0 B10R1.17 BrCCCC1=CC=CC=C1 113800 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.17 BrCCOC1=CC=CC=C1 210427 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.17 BrCCSC1=CC=CC=C1 003535 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.17 C#CCCC1=CC=CC=C1 062967 [0,0,0,0,0,0|1,0,3]=4 4 B10R1.17 C(=O)NCC1=CC=CC=C1 300142 [0,0,0,0,0,0|1,0,1]=2 5 B10R1.17 C=CCCC1=CC=CC=C1 342184 [0,0,0,0,0,0|1,0,2]=3 6 B10R1.17 C=CCOC1=CC=CC=C1 242682 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.17 C=CCSC1=CC=CC=C1 003665 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.17 CCC#CC1=CC=CC=C1 103664 [0,0,0,0,0,0|1,0,3]=4 9 B10R1.17 CCCCC1=CC=CC=C1 240933 [0,0,0,0,0,0|1,0,3]=4 10 B10R1.17 CCCNC1=CC=CC=C1 324115 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.17 CCCSC1=CC=CC=C1 094618 [0,0,0,0,0,0|2,0,2]=4 12 B10R1.17 CCNCC1=CC=CC=C1 239060 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.17 CCOCC1=CC=CC=C1 240434 [0,0,0,0,0,0|2,0,2]=4 14 B10R1.17 CCSCC1=CC=CC=C1 094637 [0,0,0,0,0,0|2,0,2]=4 15 B10R1.17 CNCCC1=CC=CC=C1 046956 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.17 ClCCCC1=CC=CC=C1 320132 [0,0,0,0,0,0|1,0,3]=4 17 B10R1.17 ClCCSC1=CC=CC=C1 003536 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.17 ClCOCC1=CC=CC=C1 106900 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.17 ICCOC1=CC=CC=C1 313818 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.17 N#CCCC1=CC=CC=C1 337065 [0,0,0,0,0,0|1,0,3]=4 21 B10R1.17 N#CCOC1=CC=CC=C1 239898 [0,0,0,0,0,0|2,0,2]=4 22 B10R1.17 N#CCSC1=CC=CC=C1 003773 [0,0,0,0,0,0|2,0,2]=4 23 B10R1.17 NCC#CC1=CC=CC=C1 050963 [0,0,0,0,0,0|1,0,3]=4 24 B10R1.17 NCCCC1=CC=CC=C1 008890 [0,0,0,0,0,0|1,0,3]=4 25 B10R1.17 NCCNC1=CC=CC=C1 320056 [0,0,0,0,0,0|2,0,2]=4 26 B10R1.17 NCCOC1=CC=CC=C1 078737 [0,0,0,0,0,0|2,0,2]=4 27 B10R1.17 O=CC#CC1=CC=CC=C1 079303 [0,0,0,0,0,0|0,0,2]=2 28 B10R1.17 O=CCCC1=CC=CC=C1 237467 [0,0,0,0,0,0|0,0,2]=2 29 B10R1.17 O=CNCC1=CC=CN=C1 032579 [0,0,0,0,0,0|2,0,1]=3 30 B10R1.17 O=COCC1=CC=CC=C1 240742 [0,0,0,0,0,0|1,0,1]=2 31 B10R1.17 O=C\C=C\C1=CC=CC=C1 099129 [0,0,0,0,0,0|0,0,0]=0 32 B10R1.17 O=C\C=C\C1=CC=CC=C1 224150 [0,0,0,0,0,0|0,0,0]=0 33 B10R1.17 OCC#CC1=CC=CC=C1 166200 [0,0,0,0,0,0|0,0,4]=4 34 B10R1.17 OCCCC1=CC=CC=C1 241187 [0,0,0,0,0,0|0,0,4]=4 35 B10R1.17 OCCNC1=CC=CC=C1 240954 [0,0,0,0,0,0|1,0,3]=4 36 B10R1.17 OCCOC1=CC=CC=C1 005091 [0,0,0,0,0,0|1,0,3]=4 37 B10R1.17 OCCSC1=CC=CC=C1 003534 [0,0,0,0,0,0|1,0,3]=4 38 B10R1.17 OC\C=C\C1=CC=CC=C1 237687 [0,0,0,0,0,0|0,0,2]=2 39 B10R1.17 S=C=NCC1=CC=CC=C1 002504 [0,0,0,0,0,0|1,1,2]=4 40 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 342017 [0,0,0,0,0,0|3,0,1]=4 41 B9R1.8 BrCCC1=CC=CC=C1 019261 [1,0,0,0,0,0|1,0,2]=4 42 B9R1.8 Br\C=C\C1=CC=CC=C1 049835 [1,0,0,0,0,0|1,0,0]=2 43 B9R1.8 C#CCC1=CC=CC=C1 080054 [1,0,0,0,0,0|0,0,3]=4 44 B9R1.8 C=CCC1=CC=CC=C1 005425 [1,0,0,0,0,0|0,0,1]=2 45 B9R1.8 C=CC[N+]1=CC=CC=C1 181022 [1,0,0,0,0,0|1,0,1]=3 46 B9R1.8 C=CSC1=CC=CC=C1 008052 [1,0,0,0,0,0|1,0,0]=2 47 B9R1.8 CC#CC1=CC=CC=C1 166000 [1,0,0,0,0,0|0,0,3]=4 48 B9R1.8 CCCC1=CC=CC=C1 095067 [1,0,0,0,0,0|0,0,3]=4 49 B9R1.8 CCNC1=CC=CC=C1 216665 [1,0,0,0,0,0|1,0,2]=4 50 B9R1.8 CCOC1=CC=CC=C1 098890 [1,0,0,0,0,0|1,0,2]=4 51 B9R1.8 CCSC1=CC=CC=C1 001759 [1,0,0,0,0,0|1,0,2]=4 52 B9R1.8 CNCC1=CC=CC=C1 020695 [1,0,0,0,0,0|1,0,2]=4 53 B9R1.8 CSCC1=CC=CC=C1 099640 [1,0,0,0,0,0|1,0,2]=4 54 B9R1.8 C\C=C/C1=CC=CC=C1 167700 [1,0,0,0,0,0|0,0,1]=2 55 B9R1.8 C\C=C\C1=CC=CC=C1 018868 [1,0,0,0,0,0|0,0,1]=2 56 B9R1.8 C\N=C\C1=CC=CC=C1 240625 [1,0,0,0,0,0|1,0,1]=3 57 B9R1.8 ClCCC1=CC=CC=C1 208883 [1,0,0,0,0,0|1,0,2]=4 58 B9R1.8 Cl[Mg]CC1=CC=CC=C1 103558 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.8 ICCC1=CC=CC=C1 001087 [1,0,0,0,0,0|1,0,2]=4 60 B9R1.8 N#C[Se]C1=CC=CC=C1 005429 [1,0,0,0,0,0|2,0,1]=4 61 B9R1.8 NCCC1=CC=CC=C1 046873 [1,0,0,0,0,0|1,0,2]=4 62 B9R1.8 NNCC1=CC=CC=C1 036859 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.8 NOCC1=CC=CC=C1 036957 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.8 O=C=NC1=CC=CC=C1 165700 [1,0,0,0,0,0|1,0,1]=3 65 B9R1.8 O=CCC1=CC=CC=C1 098878 [1,0,0,0,0,0|0,0,1]=2 66 B9R1.8 O=CNC1=CC=CC=C1 239406 [1,0,0,0,0,0|1,0,0]=2 67 B9R1.8 O=CNC1=NC=CC=C1 474802 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.8 O=S=NC1=CC=CC=C1 341767 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.8 OCCC1=CC=CC=C1 222397 [1,0,0,0,0,0|0,0,3]=4 70 B9R1.8 ONCC1=CC=CC=C1 091512 [1,0,0,0,0,0|1,0,2]=4 71 B9R1.8 ONCC1=CC=CC=C1 238633 [1,0,0,0,0,0|1,0,2]=4 72 B9R1.8 O\N=C\C1=CN=CC=C1 180049 [1,0,0,0,0,0|2,0,1]=4 73 B9R1.8 O\N=C\C1=NC=CC=C1 180048 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.8 O\N=C\C1=NC=CC=C1 227229 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.8 S=C=NC1=CC=CC=C1 358191 [1,0,0,0,0,0|1,1,1]=4 76 B11R1.1 CC1=CC=C(CN=C=O)C=C1 013635 [0,1,0,0,0,0|1,0,2]=4 77 B11R1.1 