0 B10R1.15 C(=O)C(C)C1=CC=CC=C1 003859 [0,0,0,0,0,0|1,0,1]=2 1 B10R1.15 CC(C#N)C1=CC=CC=C1 001059 [0,0,0,0,0,0|0,0,2]=2 2 B10R1.15 CC(CN)C1=CC=CC=C1 008888 [0,0,0,0,0,0|0,0,0]=0 3 B10R1.15 CCC(=O)C1=CC=CC=C1 094675 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.15 CCC(=O)C1=CC=CN=C1 494152 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.15 CCC(=O)C1=CC=NC=C1 218389 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.15 CCC(C)C1=CC=CC=C1 094615 [0,0,0,0,0,0|1,0,0]=1 7 B10R1.15 CCC(O)C1=CC=CC=C1 242652 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.15 CCN(C)C1=CC=CC=C1 092421 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 208825 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 103637 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.15 CC[C@H](N)C1=CC=CC=C1 227613 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.15 CN(C=O)C1=CC=CC=C1 208822 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.15 CNC(=O)C1=CC=CC=C1 341719 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.15 CNC(=S)C1=CC=CC=C1 180197 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.15 CNC(C)C1=CC=CC=C1 371108 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.15 CN[C@H](C)C1=CC=CC=C1 337064 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.15 COC(=O)C1=CC=CC=C1 223218 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.15 COS(=O)C1=CC=CC=C1 023251 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.15 C\C(=N/O)C1=CC=CN=C1 075987 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.15 C\C(=N/O)C1=CC=NC=C1 076004 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.15 C\C(=N/O)C1=NC=CC=C1 075986 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.15 N#CC(=O)C1=CC=CC=C1 241276 [0,0,0,0,0,0|1,0,3]=4 23 B10R1.15 N#CC(O)C1=CC=CC=C1 403371 [0,0,0,0,0,0|1,0,2]=3 24 B10R1.15 N#C[C@@H](N)C1=CC=CC=C1 324116 [0,0,0,0,0,0|1,0,2]=3 25 B10R1.15 NC(CO)C1=CC=CC=C1 364268 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.15 NCC(=O)C1=CC=CC=C1 040292 [0,0,0,0,0,0|1,0,1]=2 27 B10R1.15 NCC(O)C1=CC=CC=C1 008897 [0,0,0,0,0,0|1,0,0]=1 28 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 318280 [0,0,0,0,0,0|1,0,0]=1 29 B10R1.15 NC[C@H](O)C1=CC=CC=C1 077860 [0,0,0,0,0,0|1,0,0]=1 30 B10R1.15 NNC(=O)C1=CC=CC=C1 227678 [0,0,0,0,0,0|2,0,1]=3 31 B10R1.15 NNC(=O)C1=CC=CC=N1 060583 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.15 NNC(=O)C1=CC=CN=C1 M02155 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.15 NNC(=O)C1=CC=NC=C1 236758 [0,0,0,0,0,0|3,0,1]=4 34 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 040100 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.15 N[C@H](CO)C1=CC=CC=C1 034311 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.15 N\C(=N/O)C1=CC=CC=C1 067963 [0,0,0,0,0,0|3,0,1]=4 37 B10R1.15 N\C(=N/O)C1=CC=CC=C1 097873 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.15 N\C(=N\O)C1=CC=CC=C1 106200 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.15 O=C(CBr)C1=CC=CC=C1 040508 [0,0,0,0,0,0|2,0,1]=3 40 B10R1.15 O=C(CBr)C1=CC=CN=C1 005885 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.15 O=C(CBr)C1=CC=NC=C1 017122 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.15 O=C(CBr)C1=NC=CC=C1 005884 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.15 O=C(CCl)C1=CC=CC=C1 228091 [0,0,0,0,0,0|2,0,1]=3 44 B10R1.15 O=C(CO)C1=CC=CC=C1 219236 [0,0,0,0,0,0|2,0,1]=3 45 B10R1.15 O=C(NO)C1=CC=CC=C1 317419 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.15 O=CC(=O)C1=CC=CC=C1 454875 [0,0,0,0,0,0|2,0,2]=4 47 B10R1.15 O[C@H](CCl)C1=CC=CC=C1 103828 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.6 BrC(Br)C1=CC=CC=C1 243023 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.6 C=C(C)C1=CC=CC=C1 245708 [1,0,0,0,0,0|0,0,2]=3 50 B9R1.6 CC(=O)C1=CC=CC=C1 043319 [1,0,0,0,0,0|1,0,1]=3 51 B9R1.6 CC(=O)C1=CC=CN=C1 032763 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.6 CC(=O)C1=CC=NC=C1 033067 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.6 CC(=O)C1=NC=CC=C1 044389 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.6 CC(Br)C1=CC=CC=C1 001003 [1,0,0,0,0,0|1,0,0]=2 55 B9R1.6 CC(C)C1=CC=CC=C1 094649 [1,0,0,0,0,0|0,0,0]=1 56 B9R1.6 CC(C)C1=CC=NC=C1 024693 [1,0,0,0,0,0|1,0,0]=2 57 B9R1.6 CC(C)C1=NC=CC=C1 078691 [1,0,0,0,0,0|1,0,0]=2 58 B9R1.6 CC(N)C1=CC=CC=C1 208695 [1,0,0,0,0,0|0,0,0]=1 59 B9R1.6 CC(N)C1=CC=NC=C1 030534 [1,0,0,0,0,0|1,0,0]=2 60 B9R1.6 CC(N)C1=CC=NC=C1 097930 [1,0,0,0,0,0|1,0,0]=2 61 B9R1.6 CC(N)C1=CN=CC=C1 030750 [1,0,0,0,0,0|1,0,0]=2 62 B9R1.6 CC(N)C1=NC=CC=C1 060819 [1,0,0,0,0,0|1,0,0]=2 63 B9R1.6 CC(O)C1=CC=CC=C1 098924 [1,0,0,0,0,0|1,0,0]=2 64 B9R1.6 CC(O)C1=CC=CN=C1 094012 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.6 CC(O)C1=NC=CC=C1 088389 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.6 CN(C)C1=CC=CC=C1 098810 [1,0,0,0,0,0|1,0,0]=2 67 B9R1.6 CN(C)C1=CC=CN=C1 032574 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.6 CN(C)C1=CC=NC=C1 001704 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.6 CN(C)C1=CC=NC=C1 133700 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.6 CN(C)C1=NC=CC=C1 219108 [1,0,0,0,0,0|2,0,0]=3 71 B9R1.6 CS(=O)C1=CC=CC=C1 180124 [1,0,0,0,0,0|2,0,0]=3 72 B9R1.6 C[C@@H](N)C1=CC=CC=C1 037431 [1,0,0,0,0,0|0,0,0]=1 73 B9R1.6 C[C@@H](N)C1=NC=CC=C1 078110 [1,0,0,0,0,0|1,0,0]=2 74 B9R1.6 C[C@@H](O)C1=CC=CC=C1 222634 [1,0,0,0,0,0|1,0,0]=2 75 B9R1.6 C[C@H](N)C1=CC=CC=C1 037432 [1,0,0,0,0,0|0,0,0]=1 76 B9R1.6 C[SiH](C)C1=CC=CC=C1 S13425 [1,0,0,0,0,0|0,1,0]=2 77 B9R1.6 C[SiH](Cl)C1=CC=CC=C1 S13525 [1,0,0,0,0,0|1,1,0]=3 78 B9R1.6 ClP(Cl)C1=CC=CC=C1 223201 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.6 Cl[SiH](Cl)C1=CC=CC=C1 S13350 [1,0,0,0,0,0|2,1,0]=4 80 B9R1.6 FC(F)C1=CC=CC=C1 035819 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.6 FC(F)C1=CC=CC=N1 050442 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.6 FC(F)C1=CC=NC=C1 050447 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.6 FC(F)C1=CN=CC=C1 050443 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.6 N=C(N)C1=CC=CC=C1 044622 [1,0,0,0,0,0|1,0,1]=3 85 B9R1.6 N=C(N)C1=CC=CC=C1 067951 [1,0,0,0,0,0|1,0,1]=3 86 B9R1.6 N=C(N)C1=CC=CC=C1 099104 [1,0,0,0,0,0|1,0,1]=3 87 B9R1.6 N=C(N)C1=CC=CC=C1 102340 [1,0,0,0,0,0|1,0,1]=3 88 B9R1.6 N=C(N)C1=CC=CC=N1 044914 [1,0,0,0,0,0|2,0,1]=4 89 B9R1.6 N=C(N)C1=CC=CN=C1 068345 [1,0,0,0,0,0|2,0,1]=4 90 B9R1.6 N=C(N)C1=CC=NC=C1 209227 [1,0,0,0,0,0|2,0,1]=4 91 B9R1.6 NC(=O)C1=CC=CC=C1 099462 [1,0,0,0,0,0|1,0,1]=3 92 B9R1.6 NC(=O)C1=CC=NC=C1 079012 [1,0,0,0,0,0|2,0,1]=4 93 B9R1.6 NC(=O)C1=CN=CC=C1 239905 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.6 NC(=O)C1=NC=CC=C1 235663 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.6 NC(=S)C1=CC=CC=C1 067940 [1,0,0,0,0,0|1,0,1]=3 96 B9R1.6 NC(=S)C1=CC=CN=C1 021345 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.6 NC(=S)C1=CC=NC=C1 021346 [1,0,0,0,0,0|2,0,1]=4 98 B9R1.6 NC(=S)C1=NC=CC=C1 021344 [1,0,0,0,0,0|2,0,1]=4 99 B9R1.6 O=C(Cl)C1=CC=CC=C1 097787 [1,0,0,0,0,0|2,0,1]=4 100 B9R1.6 O=C(Cl)C1=CC=CC=C1 102565 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.6 O=C(O)C1=CC=CC=C1 102544 [1,0,0,0,0,0|2,0,1]=4 102 B9R1.6 O=C(O)C1=CC=CC=C1 237766 [1,0,0,0,0,0|2,0,1]=4 103 B9R1.6 O=C([O-])C1=CC=CC=C1 094455 [1,0,0,0,0,0|2,0,1]=4 104 B9R1.6 O=C([O-])C1=CC=CC=C1 095369 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.6 O=C([O-])C1=CC=CC=C1 099144 [1,0,0,0,0,0|2,0,1]=4 106 B9R1.6 O=C([O-])C1=CC=CC=C1 239403 [1,0,0,0,0,0|2,0,1]=4 107 B9R1.6 O=S([O-])C1=CC=CC=C1 003814 [1,0,0,0,0,0|3,0,0]=4 108 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 094600 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.6 O=[PH](O)C1=CC=CC=C1 003643 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.6 O=[Se](O)C1=CC=CC=C1 005551 [1,0,0,0,0,0|3,0,0]=4 111 B9R1.6 OB(O)C1=CC=CC=C1 019491 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.8 BrCCC1=CC=CC=C1 019261 [1,0,0,0,0,0|1,0,0]=2 113 B9R1.8 Br\C=C\C1=CC=CC=C1 049835 [1,0,0,0,0,0|1,0,2]=4 114 B9R1.8 C#CCC1=CC=CC=C1 080054 [1,0,0,0,0,0|1,0,1]=3 115 B9R1.8 C=CCC1=CC=CC=C1 005425 [1,0,0,0,0,0|1,0,1]=3 116 B9R1.8 C=CC[N+]1=CC=CC=C1 181022 [1,0,0,0,0,0|2,0,1]=4 117 B9R1.8 C=CSC1=CC=CC=C1 008052 [1,0,0,0,0,0|2,0,1]=4 118 B9R1.8 CC#CC1=CC=CC=C1 166000 [1,0,0,0,0,0|1,0,2]=4 119 B9R1.8 CCCC1=CC=CC=C1 095067 [1,0,0,0,0,0|1,0,0]=2 120 B9R1.8 CCCC1=CC=NC=C1 235894 [1,0,0,0,0,0|2,0,0]=3 121 B9R1.8 CCCC1=NC=CC=C1 242850 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.8 CCCC1=NC=CN=C1 002735 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.8 CCNC1=CC=CC=C1 216665 [1,0,0,0,0,0|2,0,0]=3 124 B9R1.8 CCOC1=CC=CC=C1 098890 [1,0,0,0,0,0|2,0,0]=3 125 B9R1.8 CCOC1=NC=CC=C1 049694 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.8 CCSC1=CC=CC=C1 001759 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.8 CCSC1=NC=CC=C1 095363 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.8 CNCC1=CC=CC=C1 020695 [1,0,0,0,0,0|2,0,0]=3 129 B9R1.8 CNCC1=CC=NC=C1 046176 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.8 CSCC1=CC=CC=C1 099640 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.8 C\C=C/C1=CC=CC=C1 167700 [1,0,0,0,0,0|1,0,2]=4 132 B9R1.8 C\C=C\C1=CC=CC=C1 018868 [1,0,0,0,0,0|1,0,2]=4 133 B9R1.8 C\N=C\C1=CC=CC=C1 240625 [1,0,0,0,0,0|2,0,1]=4 134 B9R1.8 ClCCC1=CC=CC=C1 208883 [1,0,0,0,0,0|1,0,0]=2 135 B9R1.8 ClCCC1=CC=CC=N1 070463 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.8 Cl[Mg]CC1=CC=CC=C1 103558 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.8 ICCC1=CC=CC=C1 001087 [1,0,0,0,0,0|1,0,0]=2 138 B9R1.8 N#CCC1=NC=CC=C1 047908 [1,0,0,0,0,0|1,0,2]=4 139 B9R1.8 N#C[Se]C1=CC=CC=C1 005429 [1,0,0,0,0,0|1,0,2]=4 140 B9R1.8 NCCC1=CC=CC=C1 046873 [1,0,0,0,0,0|0,0,0]=1 141 B9R1.8 NCCC1=CC=CN=C1 010689 [1,0,0,0,0,0|1,0,0]=2 142 B9R1.8 NCCC1=CC=CN=C1 033239 [1,0,0,0,0,0|1,0,0]=2 143 B9R1.8 NCCC1=CC=CN=C1 065473 [1,0,0,0,0,0|1,0,0]=2 144 B9R1.8 NCCC1=CC=NC=C1 010690 [1,0,0,0,0,0|1,0,0]=2 145 B9R1.8 NCCC1=NC=CC=C1 013702 [1,0,0,0,0,0|1,0,0]=2 146 B9R1.8 NNCC1=CC=CC=C1 036859 [1,0,0,0,0,0|1,0,0]=2 147 B9R1.8 NOCC1=CC=CC=C1 036957 [1,0,0,0,0,0|1,0,0]=2 148 B9R1.8 O=C=NC1=CC=CC=C1 165700 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.8 O=CCC1=CC=CC=C1 098878 [1,0,0,0,0,0|1,0,1]=3 150 B9R1.8 O=CNC1=CC=CC=C1 239406 [1,0,0,0,0,0|2,0,1]=4 151 B9R1.8 O=S=NC1=CC=CC=C1 341767 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.8 OCCC1=CC=CC=C1 222397 [1,0,0,0,0,0|1,0,0]=2 153 B9R1.8 OCCC1=CC=CN=C1 017523 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.8 OCCC1=CC=NC=C1 228335 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.8 OCCC1=NC=CC=C1 223718 [1,0,0,0,0,0|2,0,0]=3 156 B9R1.8 ONCC1=CC=CC=C1 091512 [1,0,0,0,0,0|2,0,0]=3 157 B9R1.8 ONCC1=CC=CC=C1 238633 [1,0,0,0,0,0|2,0,0]=3 158 B9R1.8 S=C=NC1=CC=CC=C1 358191 [1,0,0,0,0,0|2,0,1]=4 159 B11R1.7 C#CC(C)(O)C1=CC=CC=C1 008691 [0,1,0,0,0,0|1,0,1]=3 160 B11R1.7 CCC(C)(C)C1=CC=CC=C1 226678 [0,1,0,0,0,0|1,0,0]=2 161 B11R1.7 CCS(=O)(=O)C1=CC=CC=C1 001288 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.7 C[Si](C)(CCl)C1=CC=CC=C1 S04050 [0,1,0,0,0,0|1,1,0]=3 163 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 034191 [0,1,0,0,0,0|2,0,0]=3 164 B11R1.7 NNS(=O)(=O)C1=CC=CC=C1 449867 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.12 CCC(C#N)C1=CC=CC=C1 099619 [0,1,0,0,0,0|0,0,2]=3 166 B11R1.12 CCC(CC)C1=NC=CC=C1 032554 [0,1,0,0,0,0|2,0,0]=3 167 B11R1.12 CCC(CO)C1=NC=CC=C1 032577 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.12 CCN(CC)C1=CC=CC=C1 043437 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.12 CCN(CC)C1=CC=CC=C1 226653 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.12 COC(OC)C1=CC=CC=C1 018193 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.12 N#CC(C=O)C1=CC=CC=C1 020198 [0,1,0,0,0,0|0,0,3]=4 172 B11R1.16 CC(CC=O)C1=CC=CC=C1 520893 [0,1,0,0,0,0|1,0,0]=2 173 B11R1.16 CC(N=C=S)C1=CC=CC=C1 009523 [0,1,0,0,0,0|1,0,1]=3 174 B11R1.16 CCC[C@@H](O)C1=CC=CC=C1 355875 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.16 CCC[C@H](O)C1=CC=CC=C1 488025 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.16 CCOC(=O)C1=CC=CC=C1 300758 [0,1,0,0,0,0|2,0,1]=4 177 B11R1.16 CCO[PH](=O)C1=CC=CC=C1 230391 [0,1,0,0,0,0|3,0,0]=4 178 B11R1.16 CN(CCO)C1=CC=CC=C1 241296 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.16 CN(CCO)C1=NC=CC=C1 036588 [0,1,0,0,0,0|3,0,0]=4 180 B11R1.16 CNCC(O)C1=CC=CC=C1 402378 [0,1,0,0,0,0|1,0,0]=2 181 B11R1.16 COCC(=O)C1=CC=CC=C1 321462 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.16 C[C@@H](N=C=O)C1=CC=CC=C1 013633 [0,1,0,0,0,0|1,0,1]=3 183 B11R1.16 C[C@@H](N=C=S)C1=CC=CC=C1 