1 NO18686 [1,1,0,0,0,0|1,0,0]=3 674 B9R1.1 O=CC1=CN=C(Br)C=C1 NO13736 [1,1,0,0,0,0|2,0,0]=4 675 B9R1.1 O=CC1=CN=C(Cl)C=C1 NO13978 [1,1,0,0,0,0|2,0,0]=4 676 B9R1.1 O=CC1=CN=C(F)C=C1 NO19261 [1,1,0,0,0,0|2,0,0]=4 677 B9R1.1 O=CC1=CN=C(O)C=C1 NO13494 [1,1,0,0,0,0|2,0,0]=4 678 B9R1.1 O=CC1=NC=C(Cl)C=C1 NO18956 [1,1,0,0,0,0|0,0,0]=2 679 B9R1.1 O=CC1=NC=C(F)C=C1 NO20057 [1,1,0,0,0,0|0,0,0]=2 680 B9R1.1 O=CC1=NC=C(I)C=C1 DY585661 [1,1,0,0,0,0|0,0,0]=2 681 B9R1.1 O=CC1=NC=C(O)C=C1 NO12167 [1,1,0,0,0,0|0,0,0]=2 682 B9R1.1 OCC1=NC=C(Br)C=C1 NO23005 [1,1,0,0,0,0|0,0,2]=4 683 B9R1.1 OCC1=NC=C(Cl)C=C1 NO21758 [1,1,0,0,0,0|0,0,2]=4 684 B9R1.1 OCC1=NC=C(F)C=C1 NO10382 [1,1,0,0,0,0|0,0,2]=4 685 B9R1.2 CC1=CC(C#N)=NC=C1 NO20235 [1,1,0,0,0,0|1,0,1]=4 686 B9R1.2 CC1=CC(C=O)=NC=C1 NO19123 [1,1,0,0,0,0|0,0,0]=2 687 B9R1.2 CC1=CC(CCl)=NC=C1 NO15442 [1,1,0,0,0,0|1,0,1]=4 688 B9R1.2 CC1=CC(CO)=NC=C1 NO11126 [1,1,0,0,0,0|0,0,2]=4 689 B9R1.2 CC1=CC(NN)=NC=C1 NO13399 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.2 CC1=CC=CC(C#N)=N1 NO15464 [1,1,0,0,0,0|1,0,1]=4 691 B9R1.2 CC1=CC=CC(C=O)=C1 DY41127 [1,1,0,0,0,0|1,0,0]=3 692 B9R1.2 CC1=CC=CC(CCl)=N1 DY547749 [1,1,0,0,0,0|1,0,1]=4 693 B9R1.2 CC1=CC=CC(CN)=N1 NO18414 [1,1,0,0,0,0|1,0,1]=4 694 B9R1.2 CC1=CC=CC(CO)=N1 DY20920 [1,1,0,0,0,0|0,0,2]=4 695 B9R1.2 CC1=NC=CC(C=O)=C1 NO15441 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.2 CC1=NC=CC(C=O)=N1 NO19715 [1,1,0,0,0,0|1,0,0]=3 697 B9R1.2 CCC1=CC=CC(Br)=N1 NO15322 [1,1,0,0,0,0|0,0,1]=3 698 B9R1.2 CCC1=CC=CC(Cl)=C1 DY584271 [1,1,0,0,0,0|1,0,1]=4 699 B9R1.2 CCC1=CN=CC(Cl)=N1 DY447143 [1,1,0,0,0,0|1,0,1]=4 700 B9R1.2 CCC1=NC=CC(Br)=C1 DY658183 [1,1,0,0,0,0|0,0,1]=3 701 B9R1.2 CNC1=CC(Br)=CC=C1 NO22185 [1,1,0,0,0,0|2,0,0]=4 702 B9R1.2 CNC1=CC(Cl)=CC=C1 DY20486 [1,1,0,0,0,0|2,0,0]=4 703 B9R1.2 CNC1=CC(I)=CC=C1 DY563655 [1,1,0,0,0,0|2,0,0]=4 704 B9R1.2 CNC1=CC(N)=CC=C1 NO16640 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.2 CNC1=CC=CC(O)=C1 DY442233 [1,1,0,0,0,0|2,0,0]=4 706 B9R1.2 CNC1=NC(Cl)=CN=C1 NO10695 [1,1,0,0,0,0|2,0,0]=4 707 B9R1.2 CNC1=NC=CC(Br)=N1 NO14470 [1,1,0,0,0,0|2,0,0]=4 708 B9R1.2 CNC1=NC=CC(F)=C1 DY714974 [1,1,0,0,0,0|1,0,0]=3 709 B9R1.2 CNC1=NC=CC(I)=C1 DY452194 [1,1,0,0,0,0|1,0,0]=3 710 B9R1.2 CNC1=NC=CC(N)=C1 NO16967 [1,1,0,0,0,0|1,0,0]=3 711 B9R1.2 CNC1=NC=NC(C)=C1 DY695897 [1,1,0,0,0,0|2,0,0]=4 712 B9R1.2 COC1=CC(Cl)=NC=N1 NO17690 [1,1,0,0,0,0|2,0,0]=4 713 B9R1.2 COC1=CC(I)=NC=N1 NO17505 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.2 COC1=CC(N)=NC=N1 NO18114 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.2 COC1=CC=CC(Br)=N1 NO14301 [1,1,0,0,0,0|1,0,0]=3 716 B9R1.2 COC1=CC=CC(Cl)=C1 NO19894 [1,1,0,0,0,0|2,0,0]=4 717 B9R1.2 COC1=CC=CC(Cl)=N1 NO13826 [1,1,0,0,0,0|1,0,0]=3 718 B9R1.2 COC1=CC=CC(F)=C1 NO19929 [1,1,0,0,0,0|2,0,0]=4 719 B9R1.2 COC1=CC=CC(F)=N1 NO13652 [1,1,0,0,0,0|1,0,0]=3 720 B9R1.2 COC1=CC=CC(I)=N1 NO18075 [1,1,0,0,0,0|1,0,0]=3 721 B9R1.2 COC1=CC=CC(N)=C1 NO19943 [1,1,0,0,0,0|2,0,0]=4 722 B9R1.2 COC1=CC=CC(N)=N1 NO13845 [1,1,0,0,0,0|1,0,0]=3 723 B9R1.2 COC1=CC=CC(O)=C1 NO18747 [1,1,0,0,0,0|2,0,0]=4 724 B9R1.2 COC1=CN=CC(Br)=N1 DY431625 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.2 COC1=CN=CC(Cl)=N1 NO21483 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.2 COC1=CN=CC(N)=N1 NO12541 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.2 COC1=NC(Br)=NC=C1 NO12506 [1,1,0,0,0,0|2,0,0]=4 728 B9R1.2 COC1=NC(C)=CC=C1 NO15396 [1,1,0,0,0,0|1,0,0]=3 729 B9R1.2 COC1=NC(C)=CN=C1 DY710569 [1,1,0,0,0,0|2,0,0]=4 730 B9R1.2 COC1=NC(C)=NC=C1 NO11919 [1,1,0,0,0,0|2,0,0]=4 731 B9R1.2 COC1=NC(Cl)=NC=C1 NO21447 [1,1,0,0,0,0|2,0,0]=4 732 B9R1.2 COC1=NC(I)=NC=C1 NO11917 [1,1,0,0,0,0|2,0,0]=4 733 B9R1.2 COC1=NC=CC(Br)=C1 NO22650 [1,1,0,0,0,0|1,0,0]=3 734 B9R1.2 COC1=NC=CC(C)=C1 NO21637 [1,1,0,0,0,0|1,0,0]=3 735 B9R1.2 COC1=NC=CC(Cl)=C1 NO19313 [1,1,0,0,0,0|1,0,0]=3 736 B9R1.2 COC1=NC=CC(F)=C1 NO11908 [1,1,0,0,0,0|1,0,0]=3 737 B9R1.2 COC1=NC=CC(I)=C1 NO19594 [1,1,0,0,0,0|1,0,0]=3 738 B9R1.2 COC1=NC=CC(N)=C1 NO19525 [1,1,0,0,0,0|1,0,0]=3 739 B9R1.2 COC1=NC=CC(N)=N1 NO10114 [1,1,0,0,0,0|2,0,0]=4 740 B9R1.2 CSC1=CC(Cl)=NC=N1 NO12488 [1,1,0,0,0,0|2,0,0]=4 741 B9R1.2 CSC1=CC(N)=CC=C1 DY20570 [1,1,0,0,0,0|2,0,0]=4 742 B9R1.2 CSC1=NC(Cl)=NC=C1 NO19934 [1,1,0,0,0,0|2,0,0]=4 743 B9R1.2 CSC1=NC=CC(=O)N1 NO22771 [1,1,0,0,0,0|2,0,0]=4 744 B9R1.2 CSC1=NC=CC(Br)=N1 DY425588 [1,1,0,0,0,0|2,0,0]=4 745 B9R1.2 CSC1=NC=CC(Cl)=C1 NO12493 [1,1,0,0,0,0|1,0,0]=3 746 B9R1.2 CSC1=NC=CC(Cl)=N1 NO18332 [1,1,0,0,0,0|2,0,0]=4 747 B9R1.2 CSC1=NC=CC(N)=N1 NO20913 [1,1,0,0,0,0|2,0,0]=4 748 B9R1.2 CSC1=NC=CC(O)=N1 NO12612 [1,1,0,0,0,0|2,0,0]=4 749 B9R1.2 FC1=CC=CC(CBr)=N1 DY500445 [1,1,0,0,0,0|1,0,1]=4 750 B9R1.2 N#CC1=NC(Cl)=CC=C1 NO14156 [1,1,0,0,0,0|1,0,1]=4 751 B9R1.2 N#CC1=NC(F)=CC=C1 NO21512 [1,1,0,0,0,0|1,0,1]=4 752 B9R1.2 N#CC1=NC=CC(Br)=C1 NO18399 [1,1,0,0,0,0|1,0,1]=4 753 B9R1.2 N#CC1=NC=CC(Cl)=C1 NO18109 [1,1,0,0,0,0|1,0,1]=4 754 B9R1.2 NC1=CC(C=O)=CN=C1 DY659426 [1,1,0,0,0,0|2,0,0]=4 755 B9R1.2 NC1=CC(CO)=NC=C1 DY33483 [1,1,0,0,0,0|0,0,2]=4 756 B9R1.2 NC1=CC=CC(CO)=N1 NO16612 [1,1,0,0,0,0|0,0,2]=4 757 B9R1.2 NC1=NC=CC(C=O)=C1 NO18505 [1,1,0,0,0,0|2,0,0]=4 758 B9R1.2 NCC1=NC(Br)=CC=C1 NO10635 [1,1,0,0,0,0|1,0,1]=4 759 B9R1.2 NCC1=NC(Cl)=CC=C1 DY527445 [1,1,0,0,0,0|1,0,1]=4 760 B9R1.2 NCC1=NC(F)=CC=C1 NO13193 [1,1,0,0,0,0|1,0,1]=4 761 B9R1.2 NCC1=NC=CC(Br)=C1 NO12824 [1,1,0,0,0,0|1,0,1]=4 762 B9R1.2 NCC1=NC=CC(Br)=C1 NO15559 [1,1,0,0,0,0|1,0,1]=4 763 B9R1.2 NNC1=CC=CC(Br)=N1 DY545589 [1,1,0,0,0,0|2,0,0]=4 764 B9R1.2 NNC1=CC=CC(Cl)=N1 NO21479 [1,1,0,0,0,0|2,0,0]=4 765 B9R1.2 O=CC1=CC(Br)=CC=C1 NO18958 [1,1,0,0,0,0|1,0,0]=3 766 B9R1.2 O=CC1=CC(Br)=NC=C1 NO18783 [1,1,0,0,0,0|2,0,0]=4 767 B9R1.2 O=CC1=CC(Cl)=CC=C1 DY20579 [1,1,0,0,0,0|1,0,0]=3 768 B9R1.2 O=CC1=CC(F)=CC=C1 NO22298 [1,1,0,0,0,0|1,0,0]=3 769 B9R1.2 O=CC1=CC(I)=CC=C1 NO20132 [1,1,0,0,0,0|1,0,0]=3 770 B9R1.2 O=CC1=CC(O)=CC=C1 DY20422 [1,1,0,0,0,0|1,0,0]=3 771 B9R1.2 O=CC1=CC=C[N+]([O-])=C1 NO17137 [1,1,0,0,0,0|2,0,0]=4 772 B9R1.2 O=CC1=CN=CC(Br)=C1 DY20791 [1,1,0,0,0,0|2,0,0]=4 773 B9R1.2 O=CC1=CN=CC(F)=C1 NO19040 [1,1,0,0,0,0|2,0,0]=4 774 B9R1.2 O=CC1=CN=CC(O)=C1 NO15599 [1,1,0,0,0,0|2,0,0]=4 775 B9R1.2 O=CC1=NC(=O)NC=C1 DY693592 [1,1,0,0,0,0|1,0,0]=3 776 B9R1.2 O=CC1=NC(Br)=CC=C1 NO22094 [1,1,0,0,0,0|0,0,0]=2 777 B9R1.2 O=CC1=NC(Cl)=CC=C1 NO19944 [1,1,0,0,0,0|0,0,0]=2 778 B9R1.2 O=CC1=NC(F)=CC=C1 NO13928 [1,1,0,0,0,0|0,0,0]=2 779 B9R1.2 O=CC1=NC=CC(Br)=C1 NO12092 [1,1,0,0,0,0|0,0,0]=2 780 B9R1.2 O=CC1=NC=CC(Cl)=C1 NO22794 [1,1,0,0,0,0|0,0,0]=2 781 B9R1.2 OCC1=NC(Br)=CC=C1 NO23004 [1,1,0,0,0,0|0,0,2]=4 782 B9R1.2 OCC1=NC(Cl)=CC=C1 NO10667 [1,1,0,0,0,0|0,0,2]=4 783 B9R1.2 OCC1=NC(Cl)=CC=C1 NO19907 [1,1,0,0,0,0|0,0,2]=4 784 B9R1.2 OCC1=NC=CC(Br)=C1 NO18696 [1,1,0,0,0,0|0,0,2]=4 785 B9R1.2 OCC1=NC=CC(Cl)=C1 DY20517 [1,1,0,0,0,0|0,0,2]=4 786 B9R1.2 OCC1=NC=CC(O)=C1 NO17612 [1,1,0,0,0,0|0,0,2]=4 787 B9R1.8 CCOC1=CC=CN=N1 DY736406 [1,1,0,0,0,0|1,0,1]=4 788 B9R1.8 CCOC1=NC=CN=C1 NO21524 [1,1,0,0,0,0|1,0,1]=4 789 B9R1.8 CNCC1=CC=CC=C1 DY10559 [1,1,0,0,0,0|1,0,1]=4 790 B9R1.8 CNCC1=CC=CC=C1 DY20323 [1,1,0,0,0,0|1,0,1]=4 791 B9R1.8 CNCC1=CC=CC=C1 DY21006 [1,1,0,0,0,0|1,0,1]=4 792 B9R1.8 CNCC1=NC=CC=C1 DY501242 [1,1,0,0,0,0|0,0,1]=3 793 B9R1.8 CNCC1=NC=CC=C1 DY663671 [1,1,0,0,0,0|0,0,1]=3 794 B9R1.8 COCC1=NC=CC=C1 NO20909 [1,1,0,0,0,0|0,0,1]=3 795 B9R1.8 CSCC1=NC=CN=C1 DY710935 [1,1,0,0,0,0|1,0,1]=4 796 B9R1.8 ClCCC1=NC=CN=C1 DY585865 [1,1,0,0,0,0|1,0,1]=4 797 B9R1.8 ClCSC1=CC=CC=C1 DY797799 [1,1,0,0,0,0|2,0,0]=4 798 B9R1.8 N#CCC1=NC=CC=C1 NO18926 [1,1,0,0,0,0|0,0,2]=4 799 B9R1.8 NCCC1=NC=CC=C1 NO14064 [1,1,0,0,0,0|0,0,1]=3 800 B9R1.8 NCCC1=NC=CC=N1 DY510693 [1,1,0,0,0,0|1,0,1]=4 801 B9R1.8 NNCC1=NC=CC=C1 DY578445 [1,1,0,0,0,0|1,0,1]=4 802 B9R1.15 C=CC1=C(Br)C=CC=C1 NO18853 [1,1,0,0,0,0|1,0,1]=4 803 B9R1.15 C=CC1=C(Cl)C=CC=C1 NO19873 [1,1,0,0,0,0|1,0,1]=4 804 B9R1.15 CC1=CC=CC=C1C=O NO19114 [1,1,0,0,0,0|1,0,0]=3 805 B9R1.15 CC1=CC=CN=C1C#N NO20234 [1,1,0,0,0,0|1,0,1]=4 806 B9R1.15 CC1=CC=CN=C1C=O NO14987 [1,1,0,0,0,0|0,0,0]=2 807 B9R1.15 CC1=CC=CN=C1CCl NO15725 [1,1,0,0,0,0|1,0,1]=4 808 B9R1.15 CC1=CC=CN=C1CO NO19225 [1,1,0,0,0,0|0,0,2]=4 809 B9R1.15 CCC1=C(Br)C=CC=C1 NO20980 [1,1,0,0,0,0|1,0,1]=4 810 B9R1.15 CCC1=C(C)C=CC=C1 NO21536 [1,1,0,0,0,0|1,0,1]=4 811 B9R1.15 CCC1=C(I)C=CC=C1 DY534201 [1,1,0,0,0,0|1,0,1]=4 812 B9R1.15 CCC1=NC=CN=C1Cl NO21430 [1,1,0,0,0,0|1,0,1]=4 813 B9R1.15 CCC1=NC=NC=C1F NO19573 [1,1,0,0,0,0|1,0,1]=4 814 B9R1.15 CNC1=C(Br)C=CC=C1 DY584260 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.15 CNC1=C(F)C=CC=C1 NO13895 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.15 CNC1=CC=CC=C1N NO22302 [1,1,0,0,0,0|2,0,0]=4 817 B9R1.15 CNC1=NC=CC=C1Br NO17281 [1,1,0,0,0,0|1,0,0]=3 818 B9R1.15 COC1=C(Br)C=CC=C1 NO19150 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.15 COC1=C(C)C=CC=C1 DY561483 [1,1,0,0,0,0|2,0,0]=4 820 B9R1.15 COC1=C(F)C=CC=C1 NO19904 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.15 COC1=C(N)C=CC=C1 NO11812 [1,1,0,0,0,0|2,0,0]=4 822 B9R1.15 COC1=NC=CC=C1Br DY715700 [1,1,0,0,0,0|1,0,0]=3 823 B9R1.15 COC1=NC=CC=C1Br NO19258 [1,1,0,0,0,0|1,0,0]=3 824 B9R1.15 COC1=NC=CC=C1Cl NO18705 [1,1,0,0,0,0|1,0,0]=3 825 B9R1.15 COC1=NC=CC=C1F NO19564 [1,1,0,0,0,0|1,0,0]=3 826 B9R1.15 COC1=NC=CC=C1I NO13512 [1,1,0,0,0,0|1,0,0]=3 