N#C\C=C\C1=CC=C(F)C=C1 005919 [0,1,0,0,0,0|1,0,1]=3 78 B11R1.1 O=C=NCC1=CC=C(Cl)C=C1 520610 [0,1,0,0,0,0|1,0,2]=4 79 B11R1.1 O=C\C=C\C1=CC=C(Br)C=C1 242694 [0,1,0,0,0,0|0,0,0]=1 80 B11R1.1 O=C\C=C\C1=CC=C(Cl)C=C1 324046 [0,1,0,0,0,0|0,0,0]=1 81 B11R1.1 O=C\C=C\C1=CC=C(F)C=C1 076541 [0,1,0,0,0,0|0,0,0]=1 82 B11R1.16 CC(CC=O)C1=CC=CC=C1 520893 [0,1,0,0,0,0|0,0,2]=3 83 B11R1.16 CCOC(=O)C1=CC=CC=C1 300758 [0,1,0,0,0,0|2,0,1]=4 84 B11R1.16 COCC(=O)C1=CC=CC=C1 321462 [0,1,0,0,0,0|2,0,1]=4 85 B11R1.16 C[C@@H](N=C=O)C1=CC=CC=C1 013633 [0,1,0,0,0,0|1,0,2]=4 86 B11R1.16 C[C@H](N=C=O)C1=CC=CC=C1 013634 [0,1,0,0,0,0|1,0,2]=4 87 B11R1.16 N#CCC(=O)C1=CC=CC=C1 013117 [0,1,0,0,0,0|1,0,2]=4 88 B11R1.16 O=C(CCCl)C1=CC=CC=C1 092658 [0,1,0,0,0,0|1,0,2]=4 89 B11R1.16 O=C(N=C=S)C1=CC=CC=C1 018199 [0,1,0,0,0,0|1,1,1]=4 90 B11R1.16 O=C(NCO)C1=CC=CC=C1 001083 [0,1,0,0,0,0|1,0,2]=4 91 B11R1.16 O=C(OCCl)C1=CC=CC=C1 209542 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.16 O=C(\C=N\O)C1=CC=CC=C1 045202 [0,1,0,0,0,0|1,0,1]=3 93 B11R1.16 O=C=NC(=O)C1=CC=CC=C1 046912 [0,1,0,0,0,0|1,0,1]=3 94 B11R1.17 C=CCOC1=C(F)C=CC=C1 021714 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.17 O=C=NCC1=CC=CC=C1Cl 098608 [0,1,0,0,0,0|1,0,2]=4 96 B11R1.24 C=CCCC1=CC=CC(Br)=C1 200069 [0,1,0,0,0,0|1,0,2]=4 97 B11R1.28 CCC\C=C\C1=CC=CC=C1 099042 [0,1,0,0,0,0|1,0,1]=3 98 B11R1.28 CCO\C=N\C1=CC=CC=C1 102609 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.28 O=C=NCCC1=CC=CC=C1 067795 [0,1,0,0,0,0|0,0,3]=4 100 B11R1.28 O=CCOCC1=CC=CC=C1 209052 [0,1,0,0,0,0|0,0,2]=3 101 B11R1.40 C=CC(=O)NC1=CC=CC=C1 320028 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.40 C=CC(=O)OC1=CC=CC=C1 461814 [0,1,0,0,0,0|2,0,0]=3 103 B11R1.40 CNC(=O)CC1=CC=CC=C1 449006 [0,1,0,0,0,0|2,0,1]=4 104 B11R1.40 CNC(=O)NC1=CC=CC=C1 342108 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.40 CNC(=O)OC1=CC=CC=C1 104150 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.40 CNC(=S)NC1=CC=CC=C1 018860 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.40 C\C(=C/C1=CC=CC=C1)CO 531267 [0,1,0,0,0,0|0,0,2]=3 108 B11R1.40 NNC(=O)NC1=CC=CC=C1 358181 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.40 NNC(=S)NC1=CC=CC=C1 011215 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.40 N\C(CC1=CC=CC=C1)=N/O 033305 [0,1,0,0,0,0|1,0,2]=4 111 B11R1.40 O=C(CBr)NC1=CC=CC=C1 080331 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.40 O=C(CBr)OC1=CC=CC=C1 235583 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.40 O=C(CC1=CC=CC=C1)NO 188889 [0,1,0,0,0,0|1,0,2]=4 114 B11R1.40 O=C(CCl)NC1=CC=CC=C1 307343 [0,1,0,0,0,0|2,0,1]=4 115 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 321306 [0,1,0,0,0,0|0,0,0]=1 116 B11R1.91 CC(=N)SCC1=CC=CC=C1 471468 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.91 CC(=O)CCC1=CC=CC=C1 454566 [0,1,0,0,0,0|0,0,2]=3 118 B11R1.91 CC(=O)NCC1=CC=NC=C1 032566 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 104115 [0,1,0,0,0,0|0,0,0]=1 120 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 234993 [0,1,0,0,0,0|0,0,0]=1 121 B11R1.91 N=C(N)COC1=CC=CC=C1 017231 [0,1,0,0,0,0|2,0,1]=4 122 B11R1.91 N=C(N)SCC1=CC=CC=C1 099378 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.91 NC(=O)CCC1=CC=CC=C1 353451 [0,1,0,0,0,0|0,0,2]=3 124 B11R1.91 NC(=O)COC1=CC=CC=C1 001028 [0,1,0,0,0,0|1,0,1]=3 125 B11R1.91 NC(=O)NCC1=CC=CC=C1 243198 [0,1,0,0,0,0|1,0,1]=3 126 B11R1.91 NC(=O)NCC1=CN=CC=C1 352454 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.91 NC(=O)OCC1=CC=CC=C1 209067 [0,1,0,0,0,0|1,0,1]=3 128 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 240025 [0,1,0,0,0,0|0,0,0]=1 129 B11R1.91 NC(=S)NCC1=CC=CC=C1 018234 [0,1,0,0,0,0|1,1,1]=4 130 B11R1.91 NC(N)=NCC1=CC=CC=C1 047437 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 448612 [0,1,0,0,0,0|0,0,2]=3 132 B11R1.91 O=C(Cl)COC1=CC=CC=C1 099217 [0,1,0,0,0,0|1,0,1]=3 133 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 106076 [0,1,0,0,0,0|1,0,1]=3 134 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 M02865 [0,1,0,0,0,0|1,0,1]=3 135 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 099114 [0,1,0,0,0,0|0,0,0]=1 136 B11R1.91 O=C(O)C#CC1=CC=CC=C1 046965 [0,1,0,0,0,0|0,0,2]=3 137 B11R1.91 O=C(O)CCC1=CC=CC=C1 216287 [0,1,0,0,0,0|0,0,2]=3 138 B11R1.91 O=C(O)CCC1=CC=CC=N1 075030 [0,1,0,0,0,0|1,0,2]=4 139 B11R1.91 O=C(O)CCC1=CC=CN=C1 065995 [0,1,0,0,0,0|1,0,2]=4 140 B11R1.91 O=C(O)CCC1=CC=NC=C1 027685 [0,1,0,0,0,0|1,0,2]=4 141 B11R1.91 O=C(O)CNC1=CC=CC=C1 011837 [0,1,0,0,0,0|1,0,1]=3 142 B11R1.91 O=C(O)COC1=CC=CC=C1 222559 [0,1,0,0,0,0|1,0,1]=3 143 B11R1.91 O=C(O)CSC1=CC=CC=C1 001321 [0,1,0,0,0,0|1,0,1]=3 144 B11R1.91 O=C(O)CSC1=CC=NC=C1 358269 [0,1,0,0,0,0|2,0,1]=4 145 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 209013 [0,1,0,0,0,0|0,0,0]=1 146 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 003424 [0,1,0,0,0,0|1,0,0]=2 147 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 009848 [0,1,0,0,0,0|1,0,0]=2 148 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 009847 [0,1,0,0,0,0|1,0,0]=2 149 B11R1.91 O=C(O)\C=C\c1ccccc1 195963 [0,1,0,0,0,0|0,0,0]=1 150 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 239114 [0,1,0,0,0,0|1,0,0]=2 151 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 303994 [0,1,0,0,0,0|1,0,1]=3 152 B11R2.1 BrC1=CNC2=CC=CN=C12 048860 [0,0,0,1,0,0|3,0,0]=4 153 B11R2.1 CC1=CNC2=CC=CC=C12 068788 [0,0,0,1,0,0|2,0,0]=3 154 B11R2.1 CC1=COC2=CC=CC=C12 013629 [0,0,0,1,0,0|2,0,0]=3 155 B11R2.1 CC1=CSC2=CC=CC=C12 018819 [0,0,0,1,0,0|2,0,0]=3 156 B11R2.1 CN1C=CC2=C1C=CC=C2 208790 [0,0,0,1,0,0|2,0,0]=3 157 B11R2.1 CN1C=NC2=CC=CC=C21 222302 [0,0,0,1,0,0|3,0,0]=4 158 B11R2.1 ClC1=NNC2=C1C=CC=C2 076553 [0,0,0,1,0,0|3,0,0]=4 159 B11R2.1 ClC1=NOC2=CC=CC=C21 067548 [0,0,0,1,0,0|3,0,0]=4 160 B11R2.1 IC1=CN=C2C=CC=CN12 046105 [0,0,0,1,0,0|3,0,0]=4 161 B11R2.1 NC1=NCC2=CC=CC=C21 387383 [0,0,0,1,0,0|2,0,1]=4 162 B11R2.1 NC1=NNC2=C1C=CC=C2 047410 [0,0,0,1,0,0|3,0,0]=4 163 B11R2.1 O=C1CCC2=C1C=CC=C2 036208 [0,0,0,1,0,0|0,0,2]=3 164 B11R2.1 O=C1COC2=CC=CC=C12 069095 [0,0,0,1,0,0|1,0,1]=3 165 B11R2.1 O=C1NCC2=C1C=CC=C2 091909 [0,0,0,1,0,0|1,0,1]=3 166 B11R2.1 O=C1NSC2=CC=CC=C12 078756 [0,0,0,1,0,0|2,0,0]=3 167 B11R2.1 O=C1OCC2=C1C=CC=C2 091677 [0,0,0,1,0,0|1,0,1]=3 168 B11R2.1 O=C1SSC2=C1C=CC=C2 099152 [0,0,0,1,0,0|2,0,0]=3 169 B11R2.1 OC1=NOC2=CC=CC=C21 017185 [0,0,0,1,0,0|2,0,1]=4 170 B11R2.20 C1=CC2=C(C=C1)C=NC=C2 227722 [0,0,0,1,0,0|2,0,0]=3 171 B11R2.20 C1=CC2=CN=CN=C2C=C1 078701 [0,0,0,1,0,0|2,0,0]=3 172 B11R2.20 C1=CC2=NC=CN=C2N=C1 069188 [0,0,0,1,0,0|3,0,0]=4 173 B11R2.20 C1=CC=C2C=CC=CC2=C1 240561 [0,0,0,1,0,0|1,0,0]=2 174 B11R2.20 C1=CC=C2N=CC=CC2=C1 104868 [0,0,0,1,0,0|1,0,0]=2 175 B11R2.20 C1=CC=C2N=CC=CC2=C1 227698 [0,0,0,1,0,0|1,0,0]=2 176 B11R2.20 C1=CC=C2N=CC=NC2=C1 079216 [0,0,0,1,0,0|2,0,0]=3 177 B11R2.20 C1=CN=C2N=CC=CC2=C1 077859 [0,0,0,1,0,0|2,0,0]=3 178 B8R1.2 BrCC1=CC=CC=C1 003666 [2,0,0,0,0,0|1,0,1]=4 179 B8R1.2 Br[Mg]C1=CC=CC=C1 103487 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.2 Br[Mg]C1=CC=CC=C1 214282 [2,0,0,0,0,0|2,0,0]=4 181 B8R1.2 C#CC1=CC=CC=C1 003009 [2,0,0,0,0,0|0,0,2]=4 182 B8R1.2 C=CC1=CC=CC=C1 520455 [2,0,0,0,0,0|0,0,0]=2 183 B8R1.2 CCC1=CC=CC=C1 094632 [2,0,0,0,0,0|0,0,2]=4 184 B8R1.2 CNC1=CC=CC=C1 094625 [2,0,0,0,0,0|1,0,1]=4 185 B8R1.2 COC1=CC=CC=C1 M03556 [2,0,0,0,0,0|1,0,1]=4 186 B8R1.2 CSC1=CC=CC=C1 002945 [2,0,0,0,0,0|1,0,1]=4 187 B8R1.2 ClCC1=CC=CC=C1 106800 [2,0,0,0,0,0|1,0,1]=4 188 B8R1.2 Cl[Hg]C1=CC=CC=C1 101463 [2,0,0,0,0,0|2,0,0]=4 189 B8R1.2 Cl[Se]C1=CC=CC=C1 005554 [2,0,0,0,0,0|2,0,0]=4 190 B8R1.2 N#CC1=CC=CC=C1 035786 [2,0,0,0,0,0|1,0,1]=4 191 B8R1.2 N#CC1=CC=CC=C1 102548 [2,0,0,0,0,0|1,0,1]=4 192 B8R1.2 NCC1=CC=CC=C1 098408 [2,0,0,0,0,0|1,0,1]=4 193 B8R1.2 NCC1=CC=CC=C1 241882 [2,0,0,0,0,0|1,0,1]=4 194 B8R1.2 NNC1=CC=CC=C1 079470 [2,0,0,0,0,0|2,0,0]=4 195 B8R1.2 NNC1=CC=CC=C1 098902 [2,0,0,0,0,0|2,0,0]=4 196 B8R1.2 O=CC1=CC=CN=C1 065202 [2,0,0,0,0,0|1,0,0]=3 197 B8R1.2 O=CC1=CC=NC=C1 091501 [2,0,0,0,0,0|1,0,0]=3 198 B8R1.2 O=CC1=CN=CN=C1 023582 [2,0,0,0,0,0|2,0,0]=4 199 B8R1.2 O=CC1=NC=CC=C1 065201 [2,0,0,0,0,0|1,0,0]=3 200 B8R1.2 O=NC1=CC=CC=C1 106182 [2,0,0,0,0,0|1,0,0]=3 201 B8R1.2 OCC1=CC=CC=C1 094986 [2,0,0,0,0,0|0,0,2]=4 202 B8R1.2 OCC1=CC=CC=C1 105725 [2,0,0,0,0,0|0,0,2]=4 203 B8R1.2 SCC1=CC=CC=C1 098994 [2,0,0,0,0,0|0,1,1]=4 204 B8R1.2 [C-]#[N+]C1=CC=CC=C1 180012 [2,0,0,0,0,0|1,0,1]=4 205 B8R1.2 [O-]CC1=CC=CC=C1 105697 [2,0,0,0,0,0|0,0,2]=4 206 B10R1.1 CC1=CC=C(N=C=O)C=C1 099850 [1,1,0,0,0,0|1,0,1]=4 207 B10R1.1 CC1=CC=C(NC=O)C=C1 180098 [1,1,0,0,0,0|1,0,0]=3 208 B10R1.1 CC1=CC=C(\C=N\O)C=C1 300271 [1,1,0,0,0,0|1,0,1]=4 209 B10R1.1 O=C=NC1=CC=C(Br)C=C1 046917 [1,1,0,0,0,0|1,0,1]=4 210 B10R1.1 O=C=NC1=CC=C(Cl)C=C1 403156 [1,1,0,0,0,0|1,0,1]=4 211 B10R1.1 O=C=NC1=CC=C(F)C=C1 002336 [1,1,0,0,0,0|1,0,1]=4 212 B10R1.1 O=C=NC1=CC=C(I)C=C1 149800 [1,1,0,0,0,0|1,0,1]=4 213 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 217622 [1,1,0,0,0,0|1,0,1]=4 214 B10R1.1 O\N=C\C1=CC=C(F)C=C1 011169 [1,1,0,0,0,0|1,0,1]=4 215 B10R1.4 C=CCC1=C(O)C=CC=C1 520493 [1,1,0,0,0,0|0,0,1]=3 216 B10R1.4 CC1=C(N=C=O)C=CC=C1 403155 [1,1,0,0,0,0|1,0,1]=4 217 B10R1.4 CC1=CC=CC=C1NC=O 180097 [1,1,0,0,0,0|1,0,0]=3 218 B10R1.4 O=C=NC1=C(Br)C=CC=C1 046915 [1,1,0,0,0,0|1,0,1]=4 219 B10R1.4 O=C=NC1=C(Cl)C=CC=C1 046923 [1,1,0,0,0,0|1,0,1]=4 220 B10R1.4 O=C=NC1=C(F)C=CC=C1 002334 [1,1,0,0,0,0|1,0,1]=4 221 B10R1.4 O=C=NC1=CC=CC=C1I 013613 [1,1,0,0,0,0|1,0,1]=4 222 B10R1.4 O=CNC1=C(Br)C=CC=C1 530777 [1,1,0,0,0,0|1,0,0]=3 223 B10R1.10 C=CCC1=CC=CC(Cl)=C1 022313 [1,1,0,0,0,0|0,0,1]=3 224 B10R1.10 C=CCC1=CC=CC(F)=C1 022325 [1,1,0,0,0,0|0,0,1]=3 225 B10R1.10 CC1=CC=CC(N=C=O)=C1 046957 [1,1,0,0,0,0|1,0,1]=4 226 B10R1.10 