009522 [0,1,0,0,0,0|1,0,1]=3 184 B11R1.16 C[C@H](N=C=O)C1=CC=CC=C1 013634 [0,1,0,0,0,0|1,0,1]=3 185 B11R1.16 C[C@H](N=C=S)C1=CC=CC=C1 009524 [0,1,0,0,0,0|1,0,1]=3 186 B11R1.16 N#CCC(=O)C1=CC=CC=C1 013117 [0,1,0,0,0,0|1,0,2]=4 187 B11R1.16 O=C(CCCl)C1=CC=CC=C1 092658 [0,1,0,0,0,0|2,0,1]=4 188 B11R1.16 O=C(NCO)C1=CC=CC=C1 001083 [0,1,0,0,0,0|2,0,1]=4 189 B11R1.16 O=C(OCCl)C1=CC=CC=C1 209542 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 215518 [0,1,0,0,0,0|0,0,2]=3 191 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 079491 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 019003 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.22 CC1=CC=C(\C(C)=N\O)C=C1 075282 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 001001 [0,1,0,0,0,0|2,0,1]=4 195 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 216656 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 025639 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 001190 [0,1,0,0,0,0|2,0,1]=4 198 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 078553 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.22 CCC(C)C1=CC=C(O)C=C1 098816 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.22 N#CC(N)C1=CC=C(F)C=C1 007824 [0,1,0,0,0,0|1,0,2]=4 201 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 219256 [0,1,0,0,0,0|1,0,1]=3 202 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 030636 [0,1,0,0,0,0|1,0,1]=3 203 B11R1.22 NCC(O)C1=CC=C(O)C=C1 375146 [0,1,0,0,0,0|1,0,0]=2 204 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 018244 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 018360 [0,1,0,0,0,0|2,0,1]=4 206 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 006190 [0,1,0,0,0,0|2,0,1]=4 207 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 018736 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 241205 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 001372 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 036379 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 018027 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 221680 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 219727 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 001629 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.22 O=C(CF)C1=CC=C(O)C=C1 009465 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 003621 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.23 CCC(=O)C1=CC=CC(Br)=C1 114000 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.23 CCC(=O)C1=CC=CC(C)=C1 240661 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.23 C\C(=N/O)C1=CC(Cl)=CC=C1 075943 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.23 C\C(=N\O)C1=CC=CC(N)=C1 076019 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.23 NNC(=O)C1=CC(F)=CC=C1 006189 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.23 NNC(=O)C1=CC(I)=CC=C1 018735 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 018714 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 018243 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.23 NNC(=O)C1=CC=CC(Cl)=C1 018359 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.23 O=C(CBr)C1=CC(Br)=CC=C1 011106 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 017212 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 006313 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 154800 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 003400 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 093725 [0,1,0,0,0,0|1,0,1]=3 232 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 236802 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.36 CC(C)C(C)C1=CC=NC=C1 032640 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.36 CC(C)C(O)C1=CC=CC=C1 242324 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 034471 [0,1,0,0,0,0|1,0,1]=3 236 B11R1.36 NC(=O)C(O)C1=CC=CC=C1 018765 [0,1,0,0,0,0|1,0,1]=3 237 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 068259 [0,1,0,0,0,0|1,0,1]=3 238 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 093739 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 M03223 [0,1,0,0,0,0|2,0,1]=4 240 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 M03226 [0,1,0,0,0,0|2,0,1]=4 241 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 036983 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 093723 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 046847 [0,1,0,0,0,0|2,0,1]=4 244 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 093732 [0,1,0,0,0,0|2,0,1]=4 245 B11R1.36 O=C([O-])C(O)C1=CC=CC=C1 103518 [0,1,0,0,0,0|2,0,1]=4 246 B11R1.222 CC1=C(C(=O)NN)C=CC=C1 019002 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 520894 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.222 CCC(C)C1=C(O)C=CC=C1 099269 [0,1,0,0,0,0|1,0,0]=2 249 B11R1.222 CCC(C)C1=CC=CC=C1N 320033 [0,1,0,0,0,0|1,0,0]=2 250 B11R1.222 C\C(=N/O)C1=CC=CC=C1Cl 076003 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.222 NNC(=O)C1=C(F)C=CC=C1 006188 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.222 NNC(=O)C1=C(O)C=CC=C1 018713 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.222 NNC(=O)C1=CC=CC=C1Cl 018358 [0,1,0,0,0,0|2,0,1]=4 254 B11R1.222 NNC(=O)C1=CC=CC=C1N 018170 [0,1,0,0,0,0|2,0,1]=4 255 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 448702 [0,1,0,0,0,0|2,0,1]=4 256 B11R1.222 O=C(CBr)C1=CC=CC=C1Cl 017237 [0,1,0,0,0,0|2,0,1]=4 257 B11R2.1 CC1=CNC2=CC=CC=C12 068788 [0,0,0,1,0,0|0,0,2]=3 258 B11R2.1 CC1=COC2=CC=CC=C12 013629 [0,0,0,1,0,0|1,0,2]=4 259 B11R2.1 CC1=CSC2=CC=CC=C12 018819 [0,0,0,1,0,0|1,0,2]=4 260 B11R2.1 CC1CNC2=C1C=CC=C2 209516 [0,0,0,1,0,0|0,0,0]=1 261 B11R2.1 CN1C=CC2=C1C=CC=C2 208790 [0,0,0,1,0,0|2,0,1]=4 262 B11R2.1 CN1C=NC2=CC=CC=C21 222302 [0,0,0,1,0,0|1,0,2]=4 263 B11R2.1 CN1N=NC2=CC=CC=C21 018820 [0,0,0,1,0,0|2,0,1]=4 264 B11R2.1 ClC1=NNC2=C1C=CC=C2 076553 [0,0,0,1,0,0|2,0,1]=4 265 B11R2.1 NC1=NNC2=C1C=CC=C2 047410 [0,0,0,1,0,0|2,0,1]=4 266 B11R2.1 NC1CCC2=C1C=CC=C2 219954 [0,0,0,1,0,0|2,0,0]=3 267 B11R2.1 O=C1CCC2=C1C=CC=C2 036208 [0,0,0,1,0,0|2,0,1]=4 268 B11R2.1 O=C1COC2=CC=CC=C12 069095 [0,0,0,1,0,0|2,0,1]=4 269 B11R2.1 OC1CCC2=CC=CC=C21 008845 [0,0,0,1,0,0|2,0,0]=3 270 B11R2.1 O[C@@H]1CCC2=CC=CC=C21 454961 [0,0,0,1,0,0|2,0,0]=3 271 B11R2.1 O[C@H]1CCC2=CC=CC=C21 106570 [0,0,0,1,0,0|2,0,0]=3 272 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 390375 [0,0,0,1,0,0|0,0,0]=1 273 B9R1.11 NCC(O)C1=CC=CS1 019507 [0,0,0,0,1,0|2,0,0]=3 274 B11R1.40 CCC(O)CC1=CC=CC=C1 103563 [0,0,0,0,0,1|2,0,0]=3 275 B11R1.40 C\C(=C/C1=CC=CC=C1)CO 531267 [0,0,0,0,0,1|1,0,1]=3 276 B11R1.40 NNC(=O)NC1=CC=CC=C1 358181 [0,0,0,0,0,1|2,0,1]=4 277 B11R1.40 NNC(=S)NC1=CC=CC=C1 011215 [0,0,0,0,0,1|2,0,1]=4 278 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 M04116 [0,0,0,0,0,1|2,0,0]=3 279 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 317870 [0,0,0,0,0,1|2,0,0]=3 280 B11R1.40 O=C(CBr)NC1=CC=CC=C1 080331 [0,0,0,0,0,1|2,0,1]=4 281 B11R1.40 O=C(CBr)OC1=CC=CC=C1 235583 [0,0,0,0,0,1|2,0,1]=4 282 B11R1.40 O=C(CCl)NC1=CC=CC=C1 307343 [0,0,0,0,0,1|2,0,1]=4 283 B11R1.40 O[C@H](CCl)CC1=CC=CC=C1 036095 [0,0,0,0,0,1|2,0,0]=3 284 B8R1.2 BrCC1=CC=CC=C1 003666 [2,0,0,0,0,0|1,0,0]=3 285 B8R1.2 BrCC1=CC=CN=C1 214585 [2,0,0,0,0,0|2,0,0]=4 286 B8R1.2 BrCC1=CC=NC=C1 067829 [2,0,0,0,0,0|2,0,0]=4 287 B8R1.2 BrCC1=NC=CC=C1 067831 [2,0,0,0,0,0|2,0,0]=4 288 B8R1.2 Br[Mg]C1=CC=CC=C1 103487 [2,0,0,0,0,0|2,0,0]=4 289 B8R1.2 Br[Mg]C1=CC=CC=C1 214282 [2,0,0,0,0,0|2,0,0]=4 290 B8R1.2 C#CC1=CC=CC=C1 003009 [2,0,0,0,0,0|0,0,2]=4 291 B8R1.2 C=CC1=CC=CC=C1 520455 [2,0,0,0,0,0|0,0,2]=4 292 B8R1.2 CCC1=CC=CC=C1 094632 [2,0,0,0,0,0|0,0,0]=2 293 B8R1.2 CCC1=CC=CC=N1 098941 [2,0,0,0,0,0|1,0,0]=3 294 B8R1.2 CCC1=CC=CN=C1 242838 [2,0,0,0,0,0|1,0,0]=3 295 B8R1.2 CCC1=CC=NC=C1 319885 [2,0,0,0,0,0|1,0,0]=3 296 B8R1.2 CCC1=NC=CN=C1 002727 [2,0,0,0,0,0|2,0,0]=4 297 B8R1.2 CC[N+]1=CC=CC=C1 046807 [2,0,0,0,0,0|1,0,0]=3 298 B8R1.2 CNC1=CC=CC=C1 094625 [2,0,0,0,0,0|1,0,0]=3 299 B8R1.2 CNC1=CC=CN=C1 079398 [2,0,0,0,0,0|2,0,0]=4 300 B8R1.2 CNC1=CC=NC=C1 208626 [2,0,0,0,0,0|2,0,0]=4 301 B8R1.2 CNC1=NC=CC=C1 233304 [2,0,0,0,0,0|2,0,0]=4 302 B8R1.2 COC1=CC=CC=C1 M03556 [2,0,0,0,0,0|1,0,0]=3 303 B8R1.2 COC1=CC=CN=C1 079847 [2,0,0,0,0,0|2,0,0]=4 304 B8R1.2 COC1=CC=NC=C1 045194 [2,0,0,0,0,0|2,0,0]=4 305 B8R1.2 COC1=NC=CC=C1 045214 [2,0,0,0,0,0|2,0,0]=4 306 B8R1.2 CSC1=CC=CC=C1 002945 [2,0,0,0,0,0|1,0,0]=3 307 B8R1.2 ClCC1=CC=CC=C1 106800 [2,0,0,0,0,0|1,0,0]=3 308 B8R1.2 ClCC1=CC=CC=N1 026180 [2,0,0,0,0,0|2,0,0]=4 309 B8R1.2 ClCC1=CC=CN=C1 043884 [2,0,0,0,0,0|2,0,0]=4 310 B8R1.2 ClCC1=CC=NC=C1 050512 [2,0,0,0,0,0|2,0,0]=4 311 B8R1.2 Cl[Hg]C1=CC=CC=C1 101463 [2,0,0,0,0,0|2,0,0]=4 312 B8R1.2 Cl[Se]C1=CC=CC=C1 005554 [2,0,0,0,0,0|2,0,0]=4 313 B8R1.2 N#CC1=CC=CC=C1 035786 [2,0,0,0,0,0|0,0,2]=4 314 B8R1.2 N#CC1=CC=CC=C1 102548 [2,0,0,0,0,0|0,0,2]=4 315 B8R1.2 NCC1=CC=CC=C1 098408 [2,0,0,0,0,0|0,0,0]=2 316 B8R1.2 NCC1=CC=CC=C1 241882 [2,0,0,0,0,0|0,0,0]=2 317 B8R1.2 NCC1=CC=CN=C1 078185 [2,0,0,0,0,0|1,0,0]=3 318 B8R1.2 NCC1=CC=NC=C1 065475 [2,0,0,0,0,0|1,0,0]=3 319 B8R1.2 NCC1=CN=CC=N1 043597 [2,0,0,0,0,0|2,0,0]=4 320 B8R1.2 NCC1=NC=CC=C1 009750 [2,0,0,0,0,0|1,0,0]=3 321 B8R1.2 NNC1=CC=CC=C1 079470 [2,0,0,0,0,0|1,0,0]=3 322 B8R1.2 NNC1=CC=CC=C1 098902 [2,0,0,0,0,0|1,0,0]=3 323 B8R1.2 NNC1=CN=CC=C1 044299 [2,0,0,0,0,0|2,0,0]=4 324 B8R1.2 NNC1=NC=CC=C1 093675 [2,0,0,0,0,0|2,0,0]=4 325 B8R1.2 O=NC1=CC=CC=C1 106182 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.2 OCC1=CC=CC=C1 094986 [2,0,0,0,0,0|1,0,0]=3 327 B8R1.2 OCC1=CC=CC=C1 105725 [2,0,0,0,0,0|1,0,0]=3 328 B8R1.2 OCC1=CC=CN=C1 208628 [2,0,0,0,0,0|2,0,0]=4 329 B8R1.2 OCC1=CC=NC=C1 078602 [2,0,0,0,0,0|2,0,0]=4 330 B8R1.2 OCC1=NC=CC=C1 043374 [2,0,0,0,0,0|2,0,0]=4 331 B8R1.2 SCC1=CC=CC=C1 098994 [2,0,0,0,0,0|1,0,0]=3 332 B8R1.2 [C-]#[N+]C1=CC=CC=C1 180012 [2,0,0,0,0,0|1,0,1]=4 333 B8R1.2 [O-]CC1=CC=CC=C1 105697 [2,0,0,0,0,0|1,0,0]=3 334 B10R1.13 C=C(C)C1=CC=C(F)C=C1 002236 [1,1,0,0,0,0|0,0,2]=4 335 B10R1.13 C=C(C)C1=CC=C(O)C=C1 242991 [1,1,0,0,0,0|0,0,2]=4 336 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 002964 [1,1,0,0,0,0|1,0,1]=4 337 B10R1.13 CC(=O)C1=CC=C(C)C=C1 075950 [1,1,0,0,0,0|1,0,1]=4 338 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 003111 [1,1,0,0,0,0|1,0,1]=4 339 B10R1.13 CC(=O)C1=CC=C(F)C=C1 001621 [1,1,0,0,0,0|1,0,1]=4 340 B10R1.13 CC(=O)C1=CC=C(I)C=C1 003065 [1,1,0,0,0,0|1,0,1]=4 341 B10R1.13 CC(=O)C1=CC=C(I)C=C1 147401 [1,1,0,0,0,0|1,0,1]=4 342 B10R1.13 CC(=O)C1=CC=C(N)C=C1 009865 [1,1,0,0,0,0|1,0,1]=4 343 B10R1.13 CC(=O)C1=CC=C(O)C=C1 097596 [1,1,0,0,0,0|1,0,1]=4 344 B10R1.13 CC(C)C1=CC=C(Br)C=C1 005332 [1,1,0,0,0,0|0,0,0]=2 345 B10R1.13 CC(C)C1=CC=C(I)C=C1 037613 [1,1,0,0,0,0|0,0,0]=2 346 B10R1.13 CC(C)C1=CC=C(N)C=C1 044718 [1,1,0,0,0,0|0,0,0]=2 347 B10R1.13 CC(C)C1=CC=C(N)C=N1 064855 [1,1,0,0,0,0|1,0,0]=3 348 B10R1.13 CC(C)C1=CC=C(O)C=C1 224632 [1,1,0,0,0,0|0,0,0]=2 349 B10R1.13 CC(C)C1=CC=C(S)C=C1 350400 [1,1,0,0,0,0|0,0,0]=2 350 B10R1.13 CC(C)C1=CN=C(N)C=C1 091535 [1,1,0,0,0,0|1,0,0]=3 351 B10R1.13 CC(N)C1=CC=C(Br)C=C1 001101 [1,1,0,0,0,0|0,0,0]=2 352 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 065422 [1,1,0,0,0,0|0,0,0]=2 353 B10R1.13 CC(O)C1=CC=C(Br)C=C1 001129 [1,1,0,0,0,0|1,0,0]=3 354 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 002971 [1,1,0,0,0,0|1,0,0]=3 355 B10R1.13 CC(O)C1=CC=C(F)C=C1 001295 [1,1,0,0,0,0|1,0,0]=3 356 B10R1.13 CC1=CC=C(C(=N)N)C=C1 017242 [1,1,0,0,0,0|1,0,1]=4 357 B10R1.13 CC1=CC=C(C(C)C)C=C1 048590 [1,1,0,0,0,0|0,0,0]=2 358 B10R1.13 CC1=CC=C(C(C)C)CC1 099689 [1,1,0,0,0,0|0,0,2]=4 359 B10R1.13 CC1=CC=C(C(C)N)C=C1 075281 [1,1,0,0,0,0|0,0,0]=2 360 B10R1.13 CC1=CC=C(C(C)O)C=C1 494146 [1,1,0,0,0,0|1,0,0]=3 361 B10R1.13 CC1=CC=C(C(C)O)C=N1 024704 [1,1,0,0,0,0|2,0,0]=4 362 B10R1.13 CC1=CC=C(C(N)=O)C=C1 032746 [1,1,0,0,0,0|1,0,1]=4 363 B10R1.13 CC1=CC=C(C(N)=S)C=C1 021339 [1,1,0,0,0,0|1,0,1]=4 364 B10R1.13 CC1=CC=C(N(C)C)C=C1 013933 [1,1,0,0,0,0|1,0,0]=3 365 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 050080 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.13 CC1=CN=C(N(C)C)C=C1 024710 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.13 CN(C)C1=CC=C(Br)C=C1 001369 [1,1,0,0,0,0|1,0,0]=3 368 B10R1.13 CN(C)C1=CC=C(F)C=C1 008560 [1,1,0,0,0,0|1,0,0]=3 369 B10R1.13 CN(C)C1=CC=C(N)C=C1 215686 [1,1,0,0,0,0|1,0,0]=3 370 B10R1.13 CN(C)C1=CC=C(N)C=C1 463347 [1,1,0,0,0,0|1,0,0]=3 371 B10R1.13 CN(C)C1=CC=C(O)C=C1 223309 [1,1,0,0,0,0|1,0,0]=3 372 B10R1.13 CN(C)C1=CC=C(S)C=C1 023125 [1,1,0,0,0,0|1,0,0]=3 373 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 342182 