827 B9R1.15 COC1=NC=CC=C1N NO19526 [1,1,0,0,0,0|1,0,0]=3 828 B9R1.15 COC1=NC=CN=C1Br NO12288 [1,1,0,0,0,0|2,0,0]=4 829 B9R1.15 COC1=NC=CN=C1Cl NO14291 [1,1,0,0,0,0|2,0,0]=4 830 B9R1.15 COC1=NC=CN=C1N DY441119 [1,1,0,0,0,0|2,0,0]=4 831 B9R1.15 ClC1=CC=CN=C1CBr DY116292 [1,1,0,0,0,0|1,0,1]=4 832 B9R1.15 ClCC1=NC=CC=C1Br DY656902 [1,1,0,0,0,0|1,0,1]=4 833 B9R1.15 N#CC1=NC=CC=C1Br NO14847 [1,1,0,0,0,0|1,0,1]=4 834 B9R1.15 N#CC1=NC=CC=C1Cl NO18276 [1,1,0,0,0,0|1,0,1]=4 835 B9R1.15 N#CC1=NC=CC=C1I NO12161 [1,1,0,0,0,0|1,0,1]=4 836 B9R1.15 N#CC1=NC=CC=C1O NO21861 [1,1,0,0,0,0|1,0,1]=4 837 B9R1.15 NC1=C(C=O)C=CC=C1 DY20756 [1,1,0,0,0,0|1,0,0]=3 838 B9R1.15 NC1=C(C=O)C=CC=N1 NO19340 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.15 NC1=C(C=O)C=CN=C1 NO14976 [1,1,0,0,0,0|2,0,0]=4 840 B9R1.15 NC1=CC=NC=C1C=O DY509936 [1,1,0,0,0,0|2,0,0]=4 841 B9R1.15 NC1=CC=NC=C1C=O NO19349 [1,1,0,0,0,0|2,0,0]=4 842 B9R1.15 NC1=NC=CN=C1C=O NO13122 [1,1,0,0,0,0|1,0,0]=3 843 B9R1.15 NCC1=NC=CC=C1Br DY713191 [1,1,0,0,0,0|1,0,1]=4 844 B9R1.15 NCC1=NC=CC=C1N DY654384 [1,1,0,0,0,0|1,0,1]=4 845 B9R1.15 NNC1=NC=CC=C1Cl NO20171 [1,1,0,0,0,0|2,0,0]=4 846 B9R1.15 O=CC1=C(Br)N=CC=C1 NO17915 [1,1,0,0,0,0|2,0,0]=4 847 B9R1.15 O=CC1=C(Cl)C=NC=C1 DY657198 [1,1,0,0,0,0|2,0,0]=4 848 B9R1.15 O=CC1=C(Cl)C=NC=C1 NO15780 [1,1,0,0,0,0|2,0,0]=4 849 B9R1.15 O=CC1=C(Cl)N=CC=C1 NO14208 [1,1,0,0,0,0|2,0,0]=4 850 B9R1.15 O=CC1=C(F)C=CC=C1 DY794301 [1,1,0,0,0,0|1,0,0]=3 851 B9R1.15 O=CC1=C(F)C=CC=C1 NO21560 [1,1,0,0,0,0|1,0,0]=3 852 B9R1.15 O=CC1=C(F)C=CN=C1 DY577299 [1,1,0,0,0,0|2,0,0]=4 853 B9R1.15 O=CC1=C(F)N=CC=C1 NO18263 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.15 O=CC1=C(I)C=CC=C1 NO20131 [1,1,0,0,0,0|1,0,0]=3 855 B9R1.15 O=CC1=C(O)C=CC=C1 DY41121 [1,1,0,0,0,0|1,0,0]=3 856 B9R1.15 O=CC1=C(O)C=NC=C1 NO13859 [1,1,0,0,0,0|2,0,0]=4 857 B9R1.15 O=CC1=C(O)N=CC=C1 NO19011 [1,1,0,0,0,0|2,0,0]=4 858 B9R1.15 O=CC1=CNC=CC1=O NO17898 [1,1,0,0,0,0|2,0,0]=4 859 B9R1.15 OCC1=NC=CC=C1Cl NO17318 [1,1,0,0,0,0|0,0,2]=4 860 B9R1.15 OCC1=NC=CC=C1O DY20200 [1,1,0,0,0,0|0,0,2]=4 861 B9R1.11 CNC(=O)N1C=CN=C1 DY568839 [0,1,0,0,1,0|2,0,0]=4 862 B9R1.11 COC(=O)C1=CC=CN1 NO17868 [0,1,0,0,1,0|0,0,1]=3 863 B9R1.11 COC(=O)C1=CC=CO1 NO11606 [0,1,0,0,1,0|1,0,0]=3 864 B9R1.11 COC(=O)C1=CNC=C1 NO20729 [0,1,0,0,1,0|1,0,0]=3 865 B9R1.11 COC(=O)C1=CNC=N1 NO18794 [0,1,0,0,1,0|1,0,0]=3 866 B9R1.11 COC(=O)C1=CNN=C1 DY425198 [0,1,0,0,1,0|2,0,0]=4 867 B9R1.11 COC(=O)C1=CNN=C1 DY649949 [0,1,0,0,1,0|2,0,0]=4 868 B9R1.11 COC(=O)C1=CNN=N1 NO13476 [0,1,0,0,1,0|2,0,0]=4 869 B9R1.11 COC(=O)C1=NC=CN1 NO15200 [0,1,0,0,1,0|1,0,0]=3 870 B9R1.11 COC(=O)C1=NNC=C1 NO11588 [0,1,0,0,1,0|1,0,0]=3 871 B9R1.11 COC(=O)C1=NNC=N1 NO16131 [0,1,0,0,1,0|2,0,0]=4 872 B9R1.11 COC(=O)C1=NNN=C1 NO17729 [0,1,0,0,1,0|2,0,0]=4 873 B9R1.11 NCC(=O)C1=CC=CO1 DY447227 [0,1,0,0,1,0|1,0,0]=3 874 B9R1.11 NNC(=O)C1=COC=N1 DY773157 [0,1,0,0,1,0|2,0,0]=4 875 B9R1.11 O=C(CBr)C1=CC=CN1 DY718347 [0,1,0,0,1,0|0,0,1]=3 876 B9R1.11 O=C(CBr)C1=CSC=N1 DY785116 [0,1,0,0,1,0|1,0,0]=3 877 B9R1.11 O=C(CBr)C1=NC=CS1 NO21325 [0,1,0,0,1,0|1,0,0]=3 878 B9R1.11 O=CC(=O)C1=CC=CO1 DY759530 [0,1,0,0,1,0|1,0,1]=4 879 B9R1.11 O=CC(=O)C1=CC=CS1 DY447491 [0,1,0,0,1,0|1,0,1]=4 880 B9R1.35 CC(=O)C1=CC(Br)=CS1 NO20414 [0,1,0,0,1,0|1,0,0]=3 881 B9R1.35 CC(=O)C1=CC(C)=NS1 DY106270 [0,1,0,0,1,0|2,0,0]=4 882 B9R1.35 CC(=O)C1=CC(Cl)=CS1 NO21207 [0,1,0,0,1,0|1,0,0]=3 883 B9R1.35 CC(=O)C1=CC=C(Br)O1 NO20429 [0,1,0,0,1,0|1,0,0]=3 884 B9R1.35 CC(=O)C1=CC=C(C)S1 NO20396 [0,1,0,0,1,0|1,0,0]=3 885 B9R1.35 CC(=O)C1=CC=C(Cl)S1 NO21209 [0,1,0,0,1,0|1,0,0]=3 886 B9R1.35 CC(=O)C1=CN(C)N=C1 DY551973 [0,1,0,0,1,0|2,0,0]=4 887 B9R1.35 CC(=O)C1=CN=C(Br)S1 NO17877 [0,1,0,0,1,0|2,0,0]=4 888 B9R1.35 CC(=O)C1=CN=C(N)S1 DY558789 [0,1,0,0,1,0|2,0,0]=4 889 B9R1.35 CC(=O)C1=CSC(C)=N1 DY542865 [0,1,0,0,1,0|1,0,0]=3 890 B9R1.35 CC(=O)C1=CSC(N)=N1 NO20386 [0,1,0,0,1,0|1,0,0]=3 891 B9R1.35 CC(=O)C1=NC(C)=CO1 NO16603 [0,1,0,0,1,0|1,0,0]=3 892 B9R1.35 CC(=O)C1=NC=C(Cl)S1 DY571377 [0,1,0,0,1,0|1,0,0]=3 893 B9R1.35 CC(=O)C1=NOC(C)=C1 NO20434 [0,1,0,0,1,0|1,0,0]=3 894 B9R1.35 CC1=CC(C(=O)O)=CN1 NO15830 [0,1,0,0,1,0|2,0,0]=4 895 B9R1.35 CC1=CC(C(=O)O)=NN1 NO10435 [0,1,0,0,1,0|2,0,0]=4 896 B9R1.35 CC1=CC(C(N)=O)=NO1 NO10575 [0,1,0,0,1,0|2,0,0]=4 897 B9R1.35 CC1=CC=C(C(=O)O)O1 NO19440 [0,1,0,0,1,0|2,0,0]=4 898 B9R1.35 CC1=CC=C(C(=O)O)S1 NO23027 [0,1,0,0,1,0|2,0,0]=4 899 B9R1.35 CC1=COC(C(=O)O)=C1 DY104342 [0,1,0,0,1,0|2,0,0]=4 900 B9R1.35 CN1C=CC(C(=O)O)=N1 NO18190 [0,1,0,0,1,0|2,0,0]=4 901 B9R1.35 CN1C=NC(C(=O)O)=C1 NO20746 [0,1,0,0,1,0|2,0,0]=4 902 B9R1.35 CN1C=NC(C(N)=O)=C1 NO12656 [0,1,0,0,1,0|2,0,0]=4 903 B9R1.35 NC(=O)C1=CSC(N)=N1 NO19529 [0,1,0,0,1,0|2,0,0]=4 904 B9R1.35 NC(=O)C1=NC(Br)=CN1 DY725245 [0,1,0,0,1,0|2,0,0]=4 905 B9R1.35 NC1=NC(C(=O)O)=CN1 NO12779 [0,1,0,0,1,0|2,0,0]=4 906 B9R1.35 O=C(O)C1=CC(Br)=CN1 NO22700 [0,1,0,0,1,0|1,0,1]=4 907 B9R1.35 O=C(O)C1=CC(Br)=CO1 NO10558 [0,1,0,0,1,0|2,0,0]=4 908 B9R1.35 O=C(O)C1=CC(Br)=CS1 NO22681 [0,1,0,0,1,0|2,0,0]=4 909 B9R1.35 O=C(O)C1=CC=C(Br)N1 NO16375 [0,1,0,0,1,0|1,0,1]=4 910 B9R1.35 O=C(O)C1=CC=C(Br)O1 NO22685 [0,1,0,0,1,0|2,0,0]=4 911 B9R1.35 O=C(O)C1=CC=C(Br)S1 NO17287 [0,1,0,0,1,0|2,0,0]=4 912 B9R1.35 O=C(O)C1=CC=C(Cl)O1 NO10327 [0,1,0,0,1,0|2,0,0]=4 913 B9R1.35 O=C(O)C1=CC=C(Cl)S1 NO17350 [0,1,0,0,1,0|2,0,0]=4 914 B9R1.35 O=C(O)C1=CC=C(F)S1 DY456724 [0,1,0,0,1,0|2,0,0]=4 915 B9R1.35 O=C(O)C1=COC(Br)=N1 NO15537 [0,1,0,0,1,0|2,0,0]=4 916 B9R1.35 O=C(O)C1=CSC(Br)=C1 DY441053 [0,1,0,0,1,0|2,0,0]=4 917 B9R1.35 O=C(O)C1=CSC(Br)=N1 NO15291 [0,1,0,0,1,0|2,0,0]=4 918 B9R1.35 O=C(O)C1=CSC(Cl)=C1 NO10357 [0,1,0,0,1,0|2,0,0]=4 919 B9R1.35 O=C(O)C1=CSC(Cl)=N1 NO21424 [0,1,0,0,1,0|2,0,0]=4 920 B9R1.35 O=C(O)C1=NC=C(Br)S1 DY428239 [0,1,0,0,1,0|2,0,0]=4 921 B9R1.35 O=C(O)C1=NNC(Cl)=C1 NO10316 [0,1,0,0,1,0|2,0,0]=4 922 B9R1.35 O=C(O)C1=NSC(Br)=C1 DY459822 [0,1,0,0,1,0|2,0,0]=4 923 B9R1.35 O=C(O)c1cc(F)cs1 DY430853 [0,1,0,0,1,0|2,0,0]=4 924 B9R1.41 CC(=O)C1=CSC=C1Cl DY579531 [0,1,0,0,1,0|1,0,0]=3 925 B9R1.41 CC(=O)C1=NC=CN1C DY575049 [0,1,0,0,1,0|1,0,0]=3 926 B9R1.41 CC1=C(C(=O)O)C=CO1 NO21668 [0,1,0,0,1,0|2,0,0]=4 927 B9R1.41 CC1=C(C(=O)O)C=CS1 NO21702 [0,1,0,0,1,0|2,0,0]=4 928 B9R1.41 CC1=C(C(=O)O)N=CO1 NO10431 [0,1,0,0,1,0|2,0,0]=4 929 B9R1.41 CC1=C(C(=O)O)N=CS1 NO17596 [0,1,0,0,1,0|2,0,0]=4 930 B9R1.41 CC1=C(C(=O)O)NC=C1 DY106666 [0,1,0,0,1,0|1,0,1]=4 931 B9R1.41 CC1=C(C(=O)O)SC=C1 NO23026 [0,1,0,0,1,0|2,0,0]=4 932 B9R1.41 CC1=C(C(N)=O)C=CS1 DY535449 [0,1,0,0,1,0|2,0,0]=4 933 B9R1.41 CC1=CNC=C1C(=O)O DY718335 [0,1,0,0,1,0|2,0,0]=4 934 B9R1.41 CC1=CSC=C1C(=O)O NO14827 [0,1,0,0,1,0|2,0,0]=4 935 B9R1.41 CN1C=CN=C1C(=O)O NO20745 [0,1,0,0,1,0|2,0,0]=4 936 B9R1.41 NC(=O)C1=C(N)C=CS1 DY525033 [0,1,0,0,1,0|2,0,0]=4 937 B9R1.41 NC(=O)C1=C(N)NC=N1 NO21952 [0,1,0,0,1,0|2,0,0]=4 938 B9R1.41 NC(=O)C1=C(N)NC=N1 NO21953 [0,1,0,0,1,0|2,0,0]=4 939 B9R1.41 NC(=O)C1=C(N)SC=C1 NO21314 [0,1,0,0,1,0|2,0,0]=4 940 B9R1.41 NC(=O)C1=C(N)SC=N1 DY21008 [0,1,0,0,1,0|2,0,0]=4 941 B9R1.41 NC(=O)C1=CC=CN1N NO20727 [0,1,0,0,1,0|1,0,1]=4 942 B9R1.41 NC(=O)C1=NNC=C1Br NO14484 [0,1,0,0,1,0|2,0,0]=4 943 B9R1.41 NC1=C(C(=O)O)C=CO1 DY460308 [0,1,0,0,1,0|2,0,0]=4 944 B9R1.41 NC1=C(C(=O)O)SC=C1 DY787204 [0,1,0,0,1,0|2,0,0]=4 945 B9R1.41 NC1=CNN=C1C(=O)O NO15323 [0,1,0,0,1,0|2,0,0]=4 946 B9R1.41 O=C(O)C1=C(Br)C=CS1 NO17286 [0,1,0,0,1,0|2,0,0]=4 947 B9R1.41 O=C(O)C1=C(Br)SC=C1 NO21343 [0,1,0,0,1,0|2,0,0]=4 948 B9R1.41 O=C(O)C1=C(Br)SC=N1 DY456162 [0,1,0,0,1,0|2,0,0]=4 949 B9R1.41 O=C(O)C1=C(Cl)SC=C1 NO12218 [0,1,0,0,1,0|2,0,0]=4 950 B9R1.41 O=C(O)C1=C(F)C=CS1 NO21775 [0,1,0,0,1,0|2,0,0]=4 951 B9R1.41 O=C(O)C1=CSC=C1Br DY442191 [0,1,0,0,1,0|2,0,0]=4 952 B9R1.41 O=C(O)C1=NNC=C1Br NO22625 [0,1,0,0,1,0|2,0,0]=4 953 B9R1.41 O=C(O)C1=NNC=C1Cl NO15482 [0,1,0,0,1,0|2,0,0]=4 954 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 DY10315 [0,1,0,0,0,1|1,0,0]=3 955 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 NO22844 [0,1,0,0,0,1|1,0,0]=3 956 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 NO19283 [0,1,0,0,0,1|0,0,0]=2 957 B11R1.20 CC(=O)NC1=NC=C(Cl)C=N1 DY695981 [0,1,0,0,0,1|1,0,0]=3 958 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 DY20138 [0,1,0,0,0,1|1,0,0]=3 959 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 DY797913 [0,1,0,0,0,1|2,0,0]=4 960 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 NO21084 [0,1,0,0,0,1|2,0,0]=4 961 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 NO14692 [0,1,0,0,0,1|1,0,0]=3 962 B11R1.20 CC1=CN=C(NC(C)C)C=C1 DY663641 [0,1,0,0,0,1|1,0,1]=4 963 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 NO21002 [0,1,0,0,0,1|2,0,0]=4 964 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 NO20812 [0,1,0,0,0,1|2,0,0]=4 965 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 NO10817 [0,1,0,0,0,1|2,0,0]=4 966 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 NO20852 [0,1,0,0,0,1|2,0,0]=4 967 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 NO13319 [0,1,0,0,0,1|1,0,0]=3 968 B11R1.20 O=C(O)CC1=NC=C(Br)C=N1 NO12143 [0,1,0,0,0,1|2,0,0]=4 969 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 NO14073 [0,1,0,0,0,1|1,0,0]=3 970 B11R1.20 O=C(O)CC1=NC=C(Cl)C=N1 DY581931 [0,1,0,0,0,1|2,0,0]=4 971 B11R1.20 O=C(O)CC1=NC=C(F)C=N1 NO14652 [0,1,0,0,0,1|2,0,0]=4 972 B11R1.20 O=C(O)CC1=NC=C(O)C=C1 DY512037 [0,1,0,0,0,1|1,0,0]=3 