O=C=NC1=CC(Br)=CC=C1 046916 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.10 O=C=NC1=CC(Cl)=CC=C1 094703 [1,1,0,0,0,0|1,0,1]=4 228 B10R1.10 O=C=NC1=CC(F)=CC=C1 002335 [1,1,0,0,0,0|1,0,1]=4 229 B10R1.10 O=C=NC1=CC(I)=CC=C1 104022 [1,1,0,0,0,0|1,0,1]=4 230 B10R1.15 C(=O)C(C)C1=CC=CC=C1 003859 [1,1,0,0,0,0|0,0,1]=3 231 B10R1.15 CCC(=O)C1=CC=CC=C1 094675 [1,1,0,0,0,0|0,0,2]=4 232 B10R1.15 CN(C=O)C1=CC=CC=C1 208822 [1,1,0,0,0,0|1,0,0]=3 233 B10R1.15 CNC(=O)C1=CC=CC=C1 341719 [1,1,0,0,0,0|1,0,1]=4 234 B10R1.15 CNC(=S)C1=CC=CC=C1 180197 [1,1,0,0,0,0|1,0,1]=4 235 B10R1.15 COC(=O)C1=CC=CC=C1 223218 [1,1,0,0,0,0|1,0,1]=4 236 B10R1.15 N#CC(=O)C1=CC=CC=C1 241276 [1,1,0,0,0,0|1,0,1]=4 237 B10R1.15 NCC(=O)C1=CC=CC=C1 040292 [1,1,0,0,0,0|1,0,1]=4 238 B10R1.15 NNC(=O)C1=CC=CC=C1 227678 [1,1,0,0,0,0|2,0,0]=4 239 B10R1.15 N\C(=N/O)C1=CC=CC=C1 067963 [1,1,0,0,0,0|1,0,1]=4 240 B10R1.15 N\C(=N/O)C1=CC=CC=C1 097873 [1,1,0,0,0,0|1,0,1]=4 241 B10R1.15 N\C(=N\O)C1=CC=CC=C1 106200 [1,1,0,0,0,0|1,0,1]=4 242 B10R1.15 O=C(CBr)C1=CC=CC=C1 040508 [1,1,0,0,0,0|1,0,1]=4 243 B10R1.15 O=C(CCl)C1=CC=CC=C1 228091 [1,1,0,0,0,0|1,0,1]=4 244 B10R1.15 O=C(CO)C1=CC=CC=C1 219236 [1,1,0,0,0,0|0,0,2]=4 245 B10R1.15 O=C(NO)C1=CC=CC=C1 317419 [1,1,0,0,0,0|1,0,1]=4 246 B10R1.15 O=CC(=O)C1=CC=CC=C1 454875 [1,1,0,0,0,0|0,0,0]=2 247 B10R1.18 CC(=O)NC1=CC=CC=C1 098888 [1,1,0,0,0,0|1,0,0]=3 248 B10R1.18 CC(=O)NC1=CC=CC=C1 236729 [1,1,0,0,0,0|1,0,0]=3 249 B10R1.18 CC(=O)NC1=CC=CN=C1 032565 [1,1,0,0,0,0|2,0,0]=4 250 B10R1.18 CC(=O)NC1=CC=NC=C1 235412 [1,1,0,0,0,0|2,0,0]=4 251 B10R1.18 CC(=O)OC1=CC=CC=C1 106321 [1,1,0,0,0,0|1,0,0]=3 252 B10R1.18 CC(=O)SC1=CC=CC=C1 180205 [1,1,0,0,0,0|1,0,0]=3 253 B10R1.18 N=C(O)NC1=CC=CC=C1 364335 [1,1,0,0,0,0|1,0,1]=4 254 B10R1.18 NC(=O)CC1=CC=CC=C1 018952 [1,1,0,0,0,0|0,0,1]=3 255 B10R1.18 NC(=O)NC1=NC=CC=C1 023876 [1,1,0,0,0,0|2,0,0]=4 256 B10R1.18 NC(=O)OC1=CC=CC=C1 180113 [1,1,0,0,0,0|1,0,0]=3 257 B10R1.18 NC(=S)CC1=CC=CC=C1 047341 [1,1,0,0,0,0|0,1,1]=4 258 B10R1.18 NC(=S)NC1=CC=CC=C1 358215 [1,1,0,0,0,0|1,1,0]=4 259 B10R1.18 O=C(Cl)CC1=CC=CC=C1 099401 [1,1,0,0,0,0|0,0,1]=3 260 B10R1.18 O=C(Cl)OC1=CC=CC=C1 235668 [1,1,0,0,0,0|1,0,0]=3 261 B10R1.18 O=C(Cl)SC1=CC=CC=C1 015276 [1,1,0,0,0,0|1,0,0]=3 262 B10R1.18 O=C(O)CC1=CC=CN=C1 066081 [1,1,0,0,0,0|1,0,1]=4 263 B10R1.18 O=C(O)CC1=CC=CN=C1 076680 [1,1,0,0,0,0|1,0,1]=4 264 B10R1.18 O=C(O)CC1=CC=NC=C1 001787 [1,1,0,0,0,0|1,0,1]=4 265 B10R1.18 O=C(O)CC1=NC=CC=C1 066003 [1,1,0,0,0,0|1,0,1]=4 266 B10R1.18 O=C(O)C[N+]1=CC=CC=C1 180385 [1,1,0,0,0,0|1,0,1]=4 267 B10R1.18 S=C(Cl)OC1=CC=CC=C1 046963 [1,1,0,0,0,0|1,1,0]=4 268 B10R1.18 S=C(Cl)SC1=CC=CC=C1 239805 [1,1,0,0,0,0|1,1,0]=4 269 B10R1.66 O=C(O)\C=C\C1=CC=CO1 099099 [0,1,0,0,1,0|1,0,0]=3 270 B10R1.66 O=C(O)\C=C\C1=CC=CS1 018999 [0,1,0,0,1,0|1,0,0]=3 271 B12R1.16 N#C\C=C(/Cl)C1=CC=C(Cl)C=C1 019560 [0,2,0,0,0,0|1,0,1]=4 272 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 003627 [0,2,0,0,0,0|0,0,2]=4 273 B12R1.21 CC(=O)CSC1=CC=C(C)C=C1 003767 [0,2,0,0,0,0|1,0,1]=4 274 B12R1.21 CC(=O)CSC1=CC=C(Cl)C=C1 023249 [0,2,0,0,0,0|1,0,1]=4 275 B12R1.21 CC(=O)CSC1=CC=C(F)C=C1 006345 [0,2,0,0,0,0|1,0,1]=4 276 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 018857 [0,2,0,0,0,0|0,0,2]=4 277 B12R1.21 CC1=CC=C(OCC(N)=O)C=C1 106072 [0,2,0,0,0,0|1,0,1]=4 278 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 042198 [0,2,0,0,0,0|1,0,1]=4 279 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 046849 [0,2,0,0,0,0|0,0,0]=2 280 B12R1.21 NC(=O)CCC1=CC=C(Br)C=C1 103202 [0,2,0,0,0,0|0,0,2]=4 281 B12R1.21 NC(=O)COC1=CC=C(Cl)C=C1 106325 [0,2,0,0,0,0|1,0,1]=4 282 B12R1.21 NC(=O)COC1=CC=C(F)C=C1 106307 [0,2,0,0,0,0|1,0,1]=4 283 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 002500 [0,2,0,0,0,0|0,0,2]=4 284 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 104178 [0,2,0,0,0,0|0,0,0]=2 285 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 239541 [0,2,0,0,0,0|0,0,0]=2 286 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 464926 [0,2,0,0,0,0|0,0,0]=2 287 B12R1.21 O=C(Cl)CCC1=CC=C(Br)C=C1 477557 [0,2,0,0,0,0|0,0,2]=4 288 B12R1.21 O=C(Cl)\C=C\C1=CC=C(F)C=C1 014744 [0,2,0,0,0,0|0,0,0]=2 289 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 018312 [0,2,0,0,0,0|0,0,2]=4 290 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 121300 [0,2,0,0,0,0|0,0,2]=4 291 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 006340 [0,2,0,0,0,0|0,0,2]=4 292 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 033922 [0,2,0,0,0,0|0,0,2]=4 293 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 078730 [0,2,0,0,0,0|0,0,2]=4 294 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 216660 [0,2,0,0,0,0|1,0,1]=4 295 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 006318 [0,2,0,0,0,0|1,0,1]=4 296 B12R1.21 O=C(O)COC1=CC=C(O)C=C1 358423 [0,2,0,0,0,0|1,0,1]=4 297 B12R1.21 