0 B8R1.2 BrCC1=CC=NC=C1 SBB054924 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.2 BrCC1=NC=CC=C1 SBB054926 [0,0,0,0,0,0|2,0,0]=2 2 B8R1.2 C#CC1=CC=CC=C1 SBB040919 [0,0,0,0,0,0|2,0,2]=4 3 B8R1.2 C#CC1=CC=CC=N1 SBB006619 [0,0,0,0,0,0|1,0,2]=3 4 B8R1.2 C#CC1=CC=CN=C1 SBB065464 [0,0,0,0,0,0|1,0,2]=3 5 B8R1.2 C=CC1=NC=CN=C1 SBB055880 [0,0,0,0,0,0|0,0,2]=2 6 B8R1.2 CCC1=CC=CC=C1 SBB040891 [0,0,0,0,0,0|2,0,0]=2 7 B8R1.2 CCC1=CC=CC=N1 SBB060373 [0,0,0,0,0,0|1,0,0]=1 8 B8R1.2 CCC1=CC=NC=C1 SBB061128 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.2 CCC1=CN=CC=C1 SBB060374 [0,0,0,0,0,0|1,0,0]=1 10 B8R1.2 CNC1=CC=CC=C1 SBB008162 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.2 CNC1=CC=CC=C1 SBB059778 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.2 CNC1=NC=CN=C1 SBB018751 [0,0,0,0,0,0|1,0,0]=1 13 B8R1.2 CSC1=NN=CC=N1 SBB085690 [0,0,0,0,0,0|2,0,0]=2 14 B8R1.2 ClCC1=CC=NC=C1 SBB003917 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.2 ClCC1=NC=CC=C1 SBB054925 [0,0,0,0,0,0|2,0,0]=2 16 B8R1.2 N#CC1=CC=CC=C1 SBB028746 [0,0,0,0,0,0|3,0,1]=4 17 B8R1.2 N#CC1=CC=CN=C1 SBB007554 [0,0,0,0,0,0|2,0,1]=3 18 B8R1.2 N#CC1=NC=CC=C1 SBB008920 [0,0,0,0,0,0|2,0,1]=3 19 B8R1.2 N#CC1=NC=CC=N1 SBB048115 [0,0,0,0,0,0|3,0,1]=4 20 B8R1.2 N#CC1=NC=CN=C1 SBB055876 [0,0,0,0,0,0|1,0,1]=2 21 B8R1.2 NCC1=CC=CC=C1 SBB040473 [0,0,0,0,0,0|3,0,0]=3 22 B8R1.2 NCC1=CC=CN=C1 SBB004351 [0,0,0,0,0,0|2,0,0]=2 23 B8R1.2 NCC1=CC=NC=C1 SBB004350 [0,0,0,0,0,0|4,0,0]=4 24 B8R1.2 NCC1=NC=CC=C1 SBB004352 [0,0,0,0,0,0|2,0,0]=2 25 B8R1.2 NCC1=NC=CN=C1 SBB014584 [0,0,0,0,0,0|1,0,0]=1 26 B8R1.2 NCC1=NC=NC=C1 SBB086444 [0,0,0,0,0,0|3,0,0]=3 27 B8R1.2 NNC1=CC=CC=C1 SBB040886 [0,0,0,0,0,0|4,0,0]=4 28 B8R1.2 NNC1=CC=CN=N1 SBB055934 [0,0,0,0,0,0|4,0,0]=4 29 B8R1.2 NNC1=NC=CC=N1 SBB047725 [0,0,0,0,0,0|4,0,0]=4 30 B8R1.2 O=CC1=CC=CN=C1 SBB004359 [0,0,0,0,0,0|2,0,1]=3 31 B8R1.2 O=CC1=CN=CN=C1 SBB065690 [0,0,0,0,0,0|3,0,1]=4 32 B8R1.2 O=CC1=NC=CC=C1 SBB004358 [0,0,0,0,0,0|2,0,1]=3 33 B8R1.2 O=CC1=NC=CC=N1 SBB052320 [0,0,0,0,0,0|3,0,1]=4 34 B8R1.2 O=CC1=NC=CN=C1 SBB052318 [0,0,0,0,0,0|1,0,1]=2 35 B8R1.2 OCC1=CC=CC=C1 SBB058558 [0,0,0,0,0,0|3,0,0]=3 36 B8R1.2 OCC1=CC=CN=C1 SBB004344 [0,0,0,0,0,0|2,0,0]=2 37 B8R1.2 OCC1=CC=CN=N1 SBB054829 [0,0,0,0,0,0|3,0,0]=3 38 B8R1.2 OCC1=CC=NC=C1 SBB004347 [0,0,0,0,0,0|4,0,0]=4 39 B8R1.2 OCC1=CN=CN=C1 SBB065691 [0,0,0,0,0,0|3,0,0]=3 40 B8R1.2 OCC1=NC=CC=C1 SBB004348 [0,0,0,0,0,0|2,0,0]=2 41 B8R1.2 OCC1=NC=CN=C1 SBB054824 [0,0,0,0,0,0|1,0,0]=1 42 B8R1.2 OCC1=NC=NC=C1 SBB054828 [0,0,0,0,0,0|3,0,0]=3 43 B8R1.2 ONC1=CC=CC=C1 SBB008413 [0,0,0,0,0,0|4,0,0]=4 44 B8R1.2 [NH+]1=CC=CC(CCl)=C1 SBB061738 [0,0,0,0,0,0|2,0,1]=3 45 B8R1.2 [NH3+]NC1=CC=CC=C1 SBB060000 [0,0,0,0,0,0|4,0,0]=4 46 B7R1.3 BrC1=CC=CN=C1 SBB003998 [1,0,0,0,0,0|2,0,0]=3 47 B7R1.3 BrC1=CN=CN=C1 SBB054477 [1,0,0,0,0,0|3,0,0]=4 48 B7R1.3 BrC1=NC=CC=C1 SBB003999 [1,0,0,0,0,0|2,0,0]=3 49 B7R1.3 BrC1=NC=CC=N1 SBB054484 [1,0,0,0,0,0|3,0,0]=4 50 B7R1.3 BrC1=NC=CN=C1 SBB087333 [1,0,0,0,0,0|1,0,0]=2 51 B7R1.3 BrC1=NC=NC=C1 SBB054515 [1,0,0,0,0,0|3,0,0]=4 52 B7R1.3 CC1=CN=CC=N1 SBB060830 [1,0,0,0,0,0|0,0,0]=1 53 B7R1.3 ClC1=CC=CC=C1 SBB040899 [1,0,0,0,0,0|3,0,0]=4 54 B7R1.3 ClC1=CC=CN=N1 SBB054542 [1,0,0,0,0,0|3,0,0]=4 55 B7R1.3 ClC1=NC=CC=C1 SBB079180 [1,0,0,0,0,0|2,0,0]=3 56 B7R1.3 ClC1=NC=CC=N1 SBB054479 [1,0,0,0,0,0|3,0,0]=4 57 B7R1.3 ClC1=NC=NC=C1 SBB054514 [1,0,0,0,0,0|3,0,0]=4 58 B7R1.3 FC1=CC=CN=C1 SBB054315 [1,0,0,0,0,0|2,0,0]=3 59 B7R1.3 FC1=NC=CC=C1 SBB062911 [1,0,0,0,0,0|2,0,0]=3 60 B7R1.3 IC1=CC=CN=C1 SBB054246 [1,0,0,0,0,0|2,0,0]=3 61 B7R1.3 IC1=NC=CC=C1 SBB054364 [1,0,0,0,0,0|2,0,0]=3 62 B7R1.3 IC1=NC=CN=C1 SBB093563 [1,0,0,0,0,0|1,0,0]=2 63 B7R1.3 NC1=CC=CC=N1 SBB004394 [1,0,0,0,0,0|2,0,0]=3 64 B7R1.3 NC1=CC=CN=N1 SBB051973 [1,0,0,0,0,0|3,0,0]=4 65 B7R1.3 NC1=CC=NC=N1 SBB028163 [1,0,0,0,0,0|3,0,0]=4 66 B7R1.3 NC1=CN=CC=C1 SBB004395 [1,0,0,0,0,0|2,0,0]=3 67 B7R1.3 NC1=CN=CC=N1 SBB004388 [1,0,0,0,0,0|1,0,0]=2 68 B7R1.3 NC1=CN=CN=C1 SBB051965 [1,0,0,0,0,0|3,0,0]=4 69 B7R1.3 NC1=NC=CC=N1 SBB004387 [1,0,0,0,0,0|3,0,0]=4 70 B7R1.3 NC1=NN=CC=N1 SBB004379 [1,0,0,0,0,0|2,0,0]=3 71 B7R1.3 O=C1C=CC=NN1 SBB005360 [1,0,0,0,0,0|3,0,0]=4 72 B7R1.3 O=C1N=CC=CN1 SBB004216 [1,0,0,0,0,0|3,0,0]=4 73 B7R1.3 OC1=CC=CC=N1 SBB004392 [1,0,0,0,0,0|2,0,0]=3 74 B7R1.3 OC1=CN=CC=C1 SBB004391 [1,0,0,0,0,0|2,0,0]=3 75 B7R1.3 OC1=NC=CC=N1 SBB004380 [1,0,0,0,0,0|3,0,0]=4 76 B7R1.3 OC1=NC=NC=C1 SBB055919 [1,0,0,0,0,0|3,0,0]=4 77 B7R1.3 SC1=CC=CC=N1 SBB058593 [1,0,0,0,0,0|2,0,0]=3 78 B7R1.3 SC1=NC=CC=N1 SBB007595 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.1 BrCC1=CC=C(Br)C=C1 SBB040668 [0,1,0,0,0,0|3,0,0]=4 80 B9R1.1 BrCC1=CC=C(I)C=C1 SBB054901 [0,1,0,0,0,0|3,0,0]=4 81 B9R1.1 C(=O)C1=CC=C(Cl)N=C1 SBB004157 [0,1,0,0,0,0|2,0,1]=4 82 B9R1.1 CC1=CC=C(CCl)C=C1 SBB040648 [0,1,0,0,0,0|3,0,0]=4 83 B9R1.1 CC1=CC=C(CN)C=C1 SBB040468 [0,1,0,0,0,0|3,0,0]=4 84 B9R1.1 CC1=CC=C(CO)C=C1 SBB063354 [0,1,0,0,0,0|3,0,0]=4 85 B9R1.1 CC1=CC=C(CS)C=C1 SBB086032 [0,1,0,0,0,0|3,0,0]=4 86 B9R1.1 CC1=CN=C(C#N)C=C1 SBB055740 [0,1,0,0,0,0|2,0,1]=4 87 B9R1.1 CC1=CN=C(C=O)C=C1 SBB065436 [0,1,0,0,0,0|2,0,1]=4 88 B9R1.1 CC1=CN=C(CN)C=N1 SBB052489 [0,1,0,0,0,0|1,0,0]=2 89 B9R1.1 CC1=NC=C(C#N)C=C1 SBB065528 [0,1,0,0,0,0|2,0,1]=4 90 B9R1.1 CC1=NC=C(C=O)C=C1 SBB065430 [0,1,0,0,0,0|2,0,1]=4 91 B9R1.1 CC1=NC=C(CO)C=N1 SBB054825 [0,1,0,0,0,0|3,0,0]=4 92 B9R1.1 CCC1=CC=C(Br)C=C1 SBB054183 [0,1,0,0,0,0|2,0,0]=3 93 B9R1.1 CCC1=CC=C(Br)C=C1 SBB060979 [0,1,0,0,0,0|2,0,0]=3 94 B9R1.1 CCC1=CC=C(C)N=C1 SBB060375 [0,1,0,0,0,0|1,0,0]=2 95 B9R1.1 CCC1=CC=C(F)C=C1 SBB085565 [0,1,0,0,0,0|2,0,0]=3 96 B9R1.1 CCC1=CC=C(N)C=C1 SBB040445 [0,1,0,0,0,0|2,0,0]=3 97 B9R1.1 CCC1=CC=C(O)C=C1 SBB057513 [0,1,0,0,0,0|2,0,0]=3 98 B9R1.1 CNC1=CC=C(N)C=C1 SBB003597 [0,1,0,0,0,0|3,0,0]=4 99 B9R1.1 CNC1=NC=C(Br)C=N1 SBB090683 [0,1,0,0,0,0|3,0,0]=4 100 B9R1.1 CNC1=NN=C(Cl)C=C1 SBB010299 [0,1,0,0,0,0|3,0,0]=4 101 B9R1.1 COC1=CC=C(Br)C=C1 SBB060208 [0,1,0,0,0,0|3,0,0]=4 102 B9R1.1 COC1=CC=C(Br)C=N1 SBB059393 [0,1,0,0,0,0|2,0,0]=3 103 B9R1.1 COC1=CC=C(C)C=C1 SBB060064 [0,1,0,0,0,0|3,0,0]=4 104 B9R1.1 COC1=CC=C(Cl)C=C1 SBB061022 [0,1,0,0,0,0|3,0,0]=4 105 B9R1.1 COC1=CC=C(F)C=C1 SBB085645 [0,1,0,0,0,0|3,0,0]=4 106 B9R1.1 COC1=CC=C(I)N=N1 SBB054551 [0,1,0,0,0,0|3,0,0]=4 107 B9R1.1 COC1=CC=C(N)C=C1 SBB040441 [0,1,0,0,0,0|3,0,0]=4 108 B9R1.1 COC1=CC=C(O)C=C1 SBB060425 [0,1,0,0,0,0|3,0,0]=4 109 B9R1.1 COC1=CN=C(N)C=N1 SBB069821 [0,1,0,0,0,0|1,0,0]=2 110 B9R1.1 COC1=NC=C(Br)C=N1 SBB090872 [0,1,0,0,0,0|3,0,0]=4 111 B9R1.1 COC1=NC=C(F)C=C1 SBB085672 [0,1,0,0,0,0|2,0,0]=3 112 B9R1.1 COC1=NC=C(N)C=C1 SBB016584 [0,1,0,0,0,0|2,0,0]=3 113 B9R1.1 COC1=NC=C(N)C=N1 SBB051954 [0,1,0,0,0,0|3,0,0]=4 114 B9R1.1 COC1=NN=C(Cl)C=C1 SBB004124 [0,1,0,0,0,0|3,0,0]=4 115 B9R1.1 CSC1=CC=C(F)C=C1 SBB086252 [0,1,0,0,0,0|3,0,0]=4 116 B9R1.1 CSC1=CC=C(O)C=C1 SBB071908 [0,1,0,0,0,0|3,0,0]=4 117 B9R1.1 ClCC1=CC=C(Cl)C=C1 SBB058606 [0,1,0,0,0,0|3,0,0]=4 118 B9R1.1 ClCC1=CN=C(Cl)C=C1 SBB003948 [0,1,0,0,0,0|2,0,0]=3 119 B9R1.1 FC1=CC=C(CBr)C=C1 SBB058857 [0,1,0,0,0,0|3,0,0]=4 120 B9R1.1 FC1=CC=C(CCl)C=C1 SBB040604 [0,1,0,0,0,0|3,0,0]=4 121 B9R1.1 N#CC1=CC=C(Cl)N=C1 SBB054388 [0,1,0,0,0,0|2,0,1]=4 122 B9R1.1 N#CC1=CN=C(Br)C=C1 SBB054266 [0,1,0,0,0,0|2,0,1]=4 123 B9R1.1 N#CC1=CN=C(N)C=C1 SBB004293 [0,1,0,0,0,0|2,0,1]=4 124 B9R1.1 N#CC1=NC=C(Br)C=C1 SBB055727 [0,1,0,0,0,0|2,0,1]=4 125 B9R1.1 N#CC1=NC=C(Cl)C=C1 SBB055739 [0,1,0,0,0,0|2,0,1]=4 126 B9R1.1 N#CC1=NC=C(N)C=C1 SBB055614 [0,1,0,0,0,0|2,0,1]=4 127 B9R1.1 N#CC1=NC=C(N)N=C1 SBB055885 [0,1,0,0,0,0|1,0,1]=3 128 B9R1.1 N#CC1=NC=C(O)C=C1 SBB065240 [0,1,0,0,0,0|2,0,1]=4 129 B9R1.1 NC1=CC=C(CO)C=C1 SBB063021 [0,1,0,0,0,0|3,0,0]=4 130 B9R1.1 NC1=CC=C(CO)C=N1 SBB085554 [0,1,0,0,0,0|2,0,0]=3 131 B9R1.1 NC1=CC=C(SC)C=C1 SBB006658 [0,1,0,0,0,0|3,0,0]=4 