973 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 NO19083 [0,1,0,0,0,1|2,0,0]=4 974 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 DY713899 [0,1,0,0,0,1|0,0,0]=2 975 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 NO14544 [0,1,0,0,0,1|2,0,0]=4 976 B11R1.36 CC(C)C(=O)C1=NC=CC=C1 DY662080 [0,1,0,0,0,1|1,0,1]=4 977 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 NO10890 [0,1,0,0,0,1|2,0,0]=4 978 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 NO15488 [0,1,0,0,0,1|2,0,0]=4 979 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 NO14083 [0,1,0,0,0,1|2,0,0]=4 980 B11R1.36 N[C@@H](C(=O)Cl)C1=CC=CC=C1 NO15858 [0,1,0,0,0,1|2,0,0]=4 981 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 NO11192 [0,1,0,0,0,1|2,0,0]=4 982 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 NO15279 [0,1,0,0,0,1|2,0,0]=4 983 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 NO10862 [0,1,0,0,0,1|2,0,0]=4 984 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 NO10861 [0,1,0,0,0,1|2,0,0]=4 985 B11R1.40 C=CC(=O)NC1=NC=CC=N1 DY695993 [0,1,0,0,0,1|1,0,1]=4 986 B11R1.40 CCC(=O)OC1=CC=CC=C1 DY584283 [0,1,0,0,0,1|1,0,0]=3 987 B11R1.40 CNC(=O)OC1=CC=CC=C1 DY584385 [0,1,0,0,0,1|1,0,0]=3 988 B11R1.40 CNC(=S)NC1=CC=CC=C1 DY793797 [0,1,0,0,0,1|1,1,0]=4 989 B11R1.40 COC(=O)CC1=NC=CN=C1 DY551613 [0,1,0,0,0,1|1,0,0]=3 990 B11R1.40 O=C(CCl)NC1=NC=CC=N1 DY558507 [0,1,0,0,0,1|1,0,0]=3 991 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 DY10294 [0,1,0,0,0,1|1,0,0]=3 992 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 DY10318 [0,1,0,0,0,1|1,0,0]=3 993 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 DY427446 [0,1,0,0,0,1|1,0,0]=3 994 B11R1.86 CC(=O)NC1=C(C)C=CC=C1 DY744961 [0,1,0,0,0,1|1,0,0]=3 995 B11R1.86 CC(=O)NC1=C(I)C=NC=C1 DY539913 [0,1,0,0,0,1|2,0,0]=4 996 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 NO21203 [0,1,0,0,0,1|1,0,0]=3 997 B11R1.86 CC(=O)NC1=CC=CN=C1Cl DY614543 [0,1,0,0,0,1|2,0,0]=4 998 B11R1.86 CC(=S)OC1=C(Cl)C=CC=C1 DY534765 [0,1,0,0,0,1|1,1,0]=4 999 B11R1.86 CC(C)OC1=NC=CC=C1I DY657345 [0,1,0,0,0,1|1,0,1]=4 1000 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 NO21083 [0,1,0,0,0,1|2,0,0]=4 1001 B11R1.86 NC(=O)NC1=C(Br)C=CC=C1 DY789621 [0,1,0,0,0,1|2,0,0]=4 1002 B11R1.86 NC1=C(CC(=O)O)C=CC=C1 NO20995 [0,1,0,0,0,1|2,0,0]=4 1003 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 NO20809 [0,1,0,0,0,1|2,0,0]=4 1004 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 NO20826 [0,1,0,0,0,1|2,0,0]=4 1005 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 NO20849 [0,1,0,0,0,1|2,0,0]=4 1006 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 NO20941 [0,1,0,0,0,1|2,0,0]=4 1007 B11R1.86 O=C(O)CC1=NC=CC=C1Br DY567855 [0,1,0,0,0,1|1,0,0]=3 1008 B11R1.86 O=C(O)CC1=NC=CC=C1Cl NO19561 [0,1,0,0,0,1|1,0,0]=3 1009 B11R1.86 O=C(O)CC1=NC=CC=C1F DY431700 [0,1,0,0,0,1|1,0,0]=3 1010 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 NO22187 [0,1,0,0,0,1|1,0,0]=3 1011 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 NO11707 [0,1,0,0,0,1|2,0,0]=4 1012 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 NO22093 [0,1,0,0,0,1|1,0,0]=3 1013 B11R1.157 CC(=O)NC1=CC(N)=CN=C1 DY663334 [0,1,0,0,0,1|2,0,0]=4 1014 B11R1.157 CC(=O)NC1=NC(=O)NC=C1 DY20703 [0,1,0,0,0,1|1,0,0]=3 1015 B11R1.157 CC(=O)NC1=NC(C)=CC=C1 DY558867 [0,1,0,0,0,1|0,0,0]=2 1016 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 NO16776 [0,1,0,0,0,1|0,0,0]=2 1017 B11R1.157 CC(=O)NC1=NC=CC(Cl)=C1 NO11715 [0,1,0,0,0,1|0,0,0]=2 1018 B11R1.157 CC(=O)NC1=NC=NC(Cl)=C1 DY578265 [0,1,0,0,0,1|1,0,0]=3 1019 B11R1.157 CC(=O)NC1=NC=NC(N)=C1 DY115540 [0,1,0,0,0,1|1,0,0]=3 1020 B11R1.157 CC(=O)OC1=CC(Br)=CC=C1 DY40001 [0,1,0,0,0,1|1,0,0]=3 1021 B11R1.157 NC(=O)CC1=CC(Cl)=CC=C1 DY799707 [0,1,0,0,0,1|2,0,0]=4 1022 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 NO21911 [0,1,0,0,0,1|2,0,0]=4 1023 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 NO10775 [0,1,0,0,0,1|2,0,0]=4 1024 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 NO21923 [0,1,0,0,0,1|2,0,0]=4 1025 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 NO20851 [0,1,0,0,0,1|2,0,0]=4 1026 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 NO20944 [0,1,0,0,0,1|2,0,0]=4 1027 B11R1.157 O=C(O)CC1=NC(Br)=NC=C1 DY692854 [0,1,0,0,0,1|2,0,0]=4 1028 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 NO12801 [0,1,0,0,0,1|1,0,0]=3 1029 B11R1.157 O=C(O)CC1=NC(Cl)=CN=C1 NO12495 [0,1,0,0,0,1|2,0,0]=4 1030 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 DY554295 [0,2,0,0,0,0|1,0,0]=3 1031 B11R1.3 C#CC1=CN=C(N(C)C)C=C1 DY711037 [0,2,0,0,0,0|2,0,0]=4 1032 B11R1.3 C#Cc1ccc(C(=O)O)cc1 NO17809 [0,2,0,0,0,0|2,0,0]=4 1033 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 DY20903 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 DY425378 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 NO12193 [0,2,0,0,0,0|1,0,0]=3 1036 B11R1.3 CC(C)C1=NC=C(C#N)C=C1 DY447407 [0,2,0,0,0,0|1,0,1]=4 1037 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 NO13406 [0,2,0,0,0,0|2,0,0]=4 1038 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 DY441036 [0,2,0,0,0,0|1,0,0]=3 1039 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 DY20232 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 DY20515 [0,2,0,0,0,0|2,0,0]=4 1041 B11R1.3 COC1=CC=C(C(=O)O)C=C1 DY500002 [0,2,0,0,0,0|2,0,0]=4 1042 B11R1.3 COC1=CC=C(C(C)=O)C=N1 NO20044 [0,2,0,0,0,0|2,0,0]=4 1043 B11R1.3 COC1=CN=C(C(=O)O)C=C1 NO18937 [0,2,0,0,0,0|1,0,0]=3 1044 B11R1.3 COC1=CN=C(C(=O)O)C=N1 NO12309 [0,2,0,0,0,0|2,0,0]=4 1045 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 DY517671 [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 NO21997 [0,2,0,0,0,0|2,0,0]=4 1047 B11R1.3 N#CC1=CN=C(C(N)=O)C=C1 DY659996 [0,2,0,0,0,0|1,0,0]=3 1048 B11R1.3 N#CC1=CN=C([N+](=O)[O-])C=C1 DY661303 [0,2,0,0,0,0|2,0,0]=4 1049 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 NO15778 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 DY20325 [0,2,0,0,0,0|2,0,0]=4 1051 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 NO10519 [0,2,0,0,0,0|2,0,0]=4 1052 B11R1.3 NNC1=CC=C(C(N)=O)C=C1 DY822081 [0,2,0,0,0,0|2,0,0]=4 1053 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 DY10316 [0,2,0,0,0,0|2,0,0]=4 1054 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 NO20829 [0,2,0,0,0,0|2,0,0]=4 1055 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 NO20945 [0,2,0,0,0,0|2,0,0]=4 1056 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 NO20792 [0,2,0,0,0,0|2,0,0]=4 1057 B11R1.3 O=[N+]([O-])C1=NC=C(CBr)C=C1 DY713035 [0,2,0,0,0,0|2,0,0]=4 1058 B11R1.19 CC(C)(C)C1=CC=C(O)C=N1 DY567285 [0,2,0,0,0,0|1,0,1]=4 1059 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 NO16019 [0,2,0,0,0,0|0,0,2]=4 1060 B11R1.19 CC(C)(O)C1=NC=C(Cl)C=C1 DY711187 [0,2,0,0,0,0|0,0,2]=4 1061 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 DY548331 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.19 CC1=CN=C(S(C)(=O)=O)N=C1 DY738182 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.19 CC1=CN=C(S(N)(=O)=O)C=C1 NO19599 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 DY447317 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.19 CS(=O)(=O)C1=CC=C(Br)C=C1 NO10464 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 NO16414 [0,2,0,0,0,0|2,0,0]=4 1067 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)N=N1 NO12831 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 NO20302 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=C1 NO20413 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=N1 NO14272 [0,2,0,0,0,0|1,0,0]=3 1071 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 NO20393 [0,2,0,0,0,0|2,0,0]=4 1072 B11R1.19 CS(=O)(=O)C1=NC=C(Br)C=N1 NO17551 [0,2,0,0,0,0|2,0,0]=4 1073 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 NO20410 [0,2,0,0,0,0|1,0,0]=3 1074 B11R1.21 CC(=O)C1=CC(Br)=C(O)C=C1 DY584978 [0,2,0,0,0,0|1,0,0]=3 1075 B11R1.21 CC(=O)C1=CC(C)=C(Br)C=C1 DY584640 [0,2,0,0,0,0|1,0,0]=3 1076 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 NO21693 [0,2,0,0,0,0|1,0,0]=3 1077 B11R1.21 CC(=O)C1=CC(Cl)=C(Br)C=C1 NO15561 [0,2,0,0,0,0|1,0,0]=3 1078 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 NO10715 [0,2,0,0,0,0|1,0,0]=3 1079 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 NO18939 [0,2,0,0,0,0|1,0,0]=3 1080 B11R1.21 CC(=O)C1=CC(F)=C(Br)C=C1 NO22282 [0,2,0,0,0,0|1,0,0]=3 1081 B11R1.21 CC(=O)C1=CC(F)=C(C)C=C1 DY554277 [0,2,0,0,0,0|1,0,0]=3 1082 B11R1.21 CC(=O)C1=CC(F)=C(N)C=C1 NO16308 [0,2,0,0,0,0|1,0,0]=3 1083 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 NO10813 [0,2,0,0,0,0|1,0,0]=3 1084 B11R1.21 CC(=O)C1=CC(I)=C(C)C=C1 DY796023 [0,2,0,0,0,0|1,0,0]=3 1085 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 DY611115 [0,2,0,0,0,0|1,0,0]=3 1086 B11R1.21 CC(=O)C1=CC(N)=C(N)C=C1 DY540231 [0,2,0,0,0,0|1,0,0]=3 1087 B11R1.21 CC(=O)C1=CC(O)=C(Br)C=C1 DY569655 [0,2,0,0,0,0|1,0,0]=3 1088 B11R1.21 CC(=O)C1=CC(O)=C(C)C=C1 DY585060 [0,2,0,0,0,0|1,0,0]=3 1089 B11R1.21 CC(=O)C1=CC(O)=C(F)C=C1 DY453316 [0,2,0,0,0,0|1,0,0]=3 1090 B11R1.21 CC(=O)C1=CC(O)=C(I)C=C1 DY745261 [0,2,0,0,0,0|1,0,0]=3 1091 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 NO10863 [0,2,0,0,0,0|1,0,0]=3 1092 B11R1.21 CC(=O)C1=NC=C(Cl)C(Cl)=C1 DY652322 [0,2,0,0,0,0|0,0,0]=2 1093 B11R1.21 CC(=O)c1ccc(F)c(F)c1 NO19019 [0,2,0,0,0,0|1,0,0]=3 1094 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 NO20811 [0,2,0,0,0,0|2,0,0]=4 1095 B11R1.21 CC1=C(Br)C=CC(C(N)=O)=C1 DY41013 [0,2,0,0,0,0|2,0,0]=4 1096 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 NO21076 [0,2,0,0,0,0|2,0,0]=4 1097 B11R1.21 CC1=C(C)N=C(C(=O)O)C=N1 NO16867 [0,2,0,0,0,0|2,0,0]=4 1098 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 NO20828 [0,2,0,0,0,0|2,0,0]=4 1099 B11R1.21 CC1=C(Cl)C=CC(C(=O)Cl)=C1 DY584656 [0,2,0,0,0,0|2,0,0]=4 1100 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 NO19324 [0,2,0,0,0,0|2,0,0]=4 1101 B11R1.21 CC1=C(Cl)N=C(C(=O)O)C=C1 NO14760 [0,2,0,0,0,0|1,0,0]=3 1102 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 NO21927 [0,2,0,0,0,0|2,0,0]=4 1103 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 NO14298 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.21 CC1=C(F)C=CC(C(=O)O)=N1 NO12903 [0,2,0,0,0,0|1,0,0]=3 1105 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 NO21937 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 NO21906 [0,2,0,0,0,0|2,0,0]=4 1107 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 NO21001 [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 NO20943 [0,2,0,0,0,0|2,0,0]=4 1109 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 NO20947 [0,2,0,0,0,0|2,0,0]=4 1110 B11R1.21 CC1=CC(C(=O)O)=NC=C1Br NO17571 [0,2,0,0,0,0|1,0,0]=3 1111 B11R1.21 CC1=CC([C@H](C)N)=NC=C1Br DY713875 [0,2,0,0,0,0|1,0,1]=4 1112 B11R1.21 CC1=CC=C(C(=O)O)NC1=O NO16105 [0,2,0,0,0,0|1,0,1]=4 1113 B11R1.21 CC1=CN=C(C(=O)O)C=C1Cl NO17916 [0,2,0,0,0,0|1,0,0]=3 1114 B11R1.21 CC1=[N+]([O-])C=C(C(=O)O)N=C1 NO14626 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.21 CN(C)C1=NC(Cl)=C(Br)C=C1 DY715478 [0,2,0,0,0,0|2,0,0]=4 1116 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 DY574611 [0,2,0,0,0,0|2,0,0]=4 1117 B11R1.21 NC(=O)C1=CC(N)=C(Cl)C=C1 DY792711 [0,2,0,0,0,0|2,0,0]=4 1118 B11R1.21 NC(=O)C1=CC(O)=C(O)C=C1 DY796257 [0,2,0,0,0,0|2,0,0]=4 1119 B11R1.21 NC(=O)C1=NC(Cl)=C(Cl)C=C1 DY110050 [0,2,0,0,0,0|1,0,0]=3 1120 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 DY40225 [0,2,0,0,0,0|2,0,0]=4 1121 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 NO20206 [0,2,0,0,0,0|2,0,0]=4 1122 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 NO20228 [0,2,0,0,0,0|2,0,0]=4 1123 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 NO10439 [0,2,0,0,0,0|2,0,0]=4 1124 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 DY10142 [0,2,0,0,0,0|2,0,0]=4 1125 B11R1.21 NC1=C(I)C=CC(C(=O)O)=C1 DY31156 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.21 NC1=C(I)N=C(C(=O)O)C=N1 DY104768 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 NO20381 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 NO20332 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 NO10491 [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl DY20248 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.21 NC1=NC([N+](=O)[O-])=CC=C1Cl DY657168 [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Cl)C=C1 DY21024 [0,2,0,0,0,0|2,0,0]=4 1133 B11R1.21 O=C(Cl)C1=CC(I)=C(Cl)C=C1 DY789435 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.21 O=C(F)C1=CC(Br)=C(F)C=C1 DY798177 [0,2,0,0,0,0|2,0,0]=4 1135 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 NO13169 [0,2,0,0,0,0|1,0,1]=4 1136 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 NO19835 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 NO21914 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 NO16354 [0,2,0,0,0,0|2,0,0]=4 1139 B11R1.21 O=C(O)C1=CC(Br)=C(O)C=C1 DY791505 [0,2,0,0,0,0|2,0,0]=4 1140 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 NO14672 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 NO19962 [0,2,0,0,0,0|2,0,0]=4 1142 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 NO20110 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 NO21990 [0,2,0,0,0,0|2,0,0]=4 1144 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 NO19967 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 NO22285 [0,2,0,0,0,0|2,0,0]=4 1146 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 DY434062 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 NO12746 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 NO22662 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 NO20111 [0,2,0,0,0,0|2,0,0]=4 1150 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 NO18380 [0,2,0,0,0,0|2,0,0]=4 1151 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 NO20259 [0,2,0,0,0,0|2,0,0]=4 1152 B11R1.21 O=C(O)C1=CC=C(Cl)C(=O)N1 NO16864 [0,2,0,0,0,0|1,0,1]=4 1153 B11R1.21 O=C(O)C1=CC=C(O)C(=O)N1 NO17670 [0,2,0,0,0,0|1,0,1]=4 1154 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 NO13224 [0,2,0,0,0,0|1,0,0]=3 1155 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 NO15048 [0,2,0,0,0,0|1,0,0]=3 1156 B11R1.21 O=C(O)C1=NC(Cl)=C(F)C=C1 NO15050 [0,2,0,0,0,0|1,0,0]=3 1157 B11R1.21 O=C(O)C1=NC(O)=C(O)N=C1 NO17143 [0,2,0,0,0,0|2,0,0]=4 1158 B11R1.22 CC1=CC=C(C(=O)C#N)C=C1 DY791487 [0,2,0,0,0,0|1,0,1]=4 1159 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 DY563697 [0,2,0,0,0,0|1,0,0]=3 1160 B11R1.22 CC1=CN=C(C(=N)NO)C=C1 DY716168 [0,2,0,0,0,0|1,0,1]=4 1161 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 NO22698 [0,2,0,0,0,0|1,0,0]=3 1162 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 NO22795 [0,2,0,0,0,0|1,0,0]=3 1163 B11R1.22 CCC(=O)C1=CC=C(Cl)N=C1 NO20436 [0,2,0,0,0,0|2,0,0]=4 1164 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 NO22846 [0,2,0,0,0,0|1,0,0]=3 1165 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 DY584618 [0,2,0,0,0,0|1,0,0]=3 1166 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 NO15690 [0,2,0,0,0,0|1,0,0]=3 1167 B11R1.22 CCC(=O)C1=CC=C(S)C=C1 DY747823 [0,2,0,0,0,0|1,0,0]=3 1168 B11R1.22 CCC(=O)C1=NC=C(C)C=C1 DY652527 [0,2,0,0,0,0|0,0,0]=2 1169 B11R1.22 CNC(=O)C1=CC=C(Br)N=N1 DY607113 [0,2,0,0,0,0|1,0,0]=3 1170 B11R1.22 CNC(=O)C1=CC=C(N)N=C1 DY586346 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.22 CNC(=O)C1=CN=C(Cl)C=C1 DY33519 [0,2,0,0,0,0|2,0,0]=4 1172 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 NO15303 [0,2,0,0,0,0|1,0,0]=3 1173 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 NO11663 [0,2,0,0,0,0|1,0,0]=3 1174 B11R1.22 COC(=O)C1=CC=C(F)C=C1 NO20841 [0,2,0,0,0,0|1,0,0]=3 1175 B11R1.22 COC(=O)C1=CC=C(I)C=C1 NO20853 [0,2,0,0,0,0|1,0,0]=3 1176 B11R1.22 COC(=O)C1=CC=C(N)C=C1 NO20990 [0,2,0,0,0,0|1,0,0]=3 1177 B11R1.22 COC(=O)C1=CC=C(O)C=C1 NO19446 [0,2,0,0,0,0|1,0,0]=3 1178 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 NO14052 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.22 COC(=O)C1=CN=C(C)C=C1 NO10875 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.22 COC(=O)C1=CN=C(F)C=C1 NO13697 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.22 COC(=O)C1=CN=C(N)C=C1 NO14193 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.22 COC(=O)C1=COC(=O)C=C1 NO19181 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 NO14099 [0,2,0,0,0,0|0,0,0]=2 1184 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 NO12346 [0,2,0,0,0,0|1,0,0]=3 1185 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 NO11655 [0,2,0,0,0,0|1,0,0]=3 1186 B11R1.22 COC(=O)C1=NC=C(C)C=C1 NO15553 [0,2,0,0,0,0|0,0,0]=2 1187 B11R1.22 COC(=O)C1=NC=C(C)C=N1 DY115976 [0,2,0,0,0,0|1,0,0]=3 1188 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 DY713167 [0,2,0,0,0,0|0,0,0]=2 1189 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 NO14158 [0,2,0,0,0,0|1,0,0]=3 1190 B11R1.22 COC(=O)C1=NC=C(F)C=C1 NO16224 [0,2,0,0,0,0|0,0,0]=2 1191 B11R1.22 COC(=O)C1=NC=C(N)C=C1 NO21755 [0,2,0,0,0,0|0,0,0]=2 1192 B11R1.22 COC(=O)C1=NC=C(O)C=C1 NO10406 [0,2,0,0,0,0|0,0,0]=2 1193 B11R1.22 COC(=O)C1=NC=C(O)N=C1 NO19747 [0,2,0,0,0,0|1,0,0]=3 1194 B11R1.22 COC(=O)C1=NNC(=O)C=C1 NO13480 [0,2,0,0,0,0|1,0,0]=3 1195 B11R1.22 N#CC(=O)C1=CC=C(F)C=C1 DY744997 [0,2,0,0,0,0|1,0,1]=4 1196 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 NO10839 [0,2,0,0,0,0|1,0,0]=3 1197 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 DY570813 [0,2,0,0,0,0|1,0,0]=3 1198 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 NO20894 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 DY20179 [0,2,0,0,0,0|2,0,0]=4 1200 B11R1.22 NNC(=O)C1=NC=C(Cl)N=C1 NO12382 [0,2,0,0,0,0|2,0,0]=4 1201 B11R1.22 NNC(=O)C1=NC=C(F)C=C1 NO16150 [0,2,0,0,0,0|1,0,0]=3 1202 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 NO19445 [0,2,0,0,0,0|1,0,0]=3 1203 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 NO20678 [0,2,0,0,0,0|1,0,0]=3 1204 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 NO10771 [0,2,0,0,0,0|1,0,0]=3 1205 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 NO14324 [0,2,0,0,0,0|1,0,0]=3 1206 B11R1.22 O=C(CCl)C1=CC=C(Cl)N=C1 DY655286 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 DY41236 [0,2,0,0,0,0|1,0,0]=3 1208 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 DY427408 [0,2,0,0,0,0|1,0,1]=4 1209 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 NO15989 [0,2,0,0,0,0|1,0,1]=4 1210 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 DY575259 [0,2,0,0,0,0|1,0,1]=4 1211 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 NO20192 [0,2,0,0,0,0|1,0,1]=4 1212 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 NO18120 [0,2,0,0,0,0|1,0,1]=4 1213 