O=C(O)CSC1=CC=C(Br)C=C1 033382 [0,2,0,0,0,0|1,0,1]=4 298 B12R1.21 O=C(O)CSC1=CC=C(F)C=C1 006343 [0,2,0,0,0,0|1,0,1]=4 299 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 001109 [0,2,0,0,0,0|0,0,0]=2 300 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 001144 [0,2,0,0,0,0|0,0,0]=2 301 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 001180 [0,2,0,0,0,0|0,0,0]=2 302 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 076727 [0,2,0,0,0,0|0,0,0]=2 303 B12R1.21 O=C(O)\C=C\c1ccc(O)cc1 195783 [0,2,0,0,0,0|0,0,0]=2 304 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(Br)C=C1 454357 [0,2,0,0,0,0|1,0,0]=3 305 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(F)C=C1 006306 [0,2,0,0,0,0|1,0,0]=3 306 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(O)C=C1 018725 [0,2,0,0,0,0|1,0,0]=3 307 B12R1.71 COC1=CC=C(\C=C\C#N)C=C1 106456 [0,2,0,0,0,0|1,0,1]=4 308 B12R1.71 COC1=CC=C(\C=C\C=O)C=C1 103214 [0,2,0,0,0,0|0,0,0]=2 309 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 209363 [0,2,0,0,0,0|2,0,0]=4 310 B12R1.34 C\C(=N/O)C(=O)C1=CC=CC=C1 320741 [0,2,0,0,0,0|1,0,1]=4 311 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 106600 [0,2,0,0,0,0|0,0,1]=3 312 B12R1.107 CC(=O)OC(C)C1=CC=CC=C1 320170 [0,2,0,0,0,0|1,0,1]=4 313 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 358190 [0,2,0,0,0,0|0,0,2]=4 314 B12R1.107 C\C(N)=C\C(=O)C1=CC=CC=C1 185695 [0,2,0,0,0,0|1,0,0]=3 315 B12R1.107 NC(=S)NC(=O)C1=CC=CC=C1 018204 [0,2,0,0,0,0|1,1,0]=4 316 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 034469 [0,2,0,0,0,0|0,0,2]=4 317 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 040244 [0,2,0,0,0,0|0,0,2]=4 318 B12R1.107 O=C(O)C[C@H](O)C1=CC=CC=C1 103042 [0,2,0,0,0,0|0,0,2]=4 319 B12R1.125 CC1=C(OCC(N)=O)C=CC=C1 105772 [0,2,0,0,0,0|1,0,1]=4 320 B12R1.125 CC1=CC=CC=C1CCC(=O)O 018855 [0,2,0,0,0,0|0,0,2]=4 321 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)O 340690 [0,2,0,0,0,0|0,0,0]=2 322 B12R1.125 NC(=O)COC1=C(Br)C=CC=C1 106163 [0,2,0,0,0,0|1,0,1]=4 323 B12R1.125 NC(=O)COC1=C(Cl)C=CC=C1 106330 [0,2,0,0,0,0|1,0,1]=4 324 B12R1.125 NC(=O)COC1=C(F)C=CC=C1 105773 [0,2,0,0,0,0|1,0,1]=4 325 B12R1.125 NC(=O)\C=C\C1=C(F)C=CC=C1 102686 [0,2,0,0,0,0|0,0,0]=2 326 B12R1.125 O=C(Cl)\C=C\C1=CC=CC=C1F 014739 [0,2,0,0,0,0|0,0,0]=2 327 B12R1.125 O=C(O)CCC1=C(F)C=CC=C1 009235 [0,2,0,0,0,0|0,0,2]=4 328 B12R1.125 O=C(O)CCC1=CC=CC=C1Br 018310 [0,2,0,0,0,0|0,0,2]=4 329 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl 018433 [0,2,0,0,0,0|0,0,2]=4 330 B12R1.125 O=C(O)COC1=C(F)C=CC=C1 042079 [0,2,0,0,0,0|1,0,1]=4 331 B12R1.125 O=C(O)COC1=C(O)C=CC=C1 103444 [0,2,0,0,0,0|1,0,1]=4 332 B12R1.125 O=C(O)\C=C\C1=C(Br)C=CC=C1 001107 [0,2,0,0,0,0|0,0,0]=2 333 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 001142 [0,2,0,0,0,0|0,0,0]=2 334 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1F 001440 [0,2,0,0,0,0|0,0,0]=2 335 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O 375171 [0,2,0,0,0,0|0,0,0]=2 336 B12R1.125 O=[N+]([O-])\C=C\C1=C(F)C=CC=C1 006305 [0,2,0,0,0,0|1,0,0]=3 337 B12R1.125 O=[N+]([O-])\C=C\C1=CC=CC=C1Cl 241709 [0,2,0,0,0,0|1,0,0]=3 338 B12R1.226 CC1=CC(CCC(=O)O)=CC=C1 018856 [0,2,0,0,0,0|0,0,2]=4 339 B12R1.226 CC1=CC(OCC(N)=O)=CC=C1 106075 [0,2,0,0,0,0|1,0,1]=4 340 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 239535 [0,2,0,0,0,0|0,0,0]=2 341 B12R1.226 NC(=O)COC1=CC(Br)=CC=C1 069821 [0,2,0,0,0,0|1,0,1]=4 342 B12R1.226 NC(=O)COC1=CC(Cl)=CC=C1 403355 [0,2,0,0,0,0|1,0,1]=4 343 B12R1.226 NC(=O)COC1=CC(F)=CC=C1 106305 [0,2,0,0,0,0|1,0,1]=4 344 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 002499 [0,2,0,0,0,0|0,0,2]=4 345 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 018311 [0,2,0,0,0,0|0,0,2]=4 346 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 018434 [0,2,0,0,0,0|0,0,2]=4 347 B12R1.226 O=C(O)CCC1=CC=CC(O)=C1 018728 [0,2,0,0,0,0|0,0,2]=4 348 B12R1.226 O=C(O)COC1=CC(Cl)=CC=C1 040411 [0,2,0,0,0,0|1,0,1]=4 349 B12R1.226 O=C(O)\C=C\C1=CC(Br)=CC=C1 001108 [0,2,0,0,0,0|0,0,0]=2 350 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 358032 [0,2,0,0,0,0|0,0,0]=2 351 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 209894 [0,2,0,0,0,0|0,0,0]=2 352 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 001441 [0,2,0,0,0,0|0,0,0]=2 353 B12R1.226 O=[N+]([O-])\C=C\C1=CC(F)=CC=C1 240147 [0,2,0,0,0,0|1,0,0]=3 354 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 242828 [0,2,0,0,0,0|1,0,1]=4 355 B12R1.27 CNC(=O)CCC1=CC=CC=C1 105160 [0,2,0,0,0,0|0,0,2]=4 356 B12R1.27 COC(=O)CCC1=CC=CC=C1 078491 [0,2,0,0,0,0|0,0,2]=4 357 B12R1.27 COC(=O)COC1=CC=CC=C1 001024 [0,2,0,0,0,0|1,0,1]=4 358 B12R1.27 COC(=O)CSC1=CC=CC=C1 003766 [0,2,0,0,0,0|1,0,1]=4 359 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 209319 [0,2,0,0,0,0|0,0,0]=2 360 B12R1.27 NCC(=O)OCC1=CC=CC=C1 038264 [0,2,0,0,0,0|1,0,1]=4 361 B12R1.27 