132 B9R1.1 NCC1=CC=C(Br)C=C1 SBB090347 [0,1,0,0,0,0|3,0,0]=4 133 B9R1.1 NCC1=CC=C(Cl)C=C1 SBB004154 [0,1,0,0,0,0|3,0,0]=4 134 B9R1.1 NCC1=CC=C(Cl)N=C1 SBB049618 [0,1,0,0,0,0|2,0,0]=3 135 B9R1.1 NCC1=CC=C(F)C=C1 SBB017547 [0,1,0,0,0,0|3,0,0]=4 136 B9R1.1 NCC1=CC=C(F)C=C1 SBB028215 [0,1,0,0,0,0|3,0,0]=4 137 B9R1.1 NCC1=CC=C(I)C=C1 SBB052373 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.1 NCC1=CC=C(N)C=C1 SBB002565 [0,1,0,0,0,0|3,0,0]=4 139 B9R1.1 NCC1=CC=C(N)N=C1 SBB052464 [0,1,0,0,0,0|2,0,0]=3 140 B9R1.1 NCC1=CC=C(O)C=C1 SBB046561 [0,1,0,0,0,0|3,0,0]=4 141 B9R1.1 NNC1=CC=C(Br)C=N1 SBB068975 [0,1,0,0,0,0|3,0,0]=4 142 B9R1.1 O=CC1=CC=C(F)N=C1 SBB052255 [0,1,0,0,0,0|2,0,1]=4 143 B9R1.1 O=CC1=CC=C(O)N=C1 SBB052249 [0,1,0,0,0,0|2,0,1]=4 144 B9R1.1 O=CC1=CN=C(Br)C=C1 SBB052244 [0,1,0,0,0,0|2,0,1]=4 145 B9R1.1 O=CC1=NC=C(Br)C=C1 SBB052231 [0,1,0,0,0,0|2,0,1]=4 146 B9R1.1 O=CC1=NC=C(Cl)C=C1 SBB086215 [0,1,0,0,0,0|2,0,1]=4 147 B9R1.1 O=CC1=NC=C(F)C=C1 SBB065526 [0,1,0,0,0,0|2,0,1]=4 148 B9R1.1 OCC1=CC=C(Br)C=C1 SBB064717 [0,1,0,0,0,0|3,0,0]=4 149 B9R1.1 OCC1=CC=C(Cl)C=C1 SBB058581 [0,1,0,0,0,0|3,0,0]=4 150 B9R1.1 OCC1=CC=C(F)C=C1 SBB058560 [0,1,0,0,0,0|3,0,0]=4 151 B9R1.1 OCC1=CC=C(F)N=C1 SBB065619 [0,1,0,0,0,0|2,0,0]=3 152 B9R1.1 OCC1=CC=C(I)C=C1 SBB063681 [0,1,0,0,0,0|3,0,0]=4 153 B9R1.1 OCC1=CC=C(O)C=C1 SBB059322 [0,1,0,0,0,0|3,0,0]=4 154 B9R1.1 OCC1=CN=C(Cl)C=C1 SBB054780 [0,1,0,0,0,0|2,0,0]=3 155 B9R1.1 OCC1=NC=C(Br)C=C1 SBB065294 [0,1,0,0,0,0|2,0,0]=3 156 B9R1.1 OCC1=NC=C(Cl)C=C1 SBB086303 [0,1,0,0,0,0|2,0,0]=3 157 B9R1.1 SCC1=CC=C(Br)C=C1 SBB067614 [0,1,0,0,0,0|3,0,0]=4 158 B9R1.1 [NH2+](C)C1=CC=C(O)C=C1 SBB060652 [0,1,0,0,0,0|3,0,0]=4 159 B9R1.2 C(=O)C1=CC=CC(C)=N1 SBB004287 [0,1,0,0,0,0|2,0,1]=4 160 B9R1.2 CC1=CC(C#N)=NC=C1 SBB055617 [0,1,0,0,0,0|2,0,1]=4 161 B9R1.2 CC1=CC(C=O)=NC=C1 SBB052226 [0,1,0,0,0,0|2,0,1]=4 162 B9R1.2 CC1=CC(CN)=NC=C1 SBB052434 [0,1,0,0,0,0|2,0,0]=3 163 B9R1.2 CC1=CC=CC(CBr)=C1 SBB054906 [0,1,0,0,0,0|3,0,0]=4 164 B9R1.2 CC1=CC=CC(CBr)=N1 SBB070747 [0,1,0,0,0,0|2,0,0]=3 165 B9R1.2 CC1=CC=CC(CCl)=C1 SBB040670 [0,1,0,0,0,0|3,0,0]=4 166 B9R1.2 CC1=CC=CC(CN)=C1 SBB048016 [0,1,0,0,0,0|3,0,0]=4 167 B9R1.2 CC1=CC=CC(CN)=N1 SBB079460 [0,1,0,0,0,0|2,0,0]=3 168 B9R1.2 CC1=CC=CC(CO)=C1 SBB064816 [0,1,0,0,0,0|3,0,0]=4 169 B9R1.2 CC1=CC=CC(CO)=N1 SBB065460 [0,1,0,0,0,0|2,0,0]=3 170 B9R1.2 CC1=CC=CC(CS)=C1 SBB086034 [0,1,0,0,0,0|3,0,0]=4 171 B9R1.2 CC1=CN=CC(C#N)=C1 SBB065284 [0,1,0,0,0,0|2,0,1]=4 172 B9R1.2 CCC1=CC(C)=CC=C1 SBB061286 [0,1,0,0,0,0|2,0,0]=3 173 B9R1.2 CCC1=CC(C)=CC=C1 SBB061444 [0,1,0,0,0,0|2,0,0]=3 174 B9R1.2 CCC1=CC=CC(Br)=C1 SBB090239 [0,1,0,0,0,0|2,0,0]=3 175 B9R1.2 CCC1=CC=NC(N)=C1 SBB028207 [0,1,0,0,0,0|3,0,0]=4 176 B9R1.2 CCC1=CN=CC(Br)=C1 SBB054407 [0,1,0,0,0,0|1,0,0]=2 177 B9R1.2 CCC1=NC(N)=CC=C1 SBB028205 [0,1,0,0,0,0|1,0,0]=2 178 B9R1.2 CNC1=CC(Cl)=CC=C1 SBB086218 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.2 CNC1=CC=NC(Cl)=N1 SBB051952 [0,1,0,0,0,0|3,0,0]=4 180 B9R1.2 CNC1=NC=CC(N)=N1 SBB085558 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.2 COC1=CC(Br)=CC=C1 SBB007886 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.2 COC1=CC(F)=CC=C1 SBB085642 [0,1,0,0,0,0|3,0,0]=4 183 B9R1.2 COC1=CC(O)=CC=C1 SBB060932 [0,1,0,0,0,0|3,0,0]=4 184 B9R1.2 COC1=CC=CC(Br)=N1 SBB054383 [0,1,0,0,0,0|2,0,0]=3 185 B9R1.2 COC1=CC=CC(C)=C1 SBB061028 [0,1,0,0,0,0|3,0,0]=4 186 B9R1.2 COC1=CC=CC(F)=N1 SBB085671 [0,1,0,0,0,0|2,0,0]=3 187 B9R1.2 COC1=CC=CC(I)=C1 SBB059058 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.2 COC1=CC=CC(N)=C1 SBB040499 [0,1,0,0,0,0|3,0,0]=4 189 B9R1.2 COC1=CC=CC(N)=N1 SBB051862 [0,1,0,0,0,0|2,0,0]=3 190 B9R1.2 COC1=CC=NC(Cl)=N1 SBB054496 [0,1,0,0,0,0|3,0,0]=4 191 B9R1.2 COC1=CN=CC(Br)=C1 SBB054402 [0,1,0,0,0,0|2,0,0]=3 192 B9R1.2 COC1=NC(N)=NC=C1 SBB051950 [0,1,0,0,0,0|3,0,0]=4 193 B9R1.2 COC1=NC=CC(Br)=C1 SBB054328 [0,1,0,0,0,0|2,0,0]=3 194 B9R1.2 COC1=NC=CC(N)=C1 SBB051798 [0,1,0,0,0,0|2,0,0]=3 195 B9R1.2 COC1=NC=NC(Cl)=C1 SBB079086 [0,1,0,0,0,0|3,0,0]=4 196 B9R1.2 CSC1=NC(C)=CC=N1 SBB086177 [0,1,0,0,0,0|3,0,0]=4 197 B9R1.2 CSC1=NC=CC(=O)N1 SBB062854 [0,1,0,0,0,0|3,0,0]=4 198 B9R1.2 CSC1=NC=CC(Cl)=N1 SBB054478 [0,1,0,0,0,0|3,0,0]=4 199 B9R1.2 CSC1=NC=CC(N)=N1 SBB051949 [0,1,0,0,0,0|3,0,0]=4 200 B9R1.2 CSC1=NN=CC(=O)N1 SBB015202 [0,1,0,0,0,0|2,0,1]=4 201 B9R1.2 ClCC1=CC(Br)=CN=C1 SBB054923 [0,1,0,0,0,0|2,0,0]=3 202 B9R1.2 ClCC1=CC(Cl)=CC=C1 SBB040671 [0,1,0,0,0,0|3,0,0]=4 203 B9R1.2 FC1=CC(CBr)=CC=C1 SBB090883 [0,1,0,0,0,0|3,0,0]=4 204 B9R1.2 FC1=CC=CC(CCl)=C1 SBB040605 [0,1,0,0,0,0|3,0,0]=4 205 B9R1.2 N#CC1=CC(Br)=CN=C1 SBB040176 [0,1,0,0,0,0|2,0,1]=4 206 B9R1.2 N#CC1=CN=CC(O)=C1 SBB065305 [0,1,0,0,0,0|2,0,1]=4 207 B9R1.2 N#CC1=NC(Br)=CC=C1 SBB065236 [0,1,0,0,0,0|2,0,1]=4 208 B9R1.2 N#CC1=NC(Cl)=CC=C1 SBB054389 [0,1,0,0,0,0|2,0,1]=4 209 B9R1.2 N#CC1=NC(F)=CC=C1 SBB065533 [0,1,0,0,0,0|2,0,1]=4 210 B9R1.2 N#CC1=NC=CC(Br)=C1 SBB016160 [0,1,0,0,0,0|2,0,1]=4 211 B9R1.2 N#CC1=NC=CC(N)=C1 SBB055731 [0,1,0,0,0,0|2,0,1]=4 212 B9R1.2 NC1=CC=CC(CO)=C1 SBB037932 [0,1,0,0,0,0|3,0,0]=4 213 B9R1.2 NC1=NC=NC(OC)=C1 SBB004268 [0,1,0,0,0,0|3,0,0]=4 214 B9R1.2 NCC1=CC(Br)=CN=C1 SBB090527 [0,1,0,0,0,0|2,0,0]=3 215 B9R1.2 NCC1=CC(Cl)=CC=C1 SBB004155 [0,1,0,0,0,0|3,0,0]=4 216 B9R1.2 NCC1=CC=CC(Br)=C1 SBB005796 [0,1,0,0,0,0|3,0,0]=4 217 B9R1.2 NCC1=CC=CC(F)=C1 SBB028218 [0,1,0,0,0,0|3,0,0]=4 218 B9R1.2 NNC1=NC(Cl)=CC=C1 SBB017872 [0,1,0,0,0,0|3,0,0]=4 219 B9R1.2 O=CC1=CC(Br)=CN=C1 SBB052232 [0,1,0,0,0,0|2,0,1]=4 220 B9R1.2 O=CC1=CN=CC(F)=C1 SBB065432 [0,1,0,0,0,0|2,0,1]=4 221 B9R1.2 O=CC1=NC(Br)=CC=C1 SBB052238 [0,1,0,0,0,0|2,0,1]=4 222 B9R1.2 O=CC1=NC(Cl)=CC=C1 SBB052254 [0,1,0,0,0,0|2,0,1]=4 223 B9R1.2 OCC1=CC(Br)=CN=C1 SBB065467 [0,1,0,0,0,0|2,0,0]=3 224 B9R1.2 OCC1=CC(Cl)=CC=N1 SBB065656 [0,1,0,0,0,0|2,0,0]=3 225 B9R1.2 OCC1=CC(F)=CC=C1 SBB064188 [0,1,0,0,0,0|3,0,0]=4 226 B9R1.2 OCC1=CC(I)=CC=C1 SBB068728 [0,1,0,0,0,0|3,0,0]=4 227 B9R1.2 OCC1=CC(S)=CC=C1 SBB054760 [0,1,0,0,0,0|3,0,0]=4 228 B9R1.2 OCC1=CC=CC(Br)=C1 SBB063014 [0,1,0,0,0,0|3,0,0]=4 229 B9R1.2 OCC1=CC=CC(Cl)=C1 SBB064716 [0,1,0,0,0,0|3,0,0]=4 230 B9R1.2 OCC1=CC=CC(O)=C1 SBB068731 [0,1,0,0,0,0|3,0,0]=4 231 B9R1.2 OCC1=NC(Cl)=CC=C1 SBB054794 [0,1,0,0,0,0|2,0,0]=3 232 B9R1.2 [NH3+]CC1=CC(I)=CC=C1 SBB058984 [0,1,0,0,0,0|3,0,0]=4 233 B9R1.6 C=C(C)C1=CC=CC=C1 SBB060154 [0,1,0,0,0,0|2,0,1]=4 234 B9R1.6 CC(=O)C1=CC=CC=C1 SBB040241 [0,1,0,0,0,0|2,0,1]=4 235 B9R1.6 CC(=O)C1=CN=CC=C1 SBB040255 [0,1,0,0,0,0|1,0,1]=3 236 B9R1.6 CC(=O)C1=CN=CC=N1 SBB006738 [0,1,0,0,0,0|0,0,1]=2 237 B9R1.6 CC(=O)C1=NC=CC=C1 SBB058824 [0,1,0,0,0,0|1,0,1]=3 238 B9R1.6 CC(=O)C1=NC=CC=N1 SBB055904 [0,1,0,0,0,0|2,0,1]=4 239 B9R1.6 CC(Br)C1=CC=CC=C1 SBB040667 [0,1,0,0,0,0|2,0,0]=3 240 B9R1.6 CC(C)C1=CC=CC=C1 SBB040817 [0,1,0,0,0,0|2,0,0]=3 241 B9R1.6 CC(Cl)C1=CC=CC=C1 SBB007671 [0,1,0,0,0,0|2,0,0]=3 242 B9R1.6 CC(N)C1=CC=CC=C1 SBB040514 [0,1,0,0,0,0|2,0,0]=3 243 B9R1.6 CC(N)C1=CC=NC=C1 SBB007016 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.6 CC(N)C1=CN=CC=C1 SBB027288 [0,1,0,0,0,0|1,0,0]=2 245 B9R1.6 CC(N)C1=NC=CC=C1 SBB018707 [0,1,0,0,0,0|1,0,0]=2 246 B9R1.6 CC(O)C1=CC=CC=C1 SBB058702 [0,1,0,0,0,0|2,0,0]=3 247 B9R1.6 CN(C)C1=CC=CC=C1 SBB040814 [0,1,0,0,0,0|3,0,0]=4 248 B9R1.6 CN(N)C1=CC=CC=C1 SBB060814 [0,1,0,0,0,0|3,0,0]=4 249 B9R1.6 C[C@@H](O)C1=CC=NC=C1 SBB065458 [0,1,0,0,0,0|3,0,0]=4 250 B9R1.6 C[C@H](N)C1=CC=CC=C1 SBB051709 [0,1,0,0,0,0|2,0,0]=3 251 B9R1.6 N=C(N)C1=CC=CC=N1 SBB087246 [0,1,0,0,0,0|2,0,1]=4 252 B9R1.6 N=C(N)C1=NC=CN=C1 SBB055879 [0,1,0,0,0,0|1,0,1]=3 253 B9R1.6 NC(=O)C1=CC=CC=N1 SBB008128 [0,1,0,0,0,0|2,0,1]=4 254 B9R1.6 NC(=O)C1=CC=CN=C1 SBB004283 [0,1,0,0,0,0|2,0,1]=4 255 B9R1.6 NC(=O)C1=CC=CN=C1 SBB055585 [0,1,0,0,0,0|2,0,1]=4 256 B9R1.6 NC(=O)C1=CN=CC=N1 SBB004276 [0,1,0,0,0,0|1,0,1]=3 