B11R1.166 CC(=O)C1=C(Br)C=C(Br)C=C1 DY549171 [0,2,0,0,0,0|1,0,0]=3 1214 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 NO21355 [0,2,0,0,0,0|1,0,0]=3 1215 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 DY577989 [0,2,0,0,0,0|1,0,0]=3 1216 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 NO14036 [0,2,0,0,0,0|1,0,0]=3 1217 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 NO21093 [0,2,0,0,0,0|1,0,0]=3 1218 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)N=C1 DY577821 [0,2,0,0,0,0|2,0,0]=4 1219 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 NO21444 [0,2,0,0,0,0|1,0,0]=3 1220 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 NO20824 [0,2,0,0,0,0|1,0,0]=3 1221 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 NO20682 [0,2,0,0,0,0|1,0,0]=3 1222 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 DY430999 [0,2,0,0,0,0|1,0,0]=3 1223 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 NO22739 [0,2,0,0,0,0|1,0,0]=3 1224 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 NO19013 [0,2,0,0,0,0|1,0,0]=3 1225 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 NO16419 [0,2,0,0,0,0|1,0,0]=3 1226 B11R1.166 CC(=O)C1=C(N)C=C(C)N=C1 DY507342 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 NO22645 [0,2,0,0,0,0|1,0,0]=3 1228 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 DY10406 [0,2,0,0,0,0|1,0,0]=3 1229 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 DY10405 [0,2,0,0,0,0|1,0,0]=3 1230 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 NO20409 [0,2,0,0,0,0|1,0,0]=3 1231 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 NO19678 [0,2,0,0,0,0|1,0,0]=3 1232 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl NO13204 [0,2,0,0,0,0|2,0,0]=4 1233 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C DY652460 [0,2,0,0,0,0|0,0,0]=2 1234 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1Cl DY652226 [0,2,0,0,0,0|0,0,0]=2 1235 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1F DY652490 [0,2,0,0,0,0|0,0,0]=2 1236 B11R1.166 CC(=O)C1=NC=C(F)C=C1F NO15746 [0,2,0,0,0,0|0,0,0]=2 1237 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 NO15606 [0,2,0,0,0,0|2,0,0]=4 1238 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 NO22749 [0,2,0,0,0,0|2,0,0]=4 1239 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 NO21999 [0,2,0,0,0,0|2,0,0]=4 1240 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 NO18188 [0,2,0,0,0,0|2,0,0]=4 1241 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 NO12971 [0,2,0,0,0,0|2,0,0]=4 1242 B11R1.166 CC1=C(C(=O)[O-])C=CC(Cl)=C1 DY584431 [0,2,0,0,0,0|2,0,0]=4 1243 B11R1.166 CC1=C(C(N)=O)C=CC(Cl)=C1 DY584696 [0,2,0,0,0,0|2,0,0]=4 1244 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 NO21362 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.166 CC1=CC(Br)=CN=C1C(=N)N DY711127 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O NO17552 [0,2,0,0,0,0|1,0,0]=3 1247 B11R1.166 CC1=CC(Br)=CN=C1C(N)=O DY451084 [0,2,0,0,0,0|1,0,0]=3 1248 B11R1.166 CC1=CC(Br)=CN=C1[N+](=O)[O-] DY33337 [0,2,0,0,0,0|2,0,0]=4 1249 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 NO21071 [0,2,0,0,0,0|2,0,0]=4 1250 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 NO21449 [0,2,0,0,0,0|2,0,0]=4 1251 B11R1.166 CC1=CC(Cl)=CN=C1C(=O)O NO17583 [0,2,0,0,0,0|1,0,0]=3 1252 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 NO20842 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.166 CC1=CC(F)=C(C(=O)[O-])C=C1 DY584432 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 DY534207 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 NO13976 [0,2,0,0,0,0|2,0,0]=4 1256 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 NO20440 [0,2,0,0,0,0|2,0,0]=4 1257 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 NO20948 [0,2,0,0,0,0|2,0,0]=4 1258 B11R1.166 CC1=CN=C(C(=O)O)C(Br)=C1 NO15720 [0,2,0,0,0,0|1,0,0]=3 1259 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 NO15178 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.166 CC1=CN=C(C(=O)O)C(Cl)=N1 DY710107 [0,2,0,0,0,0|2,0,0]=4 1261 B11R1.166 CC1=CN=C(C(=O)O)C(N)=C1 DY656848 [0,2,0,0,0,0|1,0,0]=3 1262 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)N=N1 DY737006 [0,2,0,0,0,0|2,0,0]=4 1263 B11R1.166 NC(=O)C1=C(Cl)C=C(N)C=C1 DY539973 [0,2,0,0,0,0|2,0,0]=4 1264 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=C1 NO14625 [0,2,0,0,0,0|2,0,0]=4 1265 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 NO15300 [0,2,0,0,0,0|2,0,0]=4 1266 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1Cl NO16870 [0,2,0,0,0,0|1,0,0]=3 1267 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 NO20180 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 NO20207 [0,2,0,0,0,0|2,0,0]=4 1269 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 NO21253 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O NO14395 [0,2,0,0,0,0|1,0,0]=3 1271 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 NO10414 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 NO20227 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.166 NC1=CC(F)=CN=C1C(=O)O DY512763 [0,2,0,0,0,0|1,0,0]=3 1274 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 NO22593 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.166 Nc1ccc(C(=O)O)c(O)c1 DY538767 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.166 O=C(Cl)C1=C(F)C=C(F)C=C1 DY40465 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 NO21072 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 NO19824 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 NO21353 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.166 O=C(O)C1=C(Br)C=C(I)C=C1 NO15275 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 NO10220 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 NO14611 [0,2,0,0,0,0|2,0,0]=4 1283 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 NO20109 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 NO21987 [0,2,0,0,0,0|2,0,0]=4 1285 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 DY40267 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 NO10370 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 NO22743 [0,2,0,0,0,0|2,0,0]=4 1288 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 NO14997 [0,2,0,0,0,0|2,0,0]=4 1289 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 NO14628 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 NO14175 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.166 O=C(O)C1=C(O)C=C(I)C=C1 DY530661 [0,2,0,0,0,0|2,0,0]=4 1292 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Br DY20838 [0,2,0,0,0,0|1,0,0]=3 1293 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl NO21897 [0,2,0,0,0,0|1,0,0]=3 1294 B11R1.166 O=C1C=C(O)C(C(=O)O)=NN1 DY737000 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.166 O=[N+]([O-])C1=NC=C(Br)C=C1F DY21176 [0,2,0,0,0,0|2,0,0]=4 1296 B11R1.16 CC(N=C=O)c1ccccc1 DY587056 [0,2,0,0,0,0|1,0,1]=4 1297 B11R1.16 CCCC(=O)C1=NC=CN=C1 DY710605 [0,2,0,0,0,0|1,0,0]=3 1298 B11R1.16 CCOC(=N)C1=CC=CC=C1 DY744223 [0,2,0,0,0,0|2,0,0]=4 1299 B11R1.16 CCOC(=O)C1=CN=CC=C1 NO19194 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.16 CCOC(=O)C1=NC=CC=C1 NO14035 [0,2,0,0,0,0|0,0,0]=2 1301 B11R1.16 CNCC(=O)C1=CC=CC=C1 DY794643 [0,2,0,0,0,0|1,0,0]=3 1302 B11R1.16 C[C@H](N=C=O)C1=CC=CC=C1 DY20438 [0,2,0,0,0,0|1,0,1]=4 1303 B11R1.16 N#CCC(=O)C1=CC=CC=C1 NO10995 [0,2,0,0,0,0|1,0,0]=3 1304 B11R1.16 O=[P+](OCO)C1=CC=CC=C1 DY796893 [0,2,0,0,0,0|2,0,0]=4 1305 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 DY41278 [0,2,0,0,0,0|1,0,0]=3 1306 B11R1.23 CCC(=O)C1=CC(Br)=CN=C1 DY652484 [0,2,0,0,0,0|2,0,0]=4 1307 B11R1.23 CCC(=O)C1=CC(C)=CC=C1 DY745657 [0,2,0,0,0,0|1,0,0]=3 1308 B11R1.23 CCC(=O)C1=CC(F)=CC=C1 DY41284 [0,2,0,0,0,0|1,0,0]=3 1309 B11R1.23 CCC(N)C1=NC(C)=CC=C1 DY606027 [0,2,0,0,0,0|1,0,1]=4 1310 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 NO18168 [0,2,0,0,0,0|0,0,0]=2 1311 B11R1.23 COC(=O)C1=CC(=O)NC=C1 NO11585 [0,2,0,0,0,0|2,0,0]=4 1312 B11R1.23 COC(=O)C1=CC(Br)=CC=C1 NO20038 [0,2,0,0,0,0|1,0,0]=3 1313 B11R1.23 COC(=O)C1=CC(C)=CN=N1 DY532743 [0,2,0,0,0,0|1,0,0]=3 1314 B11R1.23 COC(=O)C1=CC(C)=NC=C1 DY530607 [0,2,0,0,0,0|2,0,0]=4 1315 B11R1.23 COC(=O)C1=CC(Cl)=CC=C1 NO11622 [0,2,0,0,0,0|1,0,0]=3 1316 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 NO18382 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.23 COC(=O)C1=CC(I)=CC=C1 NO19204 [0,2,0,0,0,0|1,0,0]=3 1318 B11R1.23 COC(=O)C1=CC(N)=CC=C1 DY40055 [0,2,0,0,0,0|1,0,0]=3 1319 B11R1.23 COC(=O)C1=CC(N)=NC=C1 NO19528 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.23 COC(=O)C1=CC(O)=CC=C1 NO13404 [0,2,0,0,0,0|1,0,0]=3 1321 B11R1.23 COC(=O)C1=CC=CC(=O)N1 NO15010 [0,2,0,0,0,0|0,0,1]=3 1322 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 NO10403 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.23 COC(=O)C1=CN=CC(C)=C1 NO11660 [0,2,0,0,0,0|2,0,0]=4 1324 B11R1.23 COC(=O)C1=CN=CC(N)=C1 DY662635 [0,2,0,0,0,0|2,0,0]=4 1325 B11R1.23 COC(=O)C1=CN=CC(N)=C1 NO18261 [0,2,0,0,0,0|2,0,0]=4 1326 B11R1.23 COC(=O)C1=CN=CC(O)=C1 NO11658 [0,2,0,0,0,0|2,0,0]=4 1327 B11R1.23 COC(=O)C1=NC(Br)=CC=C1 NO18917 [0,2,0,0,0,0|0,0,0]=2 1328 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 NO12870 [0,2,0,0,0,0|1,0,0]=3 1329 B11R1.23 COC(=O)C1=NC(Br)=NC=C1 NO15709 [0,2,0,0,0,0|1,0,0]=3 1330 B11R1.23 COC(=O)C1=NC(C)=CC=C1 NO12275 [0,2,0,0,0,0|0,0,0]=2 1331 B11R1.23 COC(=O)C1=NC(C)=NC=C1 NO15096 [0,2,0,0,0,0|1,0,0]=3 1332 B11R1.23 COC(=O)C1=NC(Cl)=CC=C1 NO10671 [0,2,0,0,0,0|0,0,0]=2 1333 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 NO12231 [0,2,0,0,0,0|1,0,0]=3 1334 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 NO12287 [0,2,0,0,0,0|1,0,0]=3 1335 B11R1.23 COC(=O)C1=NC(N)=CC=C1 NO10610 [0,2,0,0,0,0|0,0,0]=2 1336 B11R1.23 COC(=O)C1=NC(N)=CN=C1 DY509990 [0,2,0,0,0,0|1,0,0]=3 1337 B11R1.23 COC(=O)C1=NC(N)=NC=C1 NO15550 [0,2,0,0,0,0|1,0,0]=3 1338 B11R1.23 COC(=O)C1=NC=CC(Br)=N1 DY431545 [0,2,0,0,0,0|1,0,0]=3 1339 B11R1.23 COC(=O)C1=NC=CC(C)=N1 NO12268 [0,2,0,0,0,0|1,0,0]=3 1340 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 NO14005 [0,2,0,0,0,0|0,0,0]=2 1341 B11R1.23 COC(=O)C1=NC=CC(I)=C1 DY552141 [0,2,0,0,0,0|0,0,0]=2 1342 B11R1.23 NNC(=O)C1=CC(I)=CC=C1 DY552699 [0,2,0,0,0,0|2,0,0]=4 1343 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 NO19056 [0,2,0,0,0,0|1,0,0]=3 1344 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 NO15383 [0,2,0,0,0,0|1,0,0]=3 1345 B11R1.23 O=C(CBr)C1=NC(Br)=CC=C1 DY447293 [0,2,0,0,0,0|0,0,0]=2 1346 B11R1.23 O=C(CBr)C1=NC(Br)=CC=C1 DY655057 [0,2,0,0,0,0|0,0,0]=2 1347 B11R1.23 O=C(CCl)C1=CC(Cl)=CC=C1 DY20163 [0,2,0,0,0,0|1,0,0]=3 1348 B11R1.23 O=C(CCl)C1=CC=CC(F)=C1 DY584626 [0,2,0,0,0,0|1,0,0]=3 1349 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 DY20584 [0,2,0,0,0,0|2,0,0]=4 1350 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 NO15813 [0,2,0,0,0,0|1,0,0]=3 1351 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 NO20442 [0,2,0,0,0,0|1,0,0]=3 1352 B11R1.222 CNC(=O)C1=NC=CN=C1N DY455616 [0,2,0,0,0,0|1,0,0]=3 1353 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 DY20192 [0,2,0,0,0,0|1,0,0]=3 1354 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 NO22176 [0,2,0,0,0,0|2,0,0]=4 1355 B11R1.222 COC(=O)C1=C(C)N=CC=C1 NO21004 [0,2,0,0,0,0|2,0,0]=4 1356 B11R1.222 COC(=O)C1=C(Cl)N=CC=C1 NO20210 [0,2,0,0,0,0|2,0,0]=4 1357 B11R1.222 COC(=O)C1=C(F)C=CC=C1 NO11605 [0,2,0,0,0,0|1,0,0]=3 1358 B11R1.222 COC(=O)C1=C(F)N=CC=C1 NO14405 [0,2,0,0,0,0|2,0,0]=4 1359 B11R1.222 COC(=O)C1=C(I)C=CC=C1 NO15277 [0,2,0,0,0,0|1,0,0]=3 1360 B11R1.222 COC(=O)C1=C(I)C=NC=C1 NO22331 [0,2,0,0,0,0|2,0,0]=4 1361 B11R1.222 COC(=O)C1=C(O)C=NC=C1 NO11627 [0,2,0,0,0,0|2,0,0]=4 1362 B11R1.222 COC(=O)C1=CC=CN=C1N NO18010 [0,2,0,0,0,0|2,0,0]=4 1363 B11R1.222 COC(=O)C1=CN=CC=C1C NO11648 [0,2,0,0,0,0|2,0,0]=4 1364 B11R1.222 COC(=O)C1=CN=CC=C1Cl NO15530 [0,2,0,0,0,0|2,0,0]=4 1365 B11R1.222 COC(=O)C1=CN=CC=C1N NO18774 [0,2,0,0,0,0|2,0,0]=4 1366 B11R1.222 COC(=O)C1=NC=CC=C1Br NO12168 [0,2,0,0,0,0|0,0,0]=2 1367 B11R1.222 COC(=O)C1=NC=CC=C1F NO19566 [0,2,0,0,0,0|0,0,0]=2 1368 B11R1.222 COC(=O)C1=NC=CC=C1N NO22111 [0,2,0,0,0,0|0,0,0]=2 1369 B11R1.222 COC(=O)C1=NC=CC=C1O NO21936 [0,2,0,0,0,0|0,0,0]=2 1370 B11R1.222 COC(=O)C1=NC=CN=C1Br NO12415 [0,2,0,0,0,0|1,0,0]=3 1371 B11R1.222 COC(=O)C1=NC=CN=C1C DY585289 [0,2,0,0,0,0|1,0,0]=3 1372 B11R1.222 COC(=O)C1=NC=CN=C1Cl NO18208 [0,2,0,0,0,0|1,0,0]=3 1373 B11R1.222 COC(=O)C1=NC=CN=C1N NO21912 [0,2,0,0,0,0|1,0,0]=3 1374 B11R1.222 COC(=O)C1=NC=CN=C1O NO11607 [0,2,0,0,0,0|1,0,0]=3 1375 B11R1.222 COC(=O)C1=NC=NC=C1Br NO12520 [0,2,0,0,0,0|1,0,0]=3 1376 B11R1.222 C\C(=N/O)C1=C(O)C=CC=C1 DY745441 [0,2,0,0,0,0|1,0,1]=4 1377 B11R1.222 N#CC(=O)C1=C(Cl)C=CC=C1 DY794571 [0,2,0,0,0,0|1,0,1]=4 1378 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 NO15388 [0,2,0,0,0,0|1,0,0]=3 1379 B11R1.222 O=C(CBr)C1=C(Br)C=CC=C1 DY795819 [0,2,0,0,0,0|1,0,0]=3 1380 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 NO14555 [0,2,0,0,0,0|1,0,0]=3 1381 B11R1.222 O=C(CBr)C1=NC=CC=C1O DY655051 [0,2,0,0,0,0|0,0,0]=2 1382 B11R1.222 O=C(CCl)C1=NC=CC=C1F DY655280 [0,2,0,0,0,0|0,0,0]=2 1383 B11R1.222 O=C(NO)C1=C(O)C=CC=C1 NO11942 [0,2,0,0,0,0|2,0,0]=4 1384 B11R1.222 O=C(NO)C1=NC=CNC1=O DY710311 [0,2,0,0,0,0|2,0,0]=4 1385 B11R1.87 CC(C)(C)C1=NC=CC=C1Cl DY654780 [0,2,0,0,0,0|1,0,1]=4 1386 B11R1.87 CC1=CC=CN=C1S(N)(=O)=O DY657441 [0,2,0,0,0,0|2,0,0]=4 1387 B11R1.155 CC(C)(O)C1=NC(Br)=CC=C1 NO16576 [0,2,0,0,0,0|0,0,2]=4 1388 B11R1.155 CS(=O)(=O)C1=CC=CC(Br)=C1 NO10461 [0,2,0,0,0,0|2,0,0]=4 1389 B11R1.155 CS(=O)(=O)C1=CC=CC(Br)=N1 DY442239 [0,2,0,0,0,0|1,0,0]=3 1390 B11R1.155 CS(=O)(=O)C1=CC=CC(F)=C1 NO16715 [0,2,0,0,0,0|2,0,0]=4 1391 B11R1.155 CS(=O)(=O)C1=NC(Cl)=NC=C1 NO12705 [0,2,0,0,0,0|2,0,0]=4 1392 B11R1.155 CS(=O)(=O)C1=NC=CC(Br)=N1 NO12355 [0,2,0,0,0,0|2,0,0]=4 1393 B11R1.155 CS(=O)(=O)C1=NC=CC(Cl)=N1 NO22746 [0,2,0,0,0,0|2,0,0]=4 1394 B11R1.155 NC1=CC=CC(S(=O)(=O)O)=N1 DY711379 [0,2,0,0,0,0|2,0,0]=4 1395 B11R1.155 NS(=O)(=O)C1=NC(Br)=CC=C1 NO15352 [0,2,0,0,0,0|2,0,0]=4 1396 B11R1.155 O=S(=O)(Cl)C1=NC(Br)=CC=C1 DY798921 [0,2,0,0,0,0|2,0,0]=4 1397 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 NO16516 [0,2,0,0,0,0|2,0,0]=4 1398 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 NO21523 [0,2,0,0,0,0|1,0,0]=3 1399 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 NO15281 [0,2,0,0,0,0|2,0,0]=4 1400 B11R1.53 CCC1=C(C(C)=O)C=CN=C1 DY652292 [0,2,0,0,0,0|2,0,0]=4 1401 B11R1.53 CCC1=CC=CN=C1C(=N)N DY712729 [0,2,0,0,0,0|2,0,0]=4 1402 B11R1.53 COC1=C(C(=O)O)C=CC=C1 NO15086 [0,2,0,0,0,0|2,0,0]=4 1403 B11R1.53 COC1=C(C(C)=O)C=CN=C1 DY105760 [0,2,0,0,0,0|2,0,0]=4 1404 B11R1.53 COC1=CC=CN=C1C(=O)O NO22335 [0,2,0,0,0,0|1,0,0]=3 1405 B11R1.53 COC1=CC=CN=C1C(C)=O NO16598 [0,2,0,0,0,0|0,0,0]=2 1406 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] NO19391 [0,2,0,0,0,0|2,0,0]=4 1407 B11R1.53 COC1=NC=CN=C1C(=O)O NO16473 [0,2,0,0,0,0|2,0,0]=4 1408 B11R1.53 CSC1=C(C(=O)O)C=CC=C1 DY551739 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.53 C[Se]C1=C(C(=O)O)C=CC=C1 DY565725 [0,2,0,0,0,0|2,0,0]=4 1410 B11R1.53 N#CC1=CC=CN=C1C(=O)O DY103589 [0,2,0,0,0,0|1,0,0]=3 1411 B11R1.53 NC(=O)C1=C(CBr)C=CC=C1 NO16759 [0,2,0,0,0,0|2,0,0]=4 1412 B11R1.53 O=CC1=C(C(=O)O)C=CC=C1 NO13542 [0,2,0,0,0,0|2,0,0]=4 1413 B11R1.156 CC(=O)C1=C(Br)C=CC=C1Cl DY584842 [0,2,0,0,0,0|1,0,0]=3 1414 B11R1.156 CC(=O)C1=C(Br)C=CC=C1F NO13264 [0,2,0,0,0,0|1,0,0]=3 1415 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O NO15783 [0,2,0,0,0,0|1,0,0]=3 1416 B11R1.156 CC(=O)C1=C(C)C=NC=C1C DY652232 [0,2,0,0,0,0|2,0,0]=4 1417 B11R1.156 CC(=O)C1=C(F)C=CC=C1C DY584837 [0,2,0,0,0,0|1,0,0]=3 1418 B11R1.156 CC(=O)C1=C(F)C=CC=C1F NO18713 [0,2,0,0,0,0|1,0,0]=3 1419 B11R1.156 CC(=O)C1=C(F)C=CC=C1O NO19423 [0,2,0,0,0,0|1,0,0]=3 1420 B11R1.156 CC(=O)C1=C(N)C=CN=C1Cl DY507340 [0,2,0,0,0,0|2,0,0]=4 1421 B11R1.156 CC(=O)C1=C(O)C=CC=C1O NO21180 [0,2,0,0,0,0|1,0,0]=3 1422 B11R1.156 CC1=CC=CC(Br)=C1C(=O)O NO21386 [0,2,0,0,0,0|2,0,0]=4 1423 B11R1.156 CC1=CC=CC(C)=C1C(=O)O NO10891 [0,2,0,0,0,0|2,0,0]=4 1424 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)O NO20825 [0,2,0,0,0,0|2,0,0]=4 1425 B11R1.156 CC1=CC=CC(F)=C1C(=O)O NO21875 [0,2,0,0,0,0|2,0,0]=4 1426 B11R1.156 CC1=CC=CC(N)=C1C(=O)O NO20994 [0,2,0,0,0,0|2,0,0]=4 1427 B11R1.156 CC1=CC=CC(O)=C1C(=O)O NO21594 [0,2,0,0,0,0|2,0,0]=4 1428 B11R1.156 NC(=O)C1=C(F)C=CC=C1F NO10343 [0,2,0,0,0,0|2,0,0]=4 1429 B11R1.156 NC1=C(C(=O)O)C(Br)=CC=C1 NO13923 [0,2,0,0,0,0|2,0,0]=4 1430 B11R1.156 NC1=C(C(=O)O)C(Cl)=CC=C1 NO10413 [0,2,0,0,0,0|2,0,0]=4 1431 B11R1.156 NC1=C(C(=O)O)C(F)=CC=C1 NO14367 [0,2,0,0,0,0|2,0,0]=4 1432 B11R1.156 NC1=C(C(=O)O)C(O)=CC=C1 NO15536 [0,2,0,0,0,0|2,0,0]=4 1433 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Cl NO19832 [0,2,0,0,0,0|2,0,0]=4 1434 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F NO21839 [0,2,0,0,0,0|2,0,0]=4 1435 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl NO19900 [0,2,0,0,0,0|2,0,0]=4 1436 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1F NO19955 [0,2,0,0,0,0|2,0,0]=4 1437 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O DY442377 [0,2,0,0,0,0|2,0,0]=4 1438 B11R1.156 O=C(O)C1=C(O)C=CC=C1O NO14109 [0,2,0,0,0,0|2,0,0]=4 1439 B11R1.159 CC(=O)C1=C(C)C(Br)=CC=C1 DY585075 [0,2,0,0,0,0|1,0,0]=3 1440 B11R1.159 CC(=O)C1=C(Cl)C(Cl)=CC=C1 NO21018 [0,2,0,0,0,0|1,0,0]=3 1441 B11R1.159 CC(=O)C1=C(F)C(Br)=CC=C1 DY20204 [0,2,0,0,0,0|1,0,0]=3 1442 B11R1.159 CC(=O)C1=C(F)C(C)=CC=C1 DY585016 [0,2,0,0,0,0|1,0,0]=3 1443 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 NO20991 [0,2,0,0,0,0|1,0,0]=3 1444 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 NO20407 [0,2,0,0,0,0|1,0,0]=3 1445 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 NO13325 [0,2,0,0,0,0|1,0,0]=3 1446 B11R1.159 CC(=O)C1=C(O)C(Cl)=CC=C1 NO10781 [0,2,0,0,0,0|1,0,0]=3 1447 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 NO15701 [0,2,0,0,0,0|1,0,0]=3 1448 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 NO20939 [0,2,0,0,0,0|1,0,0]=3 1449 B11R1.159 CC(=O)c1cccc(Br)c1N DY433201 [0,2,0,0,0,0|1,0,0]=3 1450 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O NO17097 [0,2,0,0,0,0|1,0,0]=3 1451 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br NO10774 [0,2,0,0,0,0|2,0,0]=4 1452 B11R1.159 CC1=C(C(=O)O)C=CC=C1Cl NO22209 [0,2,0,0,0,0|2,0,0]=4 1453 B11R1.159 CC1=C(C(=O)O)C=CC=C1F NO20846 [0,2,0,0,0,0|2,0,0]=4 1454 B11R1.159 CC1=C(C(=O)O)C=CC=C1I DY20967 [0,2,0,0,0,0|2,0,0]=4 1455 B11R1.159 CC1=C(C(=O)O)C=CC=C1N NO20997 [0,2,0,0,0,0|2,0,0]=4 1456 B11R1.159 CC1=C(C(=O)O)C=CC=C1O NO20942 [0,2,0,0,0,0|2,0,0]=4 1457 B11R1.159 CC1=C(C(N)=O)C=CC=C1Br DY451270 [0,2,0,0,0,0|2,0,0]=4 1458 