NCC(=O)OCC1=CC=CC=C1 M03020 [0,2,0,0,0,0|1,0,1]=4 362 B12R1.27 NNC(=O)OCC1=CC=CC=C1 018210 [0,2,0,0,0,0|1,0,1]=4 363 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 080332 [0,2,0,0,0,0|1,0,1]=4 364 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 057933 [0,2,0,0,0,0|1,0,1]=4 365 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 320035 [0,2,0,0,0,0|1,0,1]=4 366 B12R1.27 O=C(CO)OCC1=CC=CC=C1 243220 [0,2,0,0,0,0|1,0,1]=4 367 B12R1.252 CC(=O)COCC1=CC=CC=C1 222790 [0,2,0,0,0,0|0,0,2]=4 368 B12R1.252 CC(=O)NCCC1=CC=CC=C1 240701 [0,2,0,0,0,0|0,0,2]=4 369 B12R1.252 NC(=O)CCCC1=CC=CC=C1 342267 [0,2,0,0,0,0|0,0,2]=4 370 B12R1.252 NC(=O)NCCC1=CC=CC=C1 180296 [0,2,0,0,0,0|0,0,2]=4 371 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 432089 [0,2,0,0,0,0|0,0,2]=4 372 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 318677 [0,2,0,0,0,0|0,0,2]=4 373 B12R1.252 O=C(O)CCCC1=CC=CC=C1 214820 [0,2,0,0,0,0|0,0,2]=4 374 B12R1.252 O=C(O)CCNC1=CC=CC=C1 387000 [0,2,0,0,0,0|0,0,2]=4 375 B12R1.252 O=C(O)CCSC1=CC=CC=C1 065695 [0,2,0,0,0,0|0,0,2]=4 376 B12R1.252 O=C(O)CNCC1=CC=CC=C1 011446 [0,2,0,0,0,0|0,0,2]=4 377 B12R1.252 O=C(O)CSCC1=CC=CC=C1 003688 [0,2,0,0,0,0|0,0,2]=4 378 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O 209321 [0,2,0,0,0,0|0,0,1]=3 379 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O 241185 [0,2,0,0,0,0|0,0,0]=2 380 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 M02966 [0,2,0,0,0,0|0,0,2]=4 381 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O 093728 [0,2,0,0,0,0|0,0,2]=4 382 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O 404464 [0,2,0,0,0,0|0,0,2]=4 383 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O M02961 [0,2,0,0,0,0|0,0,2]=4 384 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O M02934 [0,2,0,0,0,0|0,0,2]=4 385 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 433344 [0,2,0,0,0,0|0,0,2]=4 386 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 003388 [0,2,0,0,0,0|0,0,2]=4 387 B12R1.43 O=C([O-])C(=O)CC1=CC=CC=C1 013693 [0,2,0,0,0,0|0,0,1]=3 388 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(N)=O 222744 [0,2,0,0,0,0|0,0,2]=4 389 B12R1.118 N#CC(C#N)=CC1=CC=CC=C1 235863 [0,2,0,0,0,0|1,0,1]=4 390 B10R1.30 C(=O)C1=C(C)C=CC(F)=C1 022378 [0,0,1,1,0,0|1,0,1]=4 391 B10R1.30 CC1=CC(C=O)=C(F)C=C1 037138 [0,0,1,1,0,0|1,0,1]=4 392 B10R1.30 CC1=CC=C(Br)C(C=O)=C1 079663 [0,0,1,1,0,0|1,0,1]=4 393 B10R1.30 CC1=CC=C(C)C(C=O)=C1 329590 [0,0,1,1,0,0|0,0,2]=4 394 B10R1.30 CC1=CC=C(O)C(C=O)=C1 015625 [0,0,1,1,0,0|1,0,1]=4 395 B10R1.30 NC1=C(C=O)C=C(Br)C=C1 047033 [0,0,1,1,0,0|2,0,0]=4 396 B10R1.30 NC1=CC=C(Cl)C=C1C=O 077451 [0,0,1,1,0,0|2,0,0]=4 397 B10R1.30 O=CC1=C(Br)C=CC(Br)=C1 033754 [0,0,1,1,0,0|2,0,0]=4 398 B10R1.30 O=CC1=C(Br)C=CC(F)=C1 013206 [0,0,1,1,0,0|2,0,0]=4 399 B10R1.30 O=CC1=C(Cl)C=CC(Br)=C1 047055 [0,0,1,1,0,0|2,0,0]=4 400 B10R1.30 O=CC1=C(Cl)C=CC(F)=C1 033181 [0,0,1,1,0,0|2,0,0]=4 401 B10R1.30 O=CC1=C(F)C=CC(Br)=C1 009413 [0,0,1,1,0,0|2,0,0]=4 402 B10R1.30 O=CC1=C(F)C=CC(Cl)=C1 013958 [0,0,1,1,0,0|2,0,0]=4 403 B10R1.30 O=CC1=C(F)C=CC(F)=C1 001932 [0,0,1,1,0,0|2,0,0]=4 404 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 061448 [0,0,1,1,0,0|2,0,0]=4 405 B10R1.30 O=CC1=C(O)C=CC(F)=C1 013016 [0,0,1,1,0,0|2,0,0]=4 406 B10R1.30 O=CC1=C(O)C=CC(I)=C1 031711 [0,0,1,1,0,0|2,0,0]=4 407 B10R1.30 O=CC1=C(O)C=CC(O)=C1 033709 [0,0,1,1,0,0|2,0,0]=4 408 B10R1.30 O=CC1=CC(Br)=CC=C1O 079127 [0,0,1,1,0,0|2,0,0]=4 409 B10R1.30 O=CC1=CC(Cl)=CC=C1Br 079055 [0,0,1,1,0,0|2,0,0]=4 410 B10R1.30 O=CC1=CC(Cl)=CC=C1Cl 065148 [0,0,1,1,0,0|2,0,0]=4 411 B10R1.30 O=CC1=CC(I)=CC=C1Br 213252 [0,0,1,1,0,0|2,0,0]=4 412 B10R1.30 O=CC1=CC(I)=CC=C1F 033683 [0,0,1,1,0,0|2,0,0]=4 413 B10R1.30 O=CC1=CC(O)=CC=C1Br 031303 [0,0,1,1,0,0|2,0,0]=4 414 B10R1.30 O=CC1=CC(O)=CC=C1Cl 091944 [0,0,1,1,0,0|2,0,0]=4 415 B10R1.30 O=CC1=CC(O)=CC=C1F 076097 [0,0,1,1,0,0|2,0,0]=4 416 B10R1.20 C=CC1=CC=CC=C1C=C 245965 [0,0,1,1,0,0|1,0,0]=3 417 B10R1.172 COC1=CC(C=O)=CC=C1 208834 [0,0,1,1,0,0|1,0,1]=4 418 B10R1.172 N#CC1=CC=CC(C=O)=C1 021882 [0,0,1,1,0,0|1,0,1]=4 419 B10R1.172 O=CC1=CC=CC(C=O)=C1 079861 [0,0,1,1,0,0|1,0,0]=3 420 B10R1.172 O=CC1=CC=CC(C=O)=N1 011851 [0,0,1,1,0,0|2,0,0]=4 421 B10R2.7 C1=CC2=C(C=C1)CC=C2 358247 [1,0,0,1,0,0|0,0,1]=3 422 B10R2.7 C1=CC2=C(C=C1)NN=C2 044571 [1,0,0,1,0,0|2,0,0]=4 423 B10R2.7 C1=CC2=C(C=CN2)N=C1 036833 [1,0,0,1,0,0|2,0,0]=4 424 B10R2.7 C1=CC2=CC=NC=C2N1 040034 [1,0,0,1,0,0|2,0,0]=4 425 B10R2.7 C1=CC2=CN=CC=C2N1 040035 [1,0,0,1,0,0|2,0,0]=4 426 B10R2.7 C1=CC2=CN=CN2C=C1 219977 [1,0,0,1,0,0|2,0,0]=4 427 B10R2.7 C1=CC=C2NC=CC2=C1 068792 [1,0,0,1,0,0|1,0,0]=3 428 B10R2.7 C1=CC=C2NC=NC2=C1 235007 [1,0,0,1,0,0|2,0,0]=4 429 B10R2.7 C1=CC=C2OC=CC2=C1 078727 [1,0,0,1,0,0|0,0,1]=3 430 B10R2.7 C1=CC=C2OC=NC2=C1 078910 [1,0,0,1,0,0|1,0,1]=4 431 B10R2.7 C1=CC=C2SC=CC2=C1 003497 [1,0,0,1,0,0|0,1,0]=3 432 B10R2.7 