257 B9R1.6 NC(=S)C1=CC=CC=N1 SBB017638 [0,1,0,0,0,0|2,0,1]=4 258 B9R1.6 NC(=S)C1=CN=CC=C1 SBB028259 [0,1,0,0,0,0|2,0,1]=4 259 B9R1.6 NC(=S)C1=CN=CC=N1 SBB028262 [0,1,0,0,0,0|1,0,1]=3 260 B9R1.6 O=C(Cl)C1=CC=CN=C1 SBB005806 [0,1,0,0,0,0|2,0,1]=4 261 B9R1.6 O=C(Cl)C1=CN=CC=N1 SBB010290 [0,1,0,0,0,0|1,0,1]=3 262 B9R1.6 O=C(Cl)C1=NC=CC=C1 SBB053631 [0,1,0,0,0,0|2,0,1]=4 263 B9R1.6 O=C(O)C1=CC=CN=C1 SBB004279 [0,1,0,0,0,0|2,0,1]=4 264 B9R1.6 O=C(O)C1=NC=CC=C1 SBB004277 [0,1,0,0,0,0|2,0,1]=4 265 B9R1.6 O=C(O)C1=NC=CN=C1 SBB000051 [0,1,0,0,0,0|1,0,1]=3 266 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 SBB065520 [0,1,0,0,0,0|3,0,0]=4 267 B9R1.6 OB(O)C1=CN=CC=C1 SBB025625 [0,1,0,0,0,0|3,0,0]=4 268 B9R1.6 OB(O)C1=NC=CC=C1 SBB052574 [0,1,0,0,0,0|3,0,0]=4 269 B9R1.8 BrCCC1=CC=CC=C1 SBB059945 [0,1,0,0,0,0|2,0,0]=3 270 B9R1.8 BrCCC1=NC=CC=C1 SBB014931 [0,1,0,0,0,0|1,0,0]=2 271 B9R1.8 CCCC1=CC=CC=C1 SBB061210 [0,1,0,0,0,0|2,0,0]=3 272 B9R1.8 CCNC1=CC=CC=C1 SBB058818 [0,1,0,0,0,0|2,0,0]=3 273 B9R1.8 CNCC1=CC=CC=C1 SBB073015 [0,1,0,0,0,0|2,0,0]=3 274 B9R1.8 CNCC1=CC=CN=C1 SBB052430 [0,1,0,0,0,0|1,0,0]=2 275 B9R1.8 CNCC1=CC=NC=C1 SBB047816 [0,1,0,0,0,0|3,0,0]=4 276 B9R1.8 CNCC1=NC=CC=C1 SBB052457 [0,1,0,0,0,0|1,0,0]=2 277 B9R1.8 CNCC1=NC=CN=C1 SBB014431 [0,1,0,0,0,0|0,0,0]=1 278 B9R1.8 COCC1=CC=CC=C1 SBB063549 [0,1,0,0,0,0|2,0,0]=3 279 B9R1.8 ClCCC1=NC=CC=C1 SBB014886 [0,1,0,0,0,0|1,0,0]=2 280 B9R1.8 N#CCC1=CC=CC=C1 SBB058386 [0,1,0,0,0,0|2,0,1]=4 281 B9R1.8 N#CCC1=CC=CN=C1 SBB027148 [0,1,0,0,0,0|1,0,1]=3 282 B9R1.8 N#CCC1=NC=CC=C1 SBB049639 [0,1,0,0,0,0|1,0,1]=3 283 B9R1.8 NCCC1=CC=CC=C1 SBB058801 [0,1,0,0,0,0|2,0,0]=3 284 B9R1.8 NCCC1=CC=CN=C1 SBB028204 [0,1,0,0,0,0|1,0,0]=2 285 B9R1.8 NCCC1=CC=CN=C1 SBB052465 [0,1,0,0,0,0|1,0,0]=2 286 B9R1.8 NCCC1=CC=NC=C1 SBB014221 [0,1,0,0,0,0|3,0,0]=4 287 B9R1.8 NCCC1=NC=CC=C1 SBB028206 [0,1,0,0,0,0|1,0,0]=2 288 B9R1.8 NCCC1=NC=CN=C1 SBB010197 [0,1,0,0,0,0|0,0,0]=1 289 B9R1.8 NNCC1=CC=CC=C1 SBB063024 [0,1,0,0,0,0|3,0,0]=4 290 B9R1.8 NOCC1=CC=CC=C1 SBB003971 [0,1,0,0,0,0|3,0,0]=4 291 B9R1.8 NOCC1=CC=CC=C1 SBB032957 [0,1,0,0,0,0|3,0,0]=4 292 B9R1.8 O=CCC1=CC=CC=C1 SBB061710 [0,1,0,0,0,0|2,0,1]=4 293 B9R1.8 OCCC1=CC=CC=C1 SBB040879 [0,1,0,0,0,0|2,0,0]=3 294 B9R1.8 O\N=C\C1=CC=CN=C1 SBB004285 [0,1,0,0,0,0|2,0,1]=4 295 B9R1.8 O\N=C\C1=NC=CC=C1 SBB004284 [0,1,0,0,0,0|2,0,1]=4 296 B9R1.8 SCCC1=CC=NC=C1 SBB065275 [0,1,0,0,0,0|3,0,0]=4 297 B9R1.8 SCCC1=NC=CN=C1 SBB067078 [0,1,0,0,0,0|0,0,0]=1 298 B9R1.15 BrCC1=CC=CN=C1Br SBB070876 [0,1,0,0,0,0|2,0,0]=3 299 B9R1.15 C(=O)C1=CC=CN=C1Cl SBB004156 [0,1,0,0,0,0|2,0,1]=4 300 B9R1.15 CC1=C(C=O)C=NC=C1 SBB052236 [0,1,0,0,0,0|2,0,1]=4 301 B9R1.15 CC1=C(CBr)N=CC=C1 SBB021212 [0,1,0,0,0,0|2,0,0]=3 302 B9R1.15 CC1=C(CCl)C=CC=C1 SBB040606 [0,1,0,0,0,0|3,0,0]=4 303 B9R1.15 CC1=C(CN)C=CC=C1 SBB042694 [0,1,0,0,0,0|3,0,0]=4 304 B9R1.15 CC1=CC=CC=C1CO SBB065157 [0,1,0,0,0,0|3,0,0]=4 305 B9R1.15 CC1=CC=CC=C1CS SBB086035 [0,1,0,0,0,0|3,0,0]=4 306 B9R1.15 CC1=CC=CN=C1C#N SBB055741 [0,1,0,0,0,0|2,0,1]=4 307 B9R1.15 CC1=CC=CN=C1C=O SBB052241 [0,1,0,0,0,0|2,0,1]=4 308 B9R1.15 CC1=CC=CN=C1CN SBB052454 [0,1,0,0,0,0|2,0,0]=3 309 B9R1.15 CC1=CC=NC=C1C#N SBB055519 [0,1,0,0,0,0|2,0,1]=4 310 B9R1.15 CCC1=C(N)C=CC=C1 SBB040452 [0,1,0,0,0,0|2,0,0]=3 311 B9R1.15 CCC1=CC=CC=C1C SBB061450 [0,1,0,0,0,0|2,0,0]=3 312 B9R1.15 CNC1=CC=CC=C1Cl SBB086216 [0,1,0,0,0,0|3,0,0]=4 313 B9R1.15 CNC1=CC=CC=C1F SBB051706 [0,1,0,0,0,0|3,0,0]=4 314 B9R1.15 CNC1=CC=CC=C1N SBB071575 [0,1,0,0,0,0|3,0,0]=4 315 B9R1.15 COC1=C(I)N=CC=C1 SBB098345 [0,1,0,0,0,0|2,0,0]=3 316 B9R1.15 COC1=C(N)C=CC=C1 SBB028142 [0,1,0,0,0,0|3,0,0]=4 317 B9R1.15 COC1=C(O)C=CC=C1 SBB058681 [0,1,0,0,0,0|3,0,0]=4 318 B9R1.15 COC1=CC=CC=C1Cl SBB060957 [0,1,0,0,0,0|3,0,0]=4 319 B9R1.15 COC1=CC=CC=C1F SBB040818 [0,1,0,0,0,0|3,0,0]=4 320 B9R1.15 COC1=CC=CN=C1Br SBB005633 [0,1,0,0,0,0|2,0,0]=3 321 B9R1.15 COC1=CC=CN=C1N SBB051907 [0,1,0,0,0,0|2,0,0]=3 322 B9R1.15 COC1=CC=CN=C1O SBB046500 [0,1,0,0,0,0|2,0,0]=3 323 B9R1.15 COC1=NC=CN=C1N SBB051948 [0,1,0,0,0,0|1,0,0]=2 324 B9R1.15 CSC1=C(Br)C=CC=C1 SBB006566 [0,1,0,0,0,0|3,0,0]=4 325 B9R1.15 CSC1=C(C)N=CC=N1 SBB008573 [0,1,0,0,0,0|1,0,0]=2 326 B9R1.15 CSC1=C(Cl)C=CC=C1 SBB058978 [0,1,0,0,0,0|3,0,0]=4 327 B9R1.15 CSC1=NC=CC=C1N SBB072554 [0,1,0,0,0,0|2,0,0]=3 328 B9R1.15 ClCC1=C(Cl)C=CC=C1 SBB040669 [0,1,0,0,0,0|3,0,0]=4 329 B9R1.15 FC1=C(CBr)C=CC=C1 SBB058868 [0,1,0,0,0,0|3,0,0]=4 330 B9R1.15 FC1=C(CCl)C=CC=C1 SBB040603 [0,1,0,0,0,0|3,0,0]=4 331 B9R1.15 N#CC1=C(Br)C=CN=C1 SBB065311 [0,1,0,0,0,0|2,0,1]=4 332 B9R1.15 N#CC1=C(F)N=CC=C1 SBB065300 [0,1,0,0,0,0|2,0,1]=4 333 B9R1.15 N#CC1=C(I)C=CN=C1 SBB065313 [0,1,0,0,0,0|2,0,1]=4 334 B9R1.15 N#CC1=C(O)N=CC=C1 SBB065243 [0,1,0,0,0,0|2,0,1]=4 335 B9R1.15 N#CC1=CC=CN=C1Cl SBB013480 [0,1,0,0,0,0|2,0,1]=4 336 B9R1.15 N#CC1=CC=CN=C1N SBB028201 [0,1,0,0,0,0|2,0,1]=4 337 B9R1.15 N#CC1=NC=CC=C1Br SBB065323 [0,1,0,0,0,0|2,0,1]=4 338 B9R1.15 N#CC1=NC=CC=C1Cl SBB065258 [0,1,0,0,0,0|2,0,1]=4 339 B9R1.15 N#CC1=NC=CC=C1F SBB065259 [0,1,0,0,0,0|2,0,1]=4 340 B9R1.15 N#CC1=NC=CC=C1I SBB065324 [0,1,0,0,0,0|2,0,1]=4 341 B9R1.15 N#CC1=NC=CN=C1Cl SBB055887 [0,1,0,0,0,0|1,0,1]=3 342 B9R1.15 NC1=C(C=O)C=NC=C1 SBB014341 [0,1,0,0,0,0|2,0,1]=4 343 B9R1.15 NC1=C(CO)C=CC=C1 SBB058759 [0,1,0,0,0,0|3,0,0]=4 344 B9R1.15 NC1=CC=NC=C1CO SBB054791 [0,1,0,0,0,0|2,0,0]=3 345 B9R1.15 NC1=NC=CC=C1C=O SBB012985 [0,1,0,0,0,0|2,0,1]=4 346 B9R1.15 NC1=NC=CC=C1CO SBB054786 [0,1,0,0,0,0|2,0,0]=3 347 B9R1.15 NCC1=C(Cl)C=CC=C1 SBB004151 [0,1,0,0,0,0|3,0,0]=4 348 B9R1.15 NCC1=C(F)C=CC=C1 SBB028214 [0,1,0,0,0,0|3,0,0]=4 349 B9R1.15 NCC1=CC=CC=C1Br SBB052369 [0,1,0,0,0,0|3,0,0]=4 350 B9R1.15 NCC1=CC=CC=C1Br SBB052411 [0,1,0,0,0,0|3,0,0]=4 351 B9R1.15 NNC1=NC=CC=C1Cl SBB068633 [0,1,0,0,0,0|3,0,0]=4 352 B9R1.15 O=CC1=CC=CN=C1Br SBB052224 [0,1,0,0,0,0|2,0,1]=4 353 B9R1.15 O=CC1=CC=CN=C1F SBB065263 [0,1,0,0,0,0|2,0,1]=4 354 B9R1.15 O=CC1=CN=CC=C1Cl SBB065433 [0,1,0,0,0,0|2,0,1]=4 355 B9R1.15 O=CC1=NC=CC=C1F SBB065527 [0,1,0,0,0,0|2,0,1]=4 356 B9R1.15 OCC1=C(F)C=CC=C1 SBB064085 [0,1,0,0,0,0|3,0,0]=4 357 B9R1.15 OCC1=C(O)C=CC=N1 SBB085588 [0,1,0,0,0,0|2,0,0]=3 358 B9R1.15 OCC1=CC=CC=C1Br SBB063922 [0,1,0,0,0,0|3,0,0]=4 359 B9R1.15 OCC1=CC=CC=C1Cl SBB058557 [0,1,0,0,0,0|3,0,0]=4 360 B9R1.15 OCC1=CC=CC=C1O SBB065036 [0,1,0,0,0,0|3,0,0]=4 361 B9R1.15 OCC1=CC=CN=C1Cl SBB054785 [0,1,0,0,0,0|2,0,0]=3 362 B9R1.15 SCC1=CC=CC=C1Br SBB066540 [0,1,0,0,0,0|3,0,0]=4 363 B7R1.1 BrCC1=CSC=C1 SBB070721 [0,0,0,0,1,0|2,0,0]=3 364 B7R1.1 BrCC1=CSC=N1 SBB054932 [0,0,0,0,1,0|2,0,0]=3 365 B7R1.1 C#CC1=CC=CS1 SBB008821 [0,0,0,0,1,0|1,0,2]=4 366 B7R1.1 C#CC1=CSC=C1 SBB066455 [0,0,0,0,1,0|1,0,2]=4 367 B7R1.1 C(=O)C1=CN=CN1 SBB004381 [0,0,0,0,1,0|1,0,2]=4 368 B7R1.1 C(=O)C1=CN=CN1 SBB004382 [0,0,0,0,1,0|1,0,2]=4 369 B7R1.1 C(=O)C1=CSC=C1 SBB004320 [0,0,0,0,1,0|2,0,1]=4 370 B7R1.1 C=CN1C=CN=C1 SBB071043 [0,0,0,0,1,0|1,0,2]=4 371 B7R1.1 C=CN1C=NC=N1 SBB000031 [0,0,0,0,1,0|1,0,2]=4 372 B7R1.1 CCN1C=CC=N1 SBB020346 [0,0,0,0,1,0|1,0,0]=2 373 B7R1.1 CCN1C=CN=C1 SBB045396 [0,0,0,0,1,0|1,0,0]=2 374 B7R1.1 CSC1=CC=CS1 SBB085766 [0,0,0,0,1,0|2,0,0]=3 375 B7R1.1 CSC1=CSC=C1 SBB055747 [0,0,0,0,1,0|2,0,0]=3 376 B7R1.1 CSC1=NN=CN1 SBB059216 [0,0,0,0,1,0|2,0,1]=4 377 B7R1.1 ClCC1=CC=NO1 SBB013787 [0,0,0,0,1,0|2,0,0]=3 378 B7R1.1 ClCC1=CSC=N1 SBB054935 [0,0,0,0,1,0|2,0,0]=3 379 B7R1.1 ClCC1=NOC=C1 SBB013648 [0,0,0,0,1,0|2,0,0]=3 380 B7R1.1 ClCC1=NOC=N1 SBB005592 [0,0,0,0,1,0|2,0,0]=3 381 B7R1.1 N#CC1=CC=CN1 SBB067109 [0,0,0,0,1,0|1,0,2]=4 382 B7R1.1 N#CC1=CC=CO1 SBB055776 [0,0,0,0,1,0|2,0,1]=4 383 B7R1.1 N#CC1=CC=CS1 SBB055745 [0,0,0,0,1,0|2,0,1]=4 384 B7R1.1 N#CC1=CNC=N1 SBB055864 [0,0,0,0,1,0|1,0,2]=4 385 B7R1.1 N#CC1=CNN=C1 SBB055839 [0,0,0,0,1,0|2,0,1]=4 386 B7R1.1 N#CC1=CSC=C1 SBB047994 [0,0,0,0,1,0|2,0,1]=4 387 B7R1.1 