0 B10R1.17 C#CCCC1=CC=CC=C1 P160653 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.17 C#CCOC1=CC=CC=C1 P113824 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.17 C#CCSC1=CC=CC=C1 P101830 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.17 C1=CC(=CN=C1)C=CC=O T347360 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.17 C1=CC(=CN=C1)CN=[N+]=[N-] A479584 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.17 C1=CC=C(C=C1)C#CC#N P139462 [0,0,0,0,0,0|2,0,2]=4 6 B10R1.17 C1=CC=C(C=C1)C#CC=O P138572 [0,0,0,0,0,0|1,0,1]=2 7 B10R1.17 C1=CC=C(C=C1)C#CCCl C101885 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.17 C1=CC=C(C=C1)C#CCN P353326 [0,0,0,0,0,0|2,0,2]=4 9 B10R1.17 C1=CC=C(C=C1)C#CCO P111395 [0,0,0,0,0,0|1,0,3]=4 10 B10R1.17 C1=CC=C(C=C1)C=CC#N C107581 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.17 C1=CC=C(C=C1)C=CC=O C108630 [0,0,0,0,0,0|1,0,1]=2 12 B10R1.17 C1=CC=C(C=C1)C=CC=O C108631 [0,0,0,0,0,0|1,0,1]=2 13 B10R1.17 C1=CC=C(C=C1)C=CC=O C110083 [0,0,0,0,0,0|1,0,1]=2 14 B10R1.17 C1=CC=C(C=C1)C=CC=O C110084 [0,0,0,0,0,0|1,0,1]=2 15 B10R1.17 C1=CC=C(C=C1)C=CC=O T421609 [0,0,0,0,0,0|1,0,1]=2 16 B10R1.17 C1=CC=C(C=C1)C=CCBr B163067 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.17 C1=CC=C(C=C1)C=CCCl C102165 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.17 C1=CC=C(C=C1)C=CCO C110605 [0,0,0,0,0,0|1,0,3]=4 19 B10R1.17 C1=CC=C(C=C1)C=CCO C110606 [0,0,0,0,0,0|1,0,3]=4 20 B10R1.17 C1=CC=C(C=C1)C=CCO E303728 [0,0,0,0,0,0|1,0,3]=4 21 B10R1.17 C1=CC=C(C=C1)CCC#N P160077 [0,0,0,0,0,0|2,0,1]=3 22 B10R1.17 C1=CC=C(C=C1)CCC=O P109695 [0,0,0,0,0,0|1,0,0]=1 23 B10R1.17 C1=CC=C(C=C1)CCCBr B106986 [0,0,0,0,0,0|2,0,1]=3 24 B10R1.17 C1=CC=C(C=C1)CCCCl C122445 [0,0,0,0,0,0|2,0,1]=3 25 B10R1.17 C1=CC=C(C=C1)CCCI I469194 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.17 C1=CC=C(C=C1)CCCN P109694 [0,0,0,0,0,0|2,0,1]=3 27 B10R1.17 C1=CC=C(C=C1)CCCN P292870 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.17 C1=CC=C(C=C1)CCCO P103663 [0,0,0,0,0,0|1,0,2]=3 29 B10R1.17 C1=CC=C(C=C1)CCNN P132003 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.17 C1=CC=C(C=C1)CCNN P421872 