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 050269 [1,1,0,0,0,0|0,0,0]=2 375 B10R1.13 FC(F)C1=CC=C(Br)C=C1 023880 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.13 FC(F)C1=CC=C(Cl)C=C1 050225 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.13 FC1=CC=C(C(F)F)C=C1 024452 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 049070 [1,1,0,0,0,0|1,0,1]=4 379 B10R1.13 N=C(N)C1=CC=C(F)C=C1 061506 [1,1,0,0,0,0|1,0,1]=4 380 B10R1.13 N=C(N)C1=CC=C(N)C=C1 092316 [1,1,0,0,0,0|1,0,1]=4 381 B10R1.13 N=C(N)C1=CC=C(O)C=C1 023564 [1,1,0,0,0,0|1,0,1]=4 382 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 044652 [1,1,0,0,0,0|1,0,1]=4 383 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 240110 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.13 NC(=O)C1=CC=C(F)C=C1 006181 [1,1,0,0,0,0|1,0,1]=4 385 B10R1.13 NC(=O)C1=CC=C(I)C=C1 235780 [1,1,0,0,0,0|1,0,1]=4 386 B10R1.13 NC(=O)C1=CC=C(N)C=C1 018168 [1,1,0,0,0,0|1,0,1]=4 387 B10R1.13 NC(=O)C1=CC=C(O)C=C1 002826 [1,1,0,0,0,0|1,0,1]=4 388 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 021311 [1,1,0,0,0,0|1,0,1]=4 389 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 021318 [1,1,0,0,0,0|1,0,1]=4 390 B10R1.13 NC(=S)C1=CC=C(F)C=C1 021324 [1,1,0,0,0,0|1,0,1]=4 391 B10R1.13 NC(=S)C1=CC=C(N)C=C1 021309 [1,1,0,0,0,0|1,0,1]=4 392 B10R1.13 NC(=S)C1=CC=C(O)C=C1 021328 [1,1,0,0,0,0|1,0,1]=4 393 B10R1.13 NC(=S)C1=CC=C(O)C=C1 097900 [1,1,0,0,0,0|1,0,1]=4 394 B10R1.28 CC(C)(C)C1=CC=CC=C1 094532 [1,1,0,0,0,0|0,0,0]=2 395 B10R1.28 CC(C)(C)C1=CC=NC=C1 024692 [1,1,0,0,0,0|1,0,0]=3 396 B10R1.28 CC(C)(Cl)C1=CC=CC=C1 033938 [1,1,0,0,0,0|0,0,0]=2 397 B10R1.28 CC(C)(N)C1=CC=CC=C1 005015 [1,1,0,0,0,0|0,0,0]=2 398 B10R1.28 CC(C)(O)C1=CC=CC=C1 493347 [1,1,0,0,0,0|0,0,0]=2 399 B10R1.28 CC(C)(O)C1=CC=NC=C1 218299 [1,1,0,0,0,0|1,0,0]=3 400 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 001313 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 079257 [1,1,0,0,0,0|1,0,0]=3 402 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 222395 [1,1,0,0,0,0|1,0,0]=3 403 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 S13375 [1,1,0,0,0,0|0,1,0]=3 404 B10R1.28 ClC(Cl)(Cl)C1=CC=CC=C1 242868 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.28 FC(F)(F)C1=CC=CC=C1 004060 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 093324 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 035873 [1,1,0,0,0,0|1,0,1]=4 408 B10R1.61 CC(=O)C1=C(F)C=CC=C1 001616 [1,1,0,0,0,0|1,0,1]=4 409 B10R1.61 CC(=O)C1=CC=CC=C1Cl 003397 [1,1,0,0,0,0|1,0,1]=4 410 B10R1.61 CC(=O)C1=CC=CC=C1I 075032 [1,1,0,0,0,0|1,0,1]=4 411 B10R1.61 CC(=O)C1=CC=CC=C1N 076856 [1,1,0,0,0,0|1,0,1]=4 412 B10R1.61 CC(=O)C1=CC=CC=C1O 078584 [1,1,0,0,0,0|1,0,1]=4 413 B10R1.61 CC(C)C1=C(Br)C=CC=C1 009741 [1,1,0,0,0,0|0,0,0]=2 414 B10R1.61 CC(C)C1=C(I)C=CC=C1 001198 [1,1,0,0,0,0|0,0,0]=2 415 B10R1.61 CC(C)C1=C(N)C=CC=C1 033911 [1,1,0,0,0,0|0,0,0]=2 416 B10R1.61 CC(C)C1=CC=CC=C1O 208839 [1,1,0,0,0,0|0,0,0]=2 417 B10R1.61 CC(C)C1=CC=CC=C1S 023120 [1,1,0,0,0,0|0,0,0]=2 418 B10R1.61 CC(O)C1=C(Br)C=CC=C1 094463 [1,1,0,0,0,0|1,0,0]=3 419 B10R1.61 CC(O)C1=C(F)C=CC=C1 006337 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.61 CC(O)C1=C(F)N=CC=C1 529891 [1,1,0,0,0,0|2,0,0]=4 421 B10R1.61 CC1=C(C(N)=O)C=CC=C1 341826 [1,1,0,0,0,0|1,0,1]=4 422 B10R1.61 CC1=C(C(N)=S)C=CC=C1 021341 [1,1,0,0,0,0|1,0,1]=4 423 B10R1.61 CC1=C(C(N)=S)C=CC=C1 097832 [1,1,0,0,0,0|1,0,1]=4 424 B10R1.61 CN(C)C1=CC=CC=C1Br 215675 [1,1,0,0,0,0|1,0,0]=3 425 B10R1.61 CN(C)C1=CC=CC=C1N 079293 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.61 FC(F)C1=C(Br)C=CC=C1 023878 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.61 FC(F)C1=C(Cl)C=CC=C1 102489 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.61 FC1=C(C(F)F)C=CC=C1 023923 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.61 FC1=CC=CC=C1C(Cl)Cl 009190 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 001052 [1,1,0,0,0,0|1,0,1]=4 431 B10R1.61 NC(=O)C1=C(F)C=CC=C1 002696 [1,1,0,0,0,0|1,0,1]=4 432 B10R1.61 NC(=O)C1=C(N)C=CC=C1 018166 [1,1,0,0,0,0|1,0,1]=4 433 B10R1.61 NC(=O)C1=CC=CC=C1Cl 018355 [1,1,0,0,0,0|1,0,1]=4 434 B10R1.61 NC(=O)C1=CC=CC=C1I 242099 [1,1,0,0,0,0|1,0,1]=4 435 B10R1.61 NC(=O)C1=CC=CC=C1O 091532 [1,1,0,0,0,0|1,0,1]=4 436 B10R1.61 NC(=S)C1=C(Br)C=CC=C1 021313 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.61 NC(=S)C1=C(Cl)C=CC=C1 021317 [1,1,0,0,0,0|1,0,1]=4 438 B10R1.61 NC(=S)C1=C(N)C=CC=C1 021307 [1,1,0,0,0,0|1,0,1]=4 439 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 008816 [1,1,0,0,0,0|1,0,1]=4 440 B10R1.113 CC(=O)C1=CC(C)=CC=C1 349312 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 024871 [1,1,0,0,0,0|1,0,1]=4 442 B10R1.113 CC(=O)C1=CC(F)=CC=C1 001467 [1,1,0,0,0,0|1,0,1]=4 443 B10R1.113 CC(=O)C1=CC(I)=CC=C1 147400 [1,1,0,0,0,0|1,0,1]=4 444 B10R1.113 CC(=O)C1=CC(N)=CC=C1 001722 [1,1,0,0,0,0|1,0,1]=4 445 B10R1.113 CC(=O)C1=CC=CC(O)=C1 078748 [1,1,0,0,0,0|1,0,1]=4 446 B10R1.113 CC(C)C1=CC(Br)=CC=C1 024856 [1,1,0,0,0,0|0,0,0]=2 447 B10R1.113 CC(C)C1=CC(I)=CC=C1 037580 [1,1,0,0,0,0|0,0,0]=2 448 B10R1.113 CC(C)C1=CC(N)=CC=C1 075293 [1,1,0,0,0,0|0,0,0]=2 449 B10R1.113 CC(C)C1=CC=CC(O)=C1 099128 [1,1,0,0,0,0|0,0,0]=2 450 B10R1.113 CC(N)C1=CC(Cl)=CC=C1 035904 [1,1,0,0,0,0|0,0,0]=2 451 B10R1.113 CC(O)C1=CC(Br)=CC=C1 003550 [1,1,0,0,0,0|1,0,0]=3 452 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 353644 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.113 CC(O)C1=CC(F)=CC=C1 006338 [1,1,0,0,0,0|1,0,0]=3 454 B10R1.113 CC(O)C1=NC(Br)=CC=C1 217816 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.113 CC1=CC(C(N)=O)=CC=C1 324085 [1,1,0,0,0,0|1,0,1]=4 456 B10R1.113 CC1=CC(N(C)C)=CC=C1 242206 [1,1,0,0,0,0|1,0,0]=3 457 B10R1.113 CC1=CC=CC(C(C)O)=C1 033735 [1,1,0,0,0,0|1,0,0]=3 458 B10R1.113 CC1=CC=CC(C(N)=S)=C1 021340 [1,1,0,0,0,0|1,0,1]=4 459 B10R1.113 CC1=CC=CC(C(N)=S)=C1 097831 [1,1,0,0,0,0|1,0,1]=4 460 B10R1.113 CN(C)C1=CC(Br)=CN=C1 323893 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.113 CN(C)C1=CC(O)=CC=C1 080296 [1,1,0,0,0,0|1,0,0]=3 462 B10R1.113 CN(C)C1=CC=CC(Br)=C1 091972 [1,1,0,0,0,0|1,0,0]=3 463 B10R1.113 CN(C)C1=CC=CC(N)=C1 223097 [1,1,0,0,0,0|1,0,0]=3 464 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 468749 [1,1,0,0,0,0|0,0,0]=2 465 B10R1.113 FC(F)C1=CC=CC(Br)=C1 024453 