N#CC1=CSC=N1 SBB059707 [0,0,0,0,1,0|2,0,1]=4 388 B7R1.1 N#CC1=NNC=C1 SBB055854 [0,0,0,0,1,0|2,0,1]=4 389 B7R1.1 NCC1=CC=CO1 SBB004376 [0,0,0,0,1,0|2,0,0]=3 390 B7R1.1 NCC1=CC=CS1 SBB004315 [0,0,0,0,1,0|2,0,0]=3 391 B7R1.1 NCC1=CN=CS1 SBB047473 [0,0,0,0,1,0|2,0,0]=3 392 B7R1.1 NCC1=CNN=C1 SBB026489 [0,0,0,0,1,0|2,0,0]=3 393 B7R1.1 NCC1=CSC=C1 SBB079179 [0,0,0,0,1,0|2,0,0]=3 394 B7R1.1 NCC1=CSC=N1 SBB047472 [0,0,0,0,1,0|2,0,0]=3 395 B7R1.1 NCC1=NC=CN1 SBB013485 [0,0,0,0,1,0|1,0,1]=3 396 B7R1.1 NCC1=NC=CN1 SBB052487 [0,0,0,0,1,0|1,0,1]=3 397 B7R1.1 NCC1=NC=CS1 SBB052479 [0,0,0,0,1,0|2,0,0]=3 398 B7R1.1 NCC1=NNC=C1 SBB020888 [0,0,0,0,1,0|2,0,0]=3 399 B7R1.1 NCC1=NOC=N1 SBB052491 [0,0,0,0,1,0|2,0,0]=3 400 B7R1.1 O=CC1=CC=CN1 SBB004389 [0,0,0,0,1,0|1,0,2]=4 401 B7R1.1 O=CC1=CC=CN1 SBB004390 [0,0,0,0,1,0|1,0,2]=4 402 B7R1.1 O=CC1=CC=CO1 SBB004386 [0,0,0,0,1,0|2,0,1]=4 403 B7R1.1 O=CC1=CC=CS1 SBB004321 [0,0,0,0,1,0|2,0,1]=4 404 B7R1.1 O=CC1=CN=CS1 SBB052293 [0,0,0,0,1,0|2,0,1]=4 405 B7R1.1 O=CC1=CNC=C1 SBB052279 [0,0,0,0,1,0|1,0,2]=4 406 B7R1.1 O=CC1=CNN=C1 SBB021198 [0,0,0,0,1,0|2,0,1]=4 407 B7R1.1 O=CC1=COC=C1 SBB004385 [0,0,0,0,1,0|2,0,1]=4 408 B7R1.1 O=CC1=COC=N1 SBB052299 [0,0,0,0,1,0|2,0,1]=4 409 B7R1.1 O=CC1=CSC=N1 SBB047478 [0,0,0,0,1,0|2,0,1]=4 410 B7R1.1 O=CC1=NC=CN1 SBB004383 [0,0,0,0,1,0|1,0,2]=4 411 B7R1.1 O=CC1=NC=CN1 SBB004384 [0,0,0,0,1,0|1,0,2]=4 412 B7R1.1 O=CC1=NC=CO1 SBB052295 [0,0,0,0,1,0|2,0,1]=4 413 B7R1.1 O=CC1=NC=CS1 SBB052286 [0,0,0,0,1,0|2,0,1]=4 414 B7R1.1 O=CC1=NNC=C1 SBB052310 [0,0,0,0,1,0|2,0,1]=4 415 B7R1.1 OCC1=CC=CO1 SBB004373 [0,0,0,0,1,0|2,0,0]=3 416 B7R1.1 OCC1=CC=CS1 SBB058563 [0,0,0,0,1,0|2,0,0]=3 417 B7R1.1 OCC1=CC=NN1 SBB014141 [0,0,0,0,1,0|2,0,0]=3 418 B7R1.1 OCC1=CN=CS1 SBB066375 [0,0,0,0,1,0|2,0,0]=3 419 B7R1.1 OCC1=CN=NN1 SBB013581 [0,0,0,0,1,0|2,0,1]=4 420 B7R1.1 OCC1=CNC=N1 SBB004207 [0,0,0,0,1,0|1,0,1]=3 421 B7R1.1 OCC1=CNC=N1 SBB054821 [0,0,0,0,1,0|1,0,1]=3 422 B7R1.1 OCC1=CNN=C1 SBB073660 [0,0,0,0,1,0|2,0,0]=3 423 B7R1.1 OCC1=CSC=C1 SBB004309 [0,0,0,0,1,0|2,0,0]=3 424 B7R1.1 OCC1=CSC=N1 SBB066562 [0,0,0,0,1,0|2,0,0]=3 425 B7R1.1 OCC1=NC=CN1 SBB054820 [0,0,0,0,1,0|1,0,1]=3 426 B7R1.1 OCC1=NC=CS1 SBB054805 [0,0,0,0,1,0|2,0,0]=3 427 B7R1.1 SCC1=CC=CO1 SBB004308 [0,0,0,0,1,0|2,0,0]=3 428 B6R0.6 CCC\C=C\C=O SBB067097 [1,0,1,0,0,0|1,0,1]=4 429 B6R1.1 C1=CC=NC=C1 SBB055734 [2,0,0,0,0,0|1,0,0]=3 430 B6R1.1 C1=CN=NC=C1 SBB059541 [2,0,0,0,0,0|2,0,0]=4 431 B8R1.3 BrC1=CC=C(I)C=N1 SBB013974 [1,1,0,0,0,0|2,0,0]=4 432 B8R1.3 BrC1=CN=C(Br)C=C1 SBB054335 [1,1,0,0,0,0|2,0,0]=4 433 B8R1.3 BrC1=CN=C(Br)C=N1 SBB054474 [1,1,0,0,0,0|1,0,0]=3 434 B8R1.3 BrC1=CN=C(I)C=C1 SBB054355 [1,1,0,0,0,0|2,0,0]=4 435 B8R1.3 BrC1=CN=C(I)C=N1 SBB054462 [1,1,0,0,0,0|1,0,0]=3 436 B8R1.3 CC1=CC=C(Br)C=C1 SBB040884 [1,1,0,0,0,0|2,0,0]=4 437 B8R1.3 CC1=CC=C(Br)C=N1 SBB088566 [1,1,0,0,0,0|1,0,0]=3 438 B8R1.3 CC1=CC=C(C)N=C1 SBB060370 [1,1,0,0,0,0|1,0,0]=3 439 B8R1.3 CC1=CC=C(Cl)C=C1 SBB040887 [1,1,0,0,0,0|2,0,0]=4 440 B8R1.3 CC1=CC=C(N)C=C1 SBB040498 [1,1,0,0,0,0|2,0,0]=4 441 B8R1.3 CC1=CC=C(N)C=C1 SBB073002 [1,1,0,0,0,0|2,0,0]=4 442 B8R1.3 CC1=CC=C(N)C=N1 SBB051894 [1,1,0,0,0,0|1,0,0]=3 443 B8R1.3 CC1=CC=C(N)N=N1 SBB051974 [1,1,0,0,0,0|2,0,0]=4 444 B8R1.3 CC1=CC=C(O)C=C1 SBB040878 [1,1,0,0,0,0|2,0,0]=4 445 B8R1.3 CC1=CC=C(O)N=N1 SBB051111 [1,1,0,0,0,0|2,0,0]=4 446 B8R1.3 CC1=CN=C(Br)C=C1 SBB054301 [1,1,0,0,0,0|1,0,0]=3 447 B8R1.3 CC1=CN=C(Br)C=N1 SBB054471 [1,1,0,0,0,0|0,0,0]=2 448 B8R1.3 CC1=CN=C(C)C=N1 SBB058647 [1,1,0,0,0,0|0,0,0]=2 449 B8R1.3 CC1=CN=C(Cl)C=C1 SBB085698 [1,1,0,0,0,0|1,0,0]=3 450 B8R1.3 CC1=CN=C(N)C=C1 SBB004353 [1,1,0,0,0,0|1,0,0]=3 451 B8R1.3 CC1=CN=C(N)C=N1 SBB069755 [1,1,0,0,0,0|0,0,0]=2 452 B8R1.3 CC1=CN=C(O)C=C1 SBB055600 [1,1,0,0,0,0|1,0,0]=3 453 B8R1.3 CC1=CN=C(O)N=C1 SBB026947 [1,1,0,0,0,0|2,0,0]=4 454 B8R1.3 CC1=CN=C(S)C=C1 SBB068990 [1,1,0,0,0,0|1,0,0]=3 455 B8R1.3 CC1=CN=C(S)N=C1 SBB021424 [1,1,0,0,0,0|2,0,0]=4 456 B8R1.3 CC1=CNC(=O)C=C1 SBB040121 [1,1,0,0,0,0|1,0,1]=4 457 B8R1.3 CC1=NC=C(O)C=C1 SBB004349 [1,1,0,0,0,0|1,0,0]=3 458 B8R1.3 CC1=NN=C(Cl)C=C1 SBB039123 [1,1,0,0,0,0|2,0,0]=4 459 B8R1.3 ClC1=CC=C(Br)C=N1 SBB013973 [1,1,0,0,0,0|2,0,0]=4 460 B8R1.3 ClC1=CC=C(I)C=N1 SBB013975 [1,1,0,0,0,0|2,0,0]=4 461 B8R1.3 ClC1=CN=C(Br)C=C1 SBB054397 [1,1,0,0,0,0|2,0,0]=4 462 B8R1.3 ClC1=CN=C(Cl)C=C1 SBB054354 [1,1,0,0,0,0|2,0,0]=4 463 B8R1.3 ClC1=CN=C(I)C=C1 SBB054334 [1,1,0,0,0,0|2,0,0]=4 464 B8R1.3 ClC1=NC=C(Br)N=C1 SBB091627 [1,1,0,0,0,0|1,0,0]=3 465 B8R1.3 FC1=CC=C(Br)N=C1 SBB089107 [1,1,0,0,0,0|2,0,0]=4 466 B8R1.3 FC1=CC=C(I)C=N1 SBB013899 [1,1,0,0,0,0|2,0,0]=4 467 B8R1.3 FC1=CN=C(Cl)C=C1 SBB085793 [1,1,0,0,0,0|2,0,0]=4 468 B8R1.3 FC1=NC=C(Br)C=C1 SBB089108 [1,1,0,0,0,0|2,0,0]=4 469 B8R1.3 FC1=NC=C(Cl)C=C1 SBB085795 [1,1,0,0,0,0|2,0,0]=4 470 B8R1.3 NC1=CC=C(Br)N=C1 SBB005540 [1,1,0,0,0,0|2,0,0]=4 471 B8R1.3 NC1=CC=C(Cl)N=C1 SBB004234 [1,1,0,0,0,0|2,0,0]=4 472 B8R1.3 NC1=CC=C(F)N=C1 SBB051873 [1,1,0,0,0,0|2,0,0]=4 473 B8R1.3 NC1=CC=C(I)C=N1 SBB028436 [1,1,0,0,0,0|2,0,0]=4 474 B8R1.3 NC1=CC=C(O)N=C1 SBB028187 [1,1,0,0,0,0|2,0,0]=4 475 B8R1.3 NC1=CN=C(Br)C=N1 SBB028377 [1,1,0,0,0,0|1,0,0]=3 476 B8R1.3 NC1=CN=C(I)C=C1 SBB070540 [1,1,0,0,0,0|2,0,0]=4 477 B8R1.3 NC1=CN=C(N)C=C1 SBB004342 [1,1,0,0,0,0|2,0,0]=4 478 B8R1.3 NC1=NC=C(Br)C=C1 SBB003823 [1,1,0,0,0,0|2,0,0]=4 479 B8R1.3 NC1=NC=C(Cl)C=C1 SBB000059 [1,1,0,0,0,0|2,0,0]=4 480 B8R1.3 NC1=NC=C(F)C=C1 SBB013948 [1,1,0,0,0,0|2,0,0]=4 481 B8R1.3 OC1=CN=C(Cl)C=C1 SBB054276 [1,1,0,0,0,0|2,0,0]=4 482 B8R1.3 OC1=NC=C(Br)C=C1 SBB054347 [1,1,0,0,0,0|2,0,0]=4 483 B8R1.3 OC1=NC=C(Br)N=C1 SBB062713 [1,1,0,0,0,0|1,0,0]=3 484 B8R1.3 OC1=NC=C(Cl)C=C1 SBB054352 [1,1,0,0,0,0|2,0,0]=4 485 B8R1.3 OC1=NC=C(I)C=C1 SBB054372 [1,1,0,0,0,0|2,0,0]=4 486 B8R1.4 BrC1=CC(I)=CC=N1 SBB013971 [1,1,0,0,0,0|2,0,0]=4 487 B8R1.4 BrC1=CC=CC(Br)=N1 SBB059469 [1,1,0,0,0,0|2,0,0]=4 488 B8R1.4 BrC1=CC=NC(Br)=C1 SBB013976 [1,1,0,0,0,0|2,0,0]=4 489 B8R1.4 BrC1=CN=CC(Br)=C1 SBB003237 [1,1,0,0,0,0|2,0,0]=4 490 B8R1.4 BrC1=CN=CC(Br)=C1 SBB003238 [1,1,0,0,0,0|2,0,0]=4 491 B8R1.4 BrC1=NC(I)=CC=C1 SBB054359 [1,1,0,0,0,0|2,0,0]=4 492 B8R1.4 CC1=CC(=O)NN=C1 SBB055936 [1,1,0,0,0,0|2,0,0]=4 493 B8R1.4 CC1=CC(Br)=NC=C1 SBB054348 [1,1,0,0,0,0|2,0,0]=4 494 B8R1.4 CC1=CC(C)=NC=N1 SBB059547 [1,1,0,0,0,0|2,0,0]=4 495 B8R1.4 CC1=CC(Cl)=NC=C1 SBB054263 [1,1,0,0,0,0|2,0,0]=4 496 B8R1.4 CC1=CC(F)=NC=C1 SBB054405 [1,1,0,0,0,0|2,0,0]=4 497 B8R1.4 CC1=CC(N)=CC=C1 SBB040444 [1,1,0,0,0,0|2,0,0]=4 498 B8R1.4 CC1=CC(N)=NC=C1 SBB004354 [1,1,0,0,0,0|2,0,0]=4 499 B8R1.4 CC1=CC(O)=CC=C1 SBB060101 [1,1,0,0,0,0|2,0,0]=4 500 B8R1.4 CC1=CC(O)=NC=N1 SBB081936 [1,1,0,0,0,0|2,0,0]=4 501 B8R1.4 CC1=CC=CC(=O)N1 SBB004345 [1,1,0,0,0,0|1,0,1]=4 502 B8R1.4 CC1=CC=CC(Br)=C1 SBB060207 [1,1,0,0,0,0|2,0,0]=4 503 B8R1.4 CC1=CC=CC(Br)=N1 SBB054376 [1,1,0,0,0,0|1,0,0]=3 504 B8R1.4 CC1=CC=CC(C)=N1 SBB060371 [1,1,0,0,0,0|1,0,0]=3 505 B8R1.4 CC1=CC=CC(Cl)=N1 SBB048080 [1,1,0,0,0,0|1,0,0]=3 506 B8R1.4 CC1=CC=CC(F)=C1 SBB061650 [1,1,0,0,0,0|2,0,0]=4 507 B8R1.4 CC1=CC=CC(I)=N1 SBB054318 [1,1,0,0,0,0|1,0,0]=3 508 B8R1.4 CC1=CC=CC(N)=N1 SBB004355 [1,1,0,0,0,0|1,0,0]=3 509 B8R1.4 CC1=CC=NC(C)=C1 SBB060369 [1,1,0,0,0,0|1,0,0]=3 510 B8R1.4 CC1=CC=NC(N)=N1 SBB004343 [1,1,0,0,0,0|2,0,0]=4 511 B8R1.4 CC1=CN=CC(Br)=C1 SBB054290 [1,1,0,0,0,0|1,0,0]=3 512 B8R1.4 CC1=CN=CC(Br)=N1 SBB054472 [1,1,0,0,0,0|0,0,0]=2 513 B8R1.4 CC1=CN=CC(C)=C1 SBB060372 [1,1,0,0,0,0|1,0,0]=3 514 B8R1.4 CC1=CN=CC(Cl)=N1 SBB054461 [1,1,0,0,0,0|0,0,0]=2 515 B8R1.4 CC1=CN=CC(N)=C1 SBB051822 [1,1,0,0,0,0|1,0,0]=3 516 B8R1.4 CC1=CN=CC(N)=N1 SBB051946 [1,1,0,0,0,0|0,0,0]=2 517 B8R1.4 CC1=CN=CC(O)=C1 SBB055598 [1,1,0,0,0,0|1,0,0]=3 518 B8R1.4 CC1=CN=NC(Cl)=C1 SBB054545 [1,1,0,0,0,0|2,0,0]=4 519 B8R1.4 CC1=NC(=S)NC=C1 SBB003934 [1,1,0,0,0,0|2,0,0]=4 520 B8R1.4 CC1=NC(Cl)=NC=C1 