0 B8R1.2 BrCC1=CC=CC=C1 2844339 [0,0,0,0,0,0|1,0,0]=1 1 B8R1.2 C=CC1=CC=NC=C1 2825664 [0,0,0,0,0,0|2,0,1]=3 2 B8R1.2 CCC1=CC=CC=C1 2825676 [0,0,0,0,0,0|1,0,0]=1 3 B8R1.2 CNC1=CC=CC=C1 1366528 [0,0,0,0,0,0|2,0,0]=2 4 B8R1.2 COC1=CC=CC=C1 2825706 [0,0,0,0,0,0|2,0,0]=2 5 B8R1.2 CSC1=CC=CC=C1 2826254 [0,0,0,0,0,0|2,0,0]=2 6 B8R1.2 ClCC1=CC=CC=C1 1778716 [0,0,0,0,0,0|1,0,0]=1 7 B8R1.2 N#CC1=CC=CC=C1 1778585 [0,0,0,0,0,0|1,0,1]=2 8 B8R1.2 N#CC1=CC=CC=N1 2129613 [0,0,0,0,0,0|2,0,1]=3 9 B8R1.2 N#CC1=CC=CN=C1 2129614 [0,0,0,0,0,0|2,0,1]=3 10 B8R1.2 N#CC1=CC=NC=C1 2129615 [0,0,0,0,0,0|2,0,1]=3 11 B8R1.2 N#CC1=NC=CC=N1 3664148 [0,0,0,0,0,0|3,0,1]=4 12 B8R1.2 N#CC1=NC=CN=C1 2816880 [0,0,0,0,0,0|3,0,1]=4 13 B8R1.2 NCC1=CC=CC=C1 1038608 [0,0,0,0,0,0|1,0,0]=1 14 B8R1.2 NCC1=CC=CC=C1 6057147 [0,0,0,0,0,0|1,0,0]=1 15 B8R1.2 NCC1=CC=CN=C1 1038606 [0,0,0,0,0,0|2,0,0]=2 16 B8R1.2 NCC1=CC=NC=C1 1038607 [0,0,0,0,0,0|2,0,0]=2 17 B8R1.2 NNC1=CC=CC=C1 1156632 [0,0,0,0,0,0|2,0,0]=2 18 B8R1.2 NNC1=CC=CC=C1 6057168 [0,0,0,0,0,0|2,0,0]=2 19 B8R1.2 NNC1=NC=CC=C1 1060375 [0,0,0,0,0,0|3,0,0]=3 20 B8R1.2 O=CC1=CC=CC=C1 988591 [0,0,0,0,0,0|0,0,2]=2 21 B8R1.2 O=CC1=CC=CN=C1 2084334 [0,0,0,0,0,0|1,0,2]=3 22 B8R1.2 O=CC1=CC=NC=C1 988524 [0,0,0,0,0,0|1,0,2]=3 23 B8R1.2 O=CC1=NC=CC=C1 2084333 [0,0,0,0,0,0|1,0,2]=3 24 B8R1.2 OCC1=CC=CC=C1 1778593 [0,0,0,0,0,0|0,0,0]=0 25 B8R1.2 SCC1=CC=CC=C1 1972971 [0,0,0,0,0,0|0,1,0]=1 26 B7R1.3 BrC1=CC=CC=C1 1362060 [1,0,0,0,0,0|1,0,0]=2 27 B7R1.3 BrC1=CC=CN=C1 1361113 [1,0,0,0,0,0|2,0,0]=3 28 B7R1.3 BrC1=CC=NC=C1 1361114 [1,0,0,0,0,0|2,0,0]=3 29 B7R1.3 BrC1=CN=CN=C1 1361115 [1,0,0,0,0,0|3,0,0]=4 30 B7R1.3 BrC1=NC=CC=C1 1361112 [1,0,0,0,0,0|2,0,0]=3 31 B7R1.3 BrC1=NC=CC=N1 2822298 [1,0,0,0,0,0|3,0,0]=4 32 B7R1.3 CC1=CC=CC=C1 3585912 [1,0,0,0,0,0|0,0,0]=1 33 B7R1.3 CC1=CC=NC=C1 2825452 [1,0,0,0,0,0|1,0,0]=2 34 B7R1.3 CC1=CC=NC=N1 5791887 [1,0,0,0,0,0|2,0,0]=3 35 B7R1.3 CC1=CN=CC=C1 2825453 [1,0,0,0,0,0|1,0,0]=2 36 B7R1.3 CC1=NC=CC=C1 2825451 [1,0,0,0,0,0|1,0,0]=2 37 B7R1.3 CC1=NC=CN=C1 2816692 [1,0,0,0,0,0|2,0,0]=3 38 B7R1.3 ClC1=CC=CC=C1 2825843 [1,0,0,0,0,0|1,0,0]=2 39 B7R1.3 ClC1=NC=CC=C1 2825881 [1,0,0,0,0,0|2,0,0]=3 40 B7R1.3 ClC1=NC=CC=N1 2139047 [1,0,0,0,0,0|3,0,0]=4 41 B7R1.3 ClC1=NC=CN=C1 2139102 [1,0,0,0,0,0|3,0,0]=4 42 B7R1.3 FC1=CC=CC=C1 2825477 [1,0,0,0,0,0|1,0,0]=2 43 B7R1.3 IC1=CC=CC=C1 3040212 [1,0,0,0,0,0|1,0,0]=2 44 B7R1.3 IC1=CC=CN=C1 5012913 [1,0,0,0,0,0|2,0,0]=3 45 B7R1.3 NC1=CC=CC=C1 2825450 [1,0,0,0,0,0|1,0,0]=2 46 B7R1.3 NC1=CC=CC=C1 5753507 [1,0,0,0,0,0|1,0,0]=2 47 B7R1.3 NC1=CC=NC=C1 2825458 [1,0,0,0,0,0|2,0,0]=3 48 B7R1.3 NC1=CC=NC=N1 2630850 [1,0,0,0,0,0|3,0,0]=4 49 B7R1.3 NC1=CN=CC=C1 7119850615 [1,0,0,0,0,0|2,0,0]=3 50 B7R1.3 NC1=NC=CC=C1 2825459 [1,0,0,0,0,0|2,0,0]=3 51 B7R1.3 NC1=NC=CC=N1 0125330241 [1,0,0,0,0,0|3,0,0]=4 52 B7R1.3 NC1=NC=CN=C1 2140015 [1,0,0,0,0,0|3,0,0]=4 53 B7R1.3 N[N+]1=CC=NC=C1 12405064 [1,0,0,0,0,0|3,0,0]=4 54 B7R1.3 O=C1C=CC=CN1 2024672 [1,0,0,0,0,0|1,0,1]=3 55 B7R1.3 OC1=CC=CC=C1 2825456 [1,0,0,0,0,0|0,0,0]=1 56 B7R1.3 OC1=CC=CN=C1 22430584 [1,0,0,0,0,0|1,0,0]=2 57 B7R1.3 SC1=CC=CC=C1 2825764 [1,0,0,0,0,0|0,1,0]=2 58 B7R1.3 SC1=NC=CC=C1 3585967 [1,0,0,0,0,0|1,1,0]=3 59 B7R1.3 SC1=NC=CC=N1 2825817 [1,0,0,0,0,0|2,1,0]=4 60 B7R1.3 [O-][N+]1=CC=CC=C1 6057284 [1,0,0,0,0,0|1,0,1]=3 61 B9R1.1 CC1=CC=C(C#N)C=C1 1778674 [0,1,0,0,0,0|1,0,1]=3 62 B9R1.1 CC1=CC=C(C=O)C=C1 1901707 [0,1,0,0,0,0|0,0,2]=3 63 B9R1.1 CC1=CC=C(CCl)C=C1 1778944 [0,1,0,0,0,0|1,0,0]=2 64 B9R1.1 CC1=CC=C(CN)C=C1 7020330616 [0,1,0,0,0,0|1,0,0]=2 65 B9R1.1 CC1=CC=C(CN)C=N1 2214299 [0,1,0,0,0,0|2,0,0]=3 66 B9R1.1 CC1=CC=C(NN)C=C1 1156633 [0,1,0,0,0,0|2,0,0]=3 67 B9R1.1 CC1=CC=C(NN)C=C1 2831425 [0,1,0,0,0,0|2,0,0]=3 68 B9R1.1 CC1=CN=C(CN)C=N1 4060929 [0,1,0,0,0,0|3,0,0]=4 69 B9R1.1 CC1=NC=C(C#N)C=C1 2817230 [0,1,0,0,0,0|2,0,1]=4 70 B9R1.1 CC1=NC=C(C=O)C=C1 2652418 [0,1,0,0,0,0|1,0,2]=4 71 B9R1.1 CCC1=CC=C(Br)C=C1 1904109 [0,1,0,0,0,0|1,0,0]=2 72 B9R1.1 CCC1=CC=C(N)C=C1 1271733 [0,1,0,0,0,0|1,0,0]=2 73 B9R1.1 CCC1=CC=C(O)C=C1 1506641 [0,1,0,0,0,0|1,0,0]=2 74 B9R1.1 CNC1=CC=C(O)C=C1 2216139 [0,1,0,0,0,0|2,0,0]=3 75 B9R1.1 COC1=CC=C(Br)C=C1 1287415 [0,1,0,0,0,0|2,0,0]=3 76 B9R1.1 COC1=CC=C(C)C=C1 2125386 [0,1,0,0,0,0|2,0,0]=3 77 B9R1.1 COC1=CC=C(F)C=C1 2826315 [0,1,0,0,0,0|2,0,0]=3 78 B9R1.1 COC1=CC=C(N)C=C1 1314578 [0,1,0,0,0,0|2,0,0]=3 79 B9R1.1 COC1=CC=C(O)C=C1 2826230 [0,1,0,0,0,0|2,0,0]=3 80 B9R1.1 COC1=NC=C(N)C=C1 7020410079 [0,1,0,0,0,0|3,0,0]=4 81 B9R1.1 CSC1=NC=C(N)C=C1 1119585 [0,1,0,0,0,0|3,0,0]=4 82 B9R1.1 ClCC1=CC=C(Cl)C=C1 1779740 [0,1,0,0,0,0|1,0,0]=2 83 B9R1.1 FC1=CC=C(CCl)C=C1 1779086 [0,1,0,0,0,0|1,0,0]=2 84 B9R1.1 N#CC1=CC=C(Br)C=C1 1506352 [0,1,0,0,0,0|1,0,1]=3 85 B9R1.1 N#CC1=CC=C(Cl)C=C1 7119850520 [0,1,0,0,0,0|1,0,1]=3 86 B9R1.1 N#CC1=CC=C(F)C=C1 1506429 [0,1,0,0,0,0|1,0,1]=3 87 B9R1.1 N#CC1=CC=C(N)C=C1 1509976 [0,1,0,0,0,0|1,0,1]=3 88 B9R1.1 N#CC1=CC=C(O)C=C1 2826111 [0,1,0,0,0,0|1,0,1]=3 89 B9R1.1 N#CC1=NC=C(Br)C=C1 22430505 [0,1,0,0,0,0|2,0,1]=4 90 B9R1.1 NC1=CC=C(N=O)C=C1 3354442 [0,1,0,0,0,0|1,0,1]=3 91 B9R1.1 NCC1=CC=C(Br)C=C1 1782635 [0,1,0,0,0,0|1,0,0]=2 92 B9R1.1 NCC1=CC=C(Cl)C=C1 1038614 [0,1,0,0,0,0|1,0,0]=2 93 B9R1.1 NCC1=CC=C(F)C=C1 5946938 [0,1,0,0,0,0|1,0,0]=2 94 B9R1.1 NCC1=CC=C(F)C=C1 7020330617 [0,1,0,0,0,0|1,0,0]=2 95 B9R1.1 NCC1=CC=C(O)C=C1 2084288 [0,1,0,0,0,0|1,0,0]=2 96 B9R1.1 NNC1=CC=C(Br)C=C1 1156639 [0,1,0,0,0,0|2,0,0]=3 97 B9R1.1 NNC1=CC=C(Br)C=C1 22430444 [0,1,0,0,0,0|2,0,0]=3 98 B9R1.1 NNC1=CC=C(Cl)C=C1 1156638 [0,1,0,0,0,0|2,0,0]=3 99 B9R1.1 NNC1=CC=C(Cl)C=C1 3463727 [0,1,0,0,0,0|2,0,0]=3 100 B9R1.1 NNC1=CC=C(F)C=C1 4434688 [0,1,0,0,0,0|2,0,0]=3 101 B9R1.1 O=C1C=CC(=NO)C=C1 5974233 [0,1,0,0,0,0|1,0,0]=2 102 B9R1.1 O=CC1=CC=C(Br)C=C1 988590 [0,1,0,0,0,0|0,0,2]=3 103 B9R1.1 O=CC1=CC=C(Cl)C=C1 1901925 [0,1,0,0,0,0|0,0,2]=3 104 B9R1.1 O=CC1=CC=C(F)C=C1 1901719 [0,1,0,0,0,0|0,0,2]=3 105 B9R1.1 O=CC1=CC=C(O)C=C1 1194810 [0,1,0,0,0,0|0,0,2]=3 106 B9R1.1 O=NC1=CC=C(O)C=C1 11185890 [0,1,0,0,0,0|1,0,1]=3 107 B9R1.1 OCC1=CC=C(Cl)C=C1 1779009 [0,1,0,0,0,0|0,0,0]=1 108 B9R1.1 OCC1=CC=C(F)C=C1 1778712 [0,1,0,0,0,0|0,0,0]=1 109 B9R1.2 CC1=CC(C#N)=CC=C1 1901689 [0,1,0,0,0,0|1,0,1]=3 110 B9R1.2 CC1=CC=CC(C=O)=C1 1901706 [0,1,0,0,0,0|0,0,2]=3 111 B9R1.2 CC1=CC=CC(CCl)=C1 2048752 [0,1,0,0,0,0|1,0,0]=2 112 B9R1.2 CC1=CC=CC(CN)=C1 1038610 [0,1,0,0,0,0|1,0,0]=2 113 B9R1.2 CCC1=CC(O)=CC=C1 2826182 [0,1,0,0,0,0|1,0,0]=2 114 B9R1.2 CNC1=CC(O)=CC=C1 2225858 [0,1,0,0,0,0|2,0,0]=3 115 B9R1.2 COC1=CC(N)=CC=C1 1314579 [0,1,0,0,0,0|2,0,0]=3 116 B9R1.2 COC1=CC=CC(Br)=C1 1287416 [0,1,0,0,0,0|2,0,0]=3 117 B9R1.2 COC1=CC=CC(O)=C1 1366571 [0,1,0,0,0,0|2,0,0]=3 118 B9R1.2 ClCC1=CC(Cl)=CC=C1 2048847 [0,1,0,0,0,0|1,0,0]=2 119 B9R1.2 FC1=CC(CCl)=CC=C1 2048769 [0,1,0,0,0,0|1,0,0]=2 120 B9R1.2 N#CC1=CC(Cl)=NC=C1 2827316 [0,1,0,0,0,0|2,0,1]=4 121 B9R1.2 N#CC1=CC(N)=CC=C1 2826072 [0,1,0,0,0,0|1,0,1]=3 122 B9R1.2 N#CC1=CC=CC(Br)=C1 1903842 [0,1,0,0,0,0|1,0,1]=3 123 B9R1.2 N#CC1=CC=CC(Cl)=C1 1901869 [0,1,0,0,0,0|1,0,1]=3 124 B9R1.2 N#CC1=CC=CC(F)=C1 1901710 [0,1,0,0,0,0|1,0,1]=3 125 B9R1.2 N#CC1=NC=CC(Br)=C1 7110952495 [0,1,0,0,0,0|2,0,1]=4 126 B9R1.2 N#CC1=NC=CC(Cl)=C1 7110952643 [0,1,0,0,0,0|2,0,1]=4 127 B9R1.2 NCC1=CC=CC(N)=C1 6922927 [0,1,0,0,0,0|1,0,0]=2 128 B9R1.2 NNC1=CC(Cl)=CC=C1 1156640 [0,1,0,0,0,0|2,0,0]=3 129 B9R1.2 NNC1=CC(Cl)=CC=C1 3585957 [0,1,0,0,0,0|2,0,0]=3 130 B9R1.2 NNC1=NC(Cl)=CC=C1 2653334 [0,1,0,0,0,0|3,0,0]=4 131 B9R1.2 O=CC1=CC(Br)=CC=C1 1904103 [0,1,0,0,0,0|0,0,2]=3 132 B9R1.2 O=CC1=CC(O)=CC=C1 2826165 [0,1,0,0,0,0|0,0,2]=3 133 B9R1.2 O=CC1=CC=CC(Cl)=C1 1901924 [0,1,0,0,0,0|0,0,2]=3 134 B9R1.2 O=CC1=CC=CC(F)=C1 1901720 [0,1,0,0,0,0|0,0,2]=3 135 B9R1.6 C=C(C)C1=CC=CC=C1 2826092 [0,1,0,0,0,0|1,0,1]=3 136 B9R1.6 CC(=O)C1=CC=CC=C1 1043797 [0,1,0,0,0,0|0,0,2]=3 137 B9R1.6 CC(=O)C1=CC=CN=C1 1778688 [0,1,0,0,0,0|1,0,2]=4 138 B9R1.6 CC(=O)C1=CC=NC=C1 2826148 [0,1,0,0,0,0|1,0,2]=4 139 B9R1.6 CC(=O)C1=NC=CC=C1 2826149 [0,1,0,0,0,0|1,0,2]=4 140 B9R1.6 CC(Br)C1=CC=CC=C1 2024133 [0,1,0,0,0,0|1,0,0]=2 141 B9R1.6 CC(C)C1=CC=CC=C1 2826137 [0,1,0,0,0,0|1,0,0]=2 142 B9R1.6 CC(N)C1=CC=CC=C1 1500421 [0,1,0,0,0,0|1,0,0]=2 143 B9R1.6 CC(O)C1=NC=CC=C1 2422301 [0,1,0,0,0,0|1,0,0]=2 144 B9R1.6 CN(C)C1=CC=CC=C1 2826155 [0,1,0,0,0,0|2,0,0]=3 145 B9R1.6 CN(C)C1=CC=NC=C1 2826184 [0,1,0,0,0,0|3,0,0]=4 146 B9R1.6 N=C(N)C1=CC=CC=C1 3337437 [0,1,0,0,0,0|1,0,1]=3 147 B9R1.6 NC(=O)C1=CC=CC=C1 7113222106 [0,1,0,0,0,0|0,0,2]=3 148 B9R1.6 NC(=S)C1=CC=CC=C1 1001334 [0,1,0,0,0,0|0,1,1]=3 149 B9R1.6 NC(=S)C1=CC=CN=C1 2125389 [0,1,0,0,0,0|1,1,1]=4 150 B9R1.6 NC(=S)C1=CC=NC=C1 7020310245 [0,1,0,0,0,0|1,1,1]=4 151 B9R1.6 NC(=S)C1=NC=CC=C1 7213750105 [0,1,0,0,0,0|1,1,1]=4 152 B9R1.6 O=C(Cl)C1=CC=CN=C1 1051743 [0,1,0,0,0,0|1,0,2]=4 153 B9R1.6 O=C(Cl)C1=CC=NC=C1 4787240 [0,1,0,0,0,0|1,0,2]=4 154 B9R1.6 O=C(O)C1=CC=CC=C1 1778690 [0,1,0,0,0,0|0,0,1]=2 155 B9R1.6 O=C(O)C1=CC=CN=C1 2084332 [0,1,0,0,0,0|1,0,1]=3 156 B9R1.6 O=C(O)C1=CC=NC=C1 22430647 [0,1,0,0,0,0|1,0,1]=3 157 B9R1.6 O=C(O)C1=CC=NC=N1 0125330094 [0,1,0,0,0,0|2,0,1]=4 158 B9R1.6 O=C(O)C1=CN=CC=N1 1051746 [0,1,0,0,0,0|2,0,1]=4 159 B9R1.6 O=C(O)C1=NC=CC=C1 1051744 [0,1,0,0,0,0|1,0,1]=3 160 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 2826202 [0,1,0,0,0,0|1,0,1]=3 161 B9R1.6 OB(O)C1=CC=CC=C1 971211 [0,1,0,0,0,0|1,0,0]=2 162 B9R1.8 BrCCC1=CC=CC=C1 2889217 [0,1,0,0,0,0|1,0,0]=2 163 B9R1.8 CCCC1=CC=CC=C1 2826136 [0,1,0,0,0,0|1,0,0]=2 164 B9R1.8 CCNC1=CC=CC=C1 1220427 [0,1,0,0,0,0|1,0,0]=2 165 B9R1.8 CCOC1=CC=CC=C1 2826174 [0,1,0,0,0,0|1,0,0]=2 166 B9R1.8 CNCC1=CC=CC=C1 1268163 [0,1,0,0,0,0|1,0,0]=2 167 B9R1.8 ClCCC1=CC=CC=C1 2827551 [0,1,0,0,0,0|1,0,0]=2 168 B9R1.8 N#CCC1=CC=CC=C1 1519434 [0,1,0,0,0,0|1,0,0]=2 169 B9R1.8 N#CCC1=NC=CC=C1 1287098 [0,1,0,0,0,0|2,0,0]=3 170 B9R1.8 NCCC1=CC=CC=C1 1038619 [0,1,0,0,0,0|1,0,0]=2 171 B9R1.8 NNCC1=CC=CC=C1 1972969 [0,1,0,0,0,0|1,0,0]=2 172 B9R1.8 O=C=NC1=CC=CC=C1 1051736 [0,1,0,0,0,0|0,0,2]=3 173 B9R1.8 O=C=NC1=CN=CC=C1 2817269 [0,1,0,0,0,0|1,0,2]=4 174 B9R1.8 O=CCC1=CC=CC=C1 1204419 [0,1,0,0,0,0|0,0,1]=2 175 B9R1.8 O=CNC1=CC=CC=C1 2826151 [0,1,0,0,0,0|0,0,2]=3 176 B9R1.8 OCCC1=CC=CC=C1 1204382 [0,1,0,0,0,0|0,0,0]=1 177 B9R1.8 OCCC1=CC=CC=N1 1204379 [0,1,0,0,0,0|1,0,0]=2 178 B9R1.8 [C]=NCC1=CC=CC=C1 5679156 [0,1,0,0,0,0|1,0,0]=2 179 B9R1.15 BrCC1=C(Br)C=CC=C1 4435191 [0,1,0,0,0,0|1,0,0]=2 180 B9R1.15 CC1=C(C#N)C=CC=C1 1901688 [0,1,0,0,0,0|1,0,1]=3 181 B9R1.15 CC1=C(C=O)C=CC=C1 1901705 [0,1,0,0,0,0|0,0,2]=3 182 B9R1.15 CC1=C(CCl)C=CC=C1 2048751 [0,1,0,0,0,0|1,0,0]=2 183 B9R1.15 CC1=C(CN)C=CC=C1 1038609 [0,1,0,0,0,0|1,0,0]=2 184 B9R1.15 CC1=C(CO)N=CC=C1 2817350 [0,1,0,0,0,0|1,0,0]=2 185 B9R1.15 CC1=CC=CN=C1C#N 22430609 [0,1,0,0,0,0|2,0,1]=4 186 B9R1.15 CC1=CC=CN=C1NN 1033422 [0,1,0,0,0,0|3,0,0]=4 187 B9R1.15 CCC1=C(N)C=CC=C1 2826161 [0,1,0,0,0,0|1,0,0]=2 188 B9R1.15 CCC1=C(O)C=CC=C1 2826180 [0,1,0,0,0,0|1,0,0]=2 189 B9R1.15 CNC1=CC=CC=C1N 6871417 [0,1,0,0,0,0|2,0,0]=3 190 B9R1.15 COC1=C(Br)C=CC=C1 1287441 [0,1,0,0,0,0|2,0,0]=3 191 B9R1.15 COC1=C(C)C=CC=C1 2826177 [0,1,0,0,0,0|2,0,0]=3 192 B9R1.15 COC1=C(Cl)C=CC=C1 2827881 [0,1,0,0,0,0|2,0,0]=3 193 B9R1.15 COC1=C(F)C=CC=C1 2826313 [0,1,0,0,0,0|2,0,0]=3 194 B9R1.15 COC1=C(N)C=CC=C1 1314580 [0,1,0,0,0,0|2,0,0]=3 195 B9R1.15 COC1=C(O)C=CC=C1 2826229 [0,1,0,0,0,0|2,0,0]=3 196 B9R1.15 COC1=CC=CN=C1N 1514805 [0,1,0,0,0,0|3,0,0]=4 197 B9R1.15 CSC1=CC=CC=C1Br 22430606 [0,1,0,0,0,0|2,0,0]=3 198 B9R1.15 ClCC1=C(Cl)C=CC=C1 2048846 [0,1,0,0,0,0|1,0,0]=2 199 