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.113 FC(F)C1=CC=CC(Cl)=C1 098488 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.113 FC1=CC(C(F)F)=CC=C1 023921 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.113 FC1=CC=CC(C(Cl)Cl)=C1 009191 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.113 N=C(N)C1=CC(N)=CC=C1 540016 [1,1,0,0,0,0|1,0,1]=4 470 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 036153 [1,1,0,0,0,0|1,0,1]=4 471 B10R1.113 NC(=O)C1=CC(F)=CC=C1 006180 [1,1,0,0,0,0|1,0,1]=4 472 B10R1.113 NC(=O)C1=CC(I)=CC=C1 036159 [1,1,0,0,0,0|1,0,1]=4 473 B10R1.113 NC(=O)C1=CC(N)=CC=C1 018167 [1,1,0,0,0,0|1,0,1]=4 474 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 018356 [1,1,0,0,0,0|1,0,1]=4 475 B10R1.113 NC(=S)C1=CC(Br)=CC=C1 021312 [1,1,0,0,0,0|1,0,1]=4 476 B10R1.113 NC(=S)C1=CC(Cl)=CC=C1 021322 [1,1,0,0,0,0|1,0,1]=4 477 B10R1.113 NC(=S)C1=CC(F)=CC=C1 021325 [1,1,0,0,0,0|1,0,1]=4 478 B10R1.113 NC(=S)C1=CC(N)=CC=C1 021308 [1,1,0,0,0,0|1,0,1]=4 479 B10R1.113 NC1=CC=CC(C(F)F)=C1 217681 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.1 CC1=CC=C(CC#N)C=C1 078705 [1,1,0,0,0,0|0,0,2]=4 481 B10R1.1 CC1=CC=C(CCN)C=C1 018851 [1,1,0,0,0,0|0,0,0]=2 482 B10R1.1 CC1=CC=C(CCO)C=C1 216320 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.1 CCCC1=CC=C(Cl)C=C1 018453 [1,1,0,0,0,0|1,0,0]=3 484 B10R1.1 CCCC1=CC=C(O)C=C1 068339 [1,1,0,0,0,0|1,0,0]=3 485 B10R1.1 CCOC1=CC=C(Br)C=C1 024186 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.1 CCOC1=CC=C(F)C=C1 006317 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.1 CCOC1=CC=C(I)C=C1 038701 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.1 CCOC1=CC=C(N)C=C1 230478 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.1 CCOC1=CC=C(O)C=C1 049967 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.1 CCSC1=CC=C(C)C=C1 094757 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.1 CCSC1=CC=C(Cl)C=C1 094917 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.1 CCSC1=CC=C(F)C=C1 094569 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.1 CNCC1=CC=C(Br)C=C1 076658 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.1 CNCC1=CC=C(C)C=C1 078911 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.1 CNCC1=CC=C(F)C=C1 040105 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.1 COCC1=CC=C(Br)C=C1 325028 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.1 ClC1=CC=C(CCBr)C=C1 020895 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.1 FC1=CC=C(CCBr)C=C1 020897 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.1 FC1=CC=C(CCCl)C=C1 010403 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.1 N#CCC1=CC=C(Br)C=C1 BR1112 [1,1,0,0,0,0|0,0,2]=4 501 B10R1.1 N#CCC1=CC=C(Cl)C=C1 079011 [1,1,0,0,0,0|0,0,2]=4 502 B10R1.1 N#CCC1=CC=C(F)C=C1 001189 [1,1,0,0,0,0|0,0,2]=4 503 B10R1.1 N#CCC1=CC=C(I)C=C1 149501 [1,1,0,0,0,0|0,0,2]=4 504 B10R1.1 N#CCC1=CC=C(O)C=C1 018726 [1,1,0,0,0,0|0,0,2]=4 505 B10R1.1 NC1=CC=C(CCO)C=C1 005442 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.1 NCCC1=CC=C(Br)C=C1 013456 [1,1,0,0,0,0|0,0,0]=2 507 B10R1.1 NCCC1=CC=C(Br)C=C1 018305 [1,1,0,0,0,0|0,0,0]=2 508 B10R1.1 NCCC1=CC=C(Cl)C=C1 008894 [1,1,0,0,0,0|0,0,0]=2 509 B10R1.1 NCCC1=CC=C(F)C=C1 040108 [1,1,0,0,0,0|0,0,0]=2 510 B10R1.1 NCCC1=CC=C(F)C=C1 240692 [1,1,0,0,0,0|0,0,0]=2 511 B10R1.1 NCCC1=CC=C(N)C=C1 040089 [1,1,0,0,0,0|0,0,0]=2 512 B10R1.1 NCCC1=CC=C(O)C=C1 078887 [1,1,0,0,0,0|0,0,0]=2 513 B10R1.1 NCCC1=CC=C(O)C=C1 241212 [1,1,0,0,0,0|0,0,0]=2 514 B10R1.1 OCCC1=CC=C(Br)C=C1 040529 [1,1,0,0,0,0|1,0,0]=3 515 B10R1.1 OCCC1=CC=C(Cl)C=C1 209207 [1,1,0,0,0,0|1,0,0]=3 516 B10R1.1 OCCC1=CC=C(F)C=C1 006315 [1,1,0,0,0,0|1,0,0]=3 517 B10R1.1 OCCC1=CC=C(I)C=C1 078447 [1,1,0,0,0,0|1,0,0]=3 518 B10R1.1 OCCC1=CC=C(O)C=C1 077935 [1,1,0,0,0,0|1,0,0]=3 519 B10R1.1 [NH3+]OCC1=CC=C(F)C=C1 010009 [1,1,0,0,0,0|1,0,1]=4 520 B10R1.4 C=CCC1=C(O)C=CC=C1 520493 [1,1,0,0,0,0|1,0,1]=4 521 B10R1.4 CC1=C(CCN)C=CC=C1 018849 [1,1,0,0,0,0|0,0,0]=2 522 B10R1.4 CC1=C(CCN)C=CC=C1 094128 [1,1,0,0,0,0|0,0,0]=2 523 B10R1.4 CC1=CC=CC=C1CCO 243106 [1,1,0,0,0,0|1,0,0]=3 524 B10R1.4 CC1=CC=CN=C1CCO 032581 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.4 CCCC1=CC=NC=C1C 032545 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.4 CCNC1=C(F)C=CC=C1 017358 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.4 CCNC1=CC=CC=C1C 243028 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.4 CCOC1=C(Br)C=CC=C1 239298 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.4 CCOC1=C(C)C=CC=C1 095339 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.4 CCOC1=C(F)C=CC=C1 006316 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.4 CCOC1=C(N)C=CC=C1 044850 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.4 CCOC1=CC=CC=C1O 216685 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.4 CCSC1=C(Cl)C=CC=C1 094570 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.4 CNCC1=CC=CC=C1F 077128 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.4 COCC1=CC=CC=C1Br 233857 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.4 N#CCC1=C(Br)C=CC=C1 001135 [1,1,0,0,0,0|0,0,2]=4 537 B10R1.4 N#CCC1=C(F)C=CC=C1 001187 [1,1,0,0,0,0|0,0,2]=4 538 B10R1.4 N#CCC1=CC=CC=C1Cl 225964 [1,1,0,0,0,0|0,0,2]=4 539 B10R1.4 N#CCC1=CC=CC=C1N 208802 [1,1,0,0,0,0|0,0,2]=4 540 B10R1.4 NCCC1=C(Cl)C=CC=C1 008893 [1,1,0,0,0,0|0,0,0]=2 541 B10R1.4 NCCC1=C(F)C=CC=C1 044800 [1,1,0,0,0,0|0,0,0]=2 542 B10R1.4 NCCC1=CC=CC=C1Br 067221 [1,1,0,0,0,0|0,0,0]=2 543 B10R1.4 NNCC1=C(F)C=CC=C1 070628 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.4 OCCC1=C(F)C=CC=C1 006314 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.4 OCCC1=CC=CC=C1Br 210426 [1,1,0,0,0,0|1,0,0]=3 546 B10R1.4 OCCC1=CC=CC=C1Cl 329148 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.4 OCCC1=CC=CC=C1O 215704 [1,1,0,0,0,0|1,0,0]=3 548 B10R1.10 C=CCC1=CC=CC(Cl)=C1 022313 [1,1,0,0,0,0|1,0,1]=4 549 B10R1.10 C=CCC1=CC=CC(F)=C1 022325 [1,1,0,0,0,0|1,0,1]=4 550 B10R1.10 CC1=CC(CC#N)=CC=C1 092558 [1,1,0,0,0,0|0,0,2]=4 551 B10R1.10 CC1=CC=CC(CCO)=C1 068240 [1,1,0,0,0,0|1,0,0]=3 552 B10R1.10 CCCC1=CC=CC(O)=C1 431370 [1,1,0,0,0,0|1,0,0]=3 553 B10R1.10 CCNC1=CC=CC(C)=C1 216666 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.10 CCOC1=CC(C)=CC=C1 095135 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.10 