SBB054509 [1,1,0,0,0,0|2,0,0]=4 521 B8R1.4 CC1=NC(S)=NC=C1 SBB055918 [1,1,0,0,0,0|2,0,0]=4 522 B8R1.4 CC1=NC=CC(Br)=C1 SBB088565 [1,1,0,0,0,0|1,0,0]=3 523 B8R1.4 CC1=NC=CC(Cl)=N1 SBB085538 [1,1,0,0,0,0|2,0,0]=4 524 B8R1.4 CC1=NC=CC(N)=C1 SBB027134 [1,1,0,0,0,0|1,0,0]=3 525 B8R1.4 CC1=NC=NC(Cl)=C1 SBB039515 [1,1,0,0,0,0|2,0,0]=4 526 B8R1.4 ClC1=CC(Br)=NC=C1 SBB054398 [1,1,0,0,0,0|2,0,0]=4 527 B8R1.4 ClC1=CC=CC(Cl)=N1 SBB040849 [1,1,0,0,0,0|2,0,0]=4 528 B8R1.4 ClC1=CC=NC(Cl)=C1 SBB013978 [1,1,0,0,0,0|2,0,0]=4 529 B8R1.4 ClC1=CN=CC(Cl)=N1 SBB054463 [1,1,0,0,0,0|1,0,0]=3 530 B8R1.4 ClC1=NC=CC(Br)=C1 SBB054396 [1,1,0,0,0,0|2,0,0]=4 531 B8R1.4 ClC1=NC=CC(I)=C1 SBB054361 [1,1,0,0,0,0|2,0,0]=4 532 B8R1.4 FC1=CC(Br)=CN=C1 SBB054265 [1,1,0,0,0,0|2,0,0]=4 533 B8R1.4 FC1=CC(Br)=NC=C1 SBB089109 [1,1,0,0,0,0|2,0,0]=4 534 B8R1.4 FC1=CC=CC(Br)=N1 SBB089103 [1,1,0,0,0,0|2,0,0]=4 535 B8R1.4 FC1=CC=NC(Cl)=C1 SBB013977 [1,1,0,0,0,0|2,0,0]=4 536 B8R1.4 FC1=CN=CC(Cl)=C1 SBB085794 [1,1,0,0,0,0|2,0,0]=4 537 B8R1.4 FC1=CN=CC(F)=C1 SBB054377 [1,1,0,0,0,0|2,0,0]=4 538 B8R1.4 FC1=NC=CC(Br)=C1 SBB089106 [1,1,0,0,0,0|2,0,0]=4 539 B8R1.4 FC1=NC=CC(Cl)=C1 SBB054331 [1,1,0,0,0,0|2,0,0]=4 540 B8R1.4 FC1=NC=CC(I)=C1 SBB054283 [1,1,0,0,0,0|2,0,0]=4 541 B8R1.4 NC1=CC(Br)=CN=C1 SBB044004 [1,1,0,0,0,0|2,0,0]=4 542 B8R1.4 NC1=CC(Br)=NC=C1 SBB028374 [1,1,0,0,0,0|2,0,0]=4 543 B8R1.4 NC1=CC(Cl)=CN=C1 SBB069846 [1,1,0,0,0,0|2,0,0]=4 544 B8R1.4 NC1=CC(Cl)=NC=C1 SBB004235 [1,1,0,0,0,0|2,0,0]=4 545 B8R1.4 NC1=CC(N)=NC=C1 SBB069750 [1,1,0,0,0,0|2,0,0]=4 546 B8R1.4 NC1=CC=CC(Br)=N1 SBB028373 [1,1,0,0,0,0|2,0,0]=4 547 B8R1.4 NC1=CC=CC(N)=N1 SBB004340 [1,1,0,0,0,0|2,0,0]=4 548 B8R1.4 NC1=NC(Cl)=CC=C1 SBB028231 [1,1,0,0,0,0|2,0,0]=4 549 B8R1.4 NC1=NC(Cl)=CN=C1 SBB005488 [1,1,0,0,0,0|1,0,0]=3 550 B8R1.4 NC1=NC(F)=CC=C1 SBB069764 [1,1,0,0,0,0|2,0,0]=4 551 B8R1.4 NC1=NC=CC(Br)=C1 SBB016050 [1,1,0,0,0,0|2,0,0]=4 552 B8R1.4 NC1=NC=CC(Cl)=C1 SBB051892 [1,1,0,0,0,0|2,0,0]=4 553 B8R1.4 NC1=NC=CC(F)=C1 SBB051908 [1,1,0,0,0,0|2,0,0]=4 554 B8R1.4 OC1=CC(Cl)=CN=C1 SBB054268 [1,1,0,0,0,0|2,0,0]=4 555 B8R1.4 OC1=CC=NC(Cl)=C1 SBB085746 [1,1,0,0,0,0|2,0,0]=4 556 B8R1.4 OC1=CC=NC(O)=C1 SBB004331 [1,1,0,0,0,0|2,0,0]=4 557 B8R1.4 OC1=CN=CC(Br)=C1 SBB081337 [1,1,0,0,0,0|2,0,0]=4 558 B8R1.4 OC1=CN=CC(F)=C1 SBB062707 [1,1,0,0,0,0|2,0,0]=4 559 B8R1.4 OC1=NC(C)=CC=N1 SBB004337 [1,1,0,0,0,0|2,0,0]=4 560 B8R1.4 OC1=NC(S)=NN=C1 SBB059748 [1,1,0,0,0,0|2,0,0]=4 561 B8R1.4 OC1=NC=CC(Br)=C1 SBB054250 [1,1,0,0,0,0|2,0,0]=4 562 B8R1.5 BrC1=CC=CN=C1Br SBB003239 [1,1,0,0,0,0|2,0,0]=4 563 B8R1.5 BrC1=CC=CN=C1I SBB054393 [1,1,0,0,0,0|2,0,0]=4 564 B8R1.5 CC1=C(C)C=CC=C1 SBB040816 [1,1,0,0,0,0|2,0,0]=4 565 B8R1.5 CC1=C(C)C=NC=C1 SBB040907 [1,1,0,0,0,0|1,0,0]=3 566 B8R1.5 CC1=C(C)N=CC=C1 SBB060735 [1,1,0,0,0,0|1,0,0]=3 567 B8R1.5 CC1=C(Cl)N=NC=C1 SBB054543 [1,1,0,0,0,0|2,0,0]=4 568 B8R1.5 CC1=C(N)C=CC=C1 SBB028141 [1,1,0,0,0,0|2,0,0]=4 569 B8R1.5 CC1=C(N)C=CN=C1 SBB027197 [1,1,0,0,0,0|1,0,0]=3 570 B8R1.5 CC1=C(N)C=NC=C1 SBB028185 [1,1,0,0,0,0|2,0,0]=4 571 B8R1.5 CC1=CC=CC=C1N SBB058642 [1,1,0,0,0,0|2,0,0]=4 572 B8R1.5 CC1=CC=CC=C1O SBB060100 [1,1,0,0,0,0|2,0,0]=4 573 B8R1.5 CC1=CC=CN=C1Br SBB054403 [1,1,0,0,0,0|1,0,0]=3 574 B8R1.5 CC1=CC=CN=C1I SBB054379 [1,1,0,0,0,0|1,0,0]=3 575 B8R1.5 CC1=CC=CN=C1N SBB004356 [1,1,0,0,0,0|1,0,0]=3 576 B8R1.5 CC1=CC=CNC1=O SBB040120 [1,1,0,0,0,0|1,0,1]=4 577 B8R1.5 CC1=CC=NC=C1Br SBB054294 [1,1,0,0,0,0|2,0,0]=4 578 B8R1.5 CC1=CC=NC=C1O SBB055538 [1,1,0,0,0,0|2,0,0]=4 579 B8R1.5 CC1=NC=CC=C1Br SBB054275 [1,1,0,0,0,0|1,0,0]=3 580 B8R1.5 CC1=NC=CC=C1Cl SBB054401 [1,1,0,0,0,0|1,0,0]=3 581 B8R1.5 CC1=NC=CC=C1N SBB069748 [1,1,0,0,0,0|1,0,0]=3 582 B8R1.5 ClC1=C(Cl)N=CC=C1 SBB086564 [1,1,0,0,0,0|2,0,0]=4 583 B8R1.5 ClC1=C(I)C=CC=N1 SBB013979 [1,1,0,0,0,0|2,0,0]=4 584 B8R1.5 ClC1=CC=CN=C1Br SBB054378 [1,1,0,0,0,0|2,0,0]=4 585 B8R1.5 ClC1=CC=CN=C1I SBB051904 [1,1,0,0,0,0|2,0,0]=4 586 B8R1.5 ClC1=CC=NC=C1Br SBB054249 [1,1,0,0,0,0|2,0,0]=4 587 B8R1.5 ClC1=CC=NC=C1Cl SBB054368 [1,1,0,0,0,0|2,0,0]=4 588 B8R1.5 ClC1=CN=CC=C1Br SBB054284 [1,1,0,0,0,0|2,0,0]=4 589 B8R1.5 ClC1=CN=CC=C1I SBB054367 [1,1,0,0,0,0|2,0,0]=4 590 B8R1.5 ClC1=NC=CC=C1Br SBB003618 [1,1,0,0,0,0|2,0,0]=4 591 B8R1.5 ClC1=NC=CN=C1Cl SBB080632 [1,1,0,0,0,0|1,0,0]=3 592 B8R1.5 FC1=C(Cl)C=CN=C1 SBB088125 [1,1,0,0,0,0|2,0,0]=4 593 B8R1.5 FC1=C(I)C=CN=C1 SBB096406 [1,1,0,0,0,0|2,0,0]=4 594 B8R1.5 FC1=CC=CN=C1Br SBB089105 [1,1,0,0,0,0|2,0,0]=4 595 B8R1.5 FC1=CC=CN=C1Cl SBB085791 [1,1,0,0,0,0|2,0,0]=4 596 B8R1.5 FC1=NC=CC=C1Br SBB054288 [1,1,0,0,0,0|2,0,0]=4 597 B8R1.5 FC1=NC=CC=C1Cl SBB085790 [1,1,0,0,0,0|2,0,0]=4 598 B8R1.5 FC1=NC=CC=C1I SBB096409 [1,1,0,0,0,0|2,0,0]=4 599 B8R1.5 NC1=C(Br)C=NC=C1 SBB005537 [1,1,0,0,0,0|2,0,0]=4 600 B8R1.5 NC1=C(Cl)C=CC=N1 SBB015835 [1,1,0,0,0,0|2,0,0]=4 601 B8R1.5 NC1=C(Cl)C=CN=C1 SBB028232 [1,1,0,0,0,0|2,0,0]=4 602 B8R1.5 NC1=C(Cl)N=CC=C1 SBB004233 [1,1,0,0,0,0|2,0,0]=4 603 B8R1.5 NC1=C(F)C=NC=C1 SBB069765 [1,1,0,0,0,0|2,0,0]=4 604 B8R1.5 NC1=C(I)C=CC=N1 SBB028437 [1,1,0,0,0,0|2,0,0]=4 605 B8R1.5 NC1=C(I)C=CN=C1 SBB070538 [1,1,0,0,0,0|2,0,0]=4 606 B8R1.5 NC1=C(N)C=NC=C1 SBB004341 [1,1,0,0,0,0|2,0,0]=4 607 B8R1.5 NC1=C(O)C=CC=N1 SBB028186 [1,1,0,0,0,0|2,0,0]=4 608 B8R1.5 NC1=CC=CN=C1Br SBB005539 [1,1,0,0,0,0|2,0,0]=4 609 B8R1.5 NC1=CC=CN=C1N SBB004339 [1,1,0,0,0,0|2,0,0]=4 610 B8R1.5 NC1=CC=CN=C1O SBB051906 [1,1,0,0,0,0|2,0,0]=4 611 B8R1.5 NC1=CC=NC=C1Cl SBB051889 [1,1,0,0,0,0|2,0,0]=4 612 B8R1.5 NC1=CC=NC=C1I SBB028438 [1,1,0,0,0,0|2,0,0]=4 613 B8R1.5 NC1=CC=NC=C1O SBB051918 [1,1,0,0,0,0|2,0,0]=4 614 B8R1.5 NC1=CN=CC=C1O SBB051888 [1,1,0,0,0,0|2,0,0]=4 615 B8R1.5 NC1=NC=CC=C1Br SBB005538 [1,1,0,0,0,0|2,0,0]=4 616 B8R1.5 NC1=NC=CC=C1F SBB051797 [1,1,0,0,0,0|2,0,0]=4 617 B8R1.5 NC1=NC=CC=C1S SBB065453 [1,1,0,0,0,0|2,0,0]=4 618 B8R1.5 NC1=NC=CN=C1Cl SBB006510 [1,1,0,0,0,0|1,0,0]=3 619 B8R1.5 OC1=C(Br)C=NC=C1 SBB088832 [1,1,0,0,0,0|2,0,0]=4 620 B8R1.5 OC1=C(O)N=CC=C1 SBB004333 [1,1,0,0,0,0|2,0,0]=4 621 B8R1.5 OC1=CC=CN=C1Br SBB003805 [1,1,0,0,0,0|2,0,0]=4 622 B8R1.5 OC1=CC=CN=C1Cl SBB054358 [1,1,0,0,0,0|2,0,0]=4 623 B8R1.5 OC1=CC=CN=C1I SBB054374 [1,1,0,0,0,0|2,0,0]=4 624 B8R1.5 OC1=NC=CC=C1Cl SBB054336 [1,1,0,0,0,0|2,0,0]=4 625 B8R1.1 CC1=CC(CBr)=NO1 SBB089113 [0,1,0,0,1,0|2,0,0]=4 626 B8R1.1 CC1=CC(CCl)=NO1 SBB026481 [0,1,0,0,1,0|2,0,0]=4 627 B8R1.1 CC1=CC(CN)=NO1 SBB018900 [0,1,0,0,1,0|2,0,0]=4 628 B8R1.1 CC1=CC(CO)=CS1 SBB017457 [0,1,0,0,1,0|2,0,0]=4 629 B8R1.1 CC1=CC(CO)=NO1 SBB025974 [0,1,0,0,1,0|2,0,0]=4 630 B8R1.1 CC1=CC=C(CN)O1 SBB047770 [0,1,0,0,1,0|2,0,0]=4 631 B8R1.1 CC1=CN(CCl)N=C1 SBB031559 [0,1,0,0,1,0|2,0,0]=4 632 B8R1.1 CC1=CN(CO)N=C1 SBB023299 [0,1,0,0,1,0|2,0,0]=4 633 B8R1.1 CC1=CN=C(CO)S1 SBB054807 [0,1,0,0,1,0|2,0,0]=4 634 B8R1.1 CC1=CSC(CO)=N1 SBB054809 [0,1,0,0,1,0|2,0,0]=4 635 B8R1.1 CC1=NC(CCl)=CS1 SBB005574 [0,1,0,0,1,0|2,0,0]=4 636 B8R1.1 CC1=NC(CCl)=CS1 SBB054934 [0,1,0,0,1,0|2,0,0]=4 637 B8R1.1 CC1=NC(CCl)=NO1 SBB014359 [0,1,0,0,1,0|2,0,0]=4 638 B8R1.1 CC1=NC(CN)=CS1 SBB052476 [0,1,0,0,1,0|2,0,0]=4 639 B8R1.1 CC1=NC(CN)=NO1 SBB018524 [0,1,0,0,1,0|2,0,0]=4 640 B8R1.1 CC1=NC(CO)=NO1 SBB018815 [0,1,0,0,1,0|2,0,0]=4 641 B8R1.1 CC1=NNC(CN)=C1 SBB027644 [0,1,0,0,1,0|2,0,0]=4 642 B8R1.1 CC1=NNC(CN)=N1 SBB013189 [0,1,0,0,1,0|2,0,0]=4 643 B8R1.1 CC1=NNC(CO)=C1 SBB080476 [0,1,0,0,1,0|2,0,0]=4 644 B8R1.1 CC1=NOC(CCl)=N1 SBB014390 [0,1,0,0,1,0|2,0,0]=4 645 B8R1.1 CC1=NOC(CN)=C1 SBB026727 [0,1,0,0,1,0|2,0,0]=4 646 B8R1.1 CC1=NOC(CO)=C1 SBB025975 [0,1,0,0,1,0|2,0,0]=4 647 B8R1.1 CCC1=CC(Br)=CS1 SBB073295 [0,1,0,0,1,0|1,0,0]=3 648 B8R1.1 CCC1=NN=C(N)N1 SBB017904 [0,1,0,0,1,0|1,0,1]=4 649 B8R1.1 CCC1=NN=C(N)O1 SBB059512 [0,1,0,0,1,0|2,0,0]=4 650 B8R1.1 CCC1=NN=C(N)S1 SBB028237 [0,1,0,0,1,0|2,0,0]=4 651 B8R1.1 CCC1=NN=C(S)N1 SBB024810 [0,1,0,0,1,0|1,0,1]=4 652 B8R1.1 CCC1=NSC(N)=N1 