0 B10R1.13 C=C(C)C1=CC=C(F)C=C1 002236 [0,0,0,0,0,0|1,0,2]=3 1 B10R1.13 C=C(C)C1=CC=C(O)C=C1 242991 [0,0,0,0,0,0|1,0,2]=3 2 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 002964 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 068433 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.13 CC(=O)C1=CC=C(C)C=C1 075950 [0,0,0,0,0,0|1,0,1]=2 5 B10R1.13 CC(=O)C1=CC=C(C)N=C1 024495 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 003111 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 046158 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.13 CC(=O)C1=CC=C(F)C=C1 001621 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.13 CC(=O)C1=CC=C(I)C=C1 003065 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.13 CC(=O)C1=CC=C(I)C=C1 147401 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.13 CC(=O)C1=CC=C(N)C=C1 009865 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.13 CC(=O)C1=CC=C(O)C=C1 097596 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.13 CC(=O)C1=NC=C(O)C=C1 242217 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 CC(C)C1=CC=C(Br)C=C1 005332 [0,0,0,0,0,0|1,0,0]=1 15 B10R1.13 CC(C)C1=CC=C(I)C=C1 037613 [0,0,0,0,0,0|1,0,0]=1 16 B10R1.13 CC(C)C1=CC=C(N)C=C1 044718 [0,0,0,0,0,0|1,0,0]=1 17 B10R1.13 CC(C)C1=CC=C(N)C=N1 064855 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.13 CC(C)C1=CC=C(O)C=C1 224632 [0,0,0,0,0,0|1,0,0]=1 19 B10R1.13 CC(C)C1=CC=C(S)C=C1 350400 [0,0,0,0,0,0|1,0,0]=1 20 B10R1.13 CC(C)C1=CN=C(N)C=C1 091535 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.13 CC(N)C1=CC=C(Br)C=C1 001101 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 065422 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.13 CC(O)C1=CC=C(Br)C=C1 001129 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 002971 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.13 CC(O)C1=CC=C(F)C=C1 001295 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.13 CC1=CC=C(B(O)O)C=C1 010854 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.13 CC1=CC=C(C(=N)N)C=C1 017242 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 099143 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.13 CC1=CC=C(C(=O)O)C=C1 094627 [0,0,0,0,0,0|2,0,1]=3 30 B10R1.13 CC1=CC=C(C(=O)O)C=N1 043432 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.13 CC1=CC=C(C(C)C)C=C1 048590 [0,0,0,0,0,0|0,0,0]=0 32 B10R1.13 CC1=CC=C(C(C)C)CC1 099689 [0,0,0,0,0,0|0,0,2]=2 33 B10R1.13 CC1=CC=C(C(C)N)C=C1 075281 [0,0,0,0,0,0|1,0,0]=1 34 B10R1.13 CC1=CC=C(C(C)O)C=C1 494146 [0,0,0,0,0,0|1,0,0]=1 35 B10R1.13 CC1=CC=C(C(C)O)C=N1 024704 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.13 CC1=CC=C(C(N)=O)C=C1 032746 [0,0,0,0,0,0|2,0,1]=3 37 B10R1.13 CC1=CC=C(C(N)=S)C=C1 021339 [0,0,0,0,0,0|2,0,1]=3 38 B10R1.13 CC1=CC=C(N(C)C)C=C1 013933 [0,0,0,0,0,0|1,0,0]=1 39 B10R1.13 CC1=CC=C(S(=O)O)C=C1 080223 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 227797 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.13 CC1=CC=C([N+](=O)[O-])C=C1 241128 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 050080 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.13 CC1=CN=C(N(C)C)C=C1 024710 [0,0,0,0,0,0|2,0,0]=2 44 B10R1.13 CN(C)C1=CC=C(Br)C=C1 001369 [0,0,0,0,0,0|2,0,0]=2 45 B10R1.13 CN(C)C1=CC=C(Br)N=N1 088791 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.13 CN(C)C1=CC=C(Cl)N=N1 038614 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.13 CN(C)C1=CC=C(F)C=C1 008560 [0,0,0,0,0,0|2,0,0]=2 48 B10R1.13 CN(C)C1=CC=C(N)C=C1 215686 [0,0,0,0,0,0|2,0,0]=2 49 B10R1.13 CN(C)C1=CC=C(N)C=C1 463347 [0,0,0,0,0,0|2,0,0]=2 50 B10R1.13 CN(C)C1=CC=C(O)C=C1 223309 [0,0,0,0,0,0|2,0,0]=2 51 B10R1.13 CN(C)C1=CC=C(S)C=C1 023125 [0,0,0,0,0,0|2,0,0]=2 52 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 342182 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 050269 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.13 FC(F)C1=CC=C(Br)C=C1 023880 [0,0,0,0,0,0|3,0,0]=3 55 B10R1.13 FC(F)C1=CC=C(Cl)C=C1 050225 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.13 FC(F)C1=CN=C(Br)C=C1 050313 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.13 FC(F)C1=CN=C(Cl)C=C1 099967 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.13 FC(F)C1=NC=C(Br)C=C1 229644 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.13 FC1=CC=C(C(F)F)C=C1 024452 [0,0,0,0,0,0|3,0,0]=3 60 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 049070 [0,0,0,0,0,0|3,0,1]=4 61 B10R1.13 N=C(N)C1=CC=C(F)C=C1 061506 [0,0,0,0,0,0|3,0,1]=4 62 B10R1.13 N=C(N)C1=CC=C(N)C=C1 092316 [0,0,0,0,0,0|3,0,1]=4 63 B10R1.13 N=C(N)C1=CC=C(O)C=C1 023564 [0,0,0,0,0,0|3,0,1]=4 64 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 044652 [0,0,0,0,0,0|3,0,1]=4 65 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 240110 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.13 NC(=O)C1=CC=C(F)C=C1 006181 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.13 NC(=O)C1=CC=C(I)C=C1 235780 [0,0,0,0,0,0|3,0,1]=4 68 B10R1.13 NC(=O)C1=CC=C(N)C=C1 018168 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.13 NC(=O)C1=CC=C(O)C=C1 002826 [0,0,0,0,0,0|3,0,1]=4 70 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 021311 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 021318 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.13 NC(=S)C1=CC=C(F)C=C1 021324 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.13 NC(=S)C1=CC=C(N)C=C1 021309 [0,0,0,0,0,0|3,0,1]=4 74 B10R1.13 NC(=S)C1=CC=C(O)C=C1 021328 [0,0,0,0,0,0|3,0,1]=4 75 B10R1.13 NC(=S)C1=CC=C(O)C=C1 097900 [0,0,0,0,0,0|3,0,1]=4 76 B10R1.13 NC1=CC=C(B(O)O)C=C1 046297 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.13 NC1=CC=C(C(=O)O)C=C1 046699 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 094623 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 013058 [0,0,0,0,0,0|3,0,1]=4 80 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 094475 [0,0,0,0,0,0|3,0,1]=4 81 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 001636 [0,0,0,0,0,0|3,0,1]=4 82 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 467163 [0,0,0,0,0,0|3,0,1]=4 83 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 109801 [0,0,0,0,0,0|3,0,1]=4 84 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 079616 [0,0,0,0,0,0|3,0,1]=4 85 B10R1.13 O=C(O)C1=CC=C(F)C=C1 001711 [0,0,0,0,0,0|3,0,1]=4 86 B10R1.13 O=C(O)C1=CC=C(I)C=C1 005464 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.13 O=C(O)C1=CC=C(O)C=C1 094430 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.13 O=C(O)C1=CC=C(S)C=C1 013962 [0,0,0,0,0,0|3,0,1]=4 89 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 012755 [0,0,0,0,0,0|3,0,1]=4 90 B10R1.13 O=S([O-])C1=CC=C(Cl)C=C1 005929 [0,0,0,0,0,0|4,0,0]=4 91 B10R1.13 O=S([O-])C1=CC=C(F)C=C1 005945 [0,0,0,0,0,0|4,0,0]=4 92 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 078591 [0,0,0,0,0,0|4,0,0]=4 93 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 240926 [0,0,0,0,0,0|4,0,0]=4 94 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 002698 [0,0,0,0,0,0|4,0,0]=4 95 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 211968 [0,0,0,0,0,0|4,0,0]=4 96 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 097791 [0,0,0,0,0,0|4,0,0]=4 97 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 019486 [0,0,0,0,0,0|4,0,0]=4 98 B10R1.13 O=[N+]([O-])C1=CC=C([O-])C=C1 242860 [0,0,0,0,0,0|4,0,0]=4 99 B10R1.13 OB(O)C1=CC=C(Br)C=C1 010981 [0,0,0,0,0,0|4,0,0]=4 100 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 010986 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.13 OB(O)C1=CC=C(F)C=C1 006182 [0,0,0,0,0,0|4,0,0]=4 102 B10R1.13 OB(O)C1=CC=C(I)C=C1 011042 [0,0,0,0,0,0|4,0,0]=4 103 B10R1.13 OB(O)C1=CC=C(O)C=C1 078611 [0,0,0,0,0,0|4,0,0]=4 104 B10R1.13 OB(O)C1=CC=C(S)C=C1 092799 [0,0,0,0,0,0|4,0,0]=4 105 B9R1.1 BrCC1=CC=C(Br)C=C1 001368 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.1 BrCC1=CC=C(I)C=C1 018740 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.1 C#CC1=CC=C(Br)C=C1 040352 [1,0,0,0,0,0|1,0,2]=4 108 B9R1.1 C#CC1=CC=C(C)C=C1 040031 [1,0,0,0,0,0|0,0,2]=3 109 B9R1.1 C#CC1=CC=C(Cl)C=C1 040093 [1,0,0,0,0,0|1,0,2]=4 110 B9R1.1 C#CC1=CC=C(F)C=C1 008808 [1,0,0,0,0,0|1,0,2]=4 111 B9R1.1 C#CC1=CC=C(N)C=C1 045242 [1,0,0,0,0,0|1,0,2]=4 112 B9R1.1 C(=O)C1=CC=C(Br)C=C1 005082 [1,0,0,0,0,0|2,0,1]=4 113 B9R1.1 C(=O)C1=CC=C(F)C=C1 001460 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.1 C=CC1=CC=C(Br)C=C1 001138 [1,0,0,0,0,0|1,0,2]=4 115 B9R1.1 C=CC1=CC=C(C)C=C1 236761 [1,0,0,0,0,0|0,0,2]=3 116 B9R1.1 C=CC1=CC=C(Cl)C=C1 001267 [1,0,0,0,0,0|1,0,2]=4 117 B9R1.1 C=CC1=CC=C(F)C=C1 001296 [1,0,0,0,0,0|1,0,2]=4 118 B9R1.1 C=CC1=CC=C(N)C=C1 001223 [1,0,0,0,0,0|1,0,2]=4 119 B9R1.1 C=CC1=CC=C(O)C=C1 240601 [1,0,0,0,0,0|1,0,2]=4 120 B9R1.1 CC1=CC=C(C#N)C=C1 035883 [1,0,0,0,0,0|1,0,1]=3 121 B9R1.1 CC1=CC=C(C=O)C=C1 236923 [1,0,0,0,0,0|1,0,1]=3 122 B9R1.1 CC1=CC=C(CBr)C=C1 227793 [1,0,0,0,0,0|1,0,0]=2 123 B9R1.1 CC1=CC=C(CCl)C=C1 088360 [1,0,0,0,0,0|1,0,0]=2 124 B9R1.1 CC1=CC=C(CN)C=C1 078842 [1,0,0,0,0,0|1,0,0]=2 125 B9R1.1 CC1=CC=C(CO)C=C1 216000 [1,0,0,0,0,0|1,0,0]=2 126 B9R1.1 CC1=CC=C(NN)C=C1 043499 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.1 CC1=CC=C(NN)C=C1 043656 [1,0,0,0,0,0|2,0,0]=3 128 B9R1.1 CC1=CN=C(C#N)C=C1 024687 [1,0,0,0,0,0|2,0,1]=4 129 B9R1.1 CC1=CN=C(CN)C=N1 009009 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.1 CC1=NC=C(C#N)C=C1 003363 [1,0,0,0,0,0|2,0,1]=4 131 B9R1.1 CCC1=CC=C(Br)C=C1 001119 [1,0,0,0,0,0|1,0,0]=2 132 B9R1.1 CCC1=CC=C(C)C=C1 235264 [1,0,0,0,0,0|0,0,0]=1 133 B9R1.1 CCC1=CC=C(Cl)C=C1 001266 [1,0,0,0,0,0|1,0,0]=2 134 B9R1.1 CCC1=CC=C(F)C=C1 018681 [1,0,0,0,0,0|1,0,0]=2 