CCSC1=CC(Br)=CC=C1 094879 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.10 CNCC1=CC=CC(C)=C1 224541 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.10 CNCC1=CC=CC(F)=C1 077129 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.10 COCC1=CC(Br)=CC=C1 235324 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.10 ClC1=CC=CC(CCBr)=C1 020894 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.10 N#CCC1=CC(Br)=CC=C1 001136 [1,1,0,0,0,0|0,0,2]=4 561 B10R1.10 N#CCC1=CC(F)=CC=C1 001188 [1,1,0,0,0,0|0,0,2]=4 562 B10R1.10 N#CCC1=CC=CC(Cl)=C1 078843 [1,1,0,0,0,0|0,0,2]=4 563 B10R1.10 NCCC1=CC=CC(Br)=C1 048827 [1,1,0,0,0,0|0,0,0]=2 564 B10R1.10 NCCC1=CC=CC(Cl)=C1 018421 [1,1,0,0,0,0|0,0,0]=2 565 B10R1.10 NCCC1=CC=CC(F)=C1 040107 [1,1,0,0,0,0|0,0,0]=2 566 B10R1.10 NCCC1=CC=CC(O)=C1 009950 [1,1,0,0,0,0|0,0,0]=2 567 B10R1.10 OCCC1=CC(O)=CC=C1 092020 [1,1,0,0,0,0|1,0,0]=3 568 B10R1.10 OCCC1=CC=CC(Br)=C1 092240 [1,1,0,0,0,0|1,0,0]=3 569 B10R1.10 OCCC1=CC=CC(Cl)=C1 078742 [1,1,0,0,0,0|1,0,0]=3 570 B10R1.10 OCCC1=CC=CC(F)=C1 010684 [1,1,0,0,0,0|1,0,0]=3 571 B10R1.10 [NH3+]OCC1=CC(F)=CC=C1 010010 [1,1,0,0,0,0|1,0,1]=4 572 B10R1.17 BrCCCC1=CC=CC=C1 113800 [1,1,0,0,0,0|1,0,0]=3 573 B10R1.17 BrCCOC1=CC=CC=C1 210427 [1,1,0,0,0,0|1,0,0]=3 574 B10R1.17 BrCCSC1=CC=CC=C1 003535 [1,1,0,0,0,0|1,0,0]=3 575 B10R1.17 C#CCCC1=CC=CC=C1 062967 [1,1,0,0,0,0|1,0,0]=3 576 B10R1.17 C(=O)NCC1=CC=CC=C1 300142 [1,1,0,0,0,0|1,0,1]=4 577 B10R1.17 C=CCCC1=CC=CC=C1 342184 [1,1,0,0,0,0|1,0,0]=3 578 B10R1.17 C=CCOC1=CC=CC=C1 242682 [1,1,0,0,0,0|1,0,1]=4 579 B10R1.17 C=CCSC1=CC=CC=C1 003665 [1,1,0,0,0,0|1,0,1]=4 580 B10R1.17 CCC#CC1=CC=CC=C1 103664 [1,1,0,0,0,0|1,0,1]=4 581 B10R1.17 CCCCC1=CC=CC=C1 240933 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.17 CCCC[N+]1=CC=CC=C1 237751 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.17 CCCNC1=CC=CC=C1 324115 [1,1,0,0,0,0|1,0,0]=3 584 B10R1.17 CCCSC1=CC=CC=C1 094618 [1,1,0,0,0,0|1,0,0]=3 585 B10R1.17 CCCSC1=NC=CC=C1 097642 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.17 CCNCC1=CC=CC=C1 239060 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.17 CCNCC1=CC=CN=C1 046110 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.17 CCOCC1=CC=CC=C1 240434 [1,1,0,0,0,0|1,0,0]=3 589 B10R1.17 CCSCC1=CC=CC=C1 094637 [1,1,0,0,0,0|1,0,0]=3 590 B10R1.17 CNCCC1=CC=CC=C1 046956 [1,1,0,0,0,0|0,0,0]=2 591 B10R1.17 CNCCC1=NC=CC=C1 065480 [1,1,0,0,0,0|1,0,0]=3 592 B10R1.17 ClCCCC1=CC=CC=C1 320132 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.17 ClCCSC1=CC=CC=C1 003536 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.17 ClCOCC1=CC=CC=C1 106900 [1,1,0,0,0,0|1,0,0]=3 595 B10R1.17 ICCOC1=CC=CC=C1 313818 [1,1,0,0,0,0|1,0,0]=3 596 B10R1.17 N#CCCC1=CC=CC=C1 337065 [1,1,0,0,0,0|0,0,1]=3 597 B10R1.17 N#CCOC1=CC=CC=C1 239898 [1,1,0,0,0,0|0,0,2]=4 598 B10R1.17 N#CCSC1=CC=CC=C1 003773 [1,1,0,0,0,0|0,0,2]=4 599 B10R1.17 NCC#CC1=CC=CC=C1 050963 [1,1,0,0,0,0|0,0,1]=3 600 B10R1.17 NCCCC1=CC=CC=C1 008890 [1,1,0,0,0,0|0,0,0]=2 601 B10R1.17 NCCNC1=CC=CC=C1 320056 [1,1,0,0,0,0|0,0,0]=2 602 B10R1.17 NCCNC1=CC=NC=C1 033853 [1,1,0,0,0,0|1,0,0]=3 603 B10R1.17 NCCOC1=CC=CC=C1 078737 [1,1,0,0,0,0|0,0,0]=2 604 B10R1.17 O=CCCC1=CC=CC=C1 237467 [1,1,0,0,0,0|1,0,0]=3 605 B10R1.17 O=COCC1=CC=CC=C1 240742 [1,1,0,0,0,0|1,0,1]=4 606 B10R1.17 OCC#CC1=CC=CC=C1 166200 [1,1,0,0,0,0|1,0,1]=4 607 B10R1.17 OCCCC1=CC=CC=C1 241187 [1,1,0,0,0,0|1,0,0]=3 608 B10R1.17 OCCCC1=CC=CN=C1 032639 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.17 OCCCC1=CC=NC=C1 093367 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.17 OCCCC1=NC=CC=C1 234266 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.17 OCCNC1=CC=CC=C1 240954 [1,1,0,0,0,0|1,0,0]=3 612 B10R1.17 OCCNC1=CC=NC=C1 034928 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.17 OCCNC1=NC=CC=C1 034929 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.17 OCCNC1=NC=CC=C1 061534 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.17 OCCOC1=CC=CC=C1 005091 [1,1,0,0,0,0|1,0,0]=3 616 B10R1.17 OCCSC1=CC=CC=C1 003534 [1,1,0,0,0,0|1,0,0]=3 617 B10R1.17 OC\C=C\C1=CC=CC=C1 237687 [1,1,0,0,0,0|1,0,1]=4 618 B10R1.17 S=C=NCC1=CC=CC=C1 002504 [1,1,0,0,0,0|1,0,1]=4 619 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 342017 [1,1,0,0,0,0|1,0,1]=4 620 B10R1.18 CC(Br)CC1=CC=CC=C1 243231 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.18 CC(C)CC1=CC=NC=C1 032546 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.18 CC(C)NC1=CC=CC=C1 079480 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.18 CC(C)OC1=CC=CC=C1 038454 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.18 CC(O)CC1=CC=CC=C1 339985 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.18 CN(C)CC1=CC=CC=C1 102405 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 036085 [1,1,0,0,0,0|1,0,0]=3 627 B10R1.18 C[C@H](O)CC1=CC=CC=C1 036086 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.18 NC(=O)CC1=CC=CC=C1 018952 [1,1,0,0,0,0|0,0,1]=3 629 B10R1.18 NC(=O)OC1=CC=CC=C1 180113 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.18 NC(=S)CC1=CC=CC=C1 047341 [1,1,0,0,0,0|0,0,1]=3 631 B10R1.18 NC(=S)NC1=CC=CC=C1 358215 [1,1,0,0,0,0|1,0,1]=4 632 B10R1.18 O=C(Cl)CC1=CC=CC=C1 099401 [1,1,0,0,0,0|1,0,1]=4 633 B12R1.32 CN(CCN)CC1=CC=CC=C1 033861 [0,1,0,0,0,1|1,0,0]=3 634 B12R1.32 CN(CCO)CC1=CC=CC=C1 214692 [0,1,0,0,0,1|2,0,0]=4 635 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 M02966 [0,1,0,0,0,1|1,0,1]=4 636 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(N)=O 222744 [0,1,0,0,0,1|1,0,1]=4 637 B12R1.118 CN[C@H](CO)CC1=CC=CC=C1 209399 [0,1,0,0,0,1|1,0,0]=3 638 B12R1.118 COC(CC1=CC=CC=C1)OC 103319 [0,1,0,0,0,1|2,0,0]=4 639 B12R1.9 CC(C)(C#N)C1=CC=C(N)C=C1 068275 [0,2,0,0,0,0|0,0,2]=4 640 B12R1.39 C=CCC(C)(O)C1=CC=CC=C1 340068 [0,2,0,0,0,0|1,0,0]=3 641 B12R1.253 CC(C)(C(=O)Cl)C1=CC=CC=C1 070055 [0,2,0,0,0,0|1,0,1]=4 642 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 075279 [0,2,0,0,0,0|1,0,1]=4 643 B12R1.253 CC(C)(C(N)=O)C1=CC=CC=C1 356494 [0,2,0,0,0,0|0,0,1]=3 644 B12R1.253 NC(=O)C(F)(F)C1=CC=CC=C1 034725 [0,2,0,0,0,0|1,0,1]=4 645 B12R1.475 CCC(O)(CC)C1=CC=CC=C1 399514 [0,2,0,0,0,0|1,0,0]=3 646 B12R1.475 CCC(O)(CC)C1=CN=CC=C1 180311 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.475 COC(C)(OC)C1=CC=CC=C1 103050 