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.17 C1=CC=C(C=C1)CN=C=O B133636 [0,0,0,0,0,0|1,0,1]=2 32 B10R1.17 C1=CC=C(C=C1)CN=C=S B140288 [0,0,0,0,0,0|1,1,1]=3 33 B10R1.17 C1=CC=C(C=C1)CN=C=S B425154 [0,0,0,0,0,0|1,1,1]=3 34 B10R1.17 C1=CC=C(C=C1)CN=[N+]=[N-] B189174 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.17 C1=CC=C(C=C1)CNC=O N159287 [0,0,0,0,0,0|1,0,0]=1 36 B10R1.17 C1=CC=C(C=C1)COC=O B152855 [0,0,0,0,0,0|0,0,0]=0 37 B10R1.17 C1=CC=C(C=C1)COCCl B107578 [0,0,0,0,0,0|1,0,1]=2 38 B10R1.17 C1=CC=C(C=C1)CSC#N B152183 [0,0,0,0,0,0|1,1,1]=3 39 B10R1.17 C1=CC=C(C=C1)NCC#N P192616 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.17 C1=CC=C(C=C1)NCCN N159346 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.17 C1=CC=C(C=C1)NCCO N140440 [0,0,0,0,0,0|2,0,2]=4 42 B10R1.17 C1=CC=C(C=C1)OCC#N P160111 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.17 C1=CC=C(C=C1)OCCBr B100876 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.17 C1=CC=C(C=C1)OCCCl B135225 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.17 C1=CC=C(C=C1)OCCN P132517 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.17 C1=CC=C(C=C1)OCCO E109367 [0,0,0,0,0,0|2,0,2]=4 47 B10R1.17 C1=CC=C(C=C1)OCCO E109368 [0,0,0,0,0,0|2,0,2]=4 48 B10R1.17 C1=CC=C(C=C1)OCCO E109369 [0,0,0,0,0,0|2,0,2]=4 49 B10R1.17 C1=CC=C(C=C1)OCCO E109370 [0,0,0,0,0,0|2,0,2]=4 50 B10R1.17 C1=CC=C(C=C1)OCCO P407596 [0,0,0,0,0,0|2,0,2]=4 51 B10R1.17 C1=CC=C(C=C1)SCC#N P160109 [0,0,0,0,0,0|3,0,1]=4 52 B10R1.17 C1=CC=C(C=C1)SCCBr B152504 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.17 C1=CC=C(C=C1)SCCCl C101832 [0,0,0,0,0,0|3,0,1]=4 54 B10R1.17 C1=CC=C(C=C1)SCCO P101545 [0,0,0,0,0,0|2,0,2]=4 55 B10R1.17 C1=CC=NC(=C1)CCCO P133143 [0,0,0,0,0,0|2,0,2]=4 56 B10R1.17 C1=CN=CC=C1CCCN P192638 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.17 C1=CN=CC=C1CCCO P160633 [0,0,0,0,0,0|2,0,2]=4 58 B10R1.17 C=CC=CC1=CC=CC=C1 P305147 [0,0,0,0,0,0|2,0,1]=3 59 B10R1.17 C=CCCC1=CC=CC=C1 P160313 [0,0,0,0,0,0|2,0,0]=2 60 B10R1.17 C=CCNC1=CC=CC=C1 N159240 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.17 C=CCOC1=CC=CC=C1 A101096 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.17 