135 B9R1.1 CCC1=CC=C(I)C=C1 006113 [1,0,0,0,0,0|1,0,0]=2 136 B9R1.1 CCC1=CC=C(N)C=C1 099641 [1,0,0,0,0,0|1,0,0]=2 137 B9R1.1 CCC1=CC=C(O)C=C1 241020 [1,0,0,0,0,0|1,0,0]=2 138 B9R1.1 CCC1=CC=[N+]([O-])C=C1 180055 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.1 CCC1=CN=C(C)C=C1 222089 [1,0,0,0,0,0|1,0,0]=2 140 B9R1.1 CCC1=CN=C(Cl)N=C1 045001 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.1 CCC1=NC=C(Br)C=C1 077907 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.1 CCC1=NC=C(C)N=C1 225679 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.1 CNC1=CC=C(Br)C=C1 009647 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.1 CNC1=CC=C(C)C=C1 009655 [1,0,0,0,0,0|1,0,0]=2 145 B9R1.1 CNC1=CC=C(Cl)C=C1 009650 [1,0,0,0,0,0|2,0,0]=3 146 B9R1.1 CNC1=CC=C(F)C=C1 009651 [1,0,0,0,0,0|2,0,0]=3 147 B9R1.1 CNC1=CC=C(O)C=C1 102940 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.1 CNC1=NC=C(Br)C=C1 078710 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.1 CNC1=NC=C(Cl)C=C1 075169 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.1 COC1=CC=C(Br)C=C1 BR1023 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.1 COC1=CC=C(C)C=C1 239388 [1,0,0,0,0,0|1,0,0]=2 152 B9R1.1 COC1=CC=C(Cl)C=C1 080276 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.1 COC1=CC=C(F)C=C1 001698 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.1 COC1=CC=C(I)C=C1 001304 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.1 COC1=CC=C(N)C=C1 043321 [1,0,0,0,0,0|2,0,0]=3 156 B9R1.1 COC1=CC=C(O)C=C1 078679 [1,0,0,0,0,0|2,0,0]=3 157 B9R1.1 COC1=CC=C(S)C=C1 001774 [1,0,0,0,0,0|2,0,0]=3 158 B9R1.1 COC1=CC=[N+]([O-])C=C1 102569 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.1 COC1=CN=C(Br)C=C1 076484 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.1 COC1=CN=C(N)C=C1 036797 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.1 COC1=NC=C(Br)C=C1 023910 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.1 COC1=NC=C(Cl)C=C1 035854 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.1 COC1=NC=C(F)C=C1 033260 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.1 COC1=NC=C(N)C=C1 024176 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.1 COC1=NC=C(O)C=C1 076684 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.1 CSC1=CC=C(Br)C=C1 003696 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.1 CSC1=CC=C(C)C=C1 001781 [1,0,0,0,0,0|1,0,0]=2 168 B9R1.1 CSC1=CC=C(Cl)C=C1 002972 [1,0,0,0,0,0|2,0,0]=3 169 B9R1.1 CSC1=CC=C(F)C=C1 003730 [1,0,0,0,0,0|2,0,0]=3 170 B9R1.1 CSC1=CC=C(I)C=C1 008044 [1,0,0,0,0,0|2,0,0]=3 171 B9R1.1 CSC1=CC=C(N)C=C1 003091 [1,0,0,0,0,0|2,0,0]=3 172 B9R1.1 CSC1=CC=C(N)C=C1 104919 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.1 CSC1=CC=C(O)C=C1 003883 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.1 C[N+]1=CC=C(C#N)C=C1 181502 [1,0,0,0,0,0|2,0,1]=4 175 B9R1.1 ClC1=CC=C(CBr)C=C1 118700 [1,0,0,0,0,0|2,0,0]=3 176 B9R1.1 ClC1=CC=C([Mg]Br)C=C1 102566 [1,0,0,0,0,0|3,0,0]=4 177 B9R1.1 ClCC1=CC=C(Br)C=C1 002483 [1,0,0,0,0,0|2,0,0]=3 178 B9R1.1 ClCC1=CC=C(Cl)C=C1 079221 [1,0,0,0,0,0|2,0,0]=3 179 B9R1.1 ClCC1=CN=C(Cl)C=C1 019460 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.1 FC1=CC=C(CBr)C=C1 002963 [1,0,0,0,0,0|2,0,0]=3 181 B9R1.1 FC1=CC=C(CCl)C=C1 006201 [1,0,0,0,0,0|2,0,0]=3 182 B9R1.1 FC1=CC=C(CS)C=C1 006206 [1,0,0,0,0,0|2,0,0]=3 183 B9R1.1 N#CC1=CC=C(Br)C=C1 002988 [1,0,0,0,0,0|2,0,1]=4 184 B9R1.1 N#CC1=CC=C(Cl)C=C1 035205 [1,0,0,0,0,0|2,0,1]=4 185 B9R1.1 N#CC1=CC=C(F)C=C1 002237 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.1 N#CC1=CC=C(I)C=C1 147902 [1,0,0,0,0,0|2,0,1]=4 187 B9R1.1 N#CC1=CC=C(N)C=C1 024179 [1,0,0,0,0,0|2,0,1]=4 188 B9R1.1 N#CC1=CC=C(O)C=C1 003632 [1,0,0,0,0,0|2,0,1]=4 189 B9R1.1 NC1=CC=C(CO)C=C1 092096 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.1 NC1=CC=C(CO)C=N1 077326 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.1 NC1=CC=C(CO)C=N1 104746 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.1 NCC1=CC=C(Br)C=C1 042893 [1,0,0,0,0,0|2,0,0]=3 193 B9R1.1 NCC1=CC=C(Cl)C=C1 092218 [1,0,0,0,0,0|2,0,0]=3 194 B9R1.1 NCC1=CC=C(F)C=C1 006199 [1,0,0,0,0,0|2,0,0]=3 195 B9R1.1 NCC1=CC=C(O)C=C1 023452 [1,0,0,0,0,0|2,0,0]=3 196 B9R1.1 NCC1=CC=C(O)C=C1 047973 [1,0,0,0,0,0|2,0,0]=3 197 B9R1.1 NCC1=CN=C(Cl)C=C1 065444 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.1 NNC1=CC=C(Br)C=C1 024571 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.1 NNC1=CC=C(Br)C=C1 224144 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.1 NNC1=CC=C(Cl)C=C1 008962 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.1 NNC1=CC=C(Cl)C=C1 012720 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.1 NNC1=CC=C(F)C=C1 001712 [1,0,0,0,0,0|3,0,0]=4 203 B9R1.1 NNC1=CC=C(F)C=C1 043658 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.1 O=CC1=CC=C(Cl)C=C1 216307 [1,0,0,0,0,0|2,0,1]=4 205 B9R1.1 O=CC1=CC=C(I)C=C1 043849 [1,0,0,0,0,0|2,0,1]=4 206 B9R1.1 O=CC1=CC=C(O)C=C1 BR1235 [1,0,0,0,0,0|2,0,1]=4 207 B9R1.1 OCC1=CC=C(Br)C=C1 008822 [1,0,0,0,0,0|2,0,0]=3 208 B9R1.1 OCC1=CC=C(Cl)C=C1 008823 [1,0,0,0,0,0|2,0,0]=3 209 B9R1.1 OCC1=CC=C(F)C=C1 001624 [1,0,0,0,0,0|2,0,0]=3 210 B9R1.1 OCC1=CC=C(I)C=C1 093387 [1,0,0,0,0,0|2,0,0]=3 211 B9R1.1 OCC1=CC=C(O)C=C1 078884 [1,0,0,0,0,0|2,0,0]=3 212 B9R1.1 OCC1=CN=C(Cl)C=C1 067692 [1,0,0,0,0,0|3,0,0]=4 213 B9R1.1 OCC1=NC=C(Br)C=C1 036351 [1,0,0,0,0,0|3,0,0]=4 214 B9R1.1 SCC1=CC=C(Br)C=C1 024343 [1,0,0,0,0,0|2,0,0]=3 215 B9R1.1 SCC1=CC=C(Cl)C=C1 545320 [1,0,0,0,0,0|2,0,0]=3 216 B9R1.6 BrC(Br)C1=CC=CC=C1 243023 [1,0,0,0,0,0|2,0,0]=3 217 B9R1.6 C=C(C)C1=CC=CC=C1 245708 [1,0,0,0,0,0|0,0,2]=3 218 B9R1.6 CC(=O)C1=CC=CC=C1 043319 [1,0,0,0,0,0|1,0,1]=3 219 B9R1.6 CC(=O)C1=CC=CN=C1 032763 [1,0,0,0,0,0|2,0,1]=4 220 B9R1.6 CC(=O)C1=CC=NC=C1 033067 [1,0,0,0,0,0|2,0,1]=4 221 B9R1.6 CC(=O)C1=NC=CC=C1 044389 [1,0,0,0,0,0|2,0,1]=4 222 B9R1.6 CC(Br)C1=CC=CC=C1 001003 [1,0,0,0,0,0|1,0,0]=2 223 B9R1.6 CC(C)C1=CC=CC=C1 094649 [1,0,0,0,0,0|0,0,0]=1 224 B9R1.6 CC(C)C1=CC=NC=C1 024693 [1,0,0,0,0,0|1,0,0]=2 225 B9R1.6 CC(C)C1=NC=CC=C1 078691 [1,0,0,0,0,0|1,0,0]=2 226 B9R1.6 CC(N)C1=CC=CC=C1 208695 [1,0,0,0,0,0|1,0,0]=2 227 B9R1.6 CC(N)C1=CC=NC=C1 030534 [1,0,0,0,0,0|2,0,0]=3 228 B9R1.6 CC(N)C1=CC=NC=C1 097930 [1,0,0,0,0,0|2,0,0]=3 229 B9R1.6 CC(N)C1=CN=CC=C1 030750 [1,0,0,0,0,0|2,0,0]=3 230 B9R1.6 CC(N)C1=NC=CC=C1 060819 [1,0,0,0,0,0|2,0,0]=3 231 B9R1.6 CC(O)C1=CC=CC=C1 098924 [1,0,0,0,0,0|1,0,0]=2 232 B9R1.6 CC(O)C1=CC=CN=C1 094012 [1,0,0,0,0,0|2,0,0]=3 233 B9R1.6 CC(O)C1=NC=CC=C1 088389 [1,0,0,0,0,0|2,0,0]=3 234 B9R1.6 CN(C)C1=CC=CC=C1 098810 [1,0,0,0,0,0|1,0,0]=2 235 B9R1.6 CN(C)C1=CC=CN=C1 032574 [1,0,0,0,0,0|2,0,0]=3 236 B9R1.6 CN(C)C1=CC=NC=C1 001704 [1,0,0,0,0,0|2,0,0]=3 237 B9R1.6 CN(C)C1=CC=NC=C1 133700 [1,0,0,0,0,0|2,0,0]=3 238 B9R1.6 CN(C)C1=NC=CC=C1 219108 [1,0,0,0,0,0|2,0,0]=3 239 B9R1.6 CS(=O)C1=CC=CC=C1 180124 [1,0,0,0,0,0|2,0,0]=3 240 B9R1.6 C[C@@H](N)C1=CC=CC=C1 037431 [1,0,0,0,0,0|1,0,0]=2 241 B9R1.6 C[C@@H](N)C1=NC=CC=C1 078110 [1,0,0,0,0,0|2,0,0]=3 242 B9R1.6 C[C@@H](O)C1=CC=CC=C1 222634 [1,0,0,0,0,0|1,0,0]=2 243 B9R1.6 C[C@H](N)C1=CC=CC=C1 037432 [1,0,0,0,0,0|1,0,0]=2 244 B9R1.6 C[SiH](C)C1=CC=CC=C1 S13425 [1,0,0,0,0,0|0,1,0]=2 245 B9R1.6 C[SiH](Cl)C1=CC=CC=C1 S13525 [1,0,0,0,0,0|1,1,0]=3 246 B9R1.6 ClP(Cl)C1=CC=CC=C1 223201 [1,0,0,0,0,0|3,0,0]=4 247 B9R1.6 Cl[SiH](Cl)C1=CC=CC=C1 S13350 [1,0,0,0,0,0|2,1,0]=4 248 B9R1.6 FC(F)C1=CC=CC=C1 035819 [1,0,0,0,0,0|2,0,0]=3 249 B9R1.6 FC(F)C1=CC=CC=N1 050442 [1,0,0,0,0,0|3,0,0]=4 250 B9R1.6 FC(F)C1=CC=NC=C1 050447 [1,0,0,0,0,0|3,0,0]=4 251 B9R1.6 FC(F)C1=CN=CC=C1 050443 [1,0,0,0,0,0|3,0,0]=4 252 B9R1.6 N=C(N)C1=CC=CC=C1 044622 [1,0,0,0,0,0|2,0,1]=4 253 B9R1.6 N=C(N)C1=CC=CC=C1 067951 [1,0,0,0,0,0|2,0,1]=4 254 B9R1.6 N=C(N)C1=CC=CC=C1 099104 [1,0,0,0,0,0|2,0,1]=4 255 B9R1.6 N=C(N)C1=CC=CC=C1 102340 [1,0,0,0,0,0|2,0,1]=4 256 B9R1.6 NC(=O)C1=CC=CC=C1 099462 [1,0,0,0,0,0|2,0,1]=4 257 B9R1.6 NC(=S)C1=CC=CC=C1 067940 [1,0,0,0,0,0|2,0,1]=4 258 B9R1.6 O=C(Cl)C1=CC=CC=C1 097787 [1,0,0,0,0,0|2,0,1]=4 259 B9R1.6 O=C(Cl)C1=CC=CC=C1 102565 [1,0,0,0,0,0|2,0,1]=4 260 B9R1.6 O=C(O)C1=CC=CC=C1 102544 [1,0,0,0,0,0|2,0,1]=4 261 B9R1.6 O=C(O)C1=CC=CC=C1 237766 [1,0,0,0,0,0|2,0,1]=4 262 B9R1.6 O=C([O-])C1=CC=CC=C1 094455 [1,0,0,0,0,0|2,0,1]=4 263 B9R1.6 O=C([O-])C1=CC=CC=C1 095369 [1,0,0,0,0,0|2,0,1]=4 264 B9R1.6 O=C([O-])C1=CC=CC=C1 099144 [1,0,0,0,0,0|2,0,1]=4 265 B9R1.6 O=C([O-])C1=CC=CC=C1 239403 [1,0,0,0,0,0|2,0,1]=4 266 B9R1.6 O=S([O-])C1=CC=CC=C1 003814 [1,0,0,0,0,0|3,0,0]=4 267 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 094600 [1,0,0,0,0,0|3,0,0]=4 268 B9R1.6 O=[PH](O)C1=CC=CC=C1 003643 [1,0,0,0,0,0|3,0,0]=4 269 B9R1.6 O=[Se](O)C1=CC=CC=C1 005551 [1,0,0,0,0,0|3,0,0]=4 270 B9R1.6 OB(O)C1=CC=CC=C1 019491 [1,0,0,0,0,0|3,0,0]=4 271 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 045982 [0,1,0,0,0,0|1,0,2]=4 272 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 040138 [0,1,0,0,0,0|1,0,1]=3 273 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 078587 [0,1,0,0,0,0|1,0,2]=4 274 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 079582 [0,1,0,0,0,0|1,0,1]=3 275 B11R1.3 CC(C)C1=CC=C(C=O)C=C1 225406 [0,1,0,0,0,0|0,0,1]=2 276 B11R1.3 CC(C)C1=CC=C(CBr)C=C1 224006 [0,1,0,0,0,0|0,0,0]=1 277 B11R1.3 CC(C)C1=CC=C(CCl)C=C1 002476 [0,1,0,0,0,0|0,0,0]=1 278 B11R1.3 CC(C)C1=CC=C(CN)C=C1 060239 [0,1,0,0,0,0|0,0,0]=1 279 B11R1.3 CC(C)C1=CC=C(CO)C=C1 449201 [0,1,0,0,0,0|0,0,0]=1 280 B11R1.3 CCC1=CC=C(B(O)O)C=C1 010994 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 018679 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 065850 [0,1,0,0,0,0|2,0,1]=4 283 B11R1.3 CCC1=CC=C(C(N)=O)C=C1 104617 [0,1,0,0,0,0|2,0,1]=4 284 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 347738 [0,1,0,0,0,0|2,0,1]=4 285 B11R1.3 CN(C)C1=CC=C(C#N)C=C1 075129 [0,1,0,0,0,0|1,0,1]=3 286 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 093419 [0,1,0,0,0,0|1,0,1]=3 287 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 104102 [0,1,0,0,0,0|1,0,1]=3 288 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 105997 [0,1,0,0,0,0|1,0,1]=3 289 B11R1.3 CN(C)C1=CC=C(CN)C=C1 023603 [0,1,0,0,0,0|1,0,0]=2 290 B11R1.3 CN(C)C1=CC=C(CN)C=C1 092985 [0,1,0,0,0,0|1,0,0]=2 291 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 235735 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 003432 [0,1,0,0,0,0|3,0,0]=4 293 B11R1.3 COC1=CC=C(B(O)O)C=C1 003422 [0,1,0,0,0,0|3,0,0]=4 294 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 098865 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.3 COC1=CC=C(C(=O)O)C=C1 065743 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.3 COC1=CC=C(C(C)=O)C=C1 043293 [0,1,0,0,0,0|1,0,1]=3 297 B11R1.3 COC1=CC=C(C(C)=O)C=N1 046159 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.3 COC1=CC=C(C(C)C)C=C1 225759 [0,1,0,0,0,0|0,0,0]=1 299 B11R1.3 COC1=CC=C(C(C)N)C=C1 030158 [0,1,0,0,0,0|1,0,0]=2 300 B11R1.3 COC1=CC=C(C(C)O)C=C1 002977 [0,1,0,0,0,0|1,0,0]=2 301 B11R1.3 COC1=CC=C(C(N)=O)C=C1 240987 [0,1,0,0,0,0|2,0,1]=4 302 B11R1.3 COC1=CC=C(C(N)=S)C=C1 021331 [0,1,0,0,0,0|2,0,1]=4 303 B11R1.3 COC1=CC=C(C(N)=S)C=C1 097901 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.3 COC1=CC=C(N(C)C)C=C1 330113 [0,1,0,0,0,0|1,0,0]=2 305 B11R1.3 COC1=CC=C([C@@H](C)N)C=C1 042889 [0,1,0,0,0,0|1,0,0]=2 306 B11R1.3 COC1=CC=C([C@@H](C)N)C=C1 210022 [0,1,0,0,0,0|1,0,0]=2 307 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 040169 [0,1,0,0,0,0|1,0,0]=2 308 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 209126 [0,1,0,0,0,0|3,0,0]=4 309 B11R1.3 CSC1=CC=C(B(O)O)C=C1 011008 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 023852 [0,1,0,0,0,0|1,0,1]=3 311 B11R1.3 CSC1=CC=C(C(N)=S)C=C1 097883 [0,1,0,0,0,0|2,0,1]=4 312 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 214679 [0,1,0,0,0,0|2,0,1]=4 313 B11R1.3 NCC1=CC=C(B(O)O)C=C1 011014 [0,1,0,0,0,0|3,0,0]=4 314 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 077969 [0,1,0,0,0,0|2,0,1]=4 315 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 358361 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 019226 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 091971 [0,1,0,0,0,0|2,0,1]=4 318 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 M02899 [0,1,0,0,0,0|2,0,1]=4 319 B11R1.3 O=[N+]([O-])C1=CC=C(CBr)C=C1 160600 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.3 O=[N+]([O-])C1=CC=C(CCl)C=C1 160700 [0,1,0,0,0,0|3,0,0]=4 321 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 005177 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 011020 [0,1,0,0,0,0|3,0,0]=4 323 B11R1.3 OCC1=CC=C(B(O)O)C=C1 016259 [0,1,0,0,0,0|3,0,0]=4 324 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 001068 [0,1,0,0,0,0|1,0,0]=2 325 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 008026 [0,1,0,0,0,0|1,0,0]=2 326 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 008862 [0,1,0,0,0,0|1,0,0]=2 327 B11R1.19 CC(C)(C)C1=CC=C(O)C=C1 079474 [0,1,0,0,0,0|1,0,0]=2 328 B11R1.19 CC(C)(C)C1=CC=C(S)C=C1 023117 [0,1,0,0,0,0|1,0,0]=2 329 B11R1.19 CC(C)(O)C1=CC=C(F)C=C1 006339 [0,1,0,0,0,0|1,0,0]=2 330 B11R1.19 CC1=CC=C(C(C)(C)C)C=C1 241245 [0,1,0,0,0,0|0,0,0]=1 331 B11R1.19 CC1=CC=C(C(F)(F)F)C=C1 009277 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.19 CC1=CC=C(S(=O)(=O)Cl)C=C1 BR1703 [0,1,0,0,0,0|3,0,0]=4 333 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 075220 [0,1,0,0,0,0|3,0,0]=4 334 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 078111 [0,1,0,0,0,0|3,0,0]=4 335 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 103736 [0,1,0,0,0,0|3,0,0]=4 336 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 234166 [0,1,0,0,0,0|3,0,0]=4 337 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 009219 [0,1,0,0,0,0|3,0,0]=4 338 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 044338 [0,1,0,0,0,0|3,0,0]=4 339 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 106672 [0,1,0,0,0,0|3,0,0]=4 340 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 181979 [0,1,0,0,0,0|3,0,0]=4 341 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 183243 [0,1,0,0,0,0|3,0,0]=4 342 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 464560 [0,1,0,0,0,0|3,0,0]=4 343 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 001316 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.19 CC1=CC=C(S(N)(=O)=O)C=C1 216546 [0,1,0,0,0,0|3,0,0]=4 345 B11R1.19 CC1=CC=C([Si](C)(C)C)C=C1 S16675 [0,1,0,0,0,0|0,1,0]=2 346 B11R1.19 CC1=NC=C(C(F)(F)F)C=C1 038151 [0,1,0,0,0,0|3,0,0]=4 347 B11R1.19 CS(=O)(=O)C1=CC=C(Br)C=C1 003695 [0,1,0,0,0,0|3,0,0]=4 348 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 001765 [0,1,0,0,0,0|3,0,0]=4 349 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=C1 032697 [0,1,0,0,0,0|3,0,0]=4 350 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 023361 [0,1,0,0,0,0|3,0,0]=4 351 B11R1.19 ClC1=CC=C(C(Cl)(Cl)Cl)C=C1 216548 [0,1,0,0,0,0|3,0,0]=4 352 B11R1.19 FC(F)(F)C1=CC=C(Br)C=C1 002195 [0,1,0,0,0,0|3,0,0]=4 353 B11R1.19 FC(F)(F)C1=CC=C(Cl)C=C1 003148 [0,1,0,0,0,0|3,0,0]=4 354 B11R1.19 FC(F)(F)C1=CC=C(I)C=C1 001196 [0,1,0,0,0,0|3,0,0]=4 355 B11R1.19 FC(F)(F)C1=CC=C(S)C=C1 002622 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.19 FC1=CC=C(C(Cl)(Cl)Cl)C=C1 006194 [0,1,0,0,0,0|3,0,0]=4 357 B11R1.19 FC1=CC=C(C(F)(F)F)C=C1 002238 [0,1,0,0,0,0|3,0,0]=4 358 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 001401 [0,1,0,0,0,0|3,0,0]=4 359 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 013906 [0,1,0,0,0,0|3,0,0]=4 360 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 010205 [0,1,0,0,0,0|2,0,1]=4 361 B11R1.21 CC(=O)C1=CC(C)=C(O)C=C1 024848 [0,1,0,0,0,0|2,0,1]=4 362 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 004415 [0,1,0,0,0,0|2,0,1]=4 363 B11R1.21 CC(=O)C1=CC(F)=C(C)C=C1 005782 [0,1,0,0,0,0|1,0,1]=3 364 B11R1.21 CC(=O)C1=CC(F)=C(Cl)C=C1 013798 [0,1,0,0,0,0|2,0,1]=4 365 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 002078 [0,1,0,0,0,0|2,0,1]=4 366 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 013006 [0,1,0,0,0,0|2,0,1]=4 367 B11R1.21 CC(=O)C1=CC=C(Cl)C(Cl)=C1 036036 [0,1,0,0,0,0|2,0,1]=4 368 B11R1.21 CC(=O)C1=CC=C(O)C(O)=C1 002544 [0,1,0,0,0,0|2,0,1]=4 369 B11R1.21 CC(C)C1=CC=C(N)C(Br)=C1 018287 [0,1,0,0,0,0|1,0,0]=2 370 B11R1.21 CC(N)C1=CC=C(F)C(F)=C1 013306 [0,1,0,0,0,0|2,0,0]=3 371 B11R1.21 CC(O)C1=CC(Br)=C(F)C=C1 237650 [0,1,0,0,0,0|2,0,0]=3 372 B11R1.21 CC(O)C1=CC(F)=C(Cl)C=C1 033039 [0,1,0,0,0,0|2,0,0]=3 373 B11R1.21 CC1=C(Br)C=C(C(=O)Cl)C=C1 014697 [0,1,0,0,0,0|2,0,1]=4 374 B11R1.21 CC1=C(Br)C=C(C(N)=O)C=C1 094072 [0,1,0,0,0,0|2,0,1]=4 375 B11R1.21 CC1=C(Br)C=C([N+](=O)[O-])C=C1 001370 [0,1,0,0,0,0|3,0,0]=4 376 B11R1.21 CC1=C(C)C=C(B(O)O)C=C1 045282 [0,1,0,0,0,0|3,0,0]=4 377 B11R1.21 CC1=C(C)C=C(C(=O)Cl)C=C1 014686 [0,1,0,0,0,0|2,0,1]=4 378 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 044555 [0,1,0,0,0,0|2,0,1]=4 379 B11R1.21 CC1=C(Cl)C=C(C(=O)Cl)C=C1 062744 [0,1,0,0,0,0|2,0,1]=4 380 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 120215 [0,1,0,0,0,0|2,0,1]=4 381 B11R1.21 CC1=C(F)C=C(B(O)O)C=C1 032499 [0,1,0,0,0,0|3,0,0]=4 382 B11R1.21 CC1=C(F)C=C(C(=O)Cl)C=C1 005791 [0,1,0,0,0,0|2,0,1]=4 383 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 001468 [0,1,0,0,0,0|2,0,1]=4 384 B11R1.21 CC1=C(F)C=C(C(N)=O)C=C1 005786 [0,1,0,0,0,0|2,0,1]=4 385 B11R1.21 CC1=C(F)C=C([N+](=O)[O-])C=C1 001186 [0,1,0,0,0,0|3,0,0]=4 386 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 013858 [0,1,0,0,0,0|2,0,1]=4 387 B11R1.21 CC1=C(I)C=C([N+](=O)[O-])C=C1 149200 [0,1,0,0,0,0|3,0,0]=4 388 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 047883 [0,1,0,0,0,0|2,0,1]=4 389 B11R1.21 CC1=C(N)C=C([N+](=O)[O-])C=C1 038255 [0,1,0,0,0,0|3,0,0]=4 390 B11R1.21 CC1=CC=C(B(O)O)C=C1Cl 045266 [0,1,0,0,0,0|3,0,0]=4 391 B11R1.21 CC1=CC=C(C(=N)N)C=C1F 008342 [0,1,0,0,0,0|2,0,1]=4 392 B11R1.21 CC1=CC=C(C(=O)O)C=C1Br 075171 [0,1,0,0,0,0|2,0,1]=4 393 B11R1.21 CC1=CC=C(C(C)C)C=C1O 226523 [0,1,0,0,0,0|0,0,0]=1 394 B11R1.21 CC1=CC=C(C(N)=O)C=C1C 091232 [0,1,0,0,0,0|2,0,1]=4 395 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1C 227721 [0,1,0,0,0,0|3,0,0]=4 396 B11R1.21 FC(F)C1=CC(Br)=C(Cl)C=C1 075297 [0,1,0,0,0,0|3,0,0]=4 397 B11R1.21 FC(F)C1=CC(Cl)=C(Br)C=C1 075296 [0,1,0,0,0,0|3,0,0]=4 398 B11R1.21 FC1=C(Br)C=C(C(F)F)C=C1 032702 [0,1,0,0,0,0|3,0,0]=4 399 B11R1.21 FC1=C(Br)C=CC(C(F)F)=C1 099005 [0,1,0,0,0,0|3,0,0]=4 400 B11R1.21 FC1=C(Cl)C=C(C(F)F)C=C1 094660 [0,1,0,0,0,0|3,0,0]=4 401 B11R1.21 FC1=C(Cl)C=CC(C(F)F)=C1 094663 [0,1,0,0,0,0|3,0,0]=4 402 B11R1.21 FC1=C(F)C=C(C(F)F)C=C1 099065 [0,1,0,0,0,0|3,0,0]=4 403 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 215518 [0,1,0,0,0,0|1,0,1]=3 404 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 079491 [0,1,0,0,0,0|1,0,1]=3 405 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 019003 [0,1,0,0,0,0|2,0,1]=4 406 B11R1.22 CC1=CC=C(C(=O)NO)C=C1 180190 [0,1,0,0,0,0|2,0,1]=4 407 B11R1.22 CC1=CC=C(\C(C)=N\O)C=C1 075282 [0,1,0,0,0,0|1,0,1]=3 408 B11R1.22 CC1=CC=C(\C(N)=N\O)C=C1 017316 [0,1,0,0,0,0|2,0,1]=4 409 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 001001 [0,1,0,0,0,0|2,0,1]=4 410 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 216656 [0,1,0,0,0,0|1,0,1]=3 411 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 025639 [0,1,0,0,0,0|2,0,1]=4 412 