SBB005485 [0,1,0,0,1,0|1,0,0]=3 653 B8R1.1 CCN1C=C(Br)C=N1 SBB046690 [0,1,0,0,1,0|1,0,0]=3 654 B8R1.1 CCN1C=C(Cl)C=N1 SBB046646 [0,1,0,0,1,0|1,0,0]=3 655 B8R1.1 CCN1C=C(I)C=N1 SBB051456 [0,1,0,0,1,0|1,0,0]=3 656 B8R1.1 CCN1C=C(N)C=N1 SBB009610 [0,1,0,0,1,0|1,0,0]=3 657 B8R1.1 CCN1C=C(O)C=N1 SBB032284 [0,1,0,0,1,0|1,0,0]=3 658 B8R1.1 CCN1C=CC(Br)=N1 SBB054434 [0,1,0,0,1,0|1,0,0]=3 659 B8R1.1 CCN1C=CC(C)=N1 SBB020339 [0,1,0,0,1,0|1,0,0]=3 660 B8R1.1 CCN1C=CC(I)=N1 SBB116216 [0,1,0,0,1,0|1,0,0]=3 661 B8R1.1 CCN1C=CC(N)=N1 SBB020916 [0,1,0,0,1,0|1,0,0]=3 662 B8R1.1 CCN1C=NC(N)=N1 SBB073346 [0,1,0,0,1,0|1,0,0]=3 663 B8R1.1 CN1C=C(CCl)C=N1 SBB026129 [0,1,0,0,1,0|2,0,0]=4 664 B8R1.1 CN1C=C(CN)C=N1 SBB000039 [0,1,0,0,1,0|2,0,0]=4 665 B8R1.1 CN1C=C(CO)C=N1 SBB022156 [0,1,0,0,1,0|2,0,0]=4 666 B8R1.1 CN1C=CC(CCl)=N1 SBB054941 [0,1,0,0,1,0|2,0,0]=4 667 B8R1.1 CN1C=CC(CN)=N1 SBB020585 [0,1,0,0,1,0|2,0,0]=4 668 B8R1.1 CN1C=CC(CO)=N1 SBB073640 [0,1,0,0,1,0|2,0,0]=4 669 B8R1.1 COC1=NC(Br)=NN1 SBB116034 [0,1,0,0,1,0|2,0,0]=4 670 B8R1.1 COC1=NSC(N)=N1 SBB005490 [0,1,0,0,1,0|2,0,0]=4 671 B8R1.1 CSC1=NC(N)=NS1 SBB005495 [0,1,0,0,1,0|2,0,0]=4 672 B8R1.1 CSC1=NC(O)=NS1 SBB059105 [0,1,0,0,1,0|2,0,0]=4 673 B8R1.1 CSC1=NSC(N)=N1 SBB005494 [0,1,0,0,1,0|2,0,0]=4 674 B8R1.1 ClCC1=CC(Br)=NO1 SBB054936 [0,1,0,0,1,0|2,0,0]=4 675 B8R1.1 ClCC1=CN=C(Cl)S1 SBB070711 [0,1,0,0,1,0|2,0,0]=4 676 B8R1.1 ClCN1C=C(Br)C=N1 SBB021115 [0,1,0,0,1,0|2,0,0]=4 677 B8R1.1 ClCN1C=C(Cl)C=N1 SBB022607 [0,1,0,0,1,0|2,0,0]=4 678 B8R1.1 N1C=C(C)N=C1CC SBB004334 [0,1,0,0,1,0|0,0,1]=3 679 B8R1.1 NC1=NC(CCl)=CS1 SBB027575 [0,1,0,0,1,0|2,0,0]=4 680 B8R1.1 NC1=NC(CCl)=CS1 SBB090242 [0,1,0,0,1,0|2,0,0]=4 681 B8R1.1 NC1=NC(CO)=CS1 SBB014800 [0,1,0,0,1,0|2,0,0]=4 682 B8R1.1 NC1=NC(CO)=NN1 SBB012798 [0,1,0,0,1,0|2,0,0]=4 683 B8R1.1 NC1=NC=C(CO)S1 SBB054810 [0,1,0,0,1,0|2,0,0]=4 684 B8R1.1 NC1=NNC(CO)=C1 SBB073850 [0,1,0,0,1,0|2,0,0]=4 685 B8R1.1 NCC1=CC=C(Br)O1 SBB014655 [0,1,0,0,1,0|2,0,0]=4 686 B8R1.1 NCC1=NNC(N)=N1 SBB013195 [0,1,0,0,1,0|2,0,0]=4 687 B8R1.1 OCC1=CC(Br)=CS1 SBB091532 [0,1,0,0,1,0|2,0,0]=4 688 B8R1.1 OCC1=CC=C(Br)S1 SBB068487 [0,1,0,0,1,0|2,0,0]=4 689 B8R1.1 OCC1=CC=C(F)S1 SBB073359 [0,1,0,0,1,0|2,0,0]=4 690 B8R1.1 OCC1=CN=C(Cl)S1 SBB086668 [0,1,0,0,1,0|2,0,0]=4 691 B8R1.1 OCN1C=C(Br)C=N1 SBB024003 [0,1,0,0,1,0|2,0,0]=4 692 B8R1.1 OCN1C=C(Cl)C=N1 SBB022509 [0,1,0,0,1,0|2,0,0]=4 693 B8R1.1 SC1=NC(SC)=NS1 SBB003912 [0,1,0,0,1,0|2,0,0]=4 694 B8R1.7 CC(=O)C1=CC=CN1 SBB066752 [0,1,0,0,1,0|0,0,2]=4 695 B8R1.7 CC(=O)C1=CC=CO1 SBB040248 [0,1,0,0,1,0|1,0,1]=4 696 B8R1.7 CC(=O)C1=CC=CS1 SBB038710 [0,1,0,0,1,0|1,0,1]=4 697 B8R1.7 CC(=O)C1=CC=NN1 SBB086523 [0,1,0,0,1,0|1,0,1]=4 698 B8R1.7 CC(=O)C1=CSC=C1 SBB048022 [0,1,0,0,1,0|1,0,1]=4 699 B8R1.7 CC(=O)C1=NC=CS1 SBB085685 [0,1,0,0,1,0|1,0,1]=4 700 B8R1.7 CC(=O)N1C=CN=C1 SBB008874 [0,1,0,0,1,0|1,0,1]=4 701 B8R1.7 CC(C)C1=NNC=C1 SBB026130 [0,1,0,0,1,0|1,0,0]=3 702 B8R1.7 CC(C)N1C=CC=N1 SBB025134 [0,1,0,0,1,0|1,0,0]=3 703 B8R1.7 CC(C)N1C=CN=C1 SBB046689 [0,1,0,0,1,0|1,0,0]=3 704 B8R1.7 CC(N)C1=CC=CO1 SBB017903 [0,1,0,0,1,0|1,0,0]=3 705 B8R1.7 CC(N)C1=CC=CS1 SBB028228 [0,1,0,0,1,0|1,0,0]=3 706 B8R1.7 CN(C)C1=CC=CS1 SBB059107 [0,1,0,0,1,0|2,0,0]=4 707 B8R1.7 FC(F)C1=NNC=C1 SBB027078 [0,1,0,0,1,0|2,0,0]=4 708 B8R1.7 FC(F)N1C=CC=N1 SBB000004 [0,1,0,0,1,0|2,0,0]=4 709 B8R1.8 BrCCN1C=CC=N1 SBB051197 [0,1,0,0,1,0|1,0,0]=3 710 B8R1.8 CCCC1=CC=CS1 SBB073407 [0,1,0,0,1,0|1,0,0]=3 711 B8R1.8 CCCC1=NC=CS1 SBB055797 [0,1,0,0,1,0|1,0,0]=3 712 B8R1.8 CCCN1C=CC=N1 SBB024228 [0,1,0,0,1,0|1,0,0]=3 713 B8R1.8 CCCN1C=CN=C1 SBB073424 [0,1,0,0,1,0|1,0,0]=3 714 B8R1.8 CNCC1=CC=CO1 SBB079004 [0,1,0,0,1,0|1,0,0]=3 715 B8R1.8 CNCC1=CC=NN1 SBB023948 [0,1,0,0,1,0|1,0,0]=3 716 B8R1.8 ClCCC1=CNN=C1 SBB073776 [0,1,0,0,1,0|1,0,0]=3 717 B8R1.8 ClCCC1=NNN=N1 SBB002506 [0,1,0,0,1,0|2,0,0]=4 718 B8R1.8 ClCCN1C=CC=N1 SBB022467 [0,1,0,0,1,0|1,0,0]=3 719 B8R1.8 ClCCN1C=CN=C1 SBB005584 [0,1,0,0,1,0|1,0,0]=3 720 B8R1.8 N#CCC1=CC=CS1 SBB055746 [0,1,0,0,1,0|1,0,1]=4 721 B8R1.8 N#CCC1=CSC=C1 SBB058364 [0,1,0,0,1,0|1,0,1]=4 722 B8R1.8 N#CCN1C=CC=N1 SBB022524 [0,1,0,0,1,0|1,0,1]=4 723 B8R1.8 N#CCN1C=CN=C1 SBB047443 [0,1,0,0,1,0|1,0,1]=4 724 B8R1.8 N#CCN1C=NC=N1 SBB056169 [0,1,0,0,1,0|1,0,1]=4 725 B8R1.8 NCCC1=CC=CO1 SBB013333 [0,1,0,0,1,0|1,0,0]=3 726 B8R1.8 NCCC1=CC=CS1 SBB013250 [0,1,0,0,1,0|1,0,0]=3 727 B8R1.8 NCCC1=CC=CS1 SBB013650 [0,1,0,0,1,0|1,0,0]=3 728 B8R1.8 NCCC1=CNC=N1 SBB003722 [0,1,0,0,1,0|0,0,1]=3 729 B8R1.8 NCCC1=CNC=N1 SBB012708 [0,1,0,0,1,0|0,0,1]=3 730 B8R1.8 NCCC1=CNN=C1 SBB018789 [0,1,0,0,1,0|1,0,0]=3 731 B8R1.8 NCCC1=CSC=C1 SBB109999 [0,1,0,0,1,0|1,0,0]=3 732 B8R1.8 NCCC1=NC=CS1 SBB046047 [0,1,0,0,1,0|1,0,0]=3 733 B8R1.8 NCCC1=NC=NN1 SBB074373 [0,1,0,0,1,0|1,0,0]=3 734 B8R1.8 NCCN1C=CC=N1 SBB007087 [0,1,0,0,1,0|1,0,0]=3 735 B8R1.8 NCCN1C=CN=C1 SBB026490 [0,1,0,0,1,0|1,0,0]=3 736 B8R1.8 NCCN1C=NC=N1 SBB042070 [0,1,0,0,1,0|1,0,0]=3 737 B8R1.8 OCCC1=CC=CS1 SBB062831 [0,1,0,0,1,0|1,0,0]=3 738 B8R1.8 OCCC1=CNN=C1 SBB020248 [0,1,0,0,1,0|1,0,0]=3 739 B8R1.8 OCCC1=NNN=N1 SBB002505 [0,1,0,0,1,0|2,0,0]=4 740 B8R1.8 OCCN1C=CC=N1 SBB022466 [0,1,0,0,1,0|1,0,0]=3 741 B8R1.8 OCCN1C=CN=C1 SBB059127 [0,1,0,0,1,0|1,0,0]=3 742 B8R1.11 CC1=C(CCl)NC=N1 SBB019096 [0,1,0,0,1,0|1,0,1]=4 743 B8R1.11 CC1=C(CN)SC=C1 SBB028229 [0,1,0,0,1,0|2,0,0]=4 744 B8R1.11 CC1=C(CO)C=CO1 SBB054803 [0,1,0,0,1,0|2,0,0]=4 745 B8R1.11 CC1=NNC=C1CN SBB013491 [0,1,0,0,1,0|2,0,0]=4 746 B8R1.11 CC1=NON=C1CCl SBB020409 [0,1,0,0,1,0|2,0,0]=4 747 B8R1.11 CC1=NON=C1CN SBB012978 [0,1,0,0,1,0|2,0,0]=4 748 B8R1.11 CCC1=CC=NN1C SBB026460 [0,1,0,0,1,0|1,0,0]=3 749 B8R1.11 CCC1=CNN=C1N SBB069760 [0,1,0,0,1,0|1,0,0]=3 750 B8R1.11 CCN1N=CC=C1C SBB020345 [0,1,0,0,1,0|1,0,0]=3 751 B8R1.11 CCN1N=CC=C1F SBB116429 [0,1,0,0,1,0|1,0,0]=3 752 B8R1.11 CCN1N=CC=C1I SBB116428 [0,1,0,0,1,0|1,0,0]=3 753 B8R1.11 CCN1N=CC=C1N SBB005554 [0,1,0,0,1,0|1,0,0]=3 754 B8R1.11 CCN1N=NN=C1S SBB066381 [0,1,0,0,1,0|2,0,0]=4 755 B8R1.11 CN1C=CN=C1CCl SBB013849 [0,1,0,0,1,0|1,0,1]=4 756 B8R1.11 CN1C=CN=C1CCl SBB088045 [0,1,0,0,1,0|1,0,1]=4 757 B8R1.11 CN1C=CN=C1CN SBB014295 [0,1,0,0,1,0|1,0,1]=4 758 B8R1.11 CN1C=CN=C1CO SBB054819 [0,1,0,0,1,0|1,0,1]=4 759 B8R1.11 CN1N=CC=C1CCl SBB025039 [0,1,0,0,1,0|2,0,0]=4 760 B8R1.11 CN1N=CC=C1CN SBB021230 [0,1,0,0,1,0|2,0,0]=4 761 B8R1.11 CN1N=CC=C1CO SBB024002 [0,1,0,0,1,0|2,0,0]=4 762 B8R1.11 COC1=NON=C1N SBB000044 [0,1,0,0,1,0|2,0,0]=4 763 B8R1.11 COC1=NON=C1O SBB014555 [0,1,0,0,1,0|2,0,0]=4 764 B8R1.11 NCC1=NNC=C1I SBB073991 [0,1,0,0,1,0|2,0,0]=4 765 B8R1.11 OCC1=C(C)N=CN1 SBB005865 [0,1,0,0,1,0|1,0,1]=4 766 B8R1.11 OCC1=NNC=C1I SBB073992 [0,1,0,0,1,0|2,0,0]=4 767 B10R1.1 CCCC1=CC=C(N)C=C1 SBB008337 [0,2,0,0,0,0|2,0,0]=4 768 B10R1.1 CCCC1=CC=C(O)C=C1 SBB055506 [0,2,0,0,0,0|2,0,0]=4 769 B10R1.1 CCCC1=CN=C(Cl)N=C1 SBB054517 [0,2,0,0,0,0|2,0,0]=4 770 B10R1.1 CCCC1=CN=C(S)N=C1 SBB066482 [0,2,0,0,0,0|2,0,0]=4 771 B10R1.1 CCOC1=CC=C(Br)C=C1 SBB059353 [0,2,0,0,0,0|2,0,0]=4 772 B10R1.1 CCOC1=CC=C(C)C=C1 SBB060988 [0,2,0,0,0,0|2,0,0]=4 773 B10R1.1 CCOC1=CC=C(Cl)C=C1 SBB040853 [0,2,0,0,0,0|2,0,0]=4 774 B10R1.1 CCOC1=CC=C(Cl)N=N1 SBB049613 [0,2,0,0,0,0|2,0,0]=4 775 B10R1.1 CCOC1=CC=C(F)C=C1 SBB086157 [0,2,0,0,0,0|2,0,0]=4 776 B10R1.1 CCOC1=CC=C(N)C=C1 SBB040442 [0,2,0,0,0,0|2,0,0]=4 777 B10R1.1 CCOC1=CC=C(N)C=C1 SBB073014 [0,2,0,0,0,0|2,0,0]=4 778 B10R1.1 CCOC1=CC=C(O)C=C1 SBB043810 [0,2,0,0,0,0|2,0,0]=4 779 B10R1.1 CCOC1=NC=C(Br)C=C1 SBB054264 [0,2,0,0,0,0|1,0,0]=3 780 B10R1.1 CCSC1=CC=C(N)C=C1 SBB071614 [0,2,0,0,0,0|2,0,0]=4 781 B10R1.1 CNCC1=CC=C(C)C=C1 SBB079252 [0,2,0,0,0,0|2,0,0]=4 782 B10R1.1 CNCC1=CC=C(Cl)C=C1 SBB010371 [0,2,0,0,0,0|2,0,0]=4 783 B10R1.1 CNCC1=CC=C(F)C=C1 SBB005902 [0,2,0,0,0,0|2,0,0]=4 784 B10R1.1 CNCC1=CC=C(O)C=C1 SBB046545 [0,2,0,0,0,0|2,0,0]=4 785 B10R1.1 