C=CCSC1=CC=CC=C1 A140290 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.17 C=COCC1=CC=CC=C1 B178307 [0,0,0,0,0,0|1,0,0]=1 64 B10R1.17 CCC#CC1=CC=CC=C1 P107031 [0,0,0,0,0,0|2,0,2]=4 65 B10R1.17 CCCCC1=CC=CC=C1 B100020 [0,0,0,0,0,0|2,0,1]=3 66 B10R1.17 CCCCC1=CC=CC=C1 B100021 [0,0,0,0,0,0|2,0,1]=3 67 B10R1.17 CCCCC1=CC=CC=C1 B128171 [0,0,0,0,0,0|2,0,1]=3 68 B10R1.17 CCCCC1=CN=CC=C1 B115782 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.17 CCCC[N+]1=CC=CC=C1 B101511 [0,0,0,0,0,0|3,0,1]=4 70 B10R1.17 CCCC[N+]1=CC=CC=C1 B102654 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.17 CCCC[N+]1=CC=CC=C1 B102663 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.17 CCCC[N+]1=CC=CC=C1 B120504 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.17 CCCOC1=CC=CC=C1 P405762 [0,0,0,0,0,0|3,0,1]=4 74 B10R1.17 CCNCC1=CC=CC=C1 E113368 [0,0,0,0,0,0|2,0,1]=3 75 B10R1.17 CCNCC1=CC=CC=N1 N170728 [0,0,0,0,0,0|3,0,1]=4 76 B10R1.17 CCNCC1=CC=CC=N1 N598953 [0,0,0,0,0,0|3,0,1]=4 77 B10R1.17 CCNCC1=CC=NC=C1 E124679 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.17 CCOCC1=CC=CC=C1 E193820 [0,0,0,0,0,0|1,0,1]=2 79 B10R1.17 CNCCC1=CC=CC=C1 N159074 [0,0,0,0,0,0|3,0,0]=3 80 B10R1.17 CNCCC1=CC=CC=N1 B102783 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.17 CNCCC1=CC=CC=N1 B152161 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.17 CNCCC1=CC=CC=N1 B301305 [0,0,0,0,0,0|4,0,0]=4 83 B10R1.17 CNCCC1=CC=CC=N1 B424673 [0,0,0,0,0,0|4,0,0]=4 84 B10R1.17 CNCCC1=CC=CC=N1 M424771 [0,0,0,0,0,0|4,0,0]=4 85 B10R1.17 COCCC1=CC=CC=C1 P160567 [0,0,0,0,0,0|3,0,0]=3 86 B10R1.17 COCCC1=CC=CC=N1 M157981 [0,0,0,0,0,0|4,0,0]=4 87 B10R1.17 COCSC1=CC=CC=C1 M158419 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.8 C1=CC(=CN=C1)CC#N P137656 [1,0,0,0,0,0|2,0,1]=4 89 B9R1.8 C1=CC(=CN=C1)CCN A151786 [1,0,0,0,0,0|2,0,1]=4 90 B9R1.8 C1=CC(=CN=C1)CCN A169450 [1,0,0,0,0,0|2,0,1]=4 91 B9R1.8 C1=CC=C(C=C1)C#CBr B464040 [1,0,0,0,0,0|1,0,2]=4 92 B9R1.8 C1=CC=C(C=C1)C#CCl C464026 [1,0,0,0,0,0|1,0,2]=4 93 B9R1.8 C1=CC=C(C=C1)C=CBr B152003 [1,0,0,0,0,0|1,0,1]=3 94 B9R1.8 C1=CC=C(C=C1)C=NN B589372 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.8 C1=CC=C(C=C1)C=NO