B11R1.159 CC1=C(O)C([N+](=O)[O-])=NC=C1 NO14394 [0,2,0,0,0,0|2,0,0]=4 1459 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br NO10769 [0,2,0,0,0,0|2,0,0]=4 1460 B11R1.159 CC1=CC=CC(C(=O)O)=C1C NO21070 [0,2,0,0,0,0|2,0,0]=4 1461 B11R1.159 CC1=CC=CC(C(=O)O)=C1F NO21867 [0,2,0,0,0,0|2,0,0]=4 1462 B11R1.159 CC1=CC=CC(C(=O)O)=C1I NO21611 [0,2,0,0,0,0|2,0,0]=4 1463 B11R1.159 CC1=CC=CC(C(=O)O)=C1O NO16085 [0,2,0,0,0,0|2,0,0]=4 1464 B11R1.159 CN1C(=O)C=CC=C1C(=O)O DY562497 [0,2,0,0,0,0|1,0,1]=4 1465 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=C1 DY745573 [0,2,0,0,0,0|2,0,0]=4 1466 B11R1.159 NC(=O)C1=C(F)C(N)=CC=C1 DY686761 [0,2,0,0,0,0|2,0,0]=4 1467 B11R1.159 NC(=O)C1=C(N)C(Br)=CC=C1 NO15497 [0,2,0,0,0,0|2,0,0]=4 1468 B11R1.159 NC(=O)C1=C(N)C(N)=CC=C1 NO10963 [0,2,0,0,0,0|2,0,0]=4 1469 B11R1.159 NC(=O)C1=NC=CC(Cl)=C1I DY517011 [0,2,0,0,0,0|1,0,0]=3 1470 B11R1.159 NC1=C(C(=O)O)C=CC=C1Br NO20178 [0,2,0,0,0,0|2,0,0]=4 1471 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl NO20200 [0,2,0,0,0,0|2,0,0]=4 1472 B11R1.159 NC1=C(C(=O)O)C=CC=C1F NO10428 [0,2,0,0,0,0|2,0,0]=4 1473 B11R1.159 NC1=C(C(=O)O)C=CC=C1I NO14916 [0,2,0,0,0,0|2,0,0]=4 1474 B11R1.159 NC1=C(C(=O)O)C=CC=C1O NO20329 [0,2,0,0,0,0|2,0,0]=4 1475 B11R1.159 NC1=CC=CC(C(=O)O)=C1Br DY584822 [0,2,0,0,0,0|2,0,0]=4 1476 B11R1.159 NC1=CC=CC(C(=O)O)=C1Cl NO18598 [0,2,0,0,0,0|2,0,0]=4 1477 B11R1.159 NC1=CC=CC(C(=O)O)=C1N NO13398 [0,2,0,0,0,0|2,0,0]=4 1478 B11R1.159 NC1=CC=CC(C(=O)O)=C1O NO20331 [0,2,0,0,0,0|2,0,0]=4 1479 B11R1.159 O=C(Br)C1=C(Br)C(F)=CC=C1 DY584424 [0,2,0,0,0,0|2,0,0]=4 1480 B11R1.159 O=C(O)C1=C(Br)C(Br)=CC=C1 NO14427 [0,2,0,0,0,0|2,0,0]=4 1481 B11R1.159 O=C(O)C1=C(Br)C(F)=CC=C1 NO21833 [0,2,0,0,0,0|2,0,0]=4 1482 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CC=C1 NO14400 [0,2,0,0,0,0|2,0,0]=4 1483 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 NO19950 [0,2,0,0,0,0|2,0,0]=4 1484 B11R1.159 O=C(O)C1=C(Cl)C(O)=CC=C1 NO14808 [0,2,0,0,0,0|2,0,0]=4 1485 B11R1.159 O=C(O)C1=C(F)C(Br)=CC=C1 NO21913 [0,2,0,0,0,0|2,0,0]=4 1486 B11R1.159 O=C(O)C1=C(F)C(Cl)=CC=C1 NO19960 [0,2,0,0,0,0|2,0,0]=4 1487 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 NO12733 [0,2,0,0,0,0|2,0,0]=4 1488 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 DY20266 [0,2,0,0,0,0|2,0,0]=4 1489 B11R1.159 O=C(O)C1=C(I)C(Cl)=CC=C1 NO15350 [0,2,0,0,0,0|2,0,0]=4 1490 B11R1.159 O=C(O)C1=C(I)C(F)=CC=C1 NO14251 [0,2,0,0,0,0|2,0,0]=4 1491 B11R1.159 O=C(O)C1=C(I)C(O)=CC=C1 DY442215 [0,2,0,0,0,0|2,0,0]=4 1492 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 NO19729 [0,2,0,0,0,0|2,0,0]=4 1493 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 NO22246 [0,2,0,0,0,0|2,0,0]=4 1494 B11R1.159 O=C(O)C1=C(O)C(F)=CC=C1 NO10372 [0,2,0,0,0,0|2,0,0]=4 1495 B11R1.159 O=C(O)C1=C(O)C(O)=CC=C1 DY20146 [0,2,0,0,0,0|2,0,0]=4 1496 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 NO14948 [0,2,0,0,0,0|1,0,0]=3 1497 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 DY10476 [0,2,0,0,0,0|1,0,0]=3 1498 B11R1.167 CC(=O)C1=C(Cl)C=CC(Cl)=C1 NO21139 [0,2,0,0,0,0|1,0,0]=3 1499 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 NO10721 [0,2,0,0,0,0|1,0,0]=3 1500 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=C1 NO12150 [0,2,0,0,0,0|1,0,0]=3 1501 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 DY41254 [0,2,0,0,0,0|1,0,0]=3 1502 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 NO18839 [0,2,0,0,0,0|1,0,0]=3 1503 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 DY10366 [0,2,0,0,0,0|1,0,0]=3 1504 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 NO12985 [0,2,0,0,0,0|1,0,0]=3 1505 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 NO12192 [0,2,0,0,0,0|1,0,0]=3 1506 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 NO15935 [0,2,0,0,0,0|1,0,0]=3 1507 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 DY10135 [0,2,0,0,0,0|1,0,0]=3 1508 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 NO13715 [0,2,0,0,0,0|1,0,0]=3 1509 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 NO20840 [0,2,0,0,0,0|1,0,0]=3 1510 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 NO19932 [0,2,0,0,0,0|1,0,0]=3 1511 B11R1.167 CC(=O)C1=NC(C)=CC=C1C DY111076 [0,2,0,0,0,0|0,0,0]=2 1512 B11R1.167 CC(=O)C1=NC(Cl)=NC=C1C NO15957 [0,2,0,0,0,0|1,0,0]=3 1513 B11R1.167 CC(=O)C1=NC(F)=CC=C1Br DY652262 [0,2,0,0,0,0|0,0,0]=2 1514 B11R1.167 CC(=O)c1cc(C)ccc1C DY585131 [0,2,0,0,0,0|1,0,0]=3 1515 B11R1.167 CC(=O)c1cc(N)ccc1Cl DY799413 [0,2,0,0,0,0|1,0,0]=3 1516 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 NO20805 [0,2,0,0,0,0|2,0,0]=4 1517 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 NO10331 [0,2,0,0,0,0|2,0,0]=4 1518 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 NO14966 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 NO21678 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 NO10400 [0,2,0,0,0,0|2,0,0]=4 1521 B11R1.167 CC1=C(C(N)=O)C=C(F)C=C1 DY746125 [0,2,0,0,0,0|2,0,0]=4 1522 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 NO10772 [0,2,0,0,0,0|2,0,0]=4 1523 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 NO21075 [0,2,0,0,0,0|2,0,0]=4 1524 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 NO19779 [0,2,0,0,0,0|2,0,0]=4 1525 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 NO21612 [0,2,0,0,0,0|2,0,0]=4 1526 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 NO20992 [0,2,0,0,0,0|2,0,0]=4 1527 B11R1.167 CC1=CC(C(N)=O)=C(N)C=C1 NO14304 [0,2,0,0,0,0|2,0,0]=4 1528 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 DY559077 [0,2,0,0,0,0|1,0,0]=3 1529 B11R1.167 CC1=CC=C(O)C(C(=O)O)=N1 DY443687 [0,2,0,0,0,0|1,0,0]=3 1530 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 DY105730 [0,2,0,0,0,0|2,0,0]=4 1531 B11R1.167 CC1=CN=C(Cl)N=C1C(=O)O DY115904 [0,2,0,0,0,0|2,0,0]=4 1532 B11R1.167 CC1=NC=C(Br)C(C(=O)O)=N1 NO19714 [0,2,0,0,0,0|2,0,0]=4 1533 B11R1.167 NC(=O)C1=C(N)C=CC(Br)=C1 NO21271 [0,2,0,0,0,0|2,0,0]=4 1534 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 DY20679 [0,2,0,0,0,0|2,0,0]=4 1535 B11R1.167 NC(=O)C1=CC(Cl)=CC=C1O NO15710 [0,2,0,0,0,0|2,0,0]=4 1536 B11R1.167 NC(=O)C1=NC(Br)=CC=C1F DY431838 [0,2,0,0,0,0|1,0,0]=3 1537 B11R1.167 NC(=O)C1=NC(Br)=CN=C1N DY446957 [0,2,0,0,0,0|2,0,0]=4 1538 B11R1.167 NC(=O)C1=NC(Cl)=CC=C1N DY10412 [0,2,0,0,0,0|1,0,0]=3 1539 B11R1.167 NC(=O)C1=NC(F)=CN=C1N DY710095 [0,2,0,0,0,0|2,0,0]=4 1540 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 NO20202 [0,2,0,0,0,0|2,0,0]=4 1541 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 NO21817 [0,2,0,0,0,0|2,0,0]=4 1542 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 NO20231 [0,2,0,0,0,0|2,0,0]=4 1543 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=C1 NO18210 [0,2,0,0,0,0|2,0,0]=4 1544 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 NO20208 [0,2,0,0,0,0|2,0,0]=4 1545 B11R1.167 NC1=CC(C(=O)O)=C(O)C=C1 NO16234 [0,2,0,0,0,0|2,0,0]=4 1546 B11R1.167 NC1=CC=C(Br)C(C(=O)O)=N1 DY503307 [0,2,0,0,0,0|1,0,0]=3 1547 B11R1.167 NC1=CC=C(Br)N=C1[N+](=O)[O-] NO17780 [0,2,0,0,0,0|2,0,0]=4 1548 B11R1.167 NC1=NC=C(Br)N=C1C(=O)O NO22088 [0,2,0,0,0,0|2,0,0]=4 1549 B11R1.167 NC1=NC=C(Cl)C(C(=O)O)=N1 DY555435 [0,2,0,0,0,0|2,0,0]=4 1550 B11R1.167 NC1=NC=C(Cl)C(C(=O)O)=N1 NO17503 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.167 NC1=NC=C(Cl)N=C1C(=O)O NO12627 [0,2,0,0,0,0|2,0,0]=4 1552 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 NO19808 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 NO19830 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 NO19846 [0,2,0,0,0,0|2,0,0]=4 1555 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 NO10221 [0,2,0,0,0,0|2,0,0]=4 1556 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 NO19898 [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=C1 NO21466 [0,2,0,0,0,0|2,0,0]=4 1558 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 NO22027 [0,2,0,0,0,0|2,0,0]=4 1559 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 NO20031 [0,2,0,0,0,0|2,0,0]=4 1560 B11R1.167 O=C(O)C1=C(F)C=CC(O)=C1 NO10371 [0,2,0,0,0,0|2,0,0]=4 1561 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 NO10237 [0,2,0,0,0,0|2,0,0]=4 1562 B11R1.167 O=C(O)C1=C(I)C=CC(F)=C1 NO14765 [0,2,0,0,0,0|2,0,0]=4 1563 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 NO16232 [0,2,0,0,0,0|2,0,0]=4 1564 B11R1.167 O=C(O)C1=C(O)C=CC(Cl)=C1 NO14141 [0,2,0,0,0,0|2,0,0]=4 1565 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 NO10374 [0,2,0,0,0,0|2,0,0]=4 1566 B11R1.167 O=C(O)C1=NC(Br)=CC=C1O NO12800 [0,2,0,0,0,0|1,0,0]=3 1567 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br NO13146 [0,2,0,0,0,0|1,0,0]=3 1568 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Cl NO18671 [0,2,0,0,0,0|1,0,0]=3 1569 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F DY20813 [0,2,0,0,0,0|1,0,0]=3 1570 B11R1.167 O=C(O)C1=NC(F)=CC=C1Br DY711277 [0,2,0,0,0,0|1,0,0]=3 1571 B11R1.167 O=C(O)C1=NC(O)=CC=C1Cl NO16420 [0,2,0,0,0,0|1,0,0]=3 1572 B11R1.167 O=[N+]([O-])C1=NC(Br)=CC=C1O NO14428 [0,2,0,0,0,0|2,0,0]=4 1573 B11R1.167 O=[N+]([O-])C1=NC(Cl)=CC=C1O DY577809 [0,2,0,0,0,0|2,0,0]=4 1574 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 NO11107 [0,2,0,0,0,0|1,0,0]=3 1575 B11R1.74 CC(=O)C1=CC(C)=NC(C)=C1 DY652052 [0,2,0,0,0,0|2,0,0]=4 1576 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 NO10716 [0,2,0,0,0,0|1,0,0]=3 1577 B11R1.74 