B9R1.15 FC1=CC=CC=C1CCl 2048768 [0,1,0,0,0,0|1,0,0]=2 200 B9R1.15 N#CC1=C(Br)C=CC=N1 3678667 [0,1,0,0,0,0|2,0,1]=4 201 B9R1.15 N#CC1=C(F)C=CC=N1 3664957 [0,1,0,0,0,0|2,0,1]=4 202 B9R1.15 N#CC1=C(N)C=CC=C1 2826071 [0,1,0,0,0,0|1,0,1]=3 203 B9R1.15 N#CC1=C(N)N=CC=C1 7110951372 [0,1,0,0,0,0|2,0,1]=4 204 B9R1.15 N#CC1=C(O)N=CC=C1 3664864 [0,1,0,0,0,0|2,0,1]=4 205 B9R1.15 N#CC1=CC=CC=C1Cl 7119850361 [0,1,0,0,0,0|1,0,1]=3 206 B9R1.15 N#CC1=CC=CC=C1F 1901709 [0,1,0,0,0,0|1,0,1]=3 207 B9R1.15 N#CC1=CC=CC=C1O 2129603 [0,1,0,0,0,0|1,0,1]=3 208 B9R1.15 N#CC1=CC=CN=C1Br 7110952565 [0,1,0,0,0,0|2,0,1]=4 209 B9R1.15 N#CC1=CC=CN=C1Cl 2827314 [0,1,0,0,0,0|2,0,1]=4 210 B9R1.15 NCC1=C(Cl)C=CC=C1 1038613 [0,1,0,0,0,0|1,0,0]=2 211 B9R1.15 NCC1=C(F)C=CC=C1 7020330618 [0,1,0,0,0,0|1,0,0]=2 212 B9R1.15 NCC1=C(F)C=CC=N1 5027490 [0,1,0,0,0,0|2,0,0]=3 213 B9R1.15 NNC1=C(Cl)C=CC=C1 1156642 [0,1,0,0,0,0|2,0,0]=3 214 B9R1.15 NNC1=C(F)C=CC=C1 2832682 [0,1,0,0,0,0|2,0,0]=3 215 B9R1.15 O=CC1=C(Cl)C=CC=C1 1901923 [0,1,0,0,0,0|0,0,2]=3 216 B9R1.15 O=CC1=C(Cl)N=CC=C1 3667461 [0,1,0,0,0,0|1,0,2]=4 217 B9R1.15 O=CC1=C(F)C=CC=C1 1901718 [0,1,0,0,0,0|0,0,2]=3 218 B9R1.15 O=CC1=C(O)C=CC=C1 2129572 [0,1,0,0,0,0|0,0,2]=3 219 B9R1.15 O=CC1=CC=CC=C1Br 1904102 [0,1,0,0,0,0|0,0,2]=3 220 B9R1.15 O=CC1=NC=CC=C1Br 5161726 [0,1,0,0,0,0|1,0,2]=4 221 B9R1.15 OCC1=C(Cl)C=CC=C1 2048757 [0,1,0,0,0,0|0,0,0]=1 222 B9R1.15 OCC1=C(Cl)N=CC=C1 2819188 [0,1,0,0,0,0|1,0,0]=2 223 B9R1.15 OCC1=CC=CC=C1Br 2049225 [0,1,0,0,0,0|0,0,0]=1 224 B9R1.15 OCC1=NC=CC=C1Br 11186520 [0,1,0,0,0,0|1,0,0]=2 225 B7R1.1 CCC1=CC=CS1 2825840 [0,0,0,0,1,0|2,0,0]=3 226 B7R1.1 CCC1=NC=CN1 2816718 [0,0,0,0,1,0|3,0,0]=4 227 B7R1.1 CCN1C=CN=C1 1217863 [0,0,0,0,1,0|3,0,0]=4 228 B7R1.1 N#CC1=CC=CO1 2825449 [0,0,0,0,1,0|2,0,1]=4 229 B7R1.1 N#CC1=COC=C1 2816687 [0,0,0,0,1,0|2,0,1]=4 230 B7R1.1 N#CC1=CSC=C1 2825739 [0,0,0,0,1,0|2,0,1]=4 231 B7R1.1 NCC1=CC=CN1 7020542628 [0,0,0,0,1,0|2,0,0]=3 232 B7R1.1 NCC1=CC=CO1 1038603 [0,0,0,0,1,0|2,0,0]=3 233 B7R1.1 NCC1=CC=CS1 1038604 [0,0,0,0,1,0|2,0,0]=3 234 B7R1.1 NCC1=NC=CS1 1044145 [0,0,0,0,1,0|3,0,0]=4 235 B7R1.1 O=CC1=CC=CN1 7020420392 [0,0,0,0,1,0|1,0,2]=4 236 B7R1.1 O=CC1=CC=CO1 988493 [0,0,0,0,1,0|1,0,2]=4 237 B7R1.1 O=CC1=CC=CS1 2048717 [0,0,0,0,1,0|1,0,2]=4 238 B7R1.1 O=CC1=CSC=C1 22430573 [0,0,0,0,1,0|1,0,2]=4 239 B7R1.1 OCC1=CC=CO1 2084339 [0,0,0,0,1,0|1,0,0]=2 240 B7R1.1 OCC1=CC=NO1 2128179 [0,0,0,0,1,0|2,0,0]=3 241 B7R1.1 OCC1=COC=C1 2816728 [0,0,0,0,1,0|1,0,0]=2 242 B7R1.1 OCC1=NNC=C1 2652239 [0,0,0,0,1,0|2,0,0]=3 243 B6R0.6 O=C\C=C\C=C\[O-] 22430332 [1,0,1,0,0,0|1,0,1]=4 244 B6R1.1 C1=CN=CC=N1 12405397 [2,0,0,0,0,0|2,0,0]=4 245 B8R1.3 BrC1=CC=C(Br)C=C1 1362076 [1,1,0,0,0,0|1,0,0]=3 246 B8R1.3 CC1=CC=C(Br)C=C1 1287407 [1,1,0,0,0,0|0,0,0]=2 247 B8R1.3 CC1=CC=C(C)C=C1 2825678 [1,1,0,0,0,0|0,0,0]=2 248 B8R1.3 CC1=CC=C(F)C=C1 2825753 [1,1,0,0,0,0|0,0,0]=2 249 B8R1.3 CC1=CC=C(N)C=C1 2825688 [1,1,0,0,0,0|0,0,0]=2 250 B8R1.3 CC1=CC=C(N)C=N1 3488451 [1,1,0,0,0,0|1,0,0]=3 251 B8R1.3 CC1=CC=C(O)C=C1 2825707 [1,1,0,0,0,0|0,0,0]=2 252 B8R1.3 CC1=CC=C(S)C=C1 2826253 [1,1,0,0,0,0|0,0,0]=2 253 B8R1.3 CC1=CN=C(Br)C=C1 2835836 [1,1,0,0,0,0|1,0,0]=3 254 B8R1.3 CC1=CN=C(N)C=C1 2825716 [1,1,0,0,0,0|1,0,0]=3 255 B8R1.3 CC1=CNC(=O)C=C1 2024673 [1,1,0,0,0,0|1,0,0]=3 256 B8R1.3 CC1=NC=C(O)C=C1 2816909 [1,1,0,0,0,0|1,0,0]=3 257 B8R1.3 ClC1=CC=C(Br)C=C1 1287419 [1,1,0,0,0,0|1,0,0]=3 258 B8R1.3 ClC1=CC=C(Cl)C=C1 2828764 [1,1,0,0,0,0|1,0,0]=3 259 B8R1.3 ClC1=CC=C(Cl)N=C1 22430597 [1,1,0,0,0,0|2,0,0]=4 260 B8R1.3 ClC1=NC=C(Br)C=C1 2127455 [1,1,0,0,0,0|2,0,0]=4 261 B8R1.3 FC1=CC=C(Br)C=C1 1287410 [1,1,0,0,0,0|1,0,0]=3 262 B8R1.3 FC1=CC=C(F)C=C1 2825887 [1,1,0,0,0,0|1,0,0]=3 263 B8R1.3 NC1=CC=C(Br)C=C1 1362074 [1,1,0,0,0,0|1,0,0]=3 264 B8R1.3 NC1=CC=C(Br)C=N1 7018959928 [1,1,0,0,0,0|2,0,0]=4 265 B8R1.3 NC1=CC=C(Cl)C=C1 1506171 [1,1,0,0,0,0|1,0,0]=3 266 B8R1.3 NC1=CC=C(Cl)C=N1 7119850610 [1,1,0,0,0,0|2,0,0]=4 267 B8R1.3 NC1=CC=C(F)C=C1 1506428 [1,1,0,0,0,0|1,0,0]=3 268 B8R1.3 NC1=CC=C(I)C=C1 2977826 [1,1,0,0,0,0|1,0,0]=3 269 B8R1.3 NC1=CC=C(I)C=N1 0111070071 [1,1,0,0,0,0|2,0,0]=4 270 B8R1.3 NC1=CC=C(N)C=C1 1509975 [1,1,0,0,0,0|1,0,0]=3 271 B8R1.3 NC1=CC=C(O)C=C1 1509977 [1,1,0,0,0,0|0,0,0]=2 272 B8R1.3 NC1=CN=C(Br)C=C1 2205036 [1,1,0,0,0,0|2,0,0]=4 273 B8R1.3 NC1=CN=C(Cl)C=C1 1513452 [1,1,0,0,0,0|2,0,0]=4 274 B8R1.3 NC1=NC=C(Br)C=C1 3585769 [1,1,0,0,0,0|2,0,0]=4 275 B8R1.3 NC1=NC=C(F)C=C1 1218806 [1,1,0,0,0,0|2,0,0]=4 276 B8R1.3 O=C1C=CC(=O)C=C1 2825700 [1,1,0,0,0,0|0,0,1]=3 277 B8R1.3 O=C1C=CC(Br)=CN1 1313838 [1,1,0,0,0,0|1,0,1]=4 278 B8R1.3 O=C1C=CC(F)=CN1 2030881 [1,1,0,0,0,0|1,0,1]=4 279 B8R1.3 OC1=CC=C(Br)C=C1 1506353 [1,1,0,0,0,0|0,0,0]=2 280 B8R1.3 OC1=CC=C(Br)N=C1 5005426 [1,1,0,0,0,0|1,0,0]=3 281 B8R1.3 OC1=CC=C(Cl)C=C1 1506172 [1,1,0,0,0,0|0,0,0]=2 282 B8R1.3 OC1=CC=C(F)C=C1 1506430 [1,1,0,0,0,0|0,0,0]=2 283 B8R1.3 OC1=CC=C(O)C=C1 1194834 [1,1,0,0,0,0|0,0,0]=2 284 B8R1.3 SC1=CC=C(Br)C=C1 2932610 [1,1,0,0,0,0|0,1,0]=3 285 B8R1.3 SC1=CC=C(Cl)C=C1 2828318 [1,1,0,0,0,0|0,1,0]=3 286 B8R1.3 [NH3+]C1=CC=C([NH3+])C=C1 22430635 [1,1,0,0,0,0|1,0,0]=3 287 B8R1.4 BrC1=CN=CC(Br)=C1 3176994 [1,1,0,0,0,0|2,0,0]=4 288 B8R1.4 CC1=CC(=O)NC=C1 1445642 [1,1,0,0,0,0|1,0,0]=3 289 B8R1.4 CC1=CC(C)=NC=C1 2825693 [1,1,0,0,0,0|1,0,0]=3 290 B8R1.4 CC1=CC(C)=NC=N1 5009564 [1,1,0,0,0,0|2,0,0]=4 291 B8R1.4 CC1=CC(Cl)=NC=C1 22430560 [1,1,0,0,0,0|1,0,0]=3 292 B8R1.4 CC1=CC(N)=CC=N1 1496346 [1,1,0,0,0,0|1,0,0]=3 293 B8R1.4 CC1=CC(N)=CC=N1 1500240 [1,1,0,0,0,0|1,0,0]=3 294 B8R1.4 CC1=CC(O)=CC=C1 2825708 [1,1,0,0,0,0|0,0,0]=2 295 B8R1.4 CC1=CC=CC(Br)=C1 1287409 [1,1,0,0,0,0|0,0,0]=2 296 B8R1.4 CC1=CC=CC(C)=C1 2825677 [1,1,0,0,0,0|0,0,0]=2 297 B8R1.4 CC1=CC=CC(C)=N1 2825696 [1,1,0,0,0,0|1,0,0]=3 