T135657 [1,0,0,0,0,0|1,0,2]=4 96 B9R1.8 C1=CC=C(C=C1)CC=O P105078 [1,0,0,0,0,0|0,0,0]=1 97 B9R1.8 C1=CC=C(C=C1)CC=O P105080 [1,0,0,0,0,0|0,0,0]=1 98 B9R1.8 C1=CC=C(C=C1)CC=O P420978 [1,0,0,0,0,0|0,0,0]=1 99 B9R1.8 C1=CC=C(C=C1)CCBr B106895 [1,0,0,0,0,0|1,0,1]=3 100 B9R1.8 C1=CC=C(C=C1)CCCl C136679 [1,0,0,0,0,0|1,0,1]=3 101 B9R1.8 C1=CC=C(C=C1)CCI I138375 [1,0,0,0,0,0|1,0,1]=3 102 B9R1.8 C1=CC=C(C=C1)CCN P105641 [1,0,0,0,0,0|1,0,1]=3 103 B9R1.8 C1=CC=C(C=C1)CCN P160641 [1,0,0,0,0,0|1,0,1]=3 104 B9R1.8 C1=CC=C(C=C1)CCN P290339 [1,0,0,0,0,0|1,0,1]=3 105 B9R1.8 C1=CC=C(C=C1)CCN P408003 [1,0,0,0,0,0|1,0,1]=3 106 B9R1.8 C1=CC=C(C=C1)CCN P421867 [1,0,0,0,0,0|1,0,1]=3 107 B9R1.8 C1=CC=C(C=C1)CCN P425250 [1,0,0,0,0,0|1,0,1]=3 108 B9R1.8 C1=CC=C(C=C1)CCN P491880 [1,0,0,0,0,0|1,0,1]=3 109 B9R1.8 C1=CC=C(C=C1)CCN P493037 [1,0,0,0,0,0|1,0,1]=3 110 B9R1.8 C1=CC=C(C=C1)CCN P493125 [1,0,0,0,0,0|1,0,1]=3 111 B9R1.8 C1=CC=C(C=C1)CCO P108195 [1,0,0,0,0,0|0,0,2]=3 112 B9R1.8 C1=CC=C(C=C1)CCO P108197 [1,0,0,0,0,0|0,0,2]=3 113 B9R1.8 C1=CC=C(C=C1)CCO P424995 [1,0,0,0,0,0|0,0,2]=3 114 B9R1.8 C1=CC=C(C=C1)CCS P160530 [1,0,0,0,0,0|0,1,1]=3 115 B9R1.8 C1=CC=C(C=C1)CNN B122576 [1,0,0,0,0,0|2,0,0]=3 116 B9R1.8 C1=CC=C(C=C1)CNN B137990 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.8 C1=CC=C(C=C1)CNN B464175 [1,0,0,0,0,0|2,0,0]=3 118 B9R1.8 C1=CC=C(C=C1)CNO I137166 [1,0,0,0,0,0|1,0,1]=3 119 B9R1.8 C1=CC=C(C=C1)CON O159948 [1,0,0,0,0,0|1,0,0]=2 120 B9R1.8 C1=CC=C(C=C1)CON O189173 [1,0,0,0,0,0|1,0,0]=2 121 B9R1.8 C1=CC=C(C=C1)N=C=O P304914 [1,0,0,0,0,0|1,0,1]=3 122 B9R1.8 C1=CC=C(C=C1)N=C=S P110634 [1,0,0,0,0,0|1,1,1]=4 123 B9R1.8 C1=CC=C(C=C1)N=C=S P110635 [1,0,0,0,0,0|1,1,1]=4 124 B9R1.8 C1=CC=C(C=C1)N=C=S P110636 [1,0,0,0,0,0|1,1,1]=4 125 B9R1.8 C1=CC=C(C=C1)N=S=O N159148 [1,0,0,0,0,0|1,1,0]=3 126 B9R1.8 C1=CC=C(C=C1)N=[N+]=[N-] A462925 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.8 C1=CC=C(C=C1)NC=O F112354 [1,0,0,0,0,0|1,0,0]=2 128 B9R1.8 C1=CC=C(C=C1)OC=O P305264 [1,0,0,0,0,0|0,0,0]=1 129 B9R1.8 C1=CC=C(C=C1)SCCl C101827 [1,0,0,0,0,0|1,1,1]=4 130 B9R1.8 C1=CC=C(C=C1)[Se]C#N P168654 [1,0,0,0,0,0|1,1,1]=4 131 B9R1.8 C1=CC=NC(=C1)CC#N