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 001190 [0,1,0,0,0,0|2,0,1]=4 413 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 078553 [0,1,0,0,0,0|2,0,1]=4 414 B11R1.22 CCC(C)C1=CC=C(O)C=C1 098816 [0,1,0,0,0,0|1,0,0]=2 415 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 091217 [0,1,0,0,0,0|2,0,1]=4 416 B11R1.22 CNC(=O)C1=CC=C(C)C=C1 342068 [0,1,0,0,0,0|1,0,1]=3 417 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 105214 [0,1,0,0,0,0|2,0,1]=4 418 B11R1.22 CNC(=O)C1=CC=C(F)C=C1 033236 [0,1,0,0,0,0|2,0,1]=4 419 B11R1.22 CNC(=O)C1=CC=C(I)C=C1 102872 [0,1,0,0,0,0|2,0,1]=4 420 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 236709 [0,1,0,0,0,0|2,0,1]=4 421 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 078890 [0,1,0,0,0,0|2,0,1]=4 422 B11R1.22 COC(=O)C1=CC=C(C)C=C1 349109 [0,1,0,0,0,0|1,0,1]=3 423 B11R1.22 COC(=O)C1=CC=C(C)N=C1 024182 [0,1,0,0,0,0|2,0,1]=4 424 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 018826 [0,1,0,0,0,0|2,0,1]=4 425 B11R1.22 COC(=O)C1=CC=C(F)C=C1 006802 [0,1,0,0,0,0|2,0,1]=4 426 B11R1.22 COC(=O)C1=CC=C(I)C=C1 079685 [0,1,0,0,0,0|2,0,1]=4 427 B11R1.22 COC(=O)C1=CC=C(N)C=C1 035825 [0,1,0,0,0,0|2,0,1]=4 428 B11R1.22 COC(=O)C1=CC=C(O)C=C1 209090 [0,1,0,0,0,0|2,0,1]=4 429 B11R1.22 COC(=O)C1=CC=[N+](C)C=C1 182137 [0,1,0,0,0,0|2,0,1]=4 430 B11R1.22 COC(=O)C1=NC=C(C)C=C1 209069 [0,1,0,0,0,0|2,0,1]=4 431 B11R1.22 N#CC(N)C1=CC=C(F)C=C1 007824 [0,1,0,0,0,0|2,0,1]=4 432 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 219256 [0,1,0,0,0,0|2,0,1]=4 433 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 030636 [0,1,0,0,0,0|2,0,1]=4 434 B11R1.22 NCC(O)C1=CC=C(O)C=C1 375146 [0,1,0,0,0,0|2,0,0]=3 435 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 001372 [0,1,0,0,0,0|2,0,1]=4 436 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 036379 [0,1,0,0,0,0|2,0,1]=4 437 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 018027 [0,1,0,0,0,0|2,0,1]=4 438 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 221680 [0,1,0,0,0,0|2,0,1]=4 439 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 219727 [0,1,0,0,0,0|2,0,1]=4 440 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 001629 [0,1,0,0,0,0|2,0,1]=4 441 B11R1.22 O=C(CF)C1=CC=C(O)C=C1 009465 [0,1,0,0,0,0|2,0,1]=4 442 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 002686 [0,1,0,0,0,0|2,0,1]=4 443 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 037365 [0,1,0,0,0,0|2,0,1]=4 444 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 013255 [0,1,0,0,0,0|2,0,1]=4 445 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 009204 [0,1,0,0,0,0|2,0,1]=4 446 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 003064 [0,1,0,0,0,0|2,0,1]=4 447 B11R1.166 CC(=O)C1=CC=C(Br)C=C1O 078418 [0,1,0,0,0,0|2,0,1]=4 448 B11R1.166 CC(=O)C1=CC=C(C)C=C1F 241915 [0,1,0,0,0,0|1,0,1]=3 449 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Br 011300 [0,1,0,0,0,0|2,0,1]=4 450 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1O 225820 [0,1,0,0,0,0|2,0,1]=4 451 B11R1.166 CC(=O)C1=CC=C(F)C=C1F 001914 [0,1,0,0,0,0|2,0,1]=4 452 B11R1.166 CC(=O)C1=CC=C(O)C=C1Br 210897 [0,1,0,0,0,0|2,0,1]=4 453 B11R1.166 CC(=O)C1=CC=C(O)C=C1O 209091 [0,1,0,0,0,0|2,0,1]=4 454 B11R1.166 CC(N)C1=CC=C(F)C=C1F 080255 [0,1,0,0,0,0|2,0,0]=3 455 B11R1.166 CC(O)C1=C(Cl)C=C(F)C=C1 013804 [0,1,0,0,0,0|2,0,0]=3 456 B11R1.166 CC(O)C1=C(F)C=C(Cl)C=C1 033065 [0,1,0,0,0,0|2,0,0]=3 457 B11R1.166 CC(O)C1=C(F)C=C(F)C=C1 103224 [0,1,0,0,0,0|2,0,0]=3 458 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 018293 [0,1,0,0,0,0|2,0,1]=4 459 B11R1.166 CC1=CC(Br)=C(C(N)=O)C=C1 102871 [0,1,0,0,0,0|2,0,1]=4 460 B11R1.166 CC1=CC(Br)=C(C(N)=S)C=C1 045086 [0,1,0,0,0,0|2,0,1]=4 461 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 044544 [0,1,0,0,0,0|2,0,1]=4 462 B11R1.166 CC1=CC(F)=C(C(=O)Cl)C=C1 062680 [0,1,0,0,0,0|2,0,1]=4 463 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 037151 [0,1,0,0,0,0|2,0,1]=4 464 B11R1.166 CC1=CC(F)=C(C(N)=O)C=C1 342633 [0,1,0,0,0,0|2,0,1]=4 465 B11R1.166 CC1=CC(F)=C([N+](=O)[O-])C=C1 002352 [0,1,0,0,0,0|3,0,0]=4 466 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 033235 [0,1,0,0,0,0|2,0,1]=4 467 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 024518 [0,1,0,0,0,0|2,0,1]=4 468 B11R1.166 CC1=CC=C(B(O)O)C(C)=C1 045279 [0,1,0,0,0,0|3,0,0]=4 469 B11R1.166 CC1=CC=C(C(=O)Cl)C(C)=C1 014685 [0,1,0,0,0,0|2,0,1]=4 470 B11R1.166 CC1=CC=C(C(=O)Cl)C(Cl)=C1 038125 [0,1,0,0,0,0|2,0,1]=4 471 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=C1 038124 [0,1,0,0,0,0|2,0,1]=4 472 B11R1.166 CC1=CC=C(C(C)C)C(O)=C1 227085 [0,1,0,0,0,0|0,0,0]=1 473 B11R1.166 CC1=CC=C(C(N)=O)C(C)=C1 091230 [0,1,0,0,0,0|2,0,1]=4 474 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Cl)=C1 079224 [0,1,0,0,0,0|3,0,0]=4 475 B11R1.166 CC1=CC=C([N+](=O)[O-])C(N)=C1 092959 [0,1,0,0,0,0|3,0,0]=4 476 B11R1.166 CC1=CC=C([N+](=O)[O-])C(O)=C1 092371 [0,1,0,0,0,0|3,0,0]=4 477 B11R1.166 FC1=C(C(F)F)C=CC(Br)=C1 023879 [0,1,0,0,0,0|3,0,0]=4 478 B11R1.166 FC1=C(C(F)F)C=CC(Cl)=C1 094662 [0,1,0,0,0,0|3,0,0]=4 479 B11R1.166 FC1=CC(Br)=C(C(F)F)C=C1 023877 [0,1,0,0,0,0|3,0,0]=4 480 B11R1.166 FC1=CC(Cl)=C(C(F)F)C=C1 023882 [0,1,0,0,0,0|3,0,0]=4 481 B11R1.166 FC1=CC(F)=C(C(F)F)C=C1 023884 [0,1,0,0,0,0|3,0,0]=4 482 B9R0.1 C\C=C(C)\C=C\C=C(C)C 104616 [0,0,1,0,0,0|0,0,2]=3 483 B9R1.35 CC(=O)C1=CC=C(C)S1 001262 [0,0,0,0,1,0|2,0,1]=4 484 B9R1.35 CC(=O)C1=CN(C)C=C1 103065 [0,0,0,0,1,0|2,0,1]=4 485 B9R1.35 CC(C)C1=NNC(N)=C1 021514 [0,0,0,0,1,0|3,0,0]=4 486 B9R1.35 CC1=CSC(C(C)C)=N1 009624 [0,0,0,0,1,0|2,0,0]=3 487 B11R1.20 C(F)(F)OC1=CC=C(Br)C=C1 004836 [0,0,0,0,0,1|3,0,0]=4 488 B11R1.20 C(F)(F)OC1=CC=C(C)C=C1 004842 [0,0,0,0,0,1|2,0,0]=3 489 B11R1.20 C(F)(F)OC1=CC=C(I)C=C1 004837 [0,0,0,0,0,1|3,0,0]=4 490 B11R1.20 C(F)(F)OC1=CC=C(N)C=C1 004828 [0,0,0,0,0,1|3,0,0]=4 491 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 022868 [0,0,0,0,0,1|2,0,1]=4 492 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 002599 [0,0,0,0,0,1|1,0,1]=3 493 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 002534 [0,0,0,0,0,1|2,0,1]=4 494 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 009228 [0,0,0,0,0,1|2,0,1]=4 495 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 079222 [0,0,0,0,0,1|2,0,1]=4 496 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 154805 [0,0,0,0,0,1|1,0,1]=3 497 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 003844 [0,0,0,0,0,1|2,0,1]=4 498 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 224669 [0,0,0,0,0,1|2,0,1]=4 499 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 005037 [0,0,0,0,0,1|2,0,1]=4 500 B11R1.20 CC(=O)NC1=CC=C(S)C=C1 358280 [0,0,0,0,0,1|2,0,1]=4 501 B11R1.20 CC(=O)OC1=CC=C(Cl)C=C1 047898 [0,0,0,0,0,1|2,0,1]=4 502 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 003918 [0,0,0,0,0,1|2,0,1]=4 503 B11R1.20 CC(=O)SC1=CC=C(Br)C=C1 103481 [0,0,0,0,0,1|2,0,1]=4 504 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 043417 [0,0,0,0,0,1|1,0,0]=2 505 B11R1.20 CC(C)OC1=CC=C(N)C=C1 038449 [0,0,0,0,0,1|1,0,0]=2 506 B11R1.20 CC(C)OC1=CC=C(N)C=C1 150800 [0,0,0,0,0,1|1,0,0]=2 507 B11R1.20 CC(C)OC1=CC=C(S)C=C1 038455 [0,0,0,0,0,1|1,0,0]=2 508 B11R1.20 CC(C)SC1=CC=C(Cl)C=C1 094984 [0,0,0,0,0,1|1,0,0]=2 509 B11R1.20 CC1=CC=C(CC(=O)Cl)C=C1 014710 [0,0,0,0,0,1|2,0,1]=4 510 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 001394 [0,0,0,0,0,1|2,0,1]=4 511 B11R1.20 CC1=CC=C(CC(N)=O)C=C1 103194 [0,0,0,0,0,1|2,0,1]=4 512 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 018865 [0,0,0,0,0,1|2,0,1]=4 513 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 018863 [0,0,0,0,0,1|2,0,1]=4 514 B11R1.20 CC1=CC=C(SC(C)C)C=C1 094759 [0,0,0,0,0,1|0,0,0]=1 515 B11R1.20 FC(F)OC1=CC=C(Cl)C=C1 044085 [0,0,0,0,0,1|3,0,0]=4 516 B8R1.2 BrCC1=CC=CC=C1 003666 [2,0,0,0,0,0|1,0,0]=3 517 B8R1.2 BrCC1=CC=CN=C1 214585 [2,0,0,0,0,0|2,0,0]=4 518 B8R1.2 BrCC1=CC=NC=C1 067829 [2,0,0,0,0,0|2,0,0]=4 519 B8R1.2 BrCC1=NC=CC=C1 067831 [2,0,0,0,0,0|2,0,0]=4 520 B8R1.2 Br[Mg]C1=CC=CC=C1 103487 [2,0,0,0,0,0|2,0,0]=4 521 B8R1.2 Br[Mg]C1=CC=CC=C1 214282 [2,0,0,0,0,0|2,0,0]=4 522 B8R1.2 C#CC1=CC=CC=C1 003009 [2,0,0,0,0,0|0,0,2]=4 523 B8R1.2 C=CC1=CC=CC=C1 520455 [2,0,0,0,0,0|0,0,2]=4 524 B8R1.2 CCC1=CC=CC=C1 094632 [2,0,0,0,0,0|0,0,0]=2 525 B8R1.2 CCC1=CC=CC=N1 098941 [2,0,0,0,0,0|1,0,0]=3 526 B8R1.2 CCC1=CC=CN=C1 242838 [2,0,0,0,0,0|1,0,0]=3 527 B8R1.2 CCC1=CC=NC=C1 319885 [2,0,0,0,0,0|1,0,0]=3 528 B8R1.2 CCC1=NC=CN=C1 002727 [2,0,0,0,0,0|2,0,0]=4 529 B8R1.2 CC[N+]1=CC=CC=C1 046807 [2,0,0,0,0,0|1,0,0]=3 530 B8R1.2 CNC1=CC=CC=C1 094625 [2,0,0,0,0,0|1,0,0]=3 531 B8R1.2 CNC1=CC=CN=C1 079398 [2,0,0,0,0,0|2,0,0]=4 532 B8R1.2 CNC1=CC=NC=C1 208626 [2,0,0,0,0,0|2,0,0]=4 533 B8R1.2 CNC1=NC=CC=C1 233304 [2,0,0,0,0,0|2,0,0]=4 534 B8R1.2 COC1=CC=CC=C1 M03556 [2,0,0,0,0,0|1,0,0]=3 535 B8R1.2 COC1=CC=CN=C1 079847 [2,0,0,0,0,0|2,0,0]=4 536 B8R1.2 COC1=CC=NC=C1 045194 [2,0,0,0,0,0|2,0,0]=4 537 B8R1.2 COC1=NC=CC=C1 045214 [2,0,0,0,0,0|2,0,0]=4 538 B8R1.2 CSC1=CC=CC=C1 002945 [2,0,0,0,0,0|1,0,0]=3 539 B8R1.2 ClCC1=CC=CC=C1 106800 [2,0,0,0,0,0|1,0,0]=3 540 B8R1.2 ClCC1=CC=CC=N1 026180 [2,0,0,0,0,0|2,0,0]=4 541 B8R1.2 ClCC1=CC=CN=C1 043884 [2,0,0,0,0,0|2,0,0]=4 542 B8R1.2 ClCC1=CC=NC=C1 050512 [2,0,0,0,0,0|2,0,0]=4 543 B8R1.2 Cl[Hg]C1=CC=CC=C1 101463 [2,0,0,0,0,0|2,0,0]=4 544 B8R1.2 Cl[Se]C1=CC=CC=C1 005554 [2,0,0,0,0,0|2,0,0]=4 545 B8R1.2 N#CC1=CC=CC=C1 035786 [2,0,0,0,0,0|1,0,1]=4 546 B8R1.2 N#CC1=CC=CC=C1 102548 [2,0,0,0,0,0|1,0,1]=4 547 B8R1.2 NCC1=CC=CC=C1 098408 [2,0,0,0,0,0|1,0,0]=3 548 B8R1.2 NCC1=CC=CC=C1 241882 [2,0,0,0,0,0|1,0,0]=3 549 B8R1.2 NCC1=CC=CN=C1 078185 [2,0,0,0,0,0|2,0,0]=4 550 B8R1.2 