298 B8R1.4 CC1=CC=CC(Cl)=C1 2826369 [1,1,0,0,0,0|0,0,0]=2 299 B8R1.4 CC1=CC=CC(N)=C1 3585811 [1,1,0,0,0,0|0,0,0]=2 300 B8R1.4 CC1=CC=CC(N)=N1 2825715 [1,1,0,0,0,0|1,0,0]=3 301 B8R1.4 CC1=CC=NC(N)=C1 7015122364 [1,1,0,0,0,0|1,0,0]=3 302 B8R1.4 CC1=CC=NC(O)=N1 3353962 [1,1,0,0,0,0|2,0,0]=4 303 B8R1.4 CC1=CN=CC(Br)=C1 22430615 [1,1,0,0,0,0|1,0,0]=3 304 B8R1.4 CC1=CN=CC(C)=C1 6057011 [1,1,0,0,0,0|1,0,0]=3 305 B8R1.4 CC1=C[N+]([O-])=CC=C1 2825733 [1,1,0,0,0,0|1,0,0]=3 306 B8R1.4 CC1=NC=NC(O)=C1 3354285 [1,1,0,0,0,0|2,0,0]=4 307 B8R1.4 ClC1=CC(Cl)=NC=C1 22430594 [1,1,0,0,0,0|2,0,0]=4 308 B8R1.4 ClC1=CC=CC(Br)=C1 1287418 [1,1,0,0,0,0|1,0,0]=3 309 B8R1.4 ClC1=CC=CC(Cl)=C1 2828765 [1,1,0,0,0,0|1,0,0]=3 310 B8R1.4 ClC1=CC=CC(Cl)=N1 2828869 [1,1,0,0,0,0|2,0,0]=4 311 B8R1.4 FC1=CC=CC(Br)=C1 1903198 [1,1,0,0,0,0|1,0,0]=3 312 B8R1.4 FC1=CC=CC(F)=C1 2825886 [1,1,0,0,0,0|1,0,0]=3 313 B8R1.4 NC1=CC(Br)=CC=C1 1362075 [1,1,0,0,0,0|1,0,0]=3 314 B8R1.4 NC1=CC(Br)=NC=C1 7216640154 [1,1,0,0,0,0|2,0,0]=4 315 B8R1.4 NC1=CC(Cl)=CC=C1 2826459 [1,1,0,0,0,0|1,0,0]=3 316 B8R1.4 NC1=CC(F)=CC=C1 2825774 [1,1,0,0,0,0|1,0,0]=3 317 B8R1.4 NC1=CC(O)=CC=C1 1106784 [1,1,0,0,0,0|0,0,0]=2 318 B8R1.4 NC1=CC=CC(N)=C1 1972927 [1,1,0,0,0,0|1,0,0]=3 319 B8R1.4 NC1=CC=CC(N)=N1 2825734 [1,1,0,0,0,0|2,0,0]=4 320 B8R1.4 NC1=NC(Br)=CC=C1 2213493 [1,1,0,0,0,0|2,0,0]=4 321 B8R1.4 NC1=NC(Cl)=CC=C1 3665787 [1,1,0,0,0,0|2,0,0]=4 322 B8R1.4 NC1=NC=CC(Br)=C1 7110952492 [1,1,0,0,0,0|2,0,0]=4 323 B8R1.4 NC1=NC=CC(Cl)=C1 7110952557 [1,1,0,0,0,0|2,0,0]=4 324 B8R1.4 O=C1C=CC=C(Cl)N1 6849602 [1,1,0,0,0,0|1,0,1]=4 325 B8R1.4 OC1=CC(Br)=CC=C1 1287431 [1,1,0,0,0,0|0,0,0]=2 326 B8R1.4 OC1=CC(Cl)=CC=C1 2826548 [1,1,0,0,0,0|0,0,0]=2 327 B8R1.4 OC1=CC(F)=CC=C1 2825801 [1,1,0,0,0,0|0,0,0]=2 328 B8R1.4 OC1=CC=CC(O)=C1 2825748 [1,1,0,0,0,0|0,0,0]=2 329 B8R1.4 [O-][N+]1=CC=CC(Br)=C1 6850697 [1,1,0,0,0,0|1,0,1]=4 330 B8R1.5 CC1=C(Br)C=CC=C1 1287408 [1,1,0,0,0,0|0,0,0]=2 331 B8R1.5 CC1=C(Br)N=CC=C1 2835840 [1,1,0,0,0,0|1,0,0]=3 332 B8R1.5 CC1=C(C)C=CC=C1 2825679 [1,1,0,0,0,0|0,0,0]=2 333 B8R1.5 CC1=C(Cl)C=CC=C1 2826368 [1,1,0,0,0,0|0,0,0]=2 334 B8R1.5 CC1=C(Cl)N=CC=C1 2817631 [1,1,0,0,0,0|1,0,0]=3 335 B8R1.5 CC1=C(N)C=CC=C1 2825687 [1,1,0,0,0,0|0,0,0]=2 336 B8R1.5 CC1=C(O)C=CC=C1 2825709 [1,1,0,0,0,0|0,0,0]=2 337 B8R1.5 CC1=CC=CC=C1F 2825751 [1,1,0,0,0,0|0,0,0]=2 338 B8R1.5 CC1=CC=CC=C1N 3585807 [1,1,0,0,0,0|0,0,0]=2 339 B8R1.5 CC1=CC=CN=C1N 2825713 [1,1,0,0,0,0|1,0,0]=3 340 B8R1.5 CC1=CC=CNC1=O 1298063 [1,1,0,0,0,0|1,0,0]=3 341 B8R1.5 CC1=NC=CN=C1C 22430620 [1,1,0,0,0,0|2,0,0]=4 342 B8R1.5 ClC1=C(Br)C=CC=N1 7110952626 [1,1,0,0,0,0|2,0,0]=4 343 B8R1.5 ClC1=C(Cl)C=CC=C1 2828763 [1,1,0,0,0,0|1,0,0]=3 344 B8R1.5 FC1=C(Br)C=CC=C1 1287411 [1,1,0,0,0,0|1,0,0]=3 345 B8R1.5 FC1=C(F)C=CC=C1 2825885 [1,1,0,0,0,0|1,0,0]=3 346 B8R1.5 NC1=C(Br)C=CC=N1 7110951380 [1,1,0,0,0,0|2,0,0]=4 347 B8R1.5 NC1=C(Cl)C=CC=N1 7110951381 [1,1,0,0,0,0|2,0,0]=4 348 B8R1.5 NC1=C(Cl)N=CC=C1 7110951374 [1,1,0,0,0,0|2,0,0]=4 349 B8R1.5 NC1=C(F)C=CC=C1 2825775 [1,1,0,0,0,0|1,0,0]=3 350 B8R1.5 NC1=C(N)C=CC=C1 22430366 [1,1,0,0,0,0|1,0,0]=3 351 B8R1.5 NC1=C(N)C=CC=C1 2825714 [1,1,0,0,0,0|1,0,0]=3 352 B8R1.5 NC1=C(O)C=CC=C1 2129098 [1,1,0,0,0,0|0,0,0]=2 353 B8R1.5 NC1=CC=CC=C1Br 1362091 [1,1,0,0,0,0|1,0,0]=3 354 B8R1.5 NC1=CC=CC=C1Cl 2826458 [1,1,0,0,0,0|1,0,0]=3 355 B8R1.5 NC1=CC=CC=C1I 7020410063 [1,1,0,0,0,0|1,0,0]=3 356 B8R1.5 NC1=CC=CC=C1N 5753508 [1,1,0,0,0,0|1,0,0]=3 357 B8R1.5 NC1=NC=CC=C1O 1514722 [1,1,0,0,0,0|1,0,0]=3 358 B8R1.5 OC1=C(Br)C=CC=C1 1287430 [1,1,0,0,0,0|0,0,0]=2 359 B8R1.5 OC1=C(Cl)C=CC=C1 2826547 [1,1,0,0,0,0|0,0,0]=2 360 B8R1.5 OC1=C(F)C=CC=C1 22430483 [1,1,0,0,0,0|0,0,0]=2 361 B8R1.5 OC1=C(I)C=CC=C1 3191832 [1,1,0,0,0,0|0,0,0]=2 362 B8R1.5 OC1=C(O)C=CC=C1 2825747 [1,1,0,0,0,0|0,0,0]=2 363 B8R1.5 [O-][N+]1=C(Cl)C=CC=C1 5662452 [1,1,0,0,0,0|1,0,1]=4 364 B8R1.1 CC1=CC=C(CS)O1 5810409 [0,1,0,0,1,0|1,1,0]=4 365 B8R1.1 CN1C=C(CO)C=N1 2125365 [0,1,0,0,1,0|2,0,0]=4 366 B8R1.1 NCC1=CC(Cl)=CS1 11639171 [0,1,0,0,1,0|2,0,0]=4 367 B8R1.1 OCC1=CC(Cl)=CS1 11165208 [0,1,0,0,1,0|1,0,0]=3 368 B8R1.7 CC(O)C1=CC=CS1 1366588 [0,1,0,0,1,0|1,0,0]=3 369 B8R1.7 O=C(O)C1=CC=CN1 2825772 [0,1,0,0,1,0|1,0,1]=4 370 B8R1.7 O=C(O)C1=CC=CO1 2825796 [0,1,0,0,1,0|1,0,1]=4 371 B8R1.7 O=C(O)C1=CC=CS1 1509751 [0,1,0,0,1,0|1,0,1]=4 372 B8R1.7 O=C(O)C1=COC=C1 2825797 [0,1,0,0,1,0|1,0,1]=4 373 B8R1.7 OB(O)C1=CC=CS1 2817633 [0,1,0,0,1,0|2,0,0]=4 374 B8R1.8 N#CCC1=CC=CS1 1287095 [0,1,0,0,1,0|2,0,0]=4 375 B8R1.8 NCCN1C=CC=C1 1048773 [0,1,0,0,1,0|2,0,0]=4 376 B8R1.8 NCCN1C=CC=C1 8916334 [0,1,0,0,1,0|2,0,0]=4 377 B8R1.8 OCCC1=CC=CS1 22430596 [0,1,0,0,1,0|1,0,0]=3 378 B8R1.11 CN1C=CN=C1CO 1088507 [0,1,0,0,1,0|2,0,0]=4 379 B10R1.1 CC1=CC=C(CC#N)C=C1 1287072 [0,2,0,0,0,0|1,0,0]=3 380 B10R1.1 CC1=CC=C(CCCl)C=C1 1277178 [0,2,0,0,0,0|1,0,0]=3 381 B10R1.1 CC1=CC=C(CCN)C=C1 1038622 [0,2,0,0,0,0|1,0,0]=3 382 B10R1.1 CCCC1=CC=C(O)C=C1 2818223 [0,2,0,0,0,0|1,0,0]=3 383 B10R1.1 CCOC1=CC=C(N)C=C1 1314575 [0,2,0,0,0,0|1,0,0]=3 384 B10R1.1 CCOC1=CC=C(O)C=C1 1506720 [0,2,0,0,0,0|1,0,0]=3 385 B10R1.1 N#CCC1=CC=C(Br)C=C1 1287071 [0,2,0,0,0,0|1,0,0]=3 386 B10R1.1 N#CCC1=CC=C(Cl)C=C1 1519435 [0,2,0,0,0,0|1,0,0]=3 387 B10R1.1 N#CCC1=CC=C(F)C=C1 1519437 [0,2,0,0,0,0|1,0,0]=3 388 B10R1.1 NCCC1=CC=C(F)C=C1 1038624 [0,2,0,0,0,0|1,0,0]=3 389 B10R1.1 NCCC1=CC=C(O)C=C1 3463715 [0,2,0,0,0,0|1,0,0]=3 390 B10R1.1 O=C=NC1=CC=C(Cl)C=C1 1051737 [0,2,0,0,0,0|0,0,2]=4 391 B10R1.1 OCCC1=CC=C(Br)C=C1 1204413 [0,2,0,0,0,0|0,0,0]=2 392 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 1288010 [0,2,0,0,0,0|0,0,1]=3 393 B10R1.3 CCC1=CC=C(C#N)C=C1 1506640 [0,2,0,0,0,0|1,0,0]=3 394 B10R1.3 CCC1=CC=C(C=O)C=C1 1901843 [0,2,0,0,0,0|1,0,0]=3 395 B10R1.3 CCC1=CC=C(CCl)C=C1 