FC1=CC=C(CCCl)C=C1 SBB087329 [0,2,0,0,0,0|2,0,0]=4 786 B10R1.1 NC1=CC=C(CCO)C=C1 SBB042772 [0,2,0,0,0,0|2,0,0]=4 787 B10R1.1 NCCC1=CC=C(F)C=C1 SBB003787 [0,2,0,0,0,0|2,0,0]=4 788 B10R1.1 NCCC1=CC=C(F)C=C1 SBB058811 [0,2,0,0,0,0|2,0,0]=4 789 B10R1.1 NCCC1=CC=C(O)C=C1 SBB003808 [0,2,0,0,0,0|2,0,0]=4 790 B10R1.1 OCCC1=CC=C(Br)C=C1 SBB055082 [0,2,0,0,0,0|2,0,0]=4 791 B10R1.1 OCCC1=CC=C(F)C=C1 SBB086156 [0,2,0,0,0,0|2,0,0]=4 792 B10R1.1 OCCC1=CC=C(O)C=C1 SBB086008 [0,2,0,0,0,0|2,0,0]=4 793 B10R1.3 CCC1=CC=C(C#N)C=C1 SBB059144 [0,2,0,0,0,0|2,0,0]=4 794 B10R1.3 CCC1=CC=C(C=O)C=C1 SBB040197 [0,2,0,0,0,0|2,0,0]=4 795 B10R1.3 CCC1=CC=C(CC)C=C1 SBB061169 [0,2,0,0,0,0|2,0,0]=4 796 B10R1.3 CCC1=CC=C(CN)C=C1 SBB017636 [0,2,0,0,0,0|2,0,0]=4 797 B10R1.3 CCC1=CC=C(NN)C=C1 SBB001777 [0,2,0,0,0,0|2,0,0]=4 798 B10R1.3 CCC1=CC=C(NN)C=C1 SBB064984 [0,2,0,0,0,0|2,0,0]=4 799 B10R1.3 CCC1=CC=C(OC)C=C1 SBB060457 [0,2,0,0,0,0|2,0,0]=4 800 B10R1.3 COC1=CC=C(C#N)C=N1 SBB055563 [0,2,0,0,0,0|2,0,0]=4 801 B10R1.3 COC1=CC=C(C=O)C=N1 SBB052248 [0,2,0,0,0,0|2,0,0]=4 802 B10R1.3 N#CC1=NC=C(CBr)C=C1 SBB054921 [0,2,0,0,0,0|2,0,0]=4 803 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SBB055637 [0,2,0,0,0,0|1,0,1]=4 804 B10R1.13 CC(=O)C1=CC=C(C)N=C1 SBB055610 [0,2,0,0,0,0|1,0,1]=4 805 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 SBB055593 [0,2,0,0,0,0|1,0,1]=4 806 B10R1.13 CC(C)C1=CC=C(N)C=C1 SBB040447 [0,2,0,0,0,0|2,0,0]=4 807 B10R1.13 CC(N)C1=CC=C(F)C=C1 SBB046789 [0,2,0,0,0,0|2,0,0]=4 808 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB008453 [0,2,0,0,0,0|2,0,0]=4 809 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB080372 [0,2,0,0,0,0|2,0,0]=4 810 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 SBB063808 [0,2,0,0,0,0|2,0,0]=4 811 B10R1.13 CC(O)C1=CC=C(N)C=C1 SBB048111 [0,2,0,0,0,0|2,0,0]=4 812 B10R1.13 CC1=CC=C(C(C)C)C=C1 SBB060399 [0,2,0,0,0,0|2,0,0]=4 813 B10R1.13 CC1=CC=C(C(C)N)C=C1 SBB010017 [0,2,0,0,0,0|2,0,0]=4 814 B10R1.13 CC1=CC=C(C(C)O)C=C1 SBB061733 [0,2,0,0,0,0|2,0,0]=4 815 B10R1.13 CC1=NC=C(C(=O)O)N=C1 SBB006622 [0,2,0,0,0,0|1,0,1]=4 816 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 SBB064275 [0,2,0,0,0,0|2,0,0]=4 817 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 SBB064274 [0,2,0,0,0,0|2,0,0]=4 818 B10R1.13 ClC1=CC=C(C(Cl)Cl)C=N1 SBB054302 [0,2,0,0,0,0|2,0,0]=4 819 B10R1.13 NC(C)C1=CC=C(Br)C=C1 SBB006746 [0,2,0,0,0,0|2,0,0]=4 820 B10R1.13 NC(C)C1=CC=C(Cl)C=C1 SBB004019 [0,2,0,0,0,0|2,0,0]=4 821 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 SBB053217 [0,2,0,0,0,0|1,0,1]=4 822 B10R1.13 O=C(O)C1=NC=C(O)N=C1 SBB047806 [0,2,0,0,0,0|1,0,1]=4 823 B10R1.25 CCC1=C(C)C=C(C)C=C1 SBB061315 [0,2,0,0,0,0|2,0,0]=4 824 B10R1.25 CCC1=C(N)N=C(C)C=C1 SBB028253 [0,2,0,0,0,0|1,0,0]=3 825 B10R1.25 COC1=C(N)C=C(Br)C=N1 SBB093040 [0,2,0,0,0,0|2,0,0]=4 826 B10R1.25 COC1=CC=C(N)N=C1Br SBB005638 [0,2,0,0,0,0|2,0,0]=4 827 B10R1.25 COC1=NC=C(Br)C=C1C SBB054332 [0,2,0,0,0,0|2,0,0]=4 828 B10R1.25 O=CC1=NC=C(Cl)N=C1Cl SBB052319 [0,2,0,0,0,0|1,0,1]=4 829 B10R1.25 OCC1=CC=C(Cl)N=C1Cl SBB089352 [0,2,0,0,0,0|2,0,0]=4 830 B10R1.176 CCC1=CC(C)=C(C)C=C1 SBB061288 [0,2,0,0,0,0|2,0,0]=4 831 B10R1.176 CCC1=CC=C(O)C(N)=C1 SBB000071 [0,2,0,0,0,0|2,0,0]=4 832 B10R1.176 COC1=CC(N)=C(N)C=N1 SBB062788 [0,2,0,0,0,0|2,0,0]=4 833 B10R1.176 COC1=CC=C(N)C(Br)=N1 SBB070409 [0,2,0,0,0,0|2,0,0]=4 834 B10R1.176 OCC1=CC(Cl)=C(Cl)N=C1 SBB054797 [0,2,0,0,0,0|2,0,0]=4 835 B10R1.2 CCC1=C(O)C(C)=CC=C1 SBB071423 [0,2,0,0,0,0|2,0,0]=4 836 B10R1.2 CCC1=CC=CC(C)=C1I SBB100083 [0,2,0,0,0,0|2,0,0]=4 837 B10R1.2 CCC1=CC=CC(C)=C1N SBB040448 [0,2,0,0,0,0|2,0,0]=4 838 B10R1.8 CCC1=CC(C)=CC(C)=C1 SBB060975 [0,2,0,0,0,0|2,0,0]=4 839 B10R1.8 CCC1=CC(O)=NC(C)=N1 SBB086014 [0,2,0,0,0,0|2,0,0]=4 840 B10R1.8 CCC1=CC(O)=NC(N)=N1 SBB047641 [0,2,0,0,0,0|2,0,0]=4 841 B10R1.8 CCC1=NC(N)=NC(Cl)=C1 SBB051959 [0,2,0,0,0,0|2,0,0]=4 842 B10R1.10 CCOC1=CC(N)=CC=C1 SBB059860 [0,2,0,0,0,0|2,0,0]=4 843 B10R1.10 CCOC1=CC=CC(C)=C1 SBB060989 [0,2,0,0,0,0|2,0,0]=4 844 B10R1.10 CCOC1=CC=CC(O)=C1 SBB005788 [0,2,0,0,0,0|2,0,0]=4 845 B10R1.10 CCOC1=NC(N)=CC=N1 SBB086081 [0,2,0,0,0,0|2,0,0]=4 846 B10R1.10 CCSC1=NC(O)=CC=N1 SBB081944 [0,2,0,0,0,0|2,0,0]=4 847 B10R1.10 CNCC1=CC(O)=CC=C1 SBB046532 [0,2,0,0,0,0|2,0,0]=4 848 B10R1.10 CNCC1=NC(C)=CC=C1 SBB110044 [0,2,0,0,0,0|1,0,0]=3 849 B10R1.10 OCCC1=CC(F)=CC=C1 SBB055447 [0,2,0,0,0,0|2,0,0]=4 850 B10R1.30 CC1=CN=C(N)C(C#N)=N1 SBB055886 [0,2,0,0,0,0|1,0,1]=4 851 B10R1.30 CCC1=C(O)C=CC(C)=N1 SBB080737 [0,2,0,0,0,0|1,0,0]=3 852 B10R1.30 CCC1=NC(C)=CC=C1O SBB080762 [0,2,0,0,0,0|1,0,0]=3 853 B10R1.30 COC1=CC(Br)=CN=C1N SBB070411 [0,2,0,0,0,0|2,0,0]=4 854 B10R1.30 COC1=NC(Br)=CN=C1N SBB070417 [0,2,0,0,0,0|1,0,0]=3 855 B10R1.30 NC1=NC=C(Br)C=C1CO SBB054792 [0,2,0,0,0,0|2,0,0]=4 856 B10R1.30 NC1=NC=C(I)C=C1CO SBB065554 [0,2,0,0,0,0|2,0,0]=4 857 B10R1.30 OCC1=C(O)C=CC(C)=N1 SBB004177 [0,2,0,0,0,0|2,0,0]=4 858 B10R1.30 [NH3+]C1=CC=C(Br)C=C1CC SBB058409 [0,2,0,0,0,0|2,0,0]=4 859 B10R1.113 CC(=O)C1=CC=CC(C)=N1 SBB068974 [0,2,0,0,0,0|1,0,1]=4 860 B10R1.113 CC(=O)C1=CN=CC(Br)=C1 SBB054319 [0,2,0,0,0,0|1,0,1]=4 861 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 SBB065468 [0,2,0,0,0,0|1,0,1]=4 862 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 SBB055630 [0,2,0,0,0,0|1,0,1]=4 863 B10R1.113 CC(N)C1=CC(Br)=CC=C1 SBB047651 [0,2,0,0,0,0|2,0,0]=4 864 B10R1.113 CC(N)C1=CC(Cl)=CC=C1 SBB046822 [0,2,0,0,0,0|2,0,0]=4 865 B10R1.113 CC(N)C1=CC=CC(O)=C1 SBB080427 [0,2,0,0,0,0|2,0,0]=4 866 B10R1.113 CC(O)C1=CC(N)=CC=C1 SBB008559 [0,2,0,0,0,0|2,0,0]=4 867 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 SBB068833 [0,2,0,0,0,0|2,0,0]=4 868 B10R1.113 CC(O)C1=CC=C[N+]([O-])=C1 SBB086069 [0,2,0,0,0,0|1,0,1]=4 869 B10R1.113 CC1=CC=CC(C(C)C)=C1 SBB061535 [0,2,0,0,0,0|2,0,0]=4 870 B10R1.113 CC1=CC=CC(C(C)N)=C1 SBB046820 [0,2,0,0,0,0|2,0,0]=4 871 B10R1.113 C[C@@H](O)C1=CC=CC(Br)=C1 SBB064272 [0,2,0,0,0,0|2,0,0]=4 872 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 SBB086151 [0,2,0,0,0,0|2,0,0]=4 873 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 SBB066005 [0,2,0,0,0,0|1,0,1]=4 874 B10R1.172 BrCC1=CC=CC(CBr)=N1 SBB071671 [0,2,0,0,0,0|2,0,0]=4 875 B10R1.172 CNC1=NC(OC)=CC=C1 SBB051844 [0,2,0,0,0,0|2,0,0]=4 876 B10R1.172 COC1=CC=NC(OC)=C1 SBB086068 [0,2,0,0,0,0|2,0,0]=4 877 B10R1.172 COC1=CN=CC(C=O)=C1 SBB052243 [0,2,0,0,0,0|2,0,0]=4 878 B10R1.172 OCC1=CC=CC(CO)=N1 SBB065235 [0,2,0,0,0,0|2,0,0]=4 879 B10R1.15 BrCC(Br)C1=CC=CC=C1 SBB058656 [0,2,0,0,0,0|2,0,0]=4 880 B10R1.15 C(=O)C(C)C1=CC=CC=C1 SBB007693 [0,2,0,0,0,0|2,0,0]=4 881 B10R1.15 CC(CN)C1=CC=CC=C1 SBB028247 [0,2,0,0,0,0|2,0,0]=4 882 B10R1.15 CC(CO)C1=CC=CC=C1 SBB007853 [0,2,0,0,0,0|2,0,0]=4 883 B10R1.15 CCC(=O)C1=CC=CC=C1 SBB058853 [0,2,0,0,0,0|2,0,0]=4 884 B10R1.15 CCC(Br)C1=CC=CC=C1 SBB060201 [0,2,0,0,0,0|2,0,0]=4 885 B10R1.15 CCC(C)C1=CC=CC=C1 SBB060615 [0,2,0,0,0,0|2,0,0]=4 886 B10R1.15 CCC(N)C1=CC=CC=C1 SBB029878 [0,2,0,0,0,0|2,0,0]=4 887 B10R1.15 CCC(N)C1=CC=CC=C1 SBB080382 [0,2,0,0,0,0|2,0,0]=4 888 B10R1.15 CCC(O)C1=CC=CC=C1 SBB058750 [0,2,0,0,0,0|2,0,0]=4 889 B10R1.15 COC(=O)C1=CC=CC=N1 SBB008127 [0,2,0,0,0,0|1,0,1]=4 890 B10R1.15 COC(=O)C1=CN=CC=C1 SBB040924 [0,2,0,0,0,0|1,0,1]=4 891 B10R1.15 COC(=O)C1=NC=CN=C1 SBB053939 [0,2,0,0,0,0|0,0,1]=3 892 B10R1.15 C[C@H](CN)C1=CC=CC=C1 SBB052360 [0,2,0,0,0,0|2,0,0]=4 893 B10R1.15 C\C(=N/O)C1=CN=CC=C1 SBB085929 [0,2,0,0,0,0|1,0,1]=4 894 B10R1.15 C\C(=N\O)C1=CC=CC=N1 SBB085936 [0,2,0,0,0,0|1,0,1]=4 895 B10R1.15 ClCC(Cl)C1=CC=CC=C1 SBB007931 [0,2,0,0,0,0|2,0,0]=4 896 B10R1.15 NCC(O)C1=CC=CC=C1 SBB063224 [0,2,0,0,0,0|2,0,0]=4 897 B10R1.15 NNC(=O)C1=CN=CC=N1 SBB005150 [0,2,0,0,0,0|1,0,1]=4 898 B10R1.15 N[C@H](CO)C1=CC=CC=C1 SBB006667 [0,2,0,0,0,0|2,0,0]=4 899 B10R1.15 N\C(=N/O)C1=NC=CN=C1 SBB055895 [0,2,0,0,0,0|1,0,1]=4 900 B10R1.15 O=C(CBr)C1=CN=CC=C1 