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.3 CCN(CCO)C1=CC=CC=C1 228743 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 129800 [0,2,0,0,0,0|2,0,0]=4 650 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 235701 [0,2,0,0,0,0|1,0,1]=4 651 B12R1.478 CN(C)C(C#N)C1=CC=CC=C1 341735 [0,2,0,0,0,0|0,0,2]=4 652 B12R1.478 COC(C(=O)O)C1=CC=CC=C1 209415 [0,2,0,0,0,0|1,0,1]=4 653 B12R1.478 CO[C@@H](C(=O)O)C1=CC=CC=C1 223096 [0,2,0,0,0,0|1,0,1]=4 654 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 175800 [0,2,0,0,0,0|1,0,1]=4 655 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 339744 [0,2,0,0,0,0|1,0,0]=3 656 B12R1.16 C[C@@H](N=C=S)C1=CC=C(Br)C=C1 103205 [0,2,0,0,0,0|1,0,1]=4 657 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 040399 [0,2,0,0,0,0|2,0,0]=4 658 B12R1.16 N[C@H](CCO)C1=CC=C(Cl)C=C1 034404 [0,2,0,0,0,0|2,0,0]=4 659 B12R1.30 CCCCC(O)C1=CC=CC=C1 242321 [0,2,0,0,0,0|2,0,0]=4 660 B12R1.30 CN(CCCN)C1=CC=CC=C1 031700 [0,2,0,0,0,0|1,0,0]=3 661 B12R1.107 CC(=O)OC(C)C1=CC=CC=C1 320170 [0,2,0,0,0,0|1,0,1]=4 662 B12R1.107 CC(C)CC(C)C1=NC=CC=C1 032553 [0,2,0,0,0,0|2,0,0]=4 663 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 358190 [0,2,0,0,0,0|1,0,0]=3 664 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 034469 [0,2,0,0,0,0|2,0,0]=4 665 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 040244 [0,2,0,0,0,0|2,0,0]=4 666 B12R1.107 O=C(O)C[C@H](O)C1=CC=CC=C1 103042 [0,2,0,0,0,0|2,0,0]=4 667 B12R1.5 CCC(C)C1=CC=C(OC)C=C1 104314 [0,2,0,0,0,0|1,0,0]=3 668 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 076576 [0,2,0,0,0,0|1,0,1]=4 669 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 077631 [0,2,0,0,0,0|1,0,1]=4 670 B12R1.20 CC(C(=O)O)C1=CC=C(O)C=C1 245810 [0,2,0,0,0,0|1,0,1]=4 671 B12R1.564 CC(C)(C)C(N)C1=CC=CC=C1 078663 [0,2,0,0,0,0|2,0,0]=4 672 B12R1.564 CC(C1=CC=CC=C1)C(F)(F)F 101674 [0,2,0,0,0,0|1,0,0]=3 673 B12R1.564 FC(F)(F)C(Br)C1=CC=CC=C1 070291 [0,2,0,0,0,0|2,0,0]=4 674 B12R1.564 NC(C1=CC=CC=C1)C(F)(F)F 044275 [0,2,0,0,0,0|2,0,0]=4 675 B12R1.564 NC(C1=CC=CC=C1)C(F)(F)F 093854 [0,2,0,0,0,0|2,0,0]=4 676 B12R1.564 N[C@@H](C1=CC=CC=C1)C(F)(F)F 044273 [0,2,0,0,0,0|2,0,0]=4 677 B12R1.564 N[C@@H](C1=CC=CC=C1)C(F)(F)F 093855 [0,2,0,0,0,0|2,0,0]=4 678 B12R1.564 N[C@H](C1=CC=CC=C1)C(F)(F)F 044274 [0,2,0,0,0,0|2,0,0]=4 679 B12R1.564 N[C@H](C1=CC=CC=C1)C(F)(F)F 093856 [0,2,0,0,0,0|2,0,0]=4 680 B12R1.564 OC(C1=CC=CC=C1)C(F)(F)F 002360 [0,2,0,0,0,0|2,0,0]=4 681 B12R1.564 O[C@H](C1=CC=CC=C1)C(F)(F)F 245891 [0,2,0,0,0,0|2,0,0]=4 682 B10R2.6 C1=CC=C(C2CC2)C=C1 049412 [1,0,0,1,0,0|0,0,0]=2 683 B10R2.6 C1=CC=C(C2CO2)C=C1 227689 [1,0,0,1,0,0|1,0,0]=3 684 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 221507 [1,0,0,1,0,0|1,0,0]=3 685 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 223292 [1,0,0,1,0,0|1,0,0]=3 686 B10R2.7 C1=CC2=C(C=C1)CC=C2 358247 [1,0,0,1,0,0|1,0,1]=4 687 B10R2.7 C1=CC2=C(C=C1)CCC2 046831 [1,0,0,1,0,0|1,0,0]=3 688 B10R2.7 C1=CC2=C(C=C1)NN=C2 044571 [1,0,0,1,0,0|1,0,1]=4 689 B10R2.7 C1=CC=C2CNCC2=C1 041927 [1,0,0,1,0,0|2,0,0]=4 690 B10R2.7 C1=CC=C2NC=CC2=C1 068792 [1,0,0,1,0,0|0,0,2]=4 691 B10R2.7 C1=CC=C2NC=NC2=C1 235007 [1,0,0,1,0,0|1,0,1]=4 692 B10R2.7 C1=CC=C2NCCC2=C1 068790 [1,0,0,1,0,0|0,0,0]=2 693 B10R2.7 C1=CC=C2NN=NC2=C1 003815 [1,0,0,1,0,0|2,0,0]=4 694 B10R2.7 C1=CC=C2OCCC2=C1 017117 [1,0,0,1,0,0|1,0,0]=3 695 B10R2.7 C1=CC=C2OCOC2=C1 022089 [1,0,0,1,0,0|2,0,0]=4 696 B10R2.7 C1=CN=C2CCCC2=C1 075302 [1,0,0,1,0,0|2,0,0]=4 697 B12R2.18 CN1CC2=CC=CC=C2C1N 102477 [0,0,0,1,0,1|1,0,0]=3 698 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O 012694 [0,0,0,1,0,1|1,0,0]=3 699 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@H]1O 012689 [0,0,0,1,0,1|1,0,0]=3 700 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O 012693 [0,0,0,1,0,1|1,0,0]=3 701 B12R2.18 OC1C2=CC=CC=C2CC1Br 003061 [0,0,0,1,0,1|2,0,0]=4 702 B12R2.24 O=C1CNC2=CC=CC=C2N1 015374 [0,0,0,1,0,1|1,0,1]=4 703 B12R2.32 NCC1=CC2=C(C=CC=C2)S1 034919 [0,0,0,1,0,1|0,0,2]=4 704 B12R2.32 NCC1=NC2=CC=CC=C2N1 077977 [0,0,0,1,0,1|1,0,1]=4 705 B12R2.32 NCC1=NC2=CC=CC=C2N1 078249 [0,0,0,1,0,1|1,0,1]=4 706 B12R2.2058 C1=CC=C(OC2CNC2)C=C1 033397 [0,0,0,1,0,1|0,0,0]=2 707 B12R2.48 N#CC1(C2=CC=CC=C2)CC1 068003 [0,1,0,1,0,0|0,0,2]=4 708 B12R2.1 OCC1=CNC2=C1C=CC=C2 045221 [0,1,0,1,0,0|0,0,2]=4 709 B12R2.2 C1=CC=C(C2CCCN2)C=C1 021298 [0,1,0,1,0,0|1,0,0]=3 710 B12R2.2 C1=CC=C(N2CC=CC2)C=C1 231375 [0,1,0,1,0,0|2,0,0]=4 711 B12R2.2 C1=CN=CC(C2CCCN2)=C1 077422 [0,1,0,1,0,0|2,0,0]=4 712 B12R2.1081 CC1NCCC2=C1C=CC=C2 077277 [0,1,0,1,0,0|1,0,0]=3 713 B12R2.1081 NC1CCCC2=C1C=CC=C2 219818 [0,1,0,1,0,0|2,0,0]=4 714 B12R2.1081 NC1CCCC2=CC=CC=C21 048220 [0,1,0,1,0,0|2,0,0]=4 715 B12R2.1081 NC1COCC2=C1C=CC=C2 091889 [0,1,0,1,0,0|2,0,0]=4 716 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 048221 [0,1,0,1,0,0|2,0,0]=4 717 B12R2.1081 OC1CCCC2=CC=CC=C21 069137 [0,1,0,1,0,0|2,0,0]=4 718 B12R2.1081 OC1CCOC2=CC=CC=C21 104541 [0,1,0,1,0,0|2,0,0]=4 719 B12R2.1081 O[C@@H]1CCCC2=C1C=CC=C2 219879 [0,1,0,1,0,0|2,0,0]=4 720 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 219880 [0,1,0,1,0,0|2,0,0]=4 721 B12R2.2028 CC1=CN(C)C2=C1C=CC=C2 180164 [0,1,0,1,0,0|0,0,2]=4 722 B12R2.2028 CN1N=[N+](C)C2=C1C=CC=C2 182061 [0,1,0,1,0,0|2,0,0]=4 723 B12R2.290 NC1(C2=CC=C(Br)C=C2)CC1 210797 [0,1,0,1,0,0|2,0,0]=4 724 B12R2.290 NC1(C2=CC=C(F)C=C2)CC1 209071 [0,1,0,1,0,0|2,0,0]=4 725 B12R2.1282 NC1(C2=CC(F)=CC=C2)CC1 514135 [0,1,0,1,0,0|2,0,0]=4 726 B12R2.92 ClC1(Cl)CC1C2=CC=CC=C2 003620 [0,1,0,1,0,0|1,0,0]=3 727 B12R2.3190 O=C(O)C1CC2=CC=CC=C21 066601 [0,1,0,1,0,0|1,0,1]=4 728 B8R1.7 CC(C)C1=NC=CN1 235680 [1,0,0,0,1,0|2,0,0]=4 729 B8R1.7 CC(N)C1=CC=CS1 044441 [1,0,0,0,1,0|1,0,0]=3 730 B8R1.8 CCCC1=CC=CS1 003676 [1,0,0,0,1,0|2,0,0]=4 731 B8R1.8 ClCCN1C=CC=C1 046765 [1,0,0,0,1,0|2,0,0]=4 732 B8R1.8 NCCC1=CC=CS1 021380 [1,0,0,0,1,0|1,0,0]=3 733 B8R1.8 NCCC1=CNC=N1 068673 [1,0,0,0,1,0|2,0,0]=4 734 B8R1.8 NCCC1=CNC=N1 078943 [1,0,0,0,1,0|2,0,0]=4 735 B8R1.8 OCCC1=CC=CS1 208753 [1,0,0,0,1,0|2,0,0]=4 736 B8R1.8 OCCC1=CSC=C1 076012 [1,0,0,0,1,0|2,0,0]=4 737 B12R1.27 NCC(=O)OCC1=CC=CC=C1 038264 [0,0,0,0,0,2|1,0,1]=4 738 B12R1.27 NCC(=O)OCC1=CC=CC=C1 M03020 [0,0,0,0,0,2|1,0,1]=4 739 B12R1.27 NCC(O)COC1=CC=CC=C1 471059 [0,0,0,0,0,2|1,0,0]=3 740 B12R1.27 OCC(O)COC1=CC=CC=C1 001784 [0,0,0,0,0,2|2,0,0]=4