NCC1=CC=NC=C1 065475 [2,0,0,0,0,0|2,0,0]=4 551 B8R1.2 NCC1=NC=CC=C1 009750 [2,0,0,0,0,0|2,0,0]=4 552 B8R1.2 NNC1=CC=CC=C1 079470 [2,0,0,0,0,0|2,0,0]=4 553 B8R1.2 NNC1=CC=CC=C1 098902 [2,0,0,0,0,0|2,0,0]=4 554 B8R1.2 O=NC1=CC=CC=C1 106182 [2,0,0,0,0,0|2,0,0]=4 555 B8R1.2 OCC1=CC=CC=C1 094986 [2,0,0,0,0,0|1,0,0]=3 556 B8R1.2 OCC1=CC=CC=C1 105725 [2,0,0,0,0,0|1,0,0]=3 557 B8R1.2 OCC1=CC=CN=C1 208628 [2,0,0,0,0,0|2,0,0]=4 558 B8R1.2 OCC1=CC=NC=C1 078602 [2,0,0,0,0,0|2,0,0]=4 559 B8R1.2 OCC1=NC=CC=C1 043374 [2,0,0,0,0,0|2,0,0]=4 560 B8R1.2 SCC1=CC=CC=C1 098994 [2,0,0,0,0,0|1,0,0]=3 561 B8R1.2 [C-]#[N+]C1=CC=CC=C1 180012 [2,0,0,0,0,0|1,0,1]=4 562 B8R1.2 [O-]CC1=CC=CC=C1 105697 [2,0,0,0,0,0|1,0,0]=3 563 B8R1.3 BrC1=CC=C(Br)C=C1 125702 [2,0,0,0,0,0|2,0,0]=4 564 B8R1.3 BrC1=CC=C(I)C=C1 005440 [2,0,0,0,0,0|2,0,0]=4 565 B8R1.3 CC1=CC=C(Br)C=C1 001435 [2,0,0,0,0,0|1,0,0]=3 566 B8R1.3 CC1=CC=C(C)C=C1 098352 [2,0,0,0,0,0|0,0,0]=2 567 B8R1.3 CC1=CC=C(Cl)C=C1 099073 [2,0,0,0,0,0|1,0,0]=3 568 B8R1.3 CC1=CC=C(Cl)N=C1 049167 [2,0,0,0,0,0|2,0,0]=4 569 B8R1.3 CC1=CC=C(F)C=C1 001443 [2,0,0,0,0,0|1,0,0]=3 570 B8R1.3 CC1=CC=C(F)C=N1 035867 [2,0,0,0,0,0|2,0,0]=4 571 B8R1.3 CC1=CC=C(I)C=C1 001201 [2,0,0,0,0,0|1,0,0]=3 572 B8R1.3 CC1=CC=C(N)C=C1 080317 [2,0,0,0,0,0|1,0,0]=3 573 B8R1.3 CC1=CC=C(N)C=N1 012721 [2,0,0,0,0,0|2,0,0]=4 574 B8R1.3 CC1=CC=C(O)C=C1 240310 [2,0,0,0,0,0|1,0,0]=3 575 B8R1.3 CC1=CC=C(S)C=C1 019192 [2,0,0,0,0,0|1,0,0]=3 576 B8R1.3 CC1=CC=[N+]([O-])C=C1 237882 [2,0,0,0,0,0|2,0,0]=4 577 B8R1.3 CC1=CN=C(Br)C=C1 024508 [2,0,0,0,0,0|2,0,0]=4 578 B8R1.3 CC1=CN=C(C)C=N1 002729 [2,0,0,0,0,0|2,0,0]=4 579 B8R1.3 CC1=CN=C(F)C=C1 008920 [2,0,0,0,0,0|2,0,0]=4 580 B8R1.3 CC1=CN=C(N)C=C1 003527 [2,0,0,0,0,0|2,0,0]=4 581 B8R1.3 CC1=CN=C(O)C=C1 037381 [2,0,0,0,0,0|2,0,0]=4 582 B8R1.3 CC1=CNC(=O)C=C1 318707 [2,0,0,0,0,0|2,0,0]=4 583 B8R1.3 CC1=NC=C(Br)C=C1 033262 [2,0,0,0,0,0|2,0,0]=4 584 B8R1.3 CC1=NC=C(Cl)C=C1 221445 [2,0,0,0,0,0|2,0,0]=4 585 B8R1.3 CC1=NC=C(O)C=C1 076959 [2,0,0,0,0,0|2,0,0]=4 586 B8R1.3 ClC1=CC=C(Br)C=C1 094835 [2,0,0,0,0,0|2,0,0]=4 587 B8R1.3 ClC1=CC=C(Cl)C=C1 094994 [2,0,0,0,0,0|2,0,0]=4 588 B8R1.3 ClC1=CC=C(I)C=C1 001151 [2,0,0,0,0,0|2,0,0]=4 589 B8R1.3 FC1=CC=C(Br)C=C1 001225 [2,0,0,0,0,0|2,0,0]=4 590 B8R1.3 FC1=CC=C(Cl)C=C1 001147 [2,0,0,0,0,0|2,0,0]=4 591 B8R1.3 FC1=CC=C(F)C=C1 001170 [2,0,0,0,0,0|2,0,0]=4 592 B8R1.3 FC1=CC=C(I)C=C1 001184 [2,0,0,0,0,0|2,0,0]=4 593 B8R1.3 FC1=CC=C(S)C=C1 001625 [2,0,0,0,0,0|2,0,0]=4 594 B8R1.3 IC1=CC=C(I)C=C1 131402 [2,0,0,0,0,0|2,0,0]=4 595 B8R1.3 NC1=CC=C(Br)C=C1 002472 [2,0,0,0,0,0|2,0,0]=4 596 B8R1.3 NC1=CC=C(Cl)C=C1 046750 [2,0,0,0,0,0|2,0,0]=4 597 B8R1.3 NC1=CC=C(F)C=C1 001439 [2,0,0,0,0,0|2,0,0]=4 598 B8R1.3 NC1=CC=C(I)C=C1 005423 [2,0,0,0,0,0|2,0,0]=4 599 B8R1.3 NC1=CC=C(N)C=C1 165600 [2,0,0,0,0,0|2,0,0]=4 600 B8R1.3 NC1=CC=C(N)C=C1 238391 [2,0,0,0,0,0|2,0,0]=4 601 B8R1.3 NC1=CC=C(O)C=C1 005060 [2,0,0,0,0,0|2,0,0]=4 602 B8R1.3 NC1=CC=C(S)C=C1 050722 [2,0,0,0,0,0|2,0,0]=4 603 B8R1.3 O=C1C=CC(=O)C=C1 094629 [2,0,0,0,0,0|2,0,0]=4 604 B8R1.3 OC1=CC=C(Br)C=C1 008836 [2,0,0,0,0,0|2,0,0]=4 605 B8R1.3 OC1=CC=C(Cl)C=C1 099915 [2,0,0,0,0,0|2,0,0]=4 606 B8R1.3 OC1=CC=C(F)C=C1 001291 [2,0,0,0,0,0|2,0,0]=4 607 B8R1.3 OC1=CC=C(I)C=C1 008839 [2,0,0,0,0,0|2,0,0]=4 608 B8R1.3 OC1=CC=C(O)C=C1 146000 [2,0,0,0,0,0|2,0,0]=4 609 B8R1.3 SC1=CC=C(Br)C=C1 023261 [2,0,0,0,0,0|2,0,0]=4 610 B8R1.3 SC1=CC=C(Cl)C=C1 005205 [2,0,0,0,0,0|2,0,0]=4 611 B10R1.1 CC1=CC=C(CC#N)C=C1 078705 [1,1,0,0,0,0|0,0,1]=3 612 B10R1.1 CC1=CC=C(CCN)C=C1 018851 [1,1,0,0,0,0|0,0,0]=2 613 B10R1.1 CC1=CC=C(CCO)C=C1 216320 [1,1,0,0,0,0|0,0,0]=2 614 B10R1.1 CC1=CC=C(N=C=O)C=C1 099850 [1,1,0,0,0,0|1,0,1]=4 615 B10R1.1 CC1=CC=C(N=C=S)C=C1 001282 [1,1,0,0,0,0|1,0,1]=4 616 B10R1.1 CC1=CC=C(NC=O)C=C1 180098 [1,1,0,0,0,0|1,0,1]=4 617 B10R1.1 CC1=CC=C(\C=N\O)C=C1 300271 [1,1,0,0,0,0|1,0,1]=4 618 B10R1.1 CCCC1=CC=C(Cl)C=C1 018453 [1,1,0,0,0,0|1,0,0]=3 619 B10R1.1 CCCC1=CC=C(O)C=C1 068339 [1,1,0,0,0,0|1,0,0]=3 620 B10R1.1 CCOC1=CC=C(Br)C=C1 024186 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.1 CCOC1=CC=C(F)C=C1 006317 [1,1,0,0,0,0|1,0,0]=3 622 B10R1.1 CCOC1=CC=C(I)C=C1 038701 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.1 CCOC1=CC=C(N)C=C1 230478 [1,1,0,0,0,0|1,0,0]=3 624 B10R1.1 CCOC1=CC=C(O)C=C1 049967 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.1 CCOC1=NC=C(I)C=C1 363566 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.1 CCSC1=CC=C(C)C=C1 094757 [1,1,0,0,0,0|0,0,0]=2 627 B10R1.1 CCSC1=CC=C(Cl)C=C1 094917 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.1 CCSC1=CC=C(F)C=C1 094569 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.1 CNCC1=CC=C(Br)C=C1 076658 [1,1,0,0,0,0|1,0,0]=3 630 B10R1.1 CNCC1=CC=C(C)C=C1 078911 [1,1,0,0,0,0|0,0,0]=2 631 B10R1.1 CNCC1=CC=C(F)C=C1 040105 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.1 COCC1=CC=C(Br)C=C1 325028 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.1 ClC1=CC=C(CCBr)C=C1 020895 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.1 FC1=CC=C(CCBr)C=C1 020897 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.1 FC1=CC=C(CCCl)C=C1 010403 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.1 N#CCC1=CC=C(Br)C=C1 BR1112 [1,1,0,0,0,0|1,0,1]=4 637 B10R1.1 N#CCC1=CC=C(Cl)C=C1 079011 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.1 N#CCC1=CC=C(F)C=C1 001189 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.1 N#CCC1=CC=C(I)C=C1 149501 [1,1,0,0,0,0|1,0,1]=4 640 B10R1.1 N#CCC1=CC=C(O)C=C1 018726 [1,1,0,0,0,0|1,0,1]=4 641 B10R1.1 NC1=CC=C(CCO)C=C1 005442 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.1 NCCC1=CC=C(Br)C=C1 013456 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.1 NCCC1=CC=C(Br)C=C1 018305 [1,1,0,0,0,0|1,0,0]=3 644 B10R1.1 NCCC1=CC=C(Cl)C=C1 008894 [1,1,0,0,0,0|1,0,0]=3 645 B10R1.1 NCCC1=CC=C(F)C=C1 040108 [1,1,0,0,0,0|1,0,0]=3 646 B10R1.1 NCCC1=CC=C(F)C=C1 240692 [1,1,0,0,0,0|1,0,0]=3 647 B10R1.1 NCCC1=CC=C(N)C=C1 040089 [1,1,0,0,0,0|1,0,0]=3 648 B10R1.1 NCCC1=CC=C(O)C=C1 078887 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.1 NCCC1=CC=C(O)C=C1 241212 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.1 OCCC1=CC=C(Br)C=C1 040529 [1,1,0,0,0,0|1,0,0]=3 651 B10R1.1 OCCC1=CC=C(Cl)C=C1 209207 [1,1,0,0,0,0|1,0,0]=3 652 B10R1.1 OCCC1=CC=C(F)C=C1 006315 [1,1,0,0,0,0|1,0,0]=3 653 B10R1.1 OCCC1=CC=C(I)C=C1 078447 [1,1,0,0,0,0|1,0,0]=3 654 B10R1.1 OCCC1=CC=C(O)C=C1 077935 [1,1,0,0,0,0|1,0,0]=3 655 B10R1.1 [NH3+]OCC1=CC=C(F)C=C1 010009 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.3 BrCC1=CC=C(CBr)C=C1 041016 [1,1,0,0,0,0|1,0,0]=3 657 B10R1.3 C#CC1=CC=C(CC)C=C1 078540 [1,1,0,0,0,0|0,0,1]=3 658 B10R1.3 C#CC1=CC=C(OC)C=C1 040076 [1,1,0,0,0,0|0,0,2]=4 659 B10R1.3 C=CC1=CC=C(CCl)C=C1 238993 [1,1,0,0,0,0|0,0,2]=4 660 B10R1.3 C=CC1=CC=C(OC)C=C1 236760 [1,1,0,0,0,0|0,0,2]=4 661 B10R1.3 CCC1=CC=C(C=O)C=C1 045132 [1,1,0,0,0,0|0,0,1]=3 662 B10R1.3 CCC1=CC=C(CCl)C=C1 018680 [1,1,0,0,0,0|0,0,0]=2 663 B10R1.3 CCC1=CC=C(CO)C=C1 237130 [1,1,0,0,0,0|0,0,0]=2 664 B10R1.3 CCC1=CC=C(NN)C=C1 023498 [1,1,0,0,0,0|1,0,0]=3 665 B10R1.3 CCC1=CC=C(OC)C=C1 235779 [1,1,0,0,0,0|0,0,0]=2 666 B10R1.3 CCC1=CC=C(SC)C=C1 019350 [1,1,0,0,0,0|0,0,0]=2 667 B10R1.3 CNC1=CC=C(OC)C=C1 009653 [1,1,0,0,0,0|1,0,0]=3 668 B10R1.3 COC1=CC=C(C#N)C=C1 035884 [1,1,0,0,0,0|1,0,1]=4 669 B10R1.3 COC1=CC=C(C=O)C=C1 079445 [1,1,0,0,0,0|1,0,1]=4 670 B10R1.3 COC1=CC=C(C=O)C=C1 098960 [1,1,0,0,0,0|1,0,1]=4 671 B10R1.3 COC1=CC=C(CBr)C=C1 067817 [1,1,0,0,0,0|1,0,0]=3 672 B10R1.3 COC1=CC=C(CN)C=C1 008876 [1,1,0,0,0,0|1,0,0]=3 673 B10R1.3 COC1=CC=C(CO)C=C1 094474 [1,1,0,0,0,0|1,0,0]=3 674 B10R1.3 COC1=CC=C(CS)C=C1 050468 [1,1,0,0,0,0|1,0,0]=3 675 B10R1.3 COC1=CC=C(NN)C=C1 012691 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.3 COC1=CC=C(OC)C=C1 044664 [1,1,0,0,0,0|1,0,0]=3 677 B10R1.3 COC1=CC=C(SC)C=C1 003888 [1,1,0,0,0,0|1,0,0]=3 678 B10R1.3 COC1=CC=C([N+]#N)C=C1 390416 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.3 CSC1=CC=C(C=O)C=C1 402351 [1,1,0,0,0,0|1,0,1]=4 680 B10R1.3 CSC1=CC=C(CCl)C=C1 018873 [1,1,0,0,0,0|1,0,0]=3 681 B10R1.3 CSC1=CC=C(CN)C=C1 009292 [1,1,0,0,0,0|1,0,0]=3 682 B10R1.3 CSC1=CC=C(CO)C=C1 103356 [1,1,0,0,0,0|1,0,0]=3 683 B10R1.3 ClCC1=CC=C(CCl)C=C1 099057 [1,1,0,0,0,0|1,0,0]=3 684 B10R1.3 N#CC1=CC=C(CBr)C=C1 049319 [1,1,0,0,0,0|1,0,1]=4 685 B10R1.3 N#CC1=CC=C(CCl)C=C1 068171 [1,1,0,0,0,0|1,0,1]=4 686 B10R1.3 N#CC1=CC=C(CN)C=C1 043646 [1,1,0,0,0,0|1,0,1]=4 687 B10R1.3 N#CC1=CC=C(CO)C=C1 306933 [1,1,0,0,0,0|1,0,1]=4 688 B10R1.3 NCC1=CC=C(CO)C=C1 036740 [1,1,0,0,0,0|1,0,0]=3 689 B10R1.3 O=CC1=CC=C(CO)C=C1 222581 [1,1,0,0,0,0|1,0,1]=4 690 B10R1.3 OCC1=CC=C(CO)C=C1 225421 [1,1,0,0,0,0|1,0,0]=3 691 B10R1.25 CC1=C(CN)C=CC(F)=C1 075557 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.25 CC1=C(CO)C=CC(Cl)=C1 022248 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.25 CC1=CC(C)=C(NN)C=C1 366637 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.25 CC1=CC(Cl)=CC=C1CN 018397 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.25 CC1=CC(F)=C(CN)C=C1 342555 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.25 CC1=CC(N)=C(C#N)C=C1 064672 [1,1,0,0,0,0|1,0,1]=4 697 B10R1.25 CC1=CC=C(C#N)C(Br)=C1 062782 [1,1,0,0,0,0|1,0,1]=4 698 B10R1.25 CC1=CC=C(C#N)C(C)=C1 018610 [1,1,0,0,0,0|1,0,1]=4 699 B10R1.25 CC1=CC=C(C#N)C(F)=C1 037164 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.25 CC1=CC=C(C=O)C(Br)=C1 078053 [1,1,0,0,0,0|1,0,1]=4 701 B10R1.25 CC1=CC=C(C=O)C(C)=C1 092111 [1,1,0,0,0,0|1,0,1]=4 702 B10R1.25 CC1=CC=C(C=O)C(F)=C1 037137 [1,1,0,0,0,0|1,0,1]=4 703 B10R1.25 CC1=CC=C(C=O)C(O)=C1 015626 [1,1,0,0,0,0|1,0,1]=4 704 B10R1.25 