SBB005582 [0,2,0,0,0,0|1,0,1]=4 901 B10R1.15 O=C(CBr)C1=NC=CC=C1 SBB005581 [0,2,0,0,0,0|1,0,1]=4 902 B10R1.15 OCC(O)C1=CC=CC=C1 SBB063119 [0,2,0,0,0,0|2,0,0]=4 903 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 SBB064282 [0,2,0,0,0,0|2,0,0]=4 904 B10R1.28 CC(C)(C)C1=CC=CC=C1 SBB040882 [0,2,0,0,0,0|2,0,0]=4 905 B10R1.28 CC(C)(C)C1=CC=CC=N1 SBB085909 [0,2,0,0,0,0|1,0,0]=3 906 B10R1.28 CC(C)(N)C1=CC=CC=C1 SBB028249 [0,2,0,0,0,0|2,0,0]=4 907 B10R1.28 FC(F)(Cl)C1=CN=CC=C1 SBB039118 [0,2,0,0,0,0|2,0,0]=4 908 B10R1.28 FC(F)(F)C1=CN=CC=C1 SBB039117 [0,2,0,0,0,0|2,0,0]=4 909 B10R1.28 FC(F)(F)C1=NC=CC=C1 SBB055693 [0,2,0,0,0,0|2,0,0]=4 910 B10R1.61 CC(=O)C1=C(C)N=CC=N1 SBB005785 [0,2,0,0,0,0|0,0,1]=3 911 B10R1.61 CC(=O)C1=CC=CN=C1F SBB065563 [0,2,0,0,0,0|1,0,1]=4 912 B10R1.61 CC(=O)C1=CN=CC=C1C SBB055670 [0,2,0,0,0,0|1,0,1]=4 913 B10R1.61 CC(C)C1=C(Br)C=CC=C1 SBB092412 [0,2,0,0,0,0|2,0,0]=4 914 B10R1.61 CC(C)C1=C(N)C=CC=C1 SBB040455 [0,2,0,0,0,0|2,0,0]=4 915 B10R1.61 CC(N)C1=C(Cl)C=CC=C1 SBB046790 [0,2,0,0,0,0|2,0,0]=4 916 B10R1.61 CC(O)C1=CC=CC=C1N SBB072985 [0,2,0,0,0,0|2,0,0]=4 917 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 SBB086152 [0,2,0,0,0,0|2,0,0]=4 918 B10R1.61 C[C@H](O)C1=CC=CC=C1Br SBB064753 [0,2,0,0,0,0|2,0,0]=4 919 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl SBB064728 [0,2,0,0,0,0|2,0,0]=4 920 B10R1.61 NC(=O)C1=C(O)N=CC=N1 SBB086051 [0,2,0,0,0,0|1,0,1]=4 921 B10R1.61 O=C(O)C1=NC=CN=C1O SBB019213 [0,2,0,0,0,0|1,0,1]=4 922 B10R1.61 OC(=O)C1=C(N)N=CC=N1 SBB004179 [0,2,0,0,0,0|1,0,1]=4 923 B10R1.4 CCCC1=CC=CC=C1N SBB085906 [0,2,0,0,0,0|2,0,0]=4 924 B10R1.4 CCNC1=CC=CC=C1N SBB111820 [0,2,0,0,0,0|2,0,0]=4 925 B10R1.4 CCOC1=C(F)C=CC=C1 SBB086154 [0,2,0,0,0,0|2,0,0]=4 926 B10R1.4 CCOC1=C(N)N=CC=C1 SBB014971 [0,2,0,0,0,0|1,0,0]=3 927 B10R1.4 CCOC1=CC=CC=C1C SBB060978 [0,2,0,0,0,0|2,0,0]=4 928 B10R1.4 CCOC1=CC=CC=C1Cl SBB061024 [0,2,0,0,0,0|2,0,0]=4 929 B10R1.4 CCOC1=CC=CC=C1O SBB060424 [0,2,0,0,0,0|2,0,0]=4 930 B10R1.4 CNCC1=C(Br)C=CC=C1 SBB092552 [0,2,0,0,0,0|2,0,0]=4 931 B10R1.4 CNCC1=CC=CC=C1Cl SBB010370 [0,2,0,0,0,0|2,0,0]=4 932 B10R1.4 CNCC1=CC=CC=C1F SBB086087 [0,2,0,0,0,0|2,0,0]=4 933 B10R1.4 FC1=C(CCBr)C=CC=C1 SBB018050 [0,2,0,0,0,0|2,0,0]=4 934 B10R1.4 NC1=C(OCC)C=CC=C1 SBB006726 [0,2,0,0,0,0|2,0,0]=4 935 B10R1.4 OCCC1=C(F)C=CC=C1 SBB086155 [0,2,0,0,0,0|2,0,0]=4 936 B10R1.17 BrCCCC1=CN=CC=C1 SBB014930 [0,2,0,0,0,0|1,0,0]=3 937 B10R1.17 BrCCOC1=CC=CC=C1 SBB042586 [0,2,0,0,0,0|2,0,0]=4 938 B10R1.17 BrCCSC1=CC=CC=C1 SBB059699 [0,2,0,0,0,0|2,0,0]=4 939 B10R1.17 C(=O)CCC1=CC=CC=C1 SBB006730 [0,2,0,0,0,0|2,0,0]=4 940 B10R1.17 C=CCCC1=CC=CC=C1 SBB008476 [0,2,0,0,0,0|2,0,0]=4 941 B10R1.17 CCCNC1=CC=CC=C1 SBB059800 [0,2,0,0,0,0|2,0,0]=4 942 B10R1.17 CCCOC1=CC=CC=C1 SBB061098 [0,2,0,0,0,0|2,0,0]=4 943 B10R1.17 CCNCC1=CC=CC=C1 SBB058765 [0,2,0,0,0,0|2,0,0]=4 944 B10R1.17 CCOCC1=CC=CC=C1 SBB061196 [0,2,0,0,0,0|2,0,0]=4 945 B10R1.17 CCSCC1=CC=CC=C1 SBB061362 [0,2,0,0,0,0|2,0,0]=4 946 B10R1.17 CNCCC1=NC=CC=C1 SBB017551 [0,2,0,0,0,0|1,0,0]=3 947 B10R1.17 CNCCC1=NC=CC=C1 SBB040053 [0,2,0,0,0,0|1,0,0]=3 948 B10R1.17 ClCCCC1=CC=CC=C1 SBB061361 [0,2,0,0,0,0|2,0,0]=4 949 B10R1.17 ClCOCC1=CC=CC=C1 SBB064207 [0,2,0,0,0,0|2,0,0]=4 950 B10R1.17 ClCSCC1=CC=CC=C1 SBB055458 [0,2,0,0,0,0|2,0,0]=4 951 B10R1.17 N#CCCC1=NC=CC=C1 SBB018592 [0,2,0,0,0,0|1,0,0]=3 952 B10R1.17 NCCCC1=CC=CC=C1 SBB028248 [0,2,0,0,0,0|2,0,0]=4 953 B10R1.17 NCCCC1=CC=CC=N1 SBB012768 [0,2,0,0,0,0|1,0,0]=3 954 B10R1.17 NCCNC1=CC=CC=C1 SBB004200 [0,2,0,0,0,0|2,0,0]=4 955 B10R1.17 NCCOC1=CC=CC=C1 SBB085982 [0,2,0,0,0,0|2,0,0]=4 956 B10R1.17 NCCSC1=CC=CC=C1 SBB047720 [0,2,0,0,0,0|2,0,0]=4 957 B10R1.17 NCCSC1=NC=CC=C1 SBB050976 [0,2,0,0,0,0|1,0,0]=3 958 B10R1.17 OCCCC1=CC=CC=C1 SBB061127 [0,2,0,0,0,0|2,0,0]=4 959 B10R1.17 OCCOC1=CC=CC=C1 SBB060485 [0,2,0,0,0,0|2,0,0]=4 960 B10R1.18 CC(=O)NC1=CC=CC=N1 SBB085932 [0,2,0,0,0,0|1,0,1]=4 961 B10R1.18 CC(C)NC1=CC=CC=C1 SBB007921 [0,2,0,0,0,0|2,0,0]=4 962 B10R1.18 CC(N)CC1=CC=CC=N1 SBB025629 [0,2,0,0,0,0|1,0,0]=3 963 B10R1.18 CC(N)CC1=CN=CC=N1 SBB025636 [0,2,0,0,0,0|0,0,0]=2 964 B10R1.18 CN(C)CC1=CC=CC=C1 SBB060233 [0,2,0,0,0,0|2,0,0]=4 965 B10R1.18 N=C(N)CC1=CC=CC=N1 SBB019209 [0,2,0,0,0,0|1,0,1]=4 966 B10R1.18 N=C(N)CC1=CC=CN=C1 SBB019447 [0,2,0,0,0,0|1,0,1]=4 967 B10R1.18 O=C(O)CC1=CC=CN=C1 SBB003812 [0,2,0,0,0,0|1,0,1]=4 968 B10R1.18 O=C(O)CC1=NC=CC=C1 SBB003810 [0,2,0,0,0,0|1,0,1]=4 969 B10R1.20 CCC1=C(CC)N=CC=N1 SBB058452 [0,2,0,0,0,0|0,0,0]=2 970 B10R1.20 CCC1=CC=CC=C1C=O SBB064652 [0,2,0,0,0,0|2,0,0]=4 971 B10R1.20 CNC1=C(C=O)C=CC=N1 SBB010268 [0,2,0,0,0,0|2,0,0]=4 972 B10R1.20 CNC1=NC=CC=C1CO SBB054793 [0,2,0,0,0,0|2,0,0]=4 973 B10R1.20 COC1=C(C#N)C=CC=N1 SBB019387 [0,2,0,0,0,0|2,0,0]=4 974 B10R1.20 N#CC1=NC=CC=C1CBr SBB054920 [0,2,0,0,0,0|2,0,0]=4 975 B10R2.7 C1=CC2=C(C=C1)CCC2 SBB060083 [0,1,0,1,0,0|2,0,0]=4 976 B10R2.7 C1=CC=C2COCC2=C1 SBB068697 [0,1,0,1,0,0|2,0,0]=4 977 B10R2.7 C1=CC=C2OCCC2=C1 SBB056038 [0,1,0,1,0,0|2,0,0]=4 978 B10R2.7 N1CCC2=C1C=CC=C2 SBB004291 [0,1,0,1,0,0|2,0,0]=4 979 B6R1.2 BrC1=CC=CO1 SBB054415 [1,0,0,0,1,0|2,0,0]=4 980 B6R1.2 BrC1=CC=CS1 SBB003931 [1,0,0,0,1,0|2,0,0]=4 981 B6R1.2 BrC1=CC=NN1 SBB062821 [1,0,0,0,1,0|2,0,0]=4 982 B6R1.2 BrC1=CC=NS1 SBB027176 [1,0,0,0,1,0|2,0,0]=4 983 B6R1.2 BrC1=CN=CS1 SBB054428 [1,0,0,0,1,0|2,0,0]=4 984 B6R1.2 BrC1=CNN=C1 SBB000097 [1,0,0,0,1,0|2,0,0]=4 985 B6R1.2 BrC1=COC=C1 SBB004098 [1,0,0,0,1,0|2,0,0]=4 986 B6R1.2 BrC1=CSC=C1 SBB003930 [1,0,0,0,1,0|2,0,0]=4 987 B6R1.2 BrC1=CSN=C1 SBB013032 [1,0,0,0,1,0|2,0,0]=4 988 B6R1.2 BrC1=NC=CN1 SBB054452 [1,0,0,0,1,0|1,0,1]=4 989 B6R1.2 BrC1=NC=CS1 SBB003918 [1,0,0,0,1,0|2,0,0]=4 990 B6R1.2 BrC1=NC=NN1 SBB050161 [1,0,0,0,1,0|2,0,0]=4 991 B6R1.2 CC1=CN=CS1 SBB055804 [1,0,0,0,1,0|1,0,0]=3 992 B6R1.2 CC1=CNN=C1 SBB004402 [1,0,0,0,1,0|1,0,0]=3 993 B6R1.2 CC1=CON=C1 SBB025727 [1,0,0,0,1,0|1,0,0]=3 994 B6R1.2 CC1=NC=CN1 SBB040944 [1,0,0,0,1,0|0,0,1]=3 995 B6R1.2 CC1=NN=CN1 SBB025943 [1,0,0,0,1,0|1,0,1]=4 996 B6R1.2 CC1=NN=NN1 SBB014296 [1,0,0,0,1,0|2,0,0]=4 997 B6R1.2 CC1=NNC=C1 SBB004404 [1,0,0,0,1,0|1,0,0]=3 998 B6R1.2 CN1C=CC=N1 SBB013729 [1,0,0,0,1,0|1,0,0]=3 999 B6R1.2 CN1C=CN=C1 SBB007574 [1,0,0,0,1,0|1,0,0]=3 1000 B6R1.2 CN1C=NN=N1 SBB013782 [1,0,0,0,1,0|2,0,0]=4 1001 B6R1.2 CN1N=CN=N1 SBB013781 [1,0,0,0,1,0|2,0,0]=4 1002 B6R1.2 ClC1=CNN=C1 SBB000035 [1,0,0,0,1,0|2,0,0]=4 1003 B6R1.2 ClC1=NC=CS1 SBB054425 [1,0,0,0,1,0|2,0,0]=4 1004 B6R1.2 ClC1=NC=NN1 SBB019448 [1,0,0,0,1,0|2,0,0]=4 1005 B6R1.2 FC1=CC=CS1 SBB073288 [1,0,0,0,1,0|2,0,0]=4 1006 B6R1.2 IC1=CC=CS1 SBB054409 [1,0,0,0,1,0|2,0,0]=4 1007 B6R1.2 IC1=CNC=N1 SBB054451 [1,0,0,0,1,0|1,0,1]=4 1008 B6R1.2 IC1=CNN=C1 SBB025965 [1,0,0,0,1,0|2,0,0]=4 1009 B6R1.2 IC1=CSN=C1 SBB074233 [1,0,0,0,1,0|2,0,0]=4 1010 B6R1.2 IC1=NC=CN1 SBB054450 [1,0,0,0,1,0|1,0,1]=4 1011 B6R1.2 N1C=CC(I)=N1 SBB091657 [1,0,0,0,1,0|2,0,0]=4 1012 B6R1.2 NC1=CN=CN1 SBB017132 [1,0,0,0,1,0|1,0,1]=4 1013 B6R1.2 NC1=CN=CS1 SBB069743 [1,0,0,0,1,0|2,0,0]=4 1014 B6R1.2 NC1=CNN=C1 SBB018730 [1,0,0,0,1,0|2,0,0]=4 1015 B6R1.2 NC1=NC=CN1 SBB001015 [1,0,0,0,1,0|1,0,1]=4 1016 B6R1.2 NC1=NC=CN1 SBB051944 [1,0,0,0,1,0|1,0,1]=4 1017 B6R1.2 NC1=NC=CN1 SBB051945 [1,0,0,0,1,0|1,0,1]=4 1018 B6R1.2 NC1=NC=CO1 SBB019333 [1,0,0,0,1,0|2,0,0]=4 1019 B6R1.2 NC1=NC=CS1 SBB000070 [1,0,0,0,1,0|2,0,0]=4 1020 B6R1.2 NC1=NC=CS1 SBB028135 [1,0,0,0,1,0|2,0,0]=4 1021 B6R1.2 NC1=NC=NS1 SBB014839 [1,0,0,0,1,0|2,0,0]=4 1022 B6R1.2 NC1=NNC=C1 SBB004401 [1,0,0,0,1,0|2,0,0]=4 1023 B6R1.2 NC1=NNC=N1 SBB004400 [1,0,0,0,1,0|2,0,0]=4 1024 B6R1.2 NC1=NOC=C1 SBB051928 [1,0,0,0,1,0|2,0,0]=4 1025 B6R1.2 SC1=CC=CS1 SBB059094 [1,0,0,0,1,0|2,0,0]=4 1026 B6R1.2 SC1=NC=CN1 SBB004368 [1,0,0,0,1,0|1,0,1]=4 1027 B6R1.2 SC1=NC=CS1 SBB066357 [1,0,0,0,1,0|2,0,0]=4 1028 B6R1.2 SC1=NNC=N1 SBB004364 [1,0,0,0,1,0|2,0,0]=4