1779392 [0,2,0,0,0,0|1,0,0]=3 396 B10R1.3 COC1=CC=C(C#N)C=C1 1778844 [0,2,0,0,0,0|1,0,1]=4 397 B10R1.3 COC1=CC=C(C=O)C=C1 1180629 [0,2,0,0,0,0|0,0,2]=4 398 B10R1.3 COC1=CC=C(CN)C=C1 1038612 [0,2,0,0,0,0|1,0,0]=3 399 B10R1.3 COC1=CC=C(CO)C=C1 1778902 [0,2,0,0,0,0|0,0,0]=2 400 B10R1.3 COC1=CC=C(NN)C=C1 1156635 [0,2,0,0,0,0|2,0,0]=4 401 B10R1.3 COC1=CC=C(NN)C=C1 5482168 [0,2,0,0,0,0|2,0,0]=4 402 B10R1.3 COC1=CC=C(OC)C=C1 2827241 [0,2,0,0,0,0|2,0,0]=4 403 B10R1.3 COC1=NC=C(CN)C=C1 2228885 [0,2,0,0,0,0|2,0,0]=4 404 B10R1.3 N#CC1=CC=C(C=O)C=C1 2826747 [0,2,0,0,0,0|0,0,2]=4 405 B10R1.3 N#CC1=CC=C(CBr)C=C1 1369355 [0,2,0,0,0,0|1,0,0]=3 406 B10R1.3 N#CC1=CC=C(CCl)C=C1 2829303 [0,2,0,0,0,0|1,0,0]=3 407 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 1043807 [0,2,0,0,0,0|0,0,2]=4 408 B10R1.13 CC(=O)C1=CC=C(C)C=C1 1043798 [0,2,0,0,0,0|0,0,2]=4 409 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 1043806 [0,2,0,0,0,0|0,0,2]=4 410 B10R1.13 CC(=O)C1=CC=C(F)C=C1 1043805 [0,2,0,0,0,0|0,0,2]=4 411 B10R1.13 CC(=O)C1=CC=C(N)C=C1 7119850616 [0,2,0,0,0,0|0,0,2]=4 412 B10R1.13 CC(=O)C1=CC=C(O)C=C1 1778865 [0,2,0,0,0,0|0,0,2]=4 413 B10R1.13 CC(C)C1=CC=C(N)C=C1 2827066 [0,2,0,0,0,0|1,0,0]=3 414 B10R1.13 CC(C)C1=CC=C(N)C=C1 3585954 [0,2,0,0,0,0|1,0,0]=3 415 B10R1.13 CC(C)C1=CC=C(O)C=C1 2827119 [0,2,0,0,0,0|1,0,0]=3 416 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 1366992 [0,2,0,0,0,0|1,0,0]=3 417 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 1051709 [0,2,0,0,0,0|0,0,2]=4 418 B10R1.13 CC1=CC=C(C(=O)O)C=C1 7119561590 [0,2,0,0,0,0|0,0,1]=3 419 B10R1.13 CC1=CC=C(C(C)Br)C=C1 2024134 [0,2,0,0,0,0|1,0,0]=3 420 B10R1.13 CC1=CC=C(C(C)C)C=C1 2827025 [0,2,0,0,0,0|1,0,0]=3 421 B10R1.13 CC1=CC=C(C(C)O)C=C1 1366658 [0,2,0,0,0,0|0,0,0]=2 422 B10R1.13 CC1=CC=C(C(N)=O)C=C1 1106851 [0,2,0,0,0,0|0,0,2]=4 423 B10R1.13 CC1=CC=C(C(N)=S)C=C1 7020331312 [0,2,0,0,0,0|0,1,1]=4 424 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 2839025 [0,2,0,0,0,0|1,0,1]=4 425 B10R1.13 CC1=CC=C([N+](=O)[O-])C=C1 2827170 [0,2,0,0,0,0|1,0,1]=4 426 B10R1.13 CC1=CC=C([SH](=O)=O)C=C1 22430375 [0,2,0,0,0,0|1,0,1]=4 427 B10R1.13 CC1=NC=C(C(=O)O)C=C1 19767694 [0,2,0,0,0,0|1,0,1]=4 428 B10R1.13 CN(C)C1=CC=C(Br)C=C1 1362066 [0,2,0,0,0,0|2,0,0]=4 429 B10R1.13 CN(C)C1=CC=C(N)C=C1 1512285 [0,2,0,0,0,0|2,0,0]=4 430 B10R1.13 CN(N)C1=CC=C(F)C=C1 1778934 [0,2,0,0,0,0|2,0,0]=4 431 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 22588257 [0,2,0,0,0,0|1,0,1]=4 432 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 6057545 [0,2,0,0,0,0|1,0,1]=4 433 B10R1.13 N=C(N)C1=CC=C(F)C=C1 22588245 [0,2,0,0,0,0|1,0,1]=4 434 B10R1.13 N=C(N)C1=CC=C(N)C=C1 6300646 [0,2,0,0,0,0|1,0,1]=4 435 B10R1.13 N=C(N)C1=CC=C(O)C=C1 2827095 [0,2,0,0,0,0|1,0,1]=4 436 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 1375914 [0,2,0,0,0,0|0,0,2]=4 437 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 1375258 [0,2,0,0,0,0|0,0,2]=4 438 B10R1.13 NC(=O)C1=CC=C(F)C=C1 1375215 [0,2,0,0,0,0|0,0,2]=4 439 B10R1.13 NC(=O)C1=CC=C(I)C=C1 1445657 [0,2,0,0,0,0|0,0,2]=4 440 B10R1.13 NC(=O)C1=CC=C(N)C=C1 1375210 [0,2,0,0,0,0|0,0,2]=4 441 B10R1.13 NC(=O)C1=CC=C(O)C=C1 1375211 [0,2,0,0,0,0|0,0,2]=4 442 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 1792547 [0,2,0,0,0,0|0,1,1]=4 443 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 7020331320 [0,2,0,0,0,0|0,1,1]=4 444 B10R1.13 NC(=S)C1=CC=C(F)C=C1 7020331313 [0,2,0,0,0,0|0,1,1]=4 445 B10R1.13 NC1=CC=C(B(O)O)C=C1 19767697 [0,2,0,0,0,0|1,0,0]=3 446 B10R1.13 NC1=CC=C(C(=O)O)C=C1 1509951 [0,2,0,0,0,0|0,0,1]=3 447 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 2827229 [0,2,0,0,0,0|1,0,1]=4 448 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 1051742 [0,2,0,0,0,0|0,0,2]=4 449 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 1051712 [0,2,0,0,0,0|0,0,2]=4 450 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 1312865 [0,2,0,0,0,0|0,0,1]=3 451 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 1312854 [0,2,0,0,0,0|0,0,1]=3 452 B10R1.13 O=C(O)C1=CC=C(F)C=C1 1506397 [0,2,0,0,0,0|0,0,1]=3 453 B10R1.13 O=C(O)C1=CC=C(I)C=C1 3054307 [0,2,0,0,0,0|0,0,1]=3 454 B10R1.13 O=C(O)C1=CC=C(O)C=C1 1195424 [0,2,0,0,0,0|0,0,1]=3 455 B10R1.13 O=C(O)C1=CC=C(S)C=C1 2829768 [0,2,0,0,0,0|0,0,1]=3 456 B10R1.13 O=C(O)C1=CC=N(=O)C=C1 12405061 [0,2,0,0,0,0|1,0,1]=4 457 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 2830995 [0,2,0,0,0,0|1,0,1]=4 458 B10R1.13 O=C(O)C1=CN=C(O)C=C1 5970174 [0,2,0,0,0,0|1,0,1]=4 459 B10R1.13 O=C(O)C1=NC=C(O)C=C1 3354843 [0,2,0,0,0,0|1,0,1]=4 460 B10R1.13 O=C1C=CC(C(=O)O)=CN1 1313836 [0,2,0,0,0,0|1,0,1]=4 461 B10R1.13 O=S(Cl)C1=CC=C(Cl)C=C1 3519061 [0,2,0,0,0,0|1,0,1]=4 462 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 2830996 [0,2,0,0,0,0|1,0,1]=4 463 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 2827558 [0,2,0,0,0,0|1,0,1]=4 464 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 2827327 [0,2,0,0,0,0|1,0,1]=4 465 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 1179227 [0,2,0,0,0,0|1,0,0]=3 466 B10R1.13 OB(O)C1=CC=C(F)C=C1 1179206 [0,2,0,0,0,0|1,0,0]=3 467 B10R1.25 CC1=CC(C)=C(CBr)C=C1 2413490 [0,2,0,0,0,0|1,0,0]=3 468 B10R1.25 CC1=CC(C)=C(CO)C=C1 1778879 [0,2,0,0,0,0|0,0,0]=2 469 B10R1.25 CC1=CC(O)=CC=C1N=O 1023283 [0,2,0,0,0,0|1,0,1]=4 470 B10R1.25 COC1=C(Cl)C=C(N)C=C1 1366978 [0,2,0,0,0,0|2,0,0]=4 471 B10R1.25 COC1=C(N)C=C(C)C=C1 1366672 [0,2,0,0,0,0|2,0,0]=4 472 B10R1.25 COC1=C(N)C=C(Cl)C=C1 1366976 [0,2,0,0,0,0|2,0,0]=4 473 B10R1.25 COC1=CC=C(I)C=C1O 3479995 [0,2,0,0,0,0|2,0,0]=4 474 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 2049523 [0,2,0,0,0,0|1,0,0]=3 475 B10R1.25 N#CC1=CC=C(Br)C=C1Br 10722189 [0,2,0,0,0,0|1,0,1]=4 476 B10R1.25 NC1=NC=C(CO)C(N)=N1 