CC1=CC=C(CN)C(C)=C1 018614 [1,1,0,0,0,0|1,0,0]=3 705 B10R1.25 CC1=CC=C(NN)C(C)=C1 077986 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.25 CCC1=C(C)C=C(C)C=N1 450509 [1,1,0,0,0,0|1,0,0]=3 707 B10R1.25 CCC1=C(Cl)C=C(Cl)C=C1 105745 [1,1,0,0,0,0|1,0,0]=3 708 B10R1.25 CCC1=C(N)N=C(C)C=C1 430516 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.25 COC1=C(Br)C=C(Br)C=C1 003063 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.25 COC1=C(Br)C=C(F)C=C1 002823 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.25 COC1=C(Br)C=C(I)C=C1 038609 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.25 COC1=C(Br)C=C(N)C=C1 038608 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.25 COC1=C(C)C=C(Br)C=C1 024551 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.25 COC1=C(C)C=C(N)C=C1 038823 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.25 COC1=C(Cl)C=C(F)C=C1 013256 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.25 COC1=C(F)C=C(Br)C=C1 004207 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.25 COC1=C(F)C=C(F)C=C1 002346 [1,1,0,0,0,0|2,0,0]=4 718 B10R1.25 COC1=C(F)C=C(N)C=C1 010679 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.25 COC1=C(I)C=C(C)C=C1 148600 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.25 COC1=C(N)C=C(Cl)C=C1 020202 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.25 COC1=C(N)C=C(I)C=C1 005445 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.25 COC1=C(O)C=C(C)C=C1 009947 [1,1,0,0,0,0|1,0,0]=3 723 B10R1.25 COC1=C(O)C=C(F)C=C1 013351 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.25 COC1=C(S)C=C(C)C=C1 038021 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.25 COC1=CC=C(Br)C=C1Cl 240212 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.25 COC1=CC=C(Br)C=C1O 043697 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.25 COC1=CC=C(C)C=C1Br 018292 [1,1,0,0,0,0|1,0,0]=3 728 B10R1.25 COC1=CC=C(C)C=C1Cl 018390 [1,1,0,0,0,0|1,0,0]=3 729 B10R1.25 COC1=CC=C(C)C=C1N 043367 [1,1,0,0,0,0|1,0,0]=3 730 B10R1.25 COC1=CC=C(Cl)C=C1Br 018250 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.25 COC1=CC=C(Cl)C=C1Cl 018511 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.25 COC1=CC=C(Cl)C=C1I 018381 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.25 COC1=CC=C(F)C=C1C 013357 [1,1,0,0,0,0|2,0,0]=4 734 B10R1.25 COC1=CC=C(F)C=C1N 064681 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.25 COC1=CC=C(F)C=C1N 209750 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.25 COC1=CC=C(I)C=C1Cl 075742 [1,1,0,0,0,0|2,0,0]=4 737 B10R1.25 COC1=CC=C(N)C=C1Cl 079264 [1,1,0,0,0,0|2,0,0]=4 738 B10R1.25 COC1=CC=C(N)C=C1I 079878 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.25 COC1=CC=C(N)C=C1O 233883 [1,1,0,0,0,0|2,0,0]=4 740 B10R1.25 COC1=CC=C(O)C=C1Br 076521 [1,1,0,0,0,0|2,0,0]=4 741 B10R1.25 CSC1=C(C)C=C(C)C=C1 019336 [1,1,0,0,0,0|1,0,0]=3 742 B10R1.25 CSC1=C(F)C=C(F)C=C1 019352 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 043355 [1,1,0,0,0,0|2,0,0]=4 744 B10R1.25 FC1=C(CBr)C=CC(Br)=C1 004221 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.25 FC1=C(CBr)C=CC(Cl)=C1 009420 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.25 FC1=C(CS)C=CC(Br)=C1 024380 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.25 FC1=C(CS)C=CC(Cl)=C1 024379 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.25 FC1=CC(Cl)=C(CBr)C=C1 005630 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.25 FC1=CC(F)=C(CBr)C=C1 001922 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.25 FC1=CC=C(CCl)C(F)=C1 021891 [1,1,0,0,0,0|2,0,0]=4 751 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 237144 [1,1,0,0,0,0|2,0,0]=4 752 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 004441 [1,1,0,0,0,0|2,0,0]=4 753 B10R1.25 NCC1=C(F)C=C(Br)C=C1 013225 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 070559 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.25 NCC1=C(F)C=C(F)C=C1 004792 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.25 NCC1=CC=C(Br)C=C1F 033746 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.25 OCC1=C(Br)C=C(F)C=C1 013215 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.25 OCC1=C(Cl)C=C(Cl)C=C1 008825 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.25 OCC1=C(Cl)C=C(F)C=C1 005623 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.25 OCC1=C(F)C=C(Br)C=C1 013219 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 009419 [1,1,0,0,0,0|2,0,0]=4 762 B10R1.25 OCC1=C(F)C=C(F)C=C1 001921 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.25 SCC1=C(Cl)C=C(Cl)C=C1 051211 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.176 CC1=C(C)C=C(C#N)C=C1 002547 [1,1,0,0,0,0|1,0,1]=4 765 B10R1.176 CC1=C(Cl)C=C(C#N)C=C1 062752 [1,1,0,0,0,0|1,0,1]=4 766 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 065393 [1,1,0,0,0,0|1,0,0]=3 767 B10R1.176 CC1=C(F)C=C(C#N)C=C1 002156 [1,1,0,0,0,0|1,0,1]=4 768 B10R1.176 CC1=C(F)C=C(C=O)C=C1 005784 [1,1,0,0,0,0|1,0,1]=4 769 B10R1.176 CC1=C(F)C=C(CBr)C=C1 005799 [1,1,0,0,0,0|1,0,0]=3 770 B10R1.176 CC1=C(F)C=C(CN)C=C1 005796 [1,1,0,0,0,0|1,0,0]=3 771 B10R1.176 CC1=C(F)C=CC(CBr)=C1 005800 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.176 CC1=C(F)C=CC(CN)=C1 005797 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.176 CC1=C(F)C=CC(CO)=C1 005794 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.176 CC1=CC(CN)=CC=C1N 075980 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.176 CC1=CC=C(C#N)C=C1Br 077916 [1,1,0,0,0,0|1,0,1]=4 776 B10R1.176 CC1=CC=C(C=O)C=C1C 208818 [1,1,0,0,0,0|1,0,1]=4 777 B10R1.176 CC1=CC=C(CCl)C=C1C 018620 [1,1,0,0,0,0|1,0,0]=3 778 B10R1.176 CC1=CC=C(CN)C=C1C 018617 [1,1,0,0,0,0|1,0,0]=3 779 B10R1.176 CC1=CC=C(CO)C=C1C 237644 [1,1,0,0,0,0|1,0,0]=3 780 B10R1.176 CC1=CC=C(NN)C=C1Cl 013490 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.176 CCC1=CC(Br)=C(Br)C=C1 037708 [1,1,0,0,0,0|1,0,0]=3 782 B10R1.176 CCC1=CC(Br)=C(Cl)C=C1 037705 [1,1,0,0,0,0|1,0,0]=3 783 B10R1.176 CCC1=CC(Br)=C(F)C=C1 037706 [1,1,0,0,0,0|1,0,0]=3 784 B10R1.176 CCC1=CC(Br)=C(I)C=C1 037707 [1,1,0,0,0,0|1,0,0]=3 785 B10R1.176 CCC1=CC(N)=C(O)C=C1 311903 [1,1,0,0,0,0|1,0,0]=3 786 B10R1.176 CCC1=CC=C(N)C(Br)=C1 037704 [1,1,0,0,0,0|1,0,0]=3 787 B10R1.176 CCC1=CC=C(O)C(Br)=C1 467266 [1,1,0,0,0,0|1,0,0]=3 788 B10R1.176 CNC1=CC=C(Cl)C(Cl)=C1 045883 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.176 COC1=CC(Br)=C(C)C=C1 038675 [1,1,0,0,0,0|1,0,0]=3 790 B10R1.176 COC1=CC(Br)=C(I)C=C1 038758 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.176 COC1=CC(Br)=C(N)C=C1 064590 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.176 COC1=CC(C)=C(C)C=C1 049843 [1,1,0,0,0,0|1,0,0]=3 793 B10R1.176 COC1=CC(C)=C(F)C=C1 006276 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.176 COC1=CC(C)=C(N)C=C1 013907 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 021885 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.176 COC1=CC(Cl)=C(F)C=C1 013257 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.176 COC1=CC(Cl)=C(O)C=C1 036149 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.176 COC1=CC(F)=C(Br)C=C1 036324 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.176 COC1=CC(F)=C(Cl)C=C1 004420 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.176 COC1=CC(F)=C(F)C=C1 004776 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.176 COC1=CC(I)=C(Cl)C=C1 037531 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.176 COC1=CC(N)=C(Cl)C=C1 358387 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.176 COC1=CC=C(Br)C(Br)=C1 038757 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.176 COC1=CC=C(Br)C(C)=C1 018291 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.176 COC1=CC=C(Br)C(I)=C1 062586 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.176 COC1=CC=C(Br)C(N)=C1 062578 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.176 COC1=CC=C(C)C(N)=C1 077941 [1,1,0,0,0,0|1,0,0]=3 808 B10R1.176 COC1=CC=C(Cl)C(Br)=C1 035670 [1,1,0,0,0,0|2,0,0]=4 809 B10R1.176 COC1=CC=C(Cl)C(N)=C1 024240 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.176 COC1=CC=C(N)C(F)=C1 077923 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.176 COC1=CC=C(N)C(I)=C1 079758 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.176 COC1=CC=C(N)C(N)=C1 075218 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.176 COC1=CC=C(N)C(N)=C1 092184 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.176 CSC1=CC(C)=C(C)C=C1 019339 [1,1,0,0,0,0|1,0,0]=3 815 B10R1.176 CSC1=CC(Cl)=C(Cl)C=C1 019347 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.176 ClC1=C(Br)C=C(CBr)C=C1 044634 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.176 ClC1=C(Br)C=CC(CBr)=C1 044619 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.176 ClCC1=CC(Cl)=C(Cl)C=C1 088358 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.176 FC1=C(Cl)C=C(CBr)C=C1 005633 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.176 FC1=C(Cl)C=C(CS)C=C1 024376 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.176 FC1=C(Cl)C=CC(CBr)=C1 021808 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.176 FC1=C(F)C=C(CBr)C=C1 002085 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.176 FC1=C(F)C=C(CCl)C=C1 007846 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.176 FC1=C(F)C=C(CS)C=C1 024361 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.176 NCC1=CC(Br)=C(F)C=C1 013223 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 013145 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.176 NCC1=CC(Cl)=C(F)C=C1 004443 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.176 NCC1=CC(F)=C(Cl)C=C1 021807 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.176 