C1=CC=C2SC=NC2=C1 093451 [1,0,0,1,0,0|1,1,0]=4 433 B10R2.7 C1=CN=C2NC=CC2=C1 032720 [1,0,0,1,0,0|2,0,0]=4 434 B12R2.24 BrC1=CC2=C(C=CC=C2)N=C1 044937 [0,1,0,1,0,0|1,0,0]=3 435 B12R2.24 BrC1=CC2=C(C=CN=C2)C=C1 038558 [0,1,0,1,0,0|2,0,0]=4 436 B12R2.24 BrC1=CC=C2C=CC=CC2=C1 077976 [0,1,0,1,0,0|1,0,0]=3 437 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 076676 [0,1,0,1,0,0|1,0,0]=3 438 B12R2.24 BrC1=CC=C2C=NC=CC2=C1 036991 [0,1,0,1,0,0|2,0,0]=4 439 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 067503 [0,1,0,1,0,0|1,0,0]=3 440 B12R2.24 BrC1=CC=C2N=CC=NC2=C1 037028 [0,1,0,1,0,0|2,0,0]=4 441 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 076108 [0,1,0,1,0,0|1,0,0]=3 442 B12R2.24 BrC1=NC2=CC=CC=C2N=C1 077574 [0,1,0,1,0,0|2,0,0]=4 443 B12R2.24 CC1=CC2=C(C=C1)C=NC=C2 208923 [0,1,0,1,0,0|2,0,0]=4 444 B12R2.24 CC1=CC=C2C=CC=CC2=C1 216647 [0,1,0,1,0,0|1,0,0]=3 445 B12R2.24 CC1=CC=C2N=CC=NC2=C1 002740 [0,1,0,1,0,0|2,0,0]=4 446 B12R2.24 CC1=NC2=CC=CC=C2C=C1 078623 [0,1,0,1,0,0|1,0,0]=3 447 B12R2.24 CC1=NC2=CC=CC=C2N=C1 303297 [0,1,0,1,0,0|2,0,0]=4 448 B12R2.24 CC1=NC2=NC=CC=C2C=C1 208943 [0,1,0,1,0,0|2,0,0]=4 449 B12R2.24 ClC1=CC2=CC=CN=C2C=C1 049700 [0,1,0,1,0,0|1,0,0]=3 450 B12R2.24 ClC1=NC2=CC=CC=C2N=C1 067518 [0,1,0,1,0,0|2,0,0]=4 451 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 238872 [0,1,0,1,0,0|1,0,0]=3 452 B12R2.24 NC1=CC2=CC=CC=C2N=C1 064971 [0,1,0,1,0,0|1,0,0]=3 453 B12R2.24 NC1=CC2=CC=CN=C2C=C1 045222 [0,1,0,1,0,0|1,0,0]=3 454 B12R2.24 NC1=CC=C2C=CC=CC2=C1 079046 [0,1,0,1,0,0|1,0,0]=3 455 B12R2.24 NC1=CC=C2C=NC=CC2=C1 036790 [0,1,0,1,0,0|2,0,0]=4 456 B12R2.24 NC1=CC=C2N=CC=NC2=C1 038894 [0,1,0,1,0,0|2,0,0]=4 457 B12R2.24 NC1=NC2=CC=CC=C2C=C1 105400 [0,1,0,1,0,0|1,0,0]=3 458 B12R2.24 O=C1C=C2C=CC=CC2=CN1 208952 [0,1,0,1,0,0|1,0,0]=3 459 B12R2.24 O=C1C=CC2=C(C=CC=C2)N1 358402 [0,1,0,1,0,0|0,0,0]=2 460 B12R2.24 O=C1C=CC2=CC=CC=C2O1 239149 [0,1,0,1,0,0|0,0,0]=2 461 B12R2.24 O=C1C=NC2=CC=CC=C2N1 042360 [0,1,0,1,0,0|1,0,0]=3 462 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 012252 [0,1,0,1,0,0|0,0,2]=4 463 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 047953 [0,1,0,1,0,0|0,0,2]=4 464 B12R2.24 O=C1CCC2=CC=CC=C2O1 236946 [0,1,0,1,0,0|0,0,2]=4 465 B12R2.24 O=C1CNC2=CC=CC=C2N1 015374 [0,1,0,1,0,0|1,0,1]=4 466 B12R2.24 O=C1COC2=CC=CC=C2N1 012228 [0,1,0,1,0,0|1,0,1]=4 467 B12R2.24 O=C1CSC2=CC=CC=C2N1 011093 [0,1,0,1,0,0|1,0,1]=4 468 B12R2.24 OC1=CC2=CC=CC=C2N=C1 076701 [0,1,0,1,0,0|1,0,0]=3 469 B12R2.24 OC1=CC=C2C=CC=CC2=C1 235727 [0,1,0,1,0,0|0,0,1]=3 470 B12R2.24 OC1=CC=C2C=CC=NC2=C1 076325 [0,1,0,1,0,0|1,0,0]=3 471 B12R2.24 OC1=CC=C2C=CN=CC2=C1 068840 [0,1,0,1,0,0|1,0,1]=4 472 B12R2.24 OC1=CC=C2N=CC=CC2=C1 076700 [0,1,0,1,0,0|1,0,0]=3 473 B12R2.24 SC1=CC=C2C=CC=CC2=C1 227409 [0,1,0,1,0,0|0,1,0]=3 474 B12R2.132 CC1=CC2=C(C=C1)SC=C2C 049846 [0,1,0,1,0,0|2,0,0]=4 475 B12R2.132 CC1=CSC2=CC=C(Cl)C=C12 005326 [0,1,0,1,0,0|2,0,0]=4 476 B12R2.132 CC1=CSC2=CC=C(F)C=C12 008343 [0,1,0,1,0,0|2,0,0]=4 477 B12R2.132 NC1=CC2=C(C=C1)CNC2=O 209019 [0,1,0,1,0,0|1,0,1]=4 478 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 037027 [0,1,0,1,0,0|0,0,2]=4 479 B12R2.132 O=C1CCC2=C1C=C(F)C=C2 032493 [0,1,0,1,0,0|0,0,2]=4 480 B12R2.132 O=C1OCC2=CC=C(Br)C=C12 026924 [0,1,0,1,0,0|1,0,1]=4 481 B12R2.2 C1=CC(C2=CN=CN2)=CN=C1 046409 [0,1,0,1,0,0|2,0,0]=4 482 B12R2.2 C1=CC=C(C2=CC=CS2)N=C1 017372 [0,1,0,1,0,0|1,1,0]=4 483 B12R2.2 C1=CC=C(C2=CN=CS2)C=C1 209295 [0,1,0,1,0,0|0,1,0]=3 484 B12R2.2 C1=CC=C(C2=CNC=N2)C=C1 208941 [0,1,0,1,0,0|1,0,0]=3 485 B12R2.2 C1=CC=C(C2=CNN=N2)C=C1 036926 [0,1,0,1,0,0|2,0,0]=4 486 B12R2.2 C1=CC=C(C2=CSN=N2)C=C1 316731 [0,1,0,1,0,0|2,0,0]=4 487 B12R2.2 C1=CC=C(C2=NC=CN2)C=C1 208942 [0,1,0,1,0,0|1,0,0]=3 488 B12R2.2 C1=CC=C(C2=NN=CO2)C=C1 216488 [0,1,0,1,0,0|1,0,1]=4 489 B12R2.2 C1=CC=C(C2=NNC=C2)C=C1 017112 [0,1,0,1,0,0|1,0,0]=3 490 B12R2.2 C1=CC=C(C2=NOC=C2)C=C1 033649 [0,1,0,1,0,0|0,0,1]=3 491 B12R2.2 C1=CC=C(N2C=CC=C2)C=C1 458341 [0,1,0,1,0,0|1,0,0]=3 492 B12R2.2 C1=CC=C(N2C=CN=C2)C=C1 002610 [0,1,0,1,0,0|2,0,0]=4 493 B12R2.2 C1=CC=C(N2CC=CC2)C=C1 231375 [0,1,0,1,0,0|1,0,1]=4 494 B12R2.1081 BrC1=C2C=CC=CC2=CC=C1 222044 [0,1,0,1,0,0|1,0,0]=3 495 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 040578 [0,1,0,1,0,0|1,0,0]=3 496 B12R2.1081 BrC1=CC=CC2=C1C=CN=C2 038557 [0,1,0,1,0,0|2,0,0]=4 497 B12R2.1081 BrC1=CC=CC2=C1C=NC=C2 038559 [0,1,0,1,0,0|2,0,0]=4 498 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 048864 [0,1,0,1,0,0|1,0,0]=3 499 B12R2.1081 BrC1=CC=NC2=C1C=CC=C2 048863 [0,1,0,1,0,0|1,0,0]=3 500 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 067513 [0,1,0,1,0,0|1,0,0]=3 501 B12R2.1081 CC1=C2N=CC=CC2=CC=C1 001208 [0,1,0,1,0,0|1,0,0]=3 502 B12R2.1081 CC1=CC=CC2=CC=CC=C12 099064 [0,1,0,1,0,0|1,0,0]=3 503 B12R2.1081 CC1=CC=NC2=CC=CC=C12 079132 [0,1,0,1,0,0|1,0,0]=3 504 B12R2.1081 