2170708 [0,2,0,0,0,0|2,0,0]=4 477 B10R1.25 O=C1NC=C(CO)C(=O)N1 0125370014 [0,2,0,0,0,0|2,0,0]=4 478 B10R1.25 O=CC1=C(O)C=C(O)C=C1 2827224 [0,2,0,0,0,0|0,0,2]=4 479 B10R1.25 O=CC1=CC=C(Br)C=C1O 3488517 [0,2,0,0,0,0|0,0,2]=4 480 B10R1.25 O=CC1=CC=C(Cl)C=C1Cl 1903199 [0,2,0,0,0,0|0,0,2]=4 481 B10R1.25 O=CC1=CC=C(F)C=C1F 1901939 [0,2,0,0,0,0|0,0,2]=4 482 B10R1.25 O=CC1=CC=C(F)C=C1O 5044148 [0,2,0,0,0,0|0,0,2]=4 483 B10R1.176 CC1=C(F)C=C(C#N)C=C1 2827047 [0,2,0,0,0,0|1,0,1]=4 484 B10R1.176 CC1=CC(C#N)=CC=C1F 1506464 [0,2,0,0,0,0|1,0,1]=4 485 B10R1.176 CC1=CC(N=O)=CC=C1O 1023286 [0,2,0,0,0,0|1,0,1]=4 486 B10R1.176 CC1=CC=C(C=O)C=C1Br 1906113 [0,2,0,0,0,0|0,0,2]=4 487 B10R1.176 CCC1=CC=C(C)C(N)=C1 1366642 [0,2,0,0,0,0|1,0,0]=3 488 B10R1.176 COC1=CC(Br)=C(O)C=C1 7020688436 [0,2,0,0,0,0|2,0,0]=4 489 B10R1.176 COC1=CC(C)=C(C)C=C1 6849604 [0,2,0,0,0,0|2,0,0]=4 490 B10R1.176 COC1=CC(C)=C(N)C=C1 6923470 [0,2,0,0,0,0|2,0,0]=4 491 B10R1.176 COC1=CC(N)=C(C)C=C1 6923476 [0,2,0,0,0,0|2,0,0]=4 492 B10R1.176 COC1=CC=C(N)C(C)=C1 1366675 [0,2,0,0,0,0|2,0,0]=4 493 B10R1.176 COC1=CC=C(N)C(N)=C1 1197694 [0,2,0,0,0,0|2,0,0]=4 494 B10R1.176 ClCC1=CC(Cl)=C(Cl)C=C1 2049522 [0,2,0,0,0,0|1,0,0]=3 495 B10R1.176 NCC1=CC(F)=C(F)C=C1 2048759 [0,2,0,0,0,0|1,0,0]=3 496 B10R1.176 NNC1=CC(Cl)=C(Cl)C=C1 3676282 [0,2,0,0,0,0|2,0,0]=4 497 B10R1.176 O=C1C=C(CCl)OC=C1O 1218469 [0,2,0,0,0,0|2,0,0]=4 498 B10R1.176 O=C1C=C(CO)OC=C1O 2827707 [0,2,0,0,0,0|1,0,0]=3 499 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 7018801961 [0,2,0,0,0,0|0,0,2]=4 500 B10R1.176 O=CC1=CC=C(F)C(Cl)=C1 1902367 [0,2,0,0,0,0|0,0,2]=4 501 B10R1.176 O=CC1=CC=C(O)C(Cl)=C1 7116564493 [0,2,0,0,0,0|0,0,2]=4 502 B10R1.176 O=CC1=CC=C(O)C(O)=C1 7015151002 [0,2,0,0,0,0|0,0,2]=4 503 B10R1.2 CC1=C(NN)C=CC=C1Cl 1366953 [0,2,0,0,0,0|2,0,0]=4 504 B10R1.2 CCC1=C(N)C(C)=CC=C1 2827065 [0,2,0,0,0,0|1,0,0]=3 505 B10R1.2 OCC1=CC=CC(F)=C1Br 6956894 [0,2,0,0,0,0|0,0,0]=2 506 B10R1.8 COC1=CC(C)=CC(C)=C1 6329884 [0,2,0,0,0,0|2,0,0]=4 507 B10R1.8 O=CC1=CC(Cl)=CC(Cl)=C1 1903201 [0,2,0,0,0,0|0,0,2]=4 508 B10R1.8 O=CC1=CC(F)=CC(F)=C1 2048753 [0,2,0,0,0,0|0,0,2]=4 509 B10R1.8 OCC1=CC(Cl)=CC(Cl)=C1 2049055 [0,2,0,0,0,0|0,0,0]=2 510 B10R1.10 CC1=CC=CC(CC#N)=C1 1287074 [0,2,0,0,0,0|1,0,0]=3 511 B10R1.10 CC1=CC=CC(CCN)=C1 1038621 [0,2,0,0,0,0|1,0,0]=3 512 B10R1.10 CC1=CC=CC(N=C=O)=C1 1055564 [0,2,0,0,0,0|0,0,2]=4 513 B10R1.10 CCNC1=CC=CC(C)=C1 1220439 [0,2,0,0,0,0|1,0,0]=3 514 B10R1.10 CNCC1=CC(O)=CC=C1 1268164 [0,2,0,0,0,0|1,0,0]=3 515 B10R1.10 CNCC1=CC=CC(O)=C1 3644490 [0,2,0,0,0,0|1,0,0]=3 516 B10R1.10 CSCC1=CC(O)=CC=C1 7575917 [0,2,0,0,0,0|0,1,0]=3 517 B10R1.10 C\N=C\C1=CC=CC(O)=C1 3644500 [0,2,0,0,0,0|1,0,1]=4 518 B10R1.10 FC1=CC=CC(N=C=S)=C1 1055710 [0,2,0,0,0,0|0,1,1]=4 519 B10R1.10 N#CCC1=CC=CC(Cl)=C1 1519438 [0,2,0,0,0,0|1,0,0]=3 520 B10R1.10 NCCC1=CC(Br)=CC=C1 1786240 [0,2,0,0,0,0|1,0,0]=3 521 B10R1.10 NCCC1=CC(Cl)=CC=C1 1038630 [0,2,0,0,0,0|1,0,0]=3 522 B10R1.10 O=C=NC1=CC(Cl)=CC=C1 1051738 [0,2,0,0,0,0|0,0,2]=4 523 B10R1.10 O=CNC1=CC(Cl)=CC=C1 12154920 [0,2,0,0,0,0|0,0,2]=4 524 B10R1.30 CC1=CC=C(N)C(C#N)=C1 3651509 [0,2,0,0,0,0|1,0,1]=4 525 B10R1.30 CC1=CC=C(O)C(C=O)=C1 1156694 [0,2,0,0,0,0|0,0,2]=4 526 B10R1.30 CCC1=CC(Br)=CC=C1O 7020688456 [0,2,0,0,0,0|1,0,0]=3 527 B10R1.30 COC1=C(C)C=CC(F)=C1 5042942 [0,2,0,0,0,0|2,0,0]=4 528 B10R1.30 COC1=C(N)C=CC(C)=C1 1366673 [0,2,0,0,0,0|2,0,0]=4 529 B10R1.30 COC1=C(O)C=CC(C)=C1 2827243 [0,2,0,0,0,0|2,0,0]=4 530 B10R1.30 COC1=CC(N)=CC=C1Cl 1902326 [0,2,0,0,0,0|2,0,0]=4 531 B10R1.30 CSC1=CC(O)=CC=C1N 6641948 [0,2,0,0,0,0|2,0,0]=4 532 B10R1.30 N#CC1=C(F)C=CC(Br)=C1 1506394 [0,2,0,0,0,0|1,0,1]=4 533 B10R1.30 N#CC1=CC(Br)=CC=C1O 7118560912 [0,2,0,0,0,0|1,0,1]=4 534 B10R1.30 N#CC1=CC(Cl)=CC=C1O 7020660870 [0,2,0,0,0,0|1,0,1]=4 535 B10R1.30 O=CC1=C(F)C=CC(Br)=C1 3038833 [0,2,0,0,0,0|0,0,2]=4 536 B10R1.30 O=CC1=C(F)C=CC(F)=C1 2818785 [0,2,0,0,0,0|0,0,2]=4 537 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 7018801955 [0,2,0,0,0,0|0,0,2]=4 538 B10R1.30 O=CC1=CC(Cl)=CC=C1O 7020681006 [0,2,0,0,0,0|0,0,2]=4 539 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 1287349 [0,2,0,0,0,0|0,0,2]=4 540 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 1287348 [0,2,0,0,0,0|0,0,2]=4 541 B10R1.113 CC(=O)C1=CC(N)=CC=C1 1366640 [0,2,0,0,0,0|0,0,2]=4 542 B10R1.113 CC(=O)C1=CC=CC(O)=C1 1901859 [0,2,0,0,0,0|0,0,2]=4 543 B10R1.113 CC(C)C1=CC=CC(O)=C1 2827127 [0,2,0,0,0,0|1,0,0]=3 544 B10R1.113 CC1=CC(C(=O)O)=CN=C1 2818253 [0,2,0,0,0,0|1,0,1]=4 545 B10R1.113 CC1=CC([N+](=O)[O-])=CC=C1 2827171 [0,2,0,0,0,0|1,0,1]=4 546 B10R1.113 CC1=CC=CC(C(=N)N)=C1 5012379 [0,2,0,0,0,0|1,0,1]=4 547 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 1051708 [0,2,0,0,0,0|0,0,2]=4 548 B10R1.113 CC1=CC=CC(C(=O)O)=C1 1901858 [0,2,0,0,0,0|0,0,1]=3 549 B10R1.113 CC1=CC=CC(C(=O)O)=N1 2214917 [0,2,0,0,0,0|1,0,1]=4 550 B10R1.113 CC1=CC=CC(C(N)=O)=C1 1375208 [0,2,0,0,0,0|0,0,2]=4 551 B10R1.113 CC1=NC=CC(C(=O)O)=C1 3666565 [0,2,0,0,0,0|1,0,1]=4 552 B10R1.113 CN(C)C1=CC=CC(Br)=C1 1287426 [0,2,0,0,0,0|2,0,0]=4 553 B10R1.113 CN(C)C1=CC=CC(N)=C1 1232815 [0,2,0,0,0,0|2,0,0]=4 554 B10R1.113 NC(=O)C1=CC(Cl)=CC=C1 1375257 [0,2,0,0,0,0|0,0,2]=4 555 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 7217960159 [0,2,0,0,0,0|1,0,1]=4 556 B10R1.113 NC1=CC=CC(C(=O)O)=C1 2827166 [0,2,0,0,0,0|0,0,1]=3 557 B10R1.113 NC1=CN=CC(C(=O)O)=C1 7017520056 [0,2,0,0,0,0|1,0,1]=4 558 B10R1.113 NC1=NC(C(=O)O)=CC=C1 1218791 [0,2,0,0,0,0|1,0,1]=4 559 B10R1.113 NC1=NC=CC(C(=O)O)=C1 2214529 [0,2,0,0,0,0|1,0,1]=4 560 B10R1.113 O=C(Cl)C1=CC=CC(Br)=C1 1051714 [0,2,0,0,0,0|0,0,2]=4 561 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 1051741 [0,2,0,0,0,0|0,0,2]=4 562 B10R1.113 O=C(Cl)C1=CC=CC(F)=C1 1051711 [0,2,0,0,0,0|0,0,2]=4 563 B10R1.113 O=C(O)C1=CC(=S)NC=C1 13577371 [0,2,0,0,0,0|1,0,1]=4 564 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 973807 [0,2,0,0,0,0|0,0,1]=3 565 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 2214915 [0,2,0,0,0,0|1,0,1]=4 566 B10R1.113 O=C(O)C1=CC(F)=CC=C1 1901891 [0,2,0,0,0,0|0,0,1]=3 567 B10R1.113 O=C(O)C1=CC(O)=NC=C1 2223344 [0,2,0,0,0,0|1,0,1]=4 568 B10R1.113 O=C(O)C1=CC(S)=NC=C1 2223361 [0,2,0,0,0,0|1,0,1]=4 569 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 1906408 [0,2,0,0,0,0|0,0,1]=3 570 B10R1.113 O=C(O)C1=CC=CC(O)=C1 2827221 [0,2,0,0,0,0|0,0,1]=3 571 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 0109160011 [0,2,0,0,0,0|1,0,1]=4 572 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 5110090024 [0,2,0,0,0,0|1,0,1]=4 573 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 7017520050 [0,2,0,0,0,0|1,0,1]=4 574 B10R1.113 O=C(O)C1=NC=CC(O)=C1 7017520047 [0,2,0,0,0,0|1,0,1]=4 575 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 1362062 [0,2,0,0,0,0|1,0,1]=4 576 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 2827328 [0,2,0,0,0,0|1,0,1]=4 577 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 1179274 [0,2,0,0,0,0|1,0,0]=3 578 B10R1.113 OB(O)C1=CC=CC(F)=C1 1586087 [0,2,0,0,0,0|1,0,0]=3 579 B10R1.172 COC1=CC=CC(C#N)=C1 1778846 [0,2,0,0,0,0|1,0,1]=4 580 B10R1.172 COC1=CC=CC(C=O)=C1 1180630 [0,2,0,0,0,0|0,0,2]=4 581 B10R1.172 COC1=CC=CC(CCl)=C1 1779497 [0,2,0,0,0,0|1,0,0]=3 582 B10R1.172 COC1=CC=CC(OC)=C1 2827240 [0,2,0,0,0,0|2,0,0]=4 583 B10R1.172 N#CC1=CC(CS)=CC=C1 2117223 [0,2,0,0,0,0|0,1,0]=3 584 B10R1.172 N#CC1=CC=CC(C#N)=C1 22430454 [0,2,0,0,0,0|1,0,1]=4 585 B10R1.172 N#CC1=CC=CC(CCl)=C1 2829305 [0,2,0,0,0,0|1,0,0]=3 586 B10R1.172 NCC1=CC=CC(CN)=C1 2827131 [0,2,0,0,0,0|1,0,0]=3 587 B10R1.15 CC(C#N)C1=CC=CC=C1 1204062 [0,2,0,0,0,0|1,0,0]=3 588 B10R1.15 CC(CN)C1=NC=CC=C1 1883428 [0,2,0,0,0,0|2,0,0]=4 589 B10R1.15 CC(NO)C1=CC=CC=C1 1204024 [0,2,0,0,0,0|0,0,0]=2 590 B10R1.15 CCC(=O)C1=CC=CC=C1 1043816 [0,2,0,0,0,0|1,0,0]=3 591 B10R1.15 CCC(C)C1=CC=CC=C1 2827022 [0,2,0,0,0,0|1,0,0]=3 592 B10R1.15 CCC(N)C1=CC=CC=C1 1146635 [0,2,0,0,0,0|1,0,0]=3 593 B10R1.15 CN(C=O)C1=CC=CC=C1 2818161 [0,2,0,0,0,0|0,0,2]=4 594 B10R1.15 CNC(=O)C1=CC=CC=C1 5032223 [0,2,0,0,0,0|0,0,2]=4 595 B10R1.15 COC(=O)C1=CC=CC=C1 2132029 [0,2,0,0,0,0|0,0,1]=3 596 B10R1.15 COC(=O)C1=CC=NC=C1 2084305 [0,2,0,0,0,0|1,0,1]=4 597 B10R1.15 COC(=O)C1=NC=CC=C1 1311479 [0,2,0,0,0,0|1,0,1]=4 598 B10R1.15 CSC(=N)C1=CC=CC=C1 22430530 [0,2,0,0,0,0|0,1,1]=4 599 B10R1.15 C\C(=N/O)C1=CC=CC=C1 2827049 [0,2,0,0,0,0|0,0,1]=3 600 B10R1.15 C\C(=N/O)C1=NC=CC=C1 5011323 [0,2,0,0,0,0|1,0,1]=4 601 B10R1.15 NCC(=O)C1=CC=CC=C1 1042947 [0,2,0,0,0,0|1,0,0]=3 602 B10R1.15 NNC(=O)C1=CC=CC=C1 1778868 [0,2,0,0,0,0|0,0,2]=4 603 B10R1.15 N\C(=N\O)C1=CC=CC=C1 4434547 [0,2,0,0,0,0|0,0,1]=3 604 B10R1.15 O=C(CBr)C1=CC=CC=C1 2125402 [0,2,0,0,0,0|1,0,0]=3 605 B10R1.15 O=C(CBr)C1=CC=NC=C1 5980437 [0,2,0,0,0,0|2,0,0]=4 606 B10R1.15 O=C(CBr)C1=CN=CC=C1 4763913 [0,2,0,0,0,0|2,0,0]=4 607 B10R1.15 O=CC(=O)C1=CC=CC=C1 2826987 [0,2,0,0,0,0|0,0,2]=4 608 B10R1.15 OC(CCl)C1=CC=CC=C1 1500436 [0,2,0,0,0,0|0,0,0]=2 609 B10R1.28 CC(C)(C)C1=CC=CC=C1 2827021 [0,2,0,0,0,0|1,0,0]=3 610 B10R1.28 CC(C)(O)C1=CC=NC=C1 5028374 [0,2,0,0,0,0|1,0,0]=3 611 B10R1.28 ClC(Cl)(Cl)C1=CC=CC=C1 2961679 [0,2,0,0,0,0|1,0,0]=3 612 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 1051762 [0,2,0,0,0,0|1,0,1]=4 613 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 4194516 [0,2,0,0,0,0|1,0,0]=3 614 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 1287341 [0,2,0,0,0,0|0,0,2]=4 615 B10R1.61 CC(=O)C1=C(O)C=CC=C1 1778867 [0,2,0,0,0,0|0,0,2]=4 616 B10R1.61 CC(=O)C1=CC=CC=C1N 2827048 [0,2,0,0,0,0|0,0,2]=4 617 B10R1.61 CC(C)C1=C(N)C=CC=C1 2827067 [0,2,0,0,0,0|1,0,0]=3 618 B10R1.61 CC(C)C1=C(O)C=CC=C1 2827124 [0,2,0,0,0,0|1,0,0]=3 619 B10R1.61 CC(O)C1=C(F)C=NC=C1 6902371 [0,2,0,0,0,0|1,0,0]=3 620 B10R1.61 CC1=C(C(=O)Cl)C=CC=C1 1051707 [0,2,0,0,0,0|0,0,2]=4 621 B10R1.61 CC1=C(C(=O)O)N=CC=C1 2818254 [0,2,0,0,0,0|1,0,1]=4 622 B10R1.61 CC1=C(C(N)=O)C=CC=C1 1375207 [0,2,0,0,0,0|0,0,2]=4 623 B10R1.61 CC1=C([N+](=O)[O-])C=CC=C1 2827169 [0,2,0,0,0,0|1,0,1]=4 624 B10R1.61 CC1=CC=CC=C1C(=O)O 1901857 [0,2,0,0,0,0|0,0,1]=3 625 B10R1.61 CC1=CC=CC=C1C(N)=S 1288011 [0,2,0,0,0,0|0,1,1]=4 626 B10R1.61 CN(C)C1=C(Br)C=CC=C1 3485526 [0,2,0,0,0,0|2,0,0]=4 627 B10R1.61 N=C(N)C1=C(F)C=CC=C1 3515450 [0,2,0,0,0,0|1,0,1]=4 628 B10R1.61 NC(=O)C1=CC=CC=C1N 0125330235 [0,2,0,0,0,0|0,0,2]=4 629 B10R1.61 NC(=O)C1=CC=CC=C1O 2131902 [0,2,0,0,0,0|0,0,2]=4 630 B10R1.61 NC(=S)C1=C(Cl)C=CC=C1 7020331321 [0,2,0,0,0,0|0,1,1]=4 631 B10R1.61 NC(=S)C1=C(F)C=CC=C1 7020331314 [0,2,0,0,0,0|0,1,1]=4 632 B10R1.61 NC1=C(C(=O)O)C=CC=C1 3585810 [0,2,0,0,0,0|0,0,1]=3 633 B10R1.61 NC1=CC=CC=C1[N+](=O)[O-] 2128520 [0,2,0,0,0,0|1,0,1]=4 634 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl 1051740 [0,2,0,0,0,0|0,0,2]=4 635 B10R1.61 O=C(Cl)C1=CC=CC=C1F 1051710 [0,2,0,0,0,0|0,0,2]=4 636 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 3686191 [0,2,0,0,0,0|1,0,1]=4 637 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 1902292 [0,2,0,0,0,0|0,0,1]=3 638 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 2830994 [0,2,0,0,0,0|1,0,1]=4 639 B10R1.61 O=C(O)C1=C(I)C=CC=C1 3054308 [0,2,0,0,0,0|0,0,1]=3 640 B10R1.61 O=C(O)C1=C(S)C=CC=C1 2829766 [0,2,0,0,0,0|0,0,1]=3 641 B10R1.61 O=C(O)C1=CC=CC=C1Br 7119571920 [0,2,0,0,0,0|0,0,1]=3 642 B10R1.61 O=C(O)C1=CC=CC=C1F 1901890 [0,2,0,0,0,0|0,0,1]=3 643 B10R1.61 O=C(O)C1=CC=CC=C1O 2129564 [0,2,0,0,0,0|0,0,1]=3 644 B10R1.61 O=C(O)C1=CC=CNC1=O 4059409 [0,2,0,0,0,0|1,0,1]=4 645 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 2830993 [0,2,0,0,0,0|1,0,1]=4 646 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 2827556 [0,2,0,0,0,0|1,0,1]=4 647 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 7211720040 [0,2,0,0,0,0|1,0,1]=4 648 B10R1.61 O=[N+]([O-])C1=CC=CC=C1Br 1362061 [0,2,0,0,0,0|1,0,1]=4 649 B10R1.61 OB(O)C1=C(F)C=CC=C1 1586067 [0,2,0,0,0,0|1,0,0]=3 650 B10R1.4 C=CCC1=C(O)C=CC=C1 2827010 [0,2,0,0,0,0|1,0,0]=3 651 B10R1.4 CC1=C(N=C=O)C=CC=C1 1055563 [0,2,0,0,0,0|0,0,2]=4 652 B10R1.4 CC1=CC=CC=C1CC#N 1287073 [0,2,0,0,0,0|1,0,0]=3 653 B10R1.4 CCOC1=C(O)C=CC=C1 2827244 [0,2,0,0,0,0|1,0,0]=3 654 B10R1.4 CCOC1=CC=CC=C1N 1314577 [0,2,0,0,0,0|1,0,0]=3 655 B10R1.4 CCOC1=CC=CN=C1N 1515223 [0,2,0,0,0,0|2,0,0]=4 656 B10R1.4 FC1=C(N=C=S)C=CC=C1 1055686 [0,2,0,0,0,0|0,1,1]=4 657 B10R1.4 N#CCC1=C(F)C=CC=C1 1519443 [0,2,0,0,0,0|1,0,0]=3 658 B10R1.4 NCCC1=C(O)C=CC=C1 2227237 [0,2,0,0,0,0|1,0,0]=3 659 B10R1.4 NCCC1=CC=CC=C1F 6051017 [0,2,0,0,0,0|1,0,0]=3 660 B10R1.17 BrCCCC1=CC=CC=C1 1275152 [0,2,0,0,0,0|1,0,0]=3 661 B10R1.17 BrCCOC1=CC=CC=C1 7110952510 [0,2,0,0,0,0|1,0,0]=3 662 B10R1.17 CCCCC1=CC=CC=C1 2827024 [0,2,0,0,0,0|1,0,0]=3 663 B10R1.17 CCNCC1=CC=CC=C1 1366645 [0,2,0,0,0,0|1,0,0]=3 664 B10R1.17 CNCCC1=CC=NC=C1 7020420399 [0,2,0,0,0,0|2,0,0]=4 665 B10R1.17 CNCCC1=NC=CC=C1 4347309 [0,2,0,0,0,0|2,0,0]=4 666 B10R1.17 ClC\C=C\C1=CC=CC=C1 5970146 [0,2,0,0,0,0|1,0,0]=3 667 B10R1.17 N#CCCC1=CC=CC=C1 1512383 [0,2,0,0,0,0|1,0,0]=3 668 B10R1.17 N#CCCC1=NC=CC=C1 1973037 [0,2,0,0,0,0|2,0,0]=4 669 B10R1.17 N#CCOC1=CC=CC=C1 7020402308 [0,2,0,0,0,0|1,0,0]=3 670 B10R1.17 N=C=[SH]CC1=CC=CC=C1 22430371 [0,2,0,0,0,0|0,1,0]=3 671 B10R1.17 NCCCC1=CC=CN=C1 1038705 [0,2,0,0,0,0|2,0,0]=4 672 B10R1.17 NCCOC1=CC=CC=C1 7020330514 [0,2,0,0,0,0|1,0,0]=3 673 B10R1.17 NCCSC1=CC=CC=C1 6137840 [0,2,0,0,0,0|1,0,0]=3 674 B10R1.17 NNCCC1=CC=CC=C1 9080668 [0,2,0,0,0,0|1,0,0]=3 675 B10R1.17 O=C=NCC1=CC=CC=C1 1055530 [0,2,0,0,0,0|0,0,1]=3 676 B10R1.17 O=CCCC1=CC=CC=C1 1191525 [0,2,0,0,0,0|0,0,1]=3 677 B10R1.17 O=C\C=C\C1=CC=CC=C1 1778825 [0,2,0,0,0,0|0,0,2]=4 678 B10R1.17 OCC#CC1=CN=CC=C1 2652765 [0,2,0,0,0,0|1,0,0]=3 679 B10R1.17 OCCNC1=CC=CC=C1 1866520 [0,2,0,0,0,0|0,0,0]=2 680 B10R1.17 OCCOC1=CC=CC=C1 1275759 [0,2,0,0,0,0|0,0,0]=2 681 B10R1.17 S=C=NCC1=CC=CN=C1 2829135 [0,2,0,0,0,0|1,1,0]=4 682 B10R1.17 SCCOC1=CC=CC=C1 1310591 [0,2,0,0,0,0|0,1,0]=3 683 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 2818083 [0,2,0,0,0,0|1,0,0]=3 684 B10R1.18 CC(=O)NC1=CC=CC=C1 0118671148 [0,2,0,0,0,0|0,0,2]=4 685 B10R1.18 CC(=O)OC1=CC=CC=C1 5970182 [0,2,0,0,0,0|0,0,2]=4 686 B10R1.18 CC(C)NC1=CC=CC=C1 1220423 [0,2,0,0,0,0|1,0,0]=3 687 B10R1.18 CN(C)CC1=CC=CC=C1 2827061 [0,2,0,0,0,0|1,0,0]=3 688 B10R1.18 FC(F)SC1=CC=CC=C1 1779696 [0,2,0,0,0,0|1,0,0]=3 689 B10R1.18 NC(=O)NC1=CC=CC=C1 1778870 [0,2,0,0,0,0|0,0,2]=4 690 B10R1.18 NC(=S)CC1=CC=CC=C1 7018890438 [0,2,0,0,0,0|0,1,0]=3 691 B10R1.18 NC(=S)NC1=CC=CC=C1 1001333 [0,2,0,0,0,0|0,1,1]=4 692 B10R1.18 O=C(Cl)CC1=CC=CC=C1 1051728 [0,2,0,0,0,0|0,0,1]=3 693 B10R1.18 O=C(O)CC1=CC=CC=C1 1500423 [0,2,0,0,0,0|0,0,0]=2 694 B10R1.20 BrCC1=CC=CC=C1CBr 3585819 [0,2,0,0,0,0|1,0,0]=3 695 B10R1.20 COC1=C(C#N)C=CC=C1 1778845 [0,2,0,0,0,0|1,0,1]=4 696 B10R1.20 COC1=C(C=O)C=CC=C1 1180631 [0,2,0,0,0,0|0,0,2]=4 697 B10R1.20 COC1=C(CO)C=CC=C1 1778903 [0,2,0,0,0,0|0,0,0]=2 698 B10R1.20 COC1=C(OC)C=CC=C1 2827242 [0,2,0,0,0,0|2,0,0]=4 699 B10R1.20 COC1=CC=CC=C1NN 5009392 [0,2,0,0,0,0|2,0,0]=4 700 B10R1.20 CSC1=C(CCl)C=CC=C1 7020542491 [0,2,0,0,0,0|1,0,0]=3 701 B10R1.20 CSC1=C(CO)C=CC=C1 7020542492 [0,2,0,0,0,0|0,0,0]=2 702 B10R1.20 ClCC1=C(CCl)C=CC=C1 2837943 [0,2,0,0,0,0|1,0,0]=3 703 B10R1.20 N#CC1=C(CCl)C=CC=C1 2829304 [0,2,0,0,0,0|1,0,0]=3 704 B10R1.20 N#CC1=CC=CC=C1CBr 7212550795 [0,2,0,0,0,0|1,0,0]=3 705 B10R1.245 CC1=CC=CC(C)=C1CCl 2048808 [0,2,0,0,0,0|1,0,0]=3 706 B10R1.245 ClCC1=C(Cl)C=CC=C1Cl 2961678 [0,2,0,0,0,0|1,0,0]=3 707 B10R1.245 FC1=CC=CC(Cl)=C1CCl 2849004 [0,2,0,0,0,0|1,0,0]=3 708 B10R1.245 N#CC1=C(Cl)C=CC=C1Cl 2845093 [0,2,0,0,0,0|1,0,1]=4 709 B10R1.245 N#CC1=C(F)C=CC=C1F 22430497 [0,2,0,0,0,0|1,0,1]=4 710 B10R1.245 O=CC1=C(Br)C=CC=C1O 5918061 [0,2,0,0,0,0|0,0,2]=4 711 B10R1.245 O=CC1=C(Cl)C=CC=C1Cl 7014250488 [0,2,0,0,0,0|0,0,2]=4 712 B10R1.245 O=CC1=C(Cl)C=CC=C1F 7018801953 [0,2,0,0,0,0|0,0,2]=4 713 B10R2.6 C1=CC=C(C2CN2)C=C1 4194135 [0,1,0,1,0,0|1,0,0]=3 714 B10R2.6 C1=CC=C(C2CO2)C=C1 1205184 [0,1,0,1,0,0|0,0,0]=2 715 B10R2.7 C1=CC2=C(C=C1)NCC2 2826118 [0,1,0,1,0,0|1,0,0]=3 716 B10R2.7 C1=CC2=C(C=C1)OCC2 2826125 [0,1,0,1,0,0|0,0,0]=2 717 B10R2.7 C1=CC2=NSN=C2C=C1 7020556981 [0,1,0,1,0,0|1,1,0]=4 718 B10R2.7 C1=CC=C2CCCC2=C1 1778681 [0,1,0,1,0,0|1,0,0]=3 719 B10R2.7 C1=CC=C2CNCC2=C1 2087229 [0,1,0,1,0,0|1,0,0]=3 720 B10R2.7 C1=CC=C2N=S=NC2=C1 7017520014 [0,1,0,1,0,0|1,1,0]=4 721 B10R2.7 C1=CC=C2NC=CC2=C1 2826038 [0,1,0,1,0,0|1,0,1]=4 722 B10R2.7 C1=CC=C2NC=NC2=C1 1234652 [0,1,0,1,0,0|1,0,1]=4 723 B10R2.7 C1=CC=C2NN=CC2=C1 1435639 [0,1,0,1,0,0|1,0,1]=4 724 B10R2.7 C1=CC=C2NN=NC2=C1 2030889 [0,1,0,1,0,0|2,0,0]=4 725 B10R2.7 C1=CC=C2OCOC2=C1 2826166 [0,1,0,1,0,0|0,0,0]=2 726 B6R1.2 BrC1=CC=CS1 1362078 [1,0,0,0,1,0|2,0,0]=4 727 B6R1.2 BrC1=CSC=C1 1362079 [1,0,0,0,1,0|2,0,0]=4 728 B6R1.2 CC1=CC=CO1 2825319 [1,0,0,0,1,0|1,0,0]=3 729 B6R1.2 CC1=CC=CS1 2825522 [1,0,0,0,1,0|1,0,0]=3 730 B6R1.2 CC1=CC=NN1 5009700 [1,0,0,0,1,0|2,0,0]=4 731 B6R1.2 CC1=CN=CN1 22430348 [1,0,0,0,1,0|2,0,0]=4 732 B6R1.2 CC1=CSC=C1 2816743 [1,0,0,0,1,0|1,0,0]=3 733 B6R1.2 CC1=CSC=N1 1287022 [1,0,0,0,1,0|2,0,0]=4 734 B6R1.2 CC1=NC=CN1 2825323 [1,0,0,0,1,0|2,0,0]=4 735 B6R1.2 CC1=NNC=C1 2816612 [1,0,0,0,1,0|2,0,0]=4 736 B6R1.2 CN1C=CC=C1 2825317 [1,0,0,0,1,0|1,0,0]=3 737 B6R1.2 CN1C=CN=C1 2825324 [1,0,0,0,1,0|2,0,0]=4 738 B6R1.2 ClC1=CC=CS1 2826105 [1,0,0,0,1,0|2,0,0]=4