CC(=O)C1=NC(C)=CC(C)=C1 NO15839 [0,2,0,0,0,0|0,0,0]=2 1578 B11R1.74 CC(=O)C1=NC(Cl)=NC(Cl)=C1 DY692398 [0,2,0,0,0,0|1,0,0]=3 1579 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=C1 NO12399 [0,2,0,0,0,0|2,0,0]=4 1580 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=C1 NO15533 [0,2,0,0,0,0|2,0,0]=4 1581 B11R1.74 CC1=CC(C(=O)O)=CC(F)=C1 NO14703 [0,2,0,0,0,0|2,0,0]=4 1582 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 NO10680 [0,2,0,0,0,0|1,0,0]=3 1583 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=N1 DY578361 [0,2,0,0,0,0|2,0,0]=4 1584 B11R1.74 CC1=CC(C(N)=O)=NC(Cl)=N1 DY737804 [0,2,0,0,0,0|2,0,0]=4 1585 B11R1.74 CC1=CC(C)=CC(C(=O)Cl)=C1 DY20749 [0,2,0,0,0,0|2,0,0]=4 1586 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 NO21904 [0,2,0,0,0,0|2,0,0]=4 1587 B11R1.74 CC1=CC(Cl)=CC(C(N)=O)=N1 DY658469 [0,2,0,0,0,0|1,0,0]=3 1588 B11R1.74 CC1=CC(N)=CC(C(=O)O)=C1 DY20267 [0,2,0,0,0,0|2,0,0]=4 1589 B11R1.74 CC1=NC(C(=O)O)=CC(=O)N1 DY549933 [0,2,0,0,0,0|2,0,0]=4 1590 B11R1.74 NC(=O)C1=NC(Cl)=NC(Cl)=C1 DY583407 [0,2,0,0,0,0|2,0,0]=4 1591 B11R1.74 NC1=CC(Br)=CC(C(=O)O)=C1 NO22075 [0,2,0,0,0,0|2,0,0]=4 1592 B11R1.74 NC1=CC(F)=CC(C(=O)O)=C1 NO10981 [0,2,0,0,0,0|2,0,0]=4 1593 B11R1.74 NC1=CC(O)=CC(C(=O)O)=C1 NO22078 [0,2,0,0,0,0|2,0,0]=4 1594 B11R1.74 O=C(Cl)C1=CC(Br)=CC(Cl)=C1 DY40441 [0,2,0,0,0,0|2,0,0]=4 1595 B11R1.74 O=C(Cl)C1=CC(Br)=CC(F)=C1 DY451606 [0,2,0,0,0,0|2,0,0]=4 1596 B11R1.74 O=C(Cl)C1=CC(Cl)=CC(F)=C1 DY40453 [0,2,0,0,0,0|2,0,0]=4 1597 B11R1.74 O=C(Cl)C1=NC(Cl)=CC(Cl)=C1 DY106018 [0,2,0,0,0,0|1,0,0]=3 1598 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 NO19812 [0,2,0,0,0,0|2,0,0]=4 1599 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 NO12668 [0,2,0,0,0,0|2,0,0]=4 1600 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 NO21917 [0,2,0,0,0,0|2,0,0]=4 1601 B11R1.74 O=C(O)C1=CC(Br)=CC(I)=C1 DY20185 [0,2,0,0,0,0|2,0,0]=4 1602 B11R1.74 O=C(O)C1=CC(Br)=CC(O)=C1 DY40243 [0,2,0,0,0,0|2,0,0]=4 1603 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 NO14664 [0,2,0,0,0,0|2,0,0]=4 1604 B11R1.74 O=C(O)C1=CC(Cl)=CC(I)=C1 NO22224 [0,2,0,0,0,0|2,0,0]=4 1605 B11R1.74 O=C(O)C1=CC(F)=CC(O)=C1 NO14447 [0,2,0,0,0,0|2,0,0]=4 1606 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 DY20481 [0,2,0,0,0,0|2,0,0]=4 1607 B11R1.74 O=C(O)C1=NC(Br)=CC(Br)=C1 DY442155 [0,2,0,0,0,0|1,0,0]=3 1608 B11R1.74 O=C(O)C1=NC(Cl)=CC(Br)=C1 NO17530 [0,2,0,0,0,0|1,0,0]=3 1609 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=C1 NO22506 [0,2,0,0,0,0|1,0,0]=3 1610 B11R1.74 O=C([O-])C1=NC(O)=NC(O)=C1 DY737426 [0,2,0,0,0,0|2,0,0]=4 1611 B11R1.266 CCC1=CC=CC(C(=O)O)=N1 NO21756 [0,2,0,0,0,0|1,0,0]=3 1612 B11R1.266 CCc1cccc(C(C)=O)c1 DY584661 [0,2,0,0,0,0|1,0,0]=3 1613 B11R1.266 CN(C)C1=NC=CC(CO)=C1 DY609695 [0,2,0,0,0,0|2,0,0]=4 1614 B11R1.266 CNC1=CC=CC(C(=O)O)=N1 NO18139 [0,2,0,0,0,0|1,0,0]=3 1615 B11R1.266 COC1=CC(C(=O)O)=NC=C1 NO20334 [0,2,0,0,0,0|1,0,0]=3 1616 B11R1.266 COC1=CC(C(N)=O)=NC=C1 DY578733 [0,2,0,0,0,0|1,0,0]=3 1617 B11R1.266 COC1=CC=CC(C(=O)O)=N1 NO18200 [0,2,0,0,0,0|1,0,0]=3 1618 B11R1.266 COC1=CN=CC(C(=O)O)=N1 NO14316 [0,2,0,0,0,0|2,0,0]=4 1619 B11R1.266 CSC1=NC=CC(C(=O)O)=N1 NO19819 [0,2,0,0,0,0|2,0,0]=4 1620 B11R1.266 CSC1=NC=CC(C(C)=O)=N1 NO14547 [0,2,0,0,0,0|1,0,0]=3 1621 B11R1.266 N#CC1=CC=CC(C(=N)N)=N1 DY712423 [0,2,0,0,0,0|2,0,0]=4 1622 B11R1.266 N#CC1=CC=CC(C(=O)Cl)=C1 DY20560 [0,2,0,0,0,0|2,0,0]=4 1623 B11R1.266 N#CC1=CC=CC(C(=O)O)=N1 NO14616 [0,2,0,0,0,0|1,0,0]=3 1624 B11R1.266 N#CC1=NC=CC(C(=O)O)=N1 DY693442 [0,2,0,0,0,0|2,0,0]=4 1625 B11R1.266 NC(=O)C1=CC(C=O)=CC=C1 DY515523 [0,2,0,0,0,0|2,0,0]=4 1626 B11R1.266 NC(=O)C1=CC(CBr)=CC=C1 NO16760 [0,2,0,0,0,0|2,0,0]=4 1627 B11R1.266 NC(=O)C1=NC(CO)=CC=C1 DY434007 [0,2,0,0,0,0|1,0,0]=3 1628 B11R1.266 NC(=O)C1=NC=CC(CO)=C1 DY657937 [0,2,0,0,0,0|1,0,0]=3 1629 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 DY789789 [0,2,0,0,0,0|2,0,0]=4 1630 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 NO21006 [0,2,0,0,0,0|2,0,0]=4 1631 B11R1.266 O=C(O)C1=CC(CCl)=CC=C1 NO18966 [0,2,0,0,0,0|2,0,0]=4 1632 B11R1.266 O=CC1=CC(C(=O)O)=CC=C1 NO21920 [0,2,0,0,0,0|2,0,0]=4 1633 B9R2.50 C1=CC=C2CCC2=C1 NO19267 [1,0,0,1,0,0|1,0,1]=4 1634 B11R2.10 BrC1=CC2=CC=CC=C2C1 NO21490 [0,0,0,1,0,1|2,0,0]=4 1635 B11R2.10 CC1=CC2=CC=CC=C2N1 NO18563 [0,0,0,1,0,1|2,0,0]=4 1636 B11R2.10 CC1=CC2=CC=CN=C2N1 NO19733 [0,0,0,1,0,1|1,0,0]=3 1637 B11R2.10 CC1=CC2=NC=CC=C2N1 NO15017 [0,0,0,1,0,1|1,0,0]=3 1638 B11R2.10 CC1=CN2C=CC=CC2=N1 NO21691 [0,0,0,1,0,1|1,0,1]=4 1639 B11R2.10 CC1=NC2=C(C=CC=C2)N1 NO15288 [0,0,0,1,0,1|2,0,0]=4 1640 B11R2.10 CC1=NC2=C(C=CC=C2)S1 NO21687 [0,0,0,1,0,1|1,1,0]=4 1641 B11R2.10 CC1=NC2=NC=CC=C2N1 NO21659 [0,0,0,1,0,1|1,0,0]=3 1642 B11R2.10 CC1=NC2=NC=CC=C2O1 DY445727 [0,0,0,1,0,1|0,0,1]=3 1643 B11R2.10 CC1=NN2C=CC=NC2=C1 DY571905 [0,0,0,1,0,1|2,0,0]=4 1644 B11R2.10 ClC1=NC2=CC=CN=C2S1 NO16822 [0,0,0,1,0,1|2,0,0]=4 1645 B11R2.10 ClC1=NC2=NC=CC=C2N1 NO15218 [0,0,0,1,0,1|2,0,0]=4 1646 B11R2.10 ClC1=NC2=NC=CC=C2S1 NO13069 [0,0,0,1,0,1|1,1,0]=4 1647 B11R2.10 IC1=CC2=CC=CN=C2N1 NO15616 [0,0,0,1,0,1|1,0,1]=4 1648 B11R2.10 NC1=NC2=NC=CC=C2S1 NO15266 [0,0,0,1,0,1|1,1,0]=4 1649 B11R2.10 O=C1CC2=C(C=CC=C2)O1 DY20944 [0,0,0,1,0,1|1,0,0]=3 1650 B11R2.10 O=C1CC2=CC=CC=C2C1 NO16080 [0,0,0,1,0,1|1,0,0]=3 1651 B11R2.10 O=C1CC2=CC=CC=C2N1 NO15184 [0,0,0,1,0,1|1,0,0]=3 1652 B11R2.10 O=C1CC2=CC=CN=C2N1 DY523179 [0,0,0,1,0,1|0,0,0]=2 1653 B11R2.10 O=C1CN2C=CC=CC2N1 DY760274 [0,0,0,1,0,1|0,0,2]=4 1654 B11R2.10 O=C1NC2=C(C=CC=C2)O1 NO15190 [0,0,0,1,0,1|2,0,0]=4 1655 B11R2.10 O=C1NC2=NC=CC=C2O1 NO18902 [0,0,0,1,0,1|1,0,0]=3 1656 B11R2.10 O=C1OC2=C(C=CC=C2)O1 NO10973 [0,0,0,1,0,1|2,0,0]=4 1657 B11R2.10 OC1=CC2=NC=CC=C2N1 DY670456 [0,0,0,1,0,1|1,0,1]=4 1658 B11R2.10 S=C1NC2=NC=CC=C2O1 DY558729 [0,0,0,1,0,1|1,0,1]=4 1659 B11R2.34 BrC1=CN=C(C2CC2)C=C1 DY561543 [0,1,0,1,0,0|1,0,1]=4 1660 B11R2.1 BrC1=C2N=CC=CC2=NS1 DY554217 [0,1,0,1,0,0|1,1,0]=4 1661 B11R2.1 BrC1=CNC2=CC=CN=C12 NO13195 [0,1,0,1,0,0|1,0,1]=4 1662 B11R2.1 BrC1=COC2=CC=CN=C12 DY580287 [0,1,0,1,0,0|1,0,1]=4 1663 B11R2.1 BrC1=NNC2=CC=CN=C21 NO12243 [0,1,0,1,0,0|2,0,0]=4 1664 B11R2.1 CC1=CCC2=CC=CC=C12 DY106180 [0,1,0,1,0,0|2,0,0]=4 1665 B11R2.1 CC1=CNC2=CC=CC=C12 NO11030 [0,1,0,1,0,0|2,0,0]=4 1666 B11R2.1 CC1=CSC2=C1N=CN=C2 DY681137 [0,1,0,1,0,0|1,1,0]=4 1667 B11R2.1 CC1=NNC2=CC=CC=C21 NO17372 [0,1,0,1,0,0|2,0,0]=4 1668 B11R2.1 CC1=NOC2=C1C=CC=C2 NO22352 [0,1,0,1,0,0|1,0,1]=4 1669 B11R2.1 CN1C=CC2=CC=CN=C21 NO20755 [0,1,0,1,0,0|2,0,0]=4 1670 B11R2.1 IC1=CNC2=CC=CN=C12 NO15332 [0,1,0,1,0,0|1,0,1]=4 1671 B11R2.1 NC1=NCC2=CC=CC=C21 DY459738 [0,1,0,1,0,0|2,0,0]=4 1672 B11R2.1 NC1=NOC2=CC=CN=C21 NO12630 [0,1,0,1,0,0|1,0,1]=4 1673 B11R2.1 O=C1CCC2=CC=CC=C12 NO18668 [0,1,0,1,0,0|1,0,0]=3 1674 B11R2.1 O=C1CCC2=CC=CN=C12 NO10816 [0,1,0,1,0,0|0,0,0]=2 1675 B11R2.1 O=C1CCC2=NC=CC=C12 NO18212 [0,1,0,1,0,0|2,0,0]=4 1676 B11R2.1 O=C1COC2=NC=CC=C12 DY441318 [0,1,0,1,0,0|2,0,0]=4 1677 B11R2.1 O=C1CSC2=C1C=CC=C2 NO20606 [0,1,0,1,0,0|1,0,0]=3 1678 B11R2.1 O=C1N=NC2=CC=CC=C12 DY762524 [0,1,0,1,0,0|2,0,0]=4 1679 B11R2.1 O=C1NCC2=CC=CC=C12 NO11515 [0,1,0,1,0,0|1,0,0]=3 1680 B11R2.1 O=C1NCC2=NC=CC=C12 DY553185 [0,1,0,1,0,0|2,0,0]=4 1681 B11R2.1 O=C1NNC2=CC=CN=C12 NO16829 [0,1,0,1,0,0|1,0,0]=3 1682 B11R2.1 O=C1NSC2=C1C=CC=C2 NO14057 [0,1,0,1,0,0|2,0,0]=4 1683 B11R2.1 O=C1OCC2=CC=CC=C12 NO11853 [0,1,0,1,0,0|1,0,0]=3 1684 B11R2.1 O=C1OCC2=NC=CC=C12 NO11423 [0,1,0,1,0,0|2,0,0]=4 1685 B11R2.1 OC1CCC2=CC=CN=C21 NO10573 [0,1,0,1,0,0|0,0,2]=4 1686 B11R2.239 C1=CN=C(C2COC2)C=C1 DY732907 [0,1,0,1,0,0|0,0,2]=4 1687 B11R2.35 CC1=CC(C2=NC2)=CC=C1 DY770565 [0,1,0,1,0,0|2,0,0]=4 1688 B7R1.1 CCC1=NC=CN1 NO21533 [1,0,0,0,1,0|1,0,1]=4 1689 B7R1.1 CCN1C=CC=N1 NO20681 [1,0,0,0,1,0|1,0,1]=4 1690 B7R1.1 CNC1=CC=CS1 DY786838 [1,0,0,0,1,0|2,0,0]=4 1691 B7R1.1 CNC1=NNC=C1 DY555147 [1,0,0,0,1,0|2,0,0]=4 1692 B7R1.1 COC1=CC=CO1 DY759896 [1,0,0,0,1,0|2,0,0]=4 1693 B7R1.1 COC1=CNC=N1 DY725797 [1,0,0,0,1,0|2,0,0]=4 1694 B7R1.1 COC1=CSC=C1 NO22351 [1,0,0,0,1,0|2,0,0]=4 1695 B7R1.1 COC1=NC=CS1 NO22597 [1,0,0,0,1,0|2,0,0]=4 1696 B7R1.1 CSC1=NC=CO1 NO17723 [1,0,0,0,1,0|2,0,0]=4 1697 B7R1.1 O=CC1=CC=CN1 NO17764 [1,0,0,0,1,0|0,0,1]=3 1698 B7R1.1 O=CC1=CC=CS1 NO16400 [1,0,0,0,1,0|1,0,0]=3 1699 B7R1.1 O=CC1=CN=CS1 NO15582 [1,0,0,0,1,0|2,0,0]=4 1700 B7R1.1 O=CC1=CNC=C1 NO20728 [1,0,0,0,1,0|1,0,0]=3 1701 B7R1.1 O=CC1=CNC=N1 NO14113 [1,0,0,0,1,0|1,0,0]=3 1702 B7R1.1 O=CC1=CNN=C1 NO17644 [1,0,0,0,1,0|2,0,0]=4 1703 B7R1.1 O=CC1=CNN=C1 NO18258 [1,0,0,0,1,0|2,0,0]=4 1704 B7R1.1 O=CC1=CSC=C1 NO14553 [1,0,0,0,1,0|1,0,0]=3 1705 B7R1.1 O=CC1=NC=CN1 NO15723 [1,0,0,0,1,0|1,0,0]=3 1706 B7R1.1 O=CC1=NC=CO1 DY565689 [1,0,0,0,1,0|1,0,0]=3 1707 B7R1.1 O=CC1=NNC=C1 NO18284 [1,0,0,0,1,0|1,0,0]=3 1708 B11R1.91 CC(=O)CCC1=CC=CN=C1 DY560043 [0,0,0,0,0,2|2,0,0]=4 1709 B11R1.91 CC(C)COC1=NC=CC=C1 DY655892 [0,0,0,0,0,2|1,0,1]=4 1710 B11R1.91 N=C(N)CCC1=NC=CC=C1 DY459714 [0,0,0,0,0,2|2,0,0]=4 1711 B11R1.91 NC(=O)CCC1=NC=CC=C1 DY713935 [0,0,0,0,0,2|1,0,0]=3 1712 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 NO21725 [0,0,0,0,0,2|2,0,0]=4 1713 B11R1.91 O=C(O)C#CC1=CC=CC=C1 NO10957 [0,0,0,0,0,2|2,0,0]=4 1714 B11R1.91 O=C(O)CCC1=CC=CC=C1 DY556977 [0,0,0,0,0,2|2,0,0]=4 1715 B11R1.91 O=C(O)CNc1ccccc1 DY439073 [0,0,0,0,0,2|2,0,0]=4 1716 B11R1.91 O=C(O)CSC1=NC=CC=C1 DY500080 [0,0,0,0,0,2|1,0,0]=3