CC1=NC=NC2=CC=CC=C21 180152 [0,1,0,1,0,0|2,0,0]=4 505 B12R2.1081 ClC1=C2C=CC=CC2=NC=C1 049298 [0,1,0,1,0,0|1,0,0]=3 506 B12R2.1081 ClC1=C2C=CC=NC2=CC=C1 092866 [0,1,0,1,0,0|1,0,0]=3 507 B12R2.1081 ClC1=NC=CC2=CC=CC=C21 040234 [0,1,0,1,0,0|1,0,0]=3 508 B12R2.1081 FC1=CC=CC2=CC=CC=C12 002697 [0,1,0,1,0,0|1,0,0]=3 509 B12R2.1081 IC1=CC=CC2=CC=CC=C12 005439 [0,1,0,1,0,0|1,0,0]=3 510 B12R2.1081 NC1=C2C=CC=CC2=CC=C1 216423 [0,1,0,1,0,0|1,0,0]=3 511 B12R2.1081 NC1=C2C=CC=CC2=CC=N1 064975 [0,1,0,1,0,0|1,0,0]=3 512 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 092958 [0,1,0,1,0,0|1,0,0]=3 513 B12R2.1081 NC1=CC=CC2=NC=CC=C12 048215 [0,1,0,1,0,0|1,0,0]=3 514 B12R2.1081 NC1=CC=NC2=CC=CC=C12 076699 [0,1,0,1,0,0|1,0,0]=3 515 B12R2.1081 NC1=CN=CC2=CC=CC=C12 064972 [0,1,0,1,0,0|1,0,0]=3 516 B12R2.1081 NC1=NC=CC2=CC=CN=C21 023746 [0,1,0,1,0,0|2,0,0]=4 517 B12R2.1081 O=C1CCCC2=C1C=CC=C2 208977 [0,1,0,1,0,0|0,0,2]=4 518 B12R2.1081 O=C1CCOC2=C1C=CC=C2 317966 [0,1,0,1,0,0|0,0,2]=4 519 B12R2.1081 O=C1OCCC2=C1C=CC=C2 209012 [0,1,0,1,0,0|0,0,2]=4 520 B12R2.1081 OC1=C2C=CC=CC2=CC=C1 208940 [0,1,0,1,0,0|0,0,1]=3 521 B12R2.1081 OC1=C2C=CC=CC2=NC=N1 013606 [0,1,0,1,0,0|1,0,1]=4 522 B12R2.1081 OC1=C2C=CC=CC2=NN=C1 077034 [0,1,0,1,0,0|1,0,1]=4 523 B12R2.1081 OC1=C2C=CC=NC2=CC=C1 076698 [0,1,0,1,0,0|1,0,0]=3 524 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 093034 [0,1,0,1,0,0|1,0,0]=3 525 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 099744 [0,1,0,1,0,0|1,0,0]=3 526 B12R2.1081 OC1=CC=CC2=C1C=CN=C2 076330 [0,1,0,1,0,0|1,0,1]=4 527 B12R2.1081 OC1=CC=NC2=CC=CC=C12 050335 [0,1,0,1,0,0|0,0,1]=3 528 B12R2.1081 OC1=CN=CC2=C1C=CC=C2 093707 [0,1,0,1,0,0|0,0,1]=3 529 B12R2.1081 [O-][N+]1=CC=NC2=CC=CC=C21 184748 [0,1,0,1,0,0|1,0,1]=4 530 B12R2.2028 CC1=CN(C)C2=C1C=CC=C2 180164 [0,1,0,1,0,0|2,0,0]=4 531 B12R2.2028 N=C1NC(=N)C2=C1C=CC=C2 243129 [0,1,0,1,0,0|2,0,0]=4 532 B12R2.2028 O=C1CC(=O)C2=CC=CC=C12 011171 [0,1,0,1,0,0|0,0,1]=3 533 B12R2.2028 O=C1NC(=O)C2=C1C=CC=C2 358204 [0,1,0,1,0,0|1,0,0]=3 534 B12R2.2028 O=C1NC(=O)C2=C1C=CN=C2 092708 [0,1,0,1,0,0|2,0,0]=4 535 B12R2.2028 O=C1OC(=O)C2=C1C=CC=C2 241125 [0,1,0,1,0,0|1,0,0]=3 536 B12R2.2028 O=C1OC(=O)C2=C1C=CN=C2 045245 [0,1,0,1,0,0|2,0,0]=4 537 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 093917 [0,1,0,1,0,0|1,0,0]=3 538 B12R2.2028 O=C1OC(=O)C2=NC=CC=C12 024314 [0,1,0,1,0,0|2,0,0]=4 539 B12R2.2028 O=C1OC(Br)C2=CC=CC=C12 113900 [0,1,0,1,0,0|1,0,1]=4 540 B12R2.2028 O=C1[N-]C(=O)C2=C1C=CC=C2 214996 [0,1,0,1,0,0|1,0,0]=3 541 B12R2.32 NCC1=CC2=C(C=CC=C2)S1 034919 [0,1,0,1,0,0|1,0,1]=4 542 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 013717 [0,1,0,1,0,0|0,0,0]=2 543 B12R2.32 O=CC1=CC2=CC=CC=C2O1 036892 [0,1,0,1,0,0|0,0,0]=2 544 B12R2.32 O=CC1=CN2C=CC=CC2=N1 046410 [0,1,0,1,0,0|1,0,0]=3 545 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 033756 [0,1,0,1,0,0|1,0,0]=3 546 B12R2.32 OCC1=CC2=CC=CC=C2S1 017493 [0,1,0,1,0,0|0,0,2]=4 547 B12R2.196 CC1=C2ONC(=O)C2=CC=C1 220501 [0,1,0,1,0,0|2,0,0]=4 548 B12R2.196 NC1=CC=CC2=C1COC2=O 209034 [0,1,0,1,0,0|1,0,1]=4 549 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 011590 [0,1,0,1,0,0|0,0,2]=4 550 B12R2.196 O=C1CCC2=C1C=CC=C2O 013597 [0,1,0,1,0,0|0,0,2]=4 551 B12R2.196 O=C1OCC2=C1C=CC=C2Br 043274 [0,1,0,1,0,0|1,0,1]=4 552 B12R2.203 O=C1CCC2=CC=CC(Br)=C12 040613 [0,1,0,1,0,0|0,0,2]=4 553 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 040260 [0,1,0,1,0,0|0,0,2]=4 554 B12R2.612 CN1C=CC2=C1C=CC(Br)=C2 235071 [0,1,0,1,0,0|2,0,0]=4 555 B12R2.612 CN1C=CC2=C1C=CC(N)=C2 023909 [0,1,0,1,0,0|2,0,0]=4 556 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 077850 [0,1,0,1,0,0|1,0,1]=4 557 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 049740 [0,1,0,1,0,0|0,0,2]=4 558 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 001726 [0,1,0,1,0,0|0,0,2]=4 559 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 001148 [0,1,0,1,0,0|0,0,2]=4 560 B12R2.612 O=C1CCC2=CC(F)=CC=C12 001181 [0,1,0,1,0,0|0,0,2]=4 561 B12R2.612 O=C1COC2=CC(O)=CC=C12 069222 [0,1,0,1,0,0|1,0,1]=4 562 B12R2.612 O=C1NCC2=C1C=CC(Br)=C2 077288 [0,1,0,1,0,0|1,0,1]=4 563 B12R2.612 O=C1OCC2=C1C=CC(Br)=C2 032514 [0,1,0,1,0,0|1,0,1]=4 564 B12R2.1 N#CC1=CNC2=CC=CC=C12 019326 [0,1,0,1,0,0|1,0,1]=4 565 B12R2.1 O=CC1=CNC2=C1C=CC=C2 036402 [0,1,0,1,0,0|0,0,0]=2 566 B12R2.1 O=CC1=CNC2=NC=CC=C12 035903 [0,1,0,1,0,0|1,0,0]=3 567 B12R2.1 O=CC1=CSC2=CC=CC=C12 065306 [0,1,0,1,0,0|0,0,0]=2 568 B12R2.1 O=CC1=NC=C2C=CC=CN21 095336 [0,1,0,1,0,0|1,0,0]=3 569 B12R2.1 OCC1=CNC2=C1C=CC=C2 045221 [0,1,0,1,0,0|0,0,2]=4 570 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 223002 [0,1,0,1,0,0|2,0,0]=4 571 B12R2.18 CC1=CC2=C(C=CC=C2)N1C 078998 [0,1,0,1,0,0|2,0,0]=4 572 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O 077309 [0,1,0,1,0,0|1,0,0]=3 573 B12R2.3190 O=C(O)C1CC2=CC=CC=C21 066601 [0,1,0,1,0,0|0,0,2]=4