NCC1=CC(F)=C(F)C=C1 004794 [1,1,0,0,0,0|2,0,0]=4 830 B10R1.176 NCC1=CC(N)=C(F)C=C1 075136 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.176 NCC1=CC=C(F)C(Br)=C1 062526 [1,1,0,0,0,0|2,0,0]=4 832 B10R1.176 OCC1=CC(Br)=C(Cl)C=C1 044560 [1,1,0,0,0,0|2,0,0]=4 833 B10R1.176 OCC1=CC(Br)=C(F)C=C1 013217 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.176 OCC1=CC(Cl)=C(Br)C=C1 044809 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 008824 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.176 OCC1=CC(Cl)=C(F)C=C1 005626 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.176 OCC1=CC(F)=C(Cl)C=C1 022247 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.176 OCC1=CC(F)=C(F)C=C1 002084 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.176 OCC1=CC=C(Br)C(F)=C1 091491 [1,1,0,0,0,0|2,0,0]=4 840 B10R1.176 SCC1=CC=C(Cl)C(Cl)=C1 013511 [1,1,0,0,0,0|2,0,0]=4 841 B10R1.15 C(=O)C(C)C1=CC=CC=C1 003859 [1,1,0,0,0,0|0,0,1]=3 842 B10R1.15 CC(C#N)C1=CC=CC=C1 001059 [1,1,0,0,0,0|0,0,1]=3 843 B10R1.15 CC(CN)C1=CC=CC=C1 008888 [1,1,0,0,0,0|0,0,0]=2 844 B10R1.15 CCC(=O)C1=CC=CC=C1 094675 [1,1,0,0,0,0|1,0,1]=4 845 B10R1.15 CCC(C)C1=CC=CC=C1 094615 [1,1,0,0,0,0|0,0,0]=2 846 B10R1.15 CCC(O)C1=CC=CC=C1 242652 [1,1,0,0,0,0|1,0,0]=3 847 B10R1.15 CCN(C)C1=CC=CC=C1 092421 [1,1,0,0,0,0|1,0,0]=3 848 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 208825 [1,1,0,0,0,0|1,0,0]=3 849 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 103637 [1,1,0,0,0,0|1,0,0]=3 850 B10R1.15 CC[C@H](N)C1=CC=CC=C1 227613 [1,1,0,0,0,0|1,0,0]=3 851 B10R1.15 CN(C=O)C1=CC=CC=C1 208822 [1,1,0,0,0,0|1,0,1]=4 852 B10R1.15 CNC(=O)C1=CC=CC=C1 341719 [1,1,0,0,0,0|1,0,1]=4 853 B10R1.15 CNC(=S)C1=CC=CC=C1 180197 [1,1,0,0,0,0|1,0,1]=4 854 B10R1.15 CNC(C)C1=CC=CC=C1 371108 [1,1,0,0,0,0|0,0,0]=2 855 B10R1.15 CN[C@H](C)C1=CC=CC=C1 337064 [1,1,0,0,0,0|0,0,0]=2 856 B10R1.15 COC(=O)C1=CC=CC=C1 223218 [1,1,0,0,0,0|1,0,1]=4 857 B10R1.15 COS(=O)C1=CC=CC=C1 023251 [1,1,0,0,0,0|2,0,0]=4 858 B10R1.15 N#CC(O)C1=CC=CC=C1 403371 [1,1,0,0,0,0|1,0,1]=4 859 B10R1.15 N#C[C@@H](N)C1=CC=CC=C1 324116 [1,1,0,0,0,0|1,0,1]=4 860 B10R1.15 NC(CO)C1=CC=CC=C1 364268 [1,1,0,0,0,0|1,0,0]=3 861 B10R1.15 NCC(=O)C1=CC=CC=C1 040292 [1,1,0,0,0,0|1,0,1]=4 862 B10R1.15 NCC(O)C1=CC=CC=C1 008897 [1,1,0,0,0,0|1,0,0]=3 863 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 318280 [1,1,0,0,0,0|1,0,0]=3 864 B10R1.15 NC[C@H](O)C1=CC=CC=C1 077860 [1,1,0,0,0,0|1,0,0]=3 865 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 040100 [1,1,0,0,0,0|1,0,0]=3 866 B10R1.15 N[C@H](CO)C1=CC=CC=C1 034311 [1,1,0,0,0,0|1,0,0]=3 867 B10R1.15 O=C(CBr)C1=CC=CC=C1 040508 [1,1,0,0,0,0|1,0,1]=4 868 B10R1.15 O=C(CCl)C1=CC=CC=C1 228091 [1,1,0,0,0,0|1,0,1]=4 869 B10R1.15 O=C(CO)C1=CC=CC=C1 219236 [1,1,0,0,0,0|1,0,1]=4 870 B10R1.15 O[C@H](CCl)C1=CC=CC=C1 103828 [1,1,0,0,0,0|1,0,0]=3 871 B10R1.28 CC(C)(C)C1=CC=CC=C1 094532 [1,1,0,0,0,0|0,0,0]=2 872 B10R1.28 CC(C)(C)C1=CC=NC=C1 024692 [1,1,0,0,0,0|1,0,0]=3 873 B10R1.28 CC(C)(Cl)C1=CC=CC=C1 033938 [1,1,0,0,0,0|0,0,0]=2 874 B10R1.28 CC(C)(N)C1=CC=CC=C1 005015 [1,1,0,0,0,0|0,0,0]=2 875 B10R1.28 CC(C)(O)C1=CC=CC=C1 493347 [1,1,0,0,0,0|0,0,0]=2 876 B10R1.28 CC(C)(O)C1=CC=NC=C1 218299 [1,1,0,0,0,0|1,0,0]=3 877 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 001313 [1,1,0,0,0,0|2,0,0]=4 878 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 079257 [1,1,0,0,0,0|1,0,0]=3 879 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 222395 [1,1,0,0,0,0|1,0,0]=3 880 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 S13375 [1,1,0,0,0,0|0,1,0]=3 881 B10R1.28 ClC(Cl)(Cl)C1=CC=CC=C1 242868 [1,1,0,0,0,0|2,0,0]=4 882 B10R1.28 FC(F)(F)C1=CC=CC=C1 004060 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 035873 [1,1,0,0,0,0|1,0,1]=4 884 B10R1.61 CC(=O)C1=C(F)C=CC=C1 001616 [1,1,0,0,0,0|1,0,1]=4 885 B10R1.61 CC(=O)C1=CC=CC=C1Cl 003397 [1,1,0,0,0,0|1,0,1]=4 886 B10R1.61 CC(=O)C1=CC=CC=C1I 075032 [1,1,0,0,0,0|1,0,1]=4 887 B10R1.61 CC(=O)C1=CC=CC=C1N 076856 [1,1,0,0,0,0|1,0,1]=4 888 B10R1.61 CC(=O)C1=CC=CC=C1O 078584 [1,1,0,0,0,0|1,0,1]=4 889 B10R1.61 CC(C)C1=C(Br)C=CC=C1 009741 [1,1,0,0,0,0|0,0,0]=2 890 B10R1.61 CC(C)C1=C(I)C=CC=C1 001198 [1,1,0,0,0,0|0,0,0]=2 891 B10R1.61 CC(C)C1=C(N)C=CC=C1 033911 [1,1,0,0,0,0|0,0,0]=2 892 B10R1.61 CC(C)C1=CC=CC=C1O 208839 [1,1,0,0,0,0|0,0,0]=2 893 B10R1.61 CC(C)C1=CC=CC=C1S 023120 [1,1,0,0,0,0|0,0,0]=2 894 B10R1.61 CC(O)C1=C(Br)C=CC=C1 094463 [1,1,0,0,0,0|1,0,0]=3 895 B10R1.61 CC(O)C1=C(F)C=CC=C1 006337 [1,1,0,0,0,0|1,0,0]=3 896 B10R1.61 CC(O)C1=C(F)N=CC=C1 529891 [1,1,0,0,0,0|2,0,0]=4 897 B10R1.61 CN(C)C1=CC=CC=C1Br 215675 [1,1,0,0,0,0|1,0,0]=3 898 B10R1.61 CN(C)C1=CC=CC=C1N 079293 [1,1,0,0,0,0|1,0,0]=3 899 B10R1.61 FC(F)C1=C(Br)C=CC=C1 023878 [1,1,0,0,0,0|2,0,0]=4 900 B10R1.61 FC(F)C1=C(Cl)C=CC=C1 102489 [1,1,0,0,0,0|2,0,0]=4 901 B10R1.61 FC1=C(C(F)F)C=CC=C1 023923 [1,1,0,0,0,0|2,0,0]=4 902 B10R1.61 FC1=CC=CC=C1C(Cl)Cl 009190 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 008816 [1,1,0,0,0,0|1,0,1]=4 904 B10R1.113 CC(=O)C1=CC(C)=CC=C1 349312 [1,1,0,0,0,0|1,0,1]=4 905 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 024871 [1,1,0,0,0,0|1,0,1]=4 906 B10R1.113 CC(=O)C1=CC(F)=CC=C1 001467 [1,1,0,0,0,0|1,0,1]=4 907 B10R1.113 CC(=O)C1=CC(I)=CC=C1 147400 [1,1,0,0,0,0|1,0,1]=4 908 B10R1.113 CC(=O)C1=CC(N)=CC=C1 001722 [1,1,0,0,0,0|1,0,1]=4 909 B10R1.113 CC(=O)C1=CC=CC(O)=C1 078748 [1,1,0,0,0,0|1,0,1]=4 910 B10R1.113 CC(C)C1=CC(Br)=CC=C1 024856 [1,1,0,0,0,0|0,0,0]=2 911 B10R1.113 CC(C)C1=CC(I)=CC=C1 037580 [1,1,0,0,0,0|0,0,0]=2 912 B10R1.113 CC(C)C1=CC(N)=CC=C1 075293 [1,1,0,0,0,0|0,0,0]=2 913 B10R1.113 CC(C)C1=CC=CC(O)=C1 099128 [1,1,0,0,0,0|0,0,0]=2 914 B10R1.113 CC(N)C1=CC(Cl)=CC=C1 035904 [1,1,0,0,0,0|1,0,0]=3 915 B10R1.113 CC(O)C1=CC(Br)=CC=C1 003550 [1,1,0,0,0,0|1,0,0]=3 916 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 353644 [1,1,0,0,0,0|1,0,0]=3 917 B10R1.113 CC(O)C1=CC(F)=CC=C1 006338 [1,1,0,0,0,0|1,0,0]=3 918 B10R1.113 CC(O)C1=NC(Br)=CC=C1 217816 [1,1,0,0,0,0|2,0,0]=4 919 B10R1.113 CC1=CC(N(C)C)=CC=C1 242206 [1,1,0,0,0,0|1,0,0]=3 920 B10R1.113 CC1=CC=CC(C(C)O)=C1 033735 [1,1,0,0,0,0|1,0,0]=3 921 B10R1.113 CN(C)C1=CC(Br)=CN=C1 323893 [1,1,0,0,0,0|2,0,0]=4 922 B10R1.113 CN(C)C1=CC(O)=CC=C1 080296 [1,1,0,0,0,0|1,0,0]=3 923 B10R1.113 CN(C)C1=CC=CC(Br)=C1 091972 [1,1,0,0,0,0|1,0,0]=3 924 B10R1.113 CN(C)C1=CC=CC(N)=C1 223097 [1,1,0,0,0,0|1,0,0]=3 925 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 468749 [1,1,0,0,0,0|1,0,0]=3 926 B10R1.113 FC(F)C1=CC=CC(Br)=C1 024453 [1,1,0,0,0,0|2,0,0]=4 927 B10R1.113 FC(F)C1=CC=CC(Cl)=C1 098488 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.113 FC1=CC(C(F)F)=CC=C1 023921 [1,1,0,0,0,0|2,0,0]=4 929 B10R1.113 FC1=CC=CC(C(Cl)Cl)=C1 009191 [1,1,0,0,0,0|2,0,0]=4 930 B10R1.113 NC1=CC=CC(C(F)F)=C1 217681 [1,1,0,0,0,0|2,0,0]=4 931 B10R1.31 CC(C)C1=NC(CCl)=CS1 016130 [0,1,0,0,1,0|2,0,0]=4 932 B10R1.55 CC1=NC(C(C)(C)C)=CS1 017137 [0,1,0,0,1,0|2,0,0]=4 933 B10R1.58 CC(C)C1=NN(C)C(N)=C1 021515 [0,1,0,0,1,0|2,0,0]=4 934 B10R1.58 CC1=C(C)SC(C(C)C)=N1 009625 [0,1,0,0,1,0|2,0,0]=4 935 B12R1.4 C(F)(F)OC1=CC=C(CBr)C=C1 004834 [0,1,0,0,0,1|2,0,0]=4 936 B12R1.4 C(F)(F)OC1=CC=C(CN)C=C1 007860 [0,1,0,0,0,1|2,0,0]=4 937 B12R1.4 C(F)(F)OC1=CC=C(CO)C=C1 007857 [0,1,0,0,0,1|2,0,0]=4 938 B12R1.4 CC(=O)NC1=CC=C(CCl)C=C1 018145 [0,1,0,0,0,1|1,0,1]=4 939 B12R1.4 CC(C)OC1=CC=C(C=O)C=C1 014193 [0,1,0,0,0,1|0,0,1]=3 940 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 023446 [0,1,0,0,0,1|0,0,0]=2 941 B12R1.4 CC(C)OC1=CC=C(CO)C=C1 303185 [0,1,0,0,0,1|0,0,0]=2 942 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 003622 [0,1,0,0,0,1|1,0,1]=4 943 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 091550 [0,1,0,0,0,1|1,0,1]=4 944 B12R1.4 COC1=CC=C(SC(C)C)C=C1 097693 [0,1,0,0,0,1|0,0,0]=2 945 B12R1.19 CC(C)OC1=CC(F)=C(Cl)C=C1 094398 [0,1,0,0,0,1|1,0,0]=3 946 B12R1.19 CC(C)OC1=CC=C(Br)C(F)=C1 227656 [0,1,0,0,0,1|1,0,0]=3 947 B12R1.20 CC(Br)C(=O)C1=CC=C(Br)C=C1 104322 [0,1,0,0,0,1|2,0,0]=4 948 B12R1.20 CC(Br)C(=O)C1=CC=C(Br)C=C1 511321 [0,1,0,0,0,1|2,0,0]=4 949 B12R1.20 CN(C)C(=O)C1=CC=C(Br)C=C1 080305 [0,1,0,0,0,1|2,0,0]=4 950 B12R1.20 CN(C)C(=O)C1=CC=C(I)C=C1 222795 [0,1,0,0,0,1|2,0,0]=4 951 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 094941 [0,1,0,0,0,1|1,0,1]=4 952 B12R1.106 CC(C)(C)OC1=CC=C(Br)C=C1 401634 [0,1,0,0,0,1|1,0,0]=3 953 B12R1.106 CC(C)(C)OC1=CC=C(N)C=C1 209401 [0,1,0,0,0,1|1,0,0]=3 954 B12R1.106 CC(C)(C)OC1=CC=C(O)C=C1 013127 [0,1,0,0,0,1|1,0,0]=3 955 B12R1.106 CC1=CC=C(CC(F)(F)F)C=C1 094943 [0,1,0,0,0,1|2,0,0]=4 956 B12R1.233 CC(=O)NC1=CC=C(C)C=C1C 099517 [0,1,0,0,0,1|1,0,1]=4 957 B12R1.233 CC(C)OC1=C(Br)C=C(F)C=C1 013243 [0,1,0,0,0,1|1,0,0]=3 958 B12R1.233 CC1=CC(Br)=CC=C1OC(C)C 038827 [0,1,0,0,0,1|1,0,0]=3 959 B12R1.233 CC1=CC(N)=C(OC(C)C)C=C1 036189 [0,1,0,0,0,1|0,0,0]=2 960 B12R1.233 CC1=CC(N)=C(OC(C)C)C=C1 105078 [0,1,0,0,0,1|0,0,0]=2 961 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 103391 [0,2,0,0,0,0|1,0,1]=4 962 B12R1.5 CCC(C)C1=CC=C(OC)C=C1 104314 [0,2,0,0,0,0|0,0,0]=2 963 B12R1.5 CCC1=CC=C(C(=O)NC)C=C1 104633 [0,2,0,0,0,0|1,0,1]=4 964 B12R1.5 CCC1=CC=C(C(=O)OC)C=C1 098476 [0,2,0,0,0,0|1,0,1]=4 965 B12R1.5 COC(=O)C1=CC=C(CBr)C=C1 036150 [0,2,0,0,0,0|1,0,1]=4 966 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 017350 [0,2,0,0,0,0|1,0,1]=4 967 B12R1.5 COC(=O)C1=CC=C(CO)C=C1 329989 [0,2,0,0,0,0|1,0,1]=4 968 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 037871 [0,2,0,0,0,0|1,0,1]=4 969 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 018070 [0,2,0,0,0,0|1,0,1]=4 970 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 223112 [0,2,0,0,0,0|1,0,1]=4 971 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 076576 [0,2,0,0,0,0|1,0,1]=4 972 B12R1.5 COC1=CC=C(C(=O)CO)C=C1 329409 [0,2,0,0,0,0|1,0,1]=4 973 B12R1.5 COC1=CC=C(\C(C)=N\O)C=C1 056434 [0,2,0,0,0,0|1,0,1]=4 974 B12R1.6 C#CC1=CC=C(C(C)(C)C)C=C1 009071 [0,2,0,0,0,0|0,0,1]=3 975 B12R1.6 CC(C)(C)C1=CC=C(C#N)C=C1 018336 [0,2,0,0,0,0|0,0,1]=3 976 B12R1.6 CC(C)(C)C1=CC=C(C=O)C=C1 065159 [0,2,0,0,0,0|0,0,1]=3 977 B12R1.6 CC(C)(C)C1=CC=C(CBr)C=C1 024236 [0,2,0,0,0,0|0,0,0]=2 978 B12R1.6 CC(C)(C)C1=CC=C(CCl)C=C1 209897 [0,2,0,0,0,0|0,0,0]=2 979 B12R1.6 CC(C)(C)C1=CC=C(CN)C=C1 008874 [0,2,0,0,0,0|0,0,0]=2 980 B12R1.6 CC(C)(C)C1=CC=C(CO)C=C1 008827 [0,2,0,0,0,0|0,0,0]=2 981 B12R1.6 CC(C)(C)C1=CC=C(CS)C=C1 018337 [0,2,0,0,0,0|0,0,0]=2 982 B12R1.6 CCC1=CC=C(C(F)(F)F)C=C1 070030 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.6 COC1=CC=C(C(C)(C)C)C=C1 226271 [0,2,0,0,0,0|0,0,0]=2 984 B12R1.6 COC1=CC=C(C(F)(F)F)C=C1 013386 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.6 COC1=CC=C(S(C)(=O)=O)C=C1 019363 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.6 CS(=O)(=O)C1=CC=C(CBr)C=C1 077957 [0,2,0,0,0,0|2,0,0]=4 987 B12R1.6 CS(=O)(=O)C1=CC=C(CCl)C=C1 018869 [0,2,0,0,0,0|2,0,0]=4 988 B12R1.6 CS(=O)(=O)C1=CC=C(CN)C=C1 023367 [0,2,0,0,0,0|2,0,0]=4 989 B12R1.6 CS(=O)(=O)C1=CC=C(CN)C=C1 236675 [0,2,0,0,0,0|2,0,0]=4 990 B12R1.6 CS(=O)(=O)C1=CC=C(CO)C=C1 038251 [0,2,0,0,0,0|2,0,0]=4 991 B12R1.6 FC(F)(F)C1=CC=C(CBr)C=C1 007607 [0,2,0,0,0,0|2,0,0]=4 992 B12R1.6 FC(F)(F)C1=CC=C(CCl)C=C1 007610 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.6 FC(F)(F)C1=CC=C(CS)C=C1 024355 [0,2,0,0,0,0|2,0,0]=4 994 B12R1.6 NCC1=CC=C(C(F)(F)F)C=C1 007604 [0,2,0,0,0,0|2,0,0]=4 995 B12R1.6 OCC1=CC=C(C(F)(F)F)C=C1 002182 [0,2,0,0,0,0|2,0,0]=4 996 B12R1.48 COC1=C(Br)C=C(C(C)=O)C=C1 015345 [0,2,0,0,0,0|1,0,1]=4 997 B12R1.48 COC1=C(Br)C=C(C(C)O)C=C1 104455 [0,2,0,0,0,0|1,0,0]=3 998 B12R1.48 COC1=C(Cl)C=C(C(C)=O)C=C1 013883 [0,2,0,0,0,0|1,0,1]=4 999 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 006261 [0,2,0,0,0,0|1,0,1]=4 1000 B12R1.48 COC1=C(F)C=C(C(C)N)C=C1 013353 [0,2,0,0,0,0|1,0,0]=3 1001 B12R1.113 CC(C)C1=CC=C(CC#N)C=C1 151200 [0,2,0,0,0,0|0,0,0]=2 1002 B12R1.113 CC(C)C1=CC=C(N=C=O)C=C1 025634 [0,2,0,0,0,0|0,0,1]=3 1003 B12R1.113 CC(C)C1=CC=C(N=C=S)C=C1 002627 [0,2,0,0,0,0|0,0,1]=3 1004 B12R1.113 CCOC1=CC=C(C(C)=O)C=C1 018653 [0,2,0,0,0,0|1,0,1]=4 1005 B12R1.113 CCSC1=CC=C(C(C)=O)C=C1 022394 [0,2,0,0,0,0|1,0,1]=4 1006 B12R1.113 CN(C)C1=CC=C(CCN)C=C1 391567 [0,2,0,0,0,0|1,0,0]=3 1007 B12R1.113 CN(C)C1=CC=C(CCO)C=C1 216002 [0,2,0,0,0,0|1,0,0]=3 1008 B12R1.113 CN(C)C1=CC=C(N=C=O)C=C1 050902 [0,2,0,0,0,0|1,0,1]=4 1009 B12R1.113 CN(C)C1=CC=C(N=C=S)C=C1 005974 [0,2,0,0,0,0|1,0,1]=4 1010 B12R1.113 CN(C)C1=CC=C(SC#N)C=C1 349266 [0,2,0,0,0,0|1,0,1]=4 1011 B12R1.256 CC(=O)C1=CC=C(C(C)=O)C=C1 240796 [0,2,0,0,0,0|1,0,1]=4 1012 B12R1.256 CC(=O)C1=CC=C(C(C)C)C=C1 022395 [0,2,0,0,0,0|0,0,0]=2 1013 B12R1.256 CC(C)C1=CC=C(B(O)O)C=C1 045292 [0,2,0,0,0,0|1,0,0]=3 1014 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=C1 044335 [0,2,0,0,0,0|0,0,1]=3 1015 B12R1.256 CC(C)C1=CC=C([N+](=O)[O-])C=C1 216322 [0,2,0,0,0,0|1,0,0]=3 1016 B12R1.256 CC(O)C1=CC=C([N+](=O)[O-])C=C1 373534 [0,2,0,0,0,0|2,0,0]=4 1017 B12R1.256 CN(C)C1=CC=C(B(O)O)C=C1 046990 [0,2,0,0,0,0|2,0,0]=4 1018 B12R1.256 CN(C)C1=CC=C(C(=O)Cl)C=C1 066659 [0,2,0,0,0,0|1,0,1]=4 1019 B12R1.256 CN(C)C1=CC=C(C(=O)O)C=C1 223719 [0,2,0,0,0,0|1,0,1]=4 1020 B12R1.256 FC(F)C1=CC=C(C(F)F)C=C1 234377 [0,2,0,0,0,0|2,0,0]=4 1021 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 006260 [0,2,0,0,0,0|1,0,1]=4 1022 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 209417 [0,2,0,0,0,0|1,0,1]=4 1023 B12R1.9 CC(C)(C#N)C1=CC=C(N)C=C1 068275 [0,2,0,0,0,0|1,0,0]=3 1024 B12R1.9 CC1=CC=C(S(=O)(=O)CCl)C=C1 330036 [0,2,0,0,0,0|2,0,0]=4 1025 B12R1.9 CCS(=O)(=O)C1=CC=C(C)C=C1 095058 [0,2,0,0,0,0|2,0,0]=4 1026 B12R1.9 CNS(=O)(=O)C1=CC=C(C)C=C1 242909 [0,2,0,0,0,0|2,0,0]=4 1027 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 158300 [0,2,0,0,0,0|2,0,0]=4 1028 B12R1.23 CC(C)(C)C1=CC(Br)=C(Br)C=C1 035664 [0,2,0,0,0,0|1,0,0]=3 1029 B12R1.23 CC(C)(C)C1=CC(Br)=C(Cl)C=C1 035663 [0,2,0,0,0,0|1,0,0]=3 1030 B12R1.23 CC(C)(C)C1=CC(Br)=C(I)C=C1 035665 [0,2,0,0,0,0|1,0,0]=3 1031 B12R1.23 CC(C)(C)C1=CC(Br)=C(O)C=C1 043681 [0,2,0,0,0,0|1,0,0]=3 1032 B12R1.23 CC(C)(C)C1=CC=C(N)C(Br)=C1 023849 [0,2,0,0,0,0|1,0,0]=3 1033 B12R1.23 CC(C)(C)C1=CC=C(N)C(N)=C1 017188 [0,2,0,0,0,0|1,0,0]=3 1034 B12R1.23 CC(C)(C)C1=CC=C(O)C(N)=C1 225403 [0,2,0,0,0,0|1,0,0]=3 1035 B12R1.23 CC(C)(C)C1=CC=C(O)C(O)=C1 209430 [0,2,0,0,0,0|1,0,0]=3 1036 B12R1.23 CC(F)(F)C1=CC(Br)=C(F)C=C1 038368 [0,2,0,0,0,0|2,0,0]=4 1037 B12R1.23 CC1=C(C)C=C(C(F)(F)F)C=C1 009152 [0,2,0,0,0,0|2,0,0]=4 1038 B12R1.23 CC1=C(C)C=C(S(C)(=O)=O)C=C1 019361 [0,2,0,0,0,0|2,0,0]=4 1039 B12R1.23 CC1=C(Cl)C=C(C(F)(F)F)C=C1 044281 [0,2,0,0,0,0|2,0,0]=4 1040 B12R1.23 CC1=C(F)C=C(C(F)(F)F)C=C1 044597 [0,2,0,0,0,0|2,0,0]=4 1041 B12R1.23 CC1=C(N)C=C(C(F)(F)F)C=C1 007826 [0,2,0,0,0,0|2,0,0]=4 1042 B12R1.23 CC1=CC=C(C(F)(F)F)C=C1Br 091490 [0,2,0,0,0,0|2,0,0]=4 1043 B12R1.126 CC(F)(F)C1=C(Br)C=C(F)C=C1 038367 [0,2,0,0,0,0|2,0,0]=4 1044 B12R1.126 CC(F)(F)C1=C(Cl)C=C(Cl)C=C1 101903 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.126 CC1=CC(Br)=C(C(F)(F)F)C=C1 062792 [0,2,0,0,0,0|2,0,0]=4 1046 B12R1.126 CC1=CC(C)=C(S(C)(=O)=O)C=C1 019358 [0,2,0,0,0,0|2,0,0]=4 1047 B12R1.126 CC1=CC(Cl)=C(C(F)(F)F)C=C1 007837 [0,2,0,0,0,0|2,0,0]=4 1048 B12R1.126 CC1=CC(F)=C(C(F)(F)F)C=C1 035776 [0,2,0,0,0,0|2,0,0]=4 1049 B12R1.126 CC1=CC=C(C(C)(C)C)C(O)=C1 224474 [0,2,0,0,0,0|0,0,0]=2 1050 B12R1.126 CC1=CC=C(C(F)(F)F)C(C)=C1 062698 [0,2,0,0,0,0|2,0,0]=4 1051 B12R1.232 CC(=O)C1=CC(Br)=C(C)C=C1O 494247 [0,2,0,0,0,0|1,0,1]=4 1052 B12R1.232 CC(=O)C1=CC(Cl)=C(C)C=C1O 012071 [0,2,0,0,0,0|1,0,1]=4 1053 B12R1.367 COC(=O)C1=CC(C)=C(C)C=C1 066808 [0,2,0,0,0,0|1,0,1]=4 1054 B12R1.367 COC(=O)C1=CC(Cl)=C(C)C=C1 066816 [0,2,0,0,0,0|1,0,1]=4 1055 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 066828 [0,2,0,0,0,0|1,0,1]=4 1056 B12R1.367 COC(=O)C1=CC(O)=C(C)C=C1 066815 [0,2,0,0,0,0|1,0,1]=4 1057 B12R1.367 COC(=O)C1=CC=C(C)C(Br)=C1 078944 [0,2,0,0,0,0|1,0,1]=4 1058 B12R1.367 COC(=O)C1=CC=C(C)C(F)=C1 078364 [0,2,0,0,0,0|1,0,1]=4 1059 B12R1.1005 CC(C)C1=CC(Br)=C(N)C(Br)=C1 023322 [0,2,0,0,0,0|1,0,0]=3 1060 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 129800 [0,2,0,0,0,0|2,0,0]=4 1061 B12R1.16 CC1=CC=C(C(=O)CC#N)C=C1 206989 [0,2,0,0,0,0|1,0,1]=4 1062 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 242531 [0,2,0,0,0,0|1,0,1]=4 1063 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 339744 [0,2,0,0,0,0|2,0,0]=4 1064 B12R1.16 C[C@@H](N=C=S)C1=CC=C(Br)C=C1 103205 [0,2,0,0,0,0|1,0,1]=4 1065 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 040399 [0,2,0,0,0,0|2,0,0]=4 1066 B12R1.16 N[C@H](CCO)C1=CC=C(Cl)C=C1 034404 [0,2,0,0,0,0|2,0,0]=4 1067 B12R1.1703 CC1=CC=C(C(=O)CBr)C(C)=C1 211289 [0,2,0,0,0,0|1,0,1]=4 1068 B12R1.1703 COC(=O)C1=C(Cl)C=C(C)C=C1 099557 [0,2,0,0,0,0|1,0,1]=4 1069 B12R1.1703 COC(=O)C1=CC=C(C)C=C1Br 078837 [0,2,0,0,0,0|1,0,1]=4 1070 B12R1.1703 COC(=O)C1=CC=C(C)C=C1C 337152 [0,2,0,0,0,0|1,0,1]=4 1071 B12R1.1703 COC(=O)C1=CC=C(C)C=C1F 472716 [0,2,0,0,0,0|1,0,1]=4 1072 B12R1.1703 COC(=O)C1=CC=C(C)C=C1O 222920 [0,2,0,0,0,0|1,0,1]=4 1073 B12R1.57 COC1=C(C(C)C)C=CC(C)=C1 103225 [0,2,0,0,0,0|0,0,0]=2 1074 B12R1.1000 CC(=O)C1=C(C)C=C(C)C=C1C 002623 [0,2,0,0,0,0|1,0,1]=4 1075 B10R2.31 BrC1=CC=C2CCC2=C1 079227 [1,0,0,1,0,0|1,0,0]=3 1076 B10R2.6 C1=CC=C(C2CC2)C=C1 049412 [1,0,0,1,0,0|0,0,0]=2 1077 B10R2.6 C1=CC=C(C2CO2)C=C1 227689 [1,0,0,1,0,0|1,0,0]=3 1078 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 221507 [1,0,0,1,0,0|1,0,0]=3 1079 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 223292 [1,0,0,1,0,0|1,0,0]=3 1080 B12R2.606 CC1=CC=C2NC(C)=CC2=C1 023432 [0,0,0,1,0,1|0,0,2]=4 1081 B12R2.606 CC1=CC=C2[Se]C(C)=NC2=C1 101840 [0,0,0,1,0,1|1,0,1]=4 1082 B12R2.290 NC1(C2=CC=C(Br)C=C2)CC1 210797 [0,1,0,1,0,0|1,0,0]=3 1083 B12R2.290 NC1(C2=CC=C(F)C=C2)CC1 209071 [0,1,0,1,0,0|1,0,0]=3 1084 B8R1.1 CC1=CC=C(CN)O1 225706 [1,0,0,0,1,0|2,0,0]=4 1085 B8R1.1 CC1=CC=C(CO)O1 013649 [1,0,0,0,1,0|2,0,0]=4 1086 B8R1.1 CC1=CC=C(CO)S1 362444 [1,0,0,0,1,0|2,0,0]=4 1087 B8R1.1 CC1=CSC(CN)=C1 023898 [1,0,0,0,1,0|2,0,0]=4 1088 B8R1.1 CCC1=NC=C(C)N1 403581 [1,0,0,0,1,0|2,0,0]=4 1089 B8R1.1 CCN1C=C[N+](C)=C1 245878 [1,0,0,0,1,0|2,0,0]=4 1090 B8R1.7 CC(C)C1=NC=CN1 235680 [1,0,0,0,1,0|2,0,0]=4 1091 B8R1.7 CC(N)C1=CC=CS1 044441 [1,0,0,0,1,0|2,0,0]=4 1092 B10R1.18 CC(=O)NC1=CC=CC=C1 098888 [1,0,0,0,0,1|1,0,1]=4 1093 B10R1.18 CC(=O)NC1=CC=CC=C1 236729 [1,0,0,0,0,1|1,0,1]=4 1094 B10R1.18 CC(=O)OC1=CC=CC=C1 106321 [1,0,0,0,0,1|1,0,1]=4 1095 B10R1.18 CC(=O)SC1=CC=CC=C1 180205 [1,0,0,0,0,1|1,0,1]=4 1096 B10R1.18 CC(Br)CC1=CC=CC=C1 243231 [1,0,0,0,0,1|1,0,0]=3 1097 B10R1.18 CC(C)CC1=CC=NC=C1 032546 [1,0,0,0,0,1|1,0,0]=3 1098 B10R1.18 CC(C)NC1=CC=CC=C1 079480 [1,0,0,0,0,1|0,0,0]=2 1099 B10R1.18 CC(C)OC1=CC=CC=C1 038454 [1,0,0,0,0,1|0,0,0]=2 1100 B10R1.18 CC(O)CC1=CC=CC=C1 339985 [1,0,0,0,0,1|1,0,0]=3 1101 B10R1.18 CN(C)CC1=CC=CC=C1 102405 [1,0,0,0,0,1|1,0,0]=3 1102 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 036085 [1,0,0,0,0,1|1,0,0]=3 1103 B10R1.18 C[C@H](O)CC1=CC=CC=C1 036086 [1,0,0,0,0,1|1,0,0]=3 1104 B12R1.21 CC(=O)CSC1=CC=C(C)C=C1 003767 [0,0,0,0,0,2|1,0,1]=4 1105 B12R1.21 CC(C)COC1=CC=C(N)C=C1 038448 [0,0,0,0,0,2|1,0,0]=3 1106 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 008895 [0,0,0,0,0,2|2,0,0]=4 1107 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 239138 [0,0,0,0,0,2|2,0,0]=4