P160781 [1,0,0,0,0,0|2,0,1]=4 132 B9R1.8 C1=CC=NC(=C1)CCBr B186289 [1,0,0,0,0,0|2,0,1]=4 133 B9R1.8 C1=CC=NC(=C1)CCN A151790 [1,0,0,0,0,0|2,0,1]=4 134 B9R1.8 C1=CC=NC(=C1)CCO P160791 [1,0,0,0,0,0|1,0,2]=4 135 B9R1.8 C1=CC=[N+](C=C1)CC#N C154126 [1,0,0,0,0,0|2,0,1]=4 136 B9R1.8 C1=CN=CC=C1CC#N D302357 [1,0,0,0,0,0|2,0,1]=4 137 B9R1.8 C1=CN=CC=C1CC#N P304979 [1,0,0,0,0,0|2,0,1]=4 138 B9R1.8 C1=CN=CC=C1CCN A109738 [1,0,0,0,0,0|2,0,1]=4 139 B9R1.8 C1=CN=CC=C1CCS P134707 [1,0,0,0,0,0|1,1,1]=4 140 B9R1.8 C1=CN=CC=C1CCS P478833 [1,0,0,0,0,0|1,1,1]=4 141 B9R1.8 C=CCC1=CC=CC=C1 A101037 [1,0,0,0,0,0|1,0,0]=2 142 B9R1.8 C=CSC1=CC=CC=C1 P101810 [1,0,0,0,0,0|1,1,0]=3 143 B9R1.8 C=C[CH-]C1=CC=CC=C1 P129181 [1,0,0,0,0,0|1,0,1]=3 144 B9R1.8 CC#CC1=CC=CC=C1 P141240 [1,0,0,0,0,0|1,0,2]=4 145 B9R1.8 CC=CC1=CC=CC=C1 C153576 [1,0,0,0,0,0|1,0,1]=3 146 B9R1.8 CC=CC1=CC=CC=C1 M136687 [1,0,0,0,0,0|1,0,1]=3 147 B9R1.8 CC=CC1=CC=CC=C1 T134052 [1,0,0,0,0,0|1,0,1]=3 148 B9R1.8 CC=CC1=CC=CC=C1 T301941 [1,0,0,0,0,0|1,0,1]=3 149 B9R1.8 CCCC1=CC=CC=C1 P104621 [1,0,0,0,0,0|1,0,1]=3 150 B9R1.8 CCCC1=CC=CC=C1 P104624 [1,0,0,0,0,0|1,0,1]=3 151 B9R1.8 CCCC1=CC=CC=C1 P104625 [1,0,0,0,0,0|1,0,1]=3 152 B9R1.8 CCCC1=CC=CC=C1 P104626 [1,0,0,0,0,0|1,0,1]=3 153 B9R1.8 CCCC1=CC=CC=C1 P128158 [1,0,0,0,0,0|1,0,1]=3 154 B9R1.8 CCCC1=CC=CC=N1 P160637 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.8 CCCC1=CC=NC=C1 P160632 [1,0,0,0,0,0|2,0,1]=4 156 B9R1.8 CCC[N+]1=CC=CC=C1 P404861 [1,0,0,0,0,0|2,0,1]=4 157 B9R1.8 CCNC1=CC=CC=C1 E103974 [1,0,0,0,0,0|2,0,1]=4 158 B9R1.8 CCOC1=CC=CC=C1 E108654 [1,0,0,0,0,0|1,0,1]=3 159 B9R1.8 CCOC1=CC=CC=C1 E108655 [1,0,0,0,0,0|1,0,1]=3 160 B9R1.8 CCOC1=CC=CC=N1 E137467 [1,0,0,0,0,0|2,0,1]=4 161 B9R1.8 CCSC1=CC=CC=C1 E101809 [1,0,0,0,0,0|1,1,1]=4 162 B9R1.8 CNCC1=CC=CC=C1 B106919 [1,0,0,0,0,0|1,0,1]=3 163 B9R1.8 CNCC1=CC=CC=N1 M168526 [1,0,0,0,0,0|2,0,1]=4 164 B9R1.8 CNCC1=CN=CC=C1 M138441 [1,0,0,0,0,0|2,0,1]=4 165 B9R1.8 COCC1=CC=CC=C1 B103161 [1,0,0,0,0,0|0,0,1]=2 166 B9R1.8 COCC1=CC=CC=C1 B591251 [1,0,0,0,0,0|0,0,1]=2 167 B9R1.8 CSCC1=CC=CC=C1 B152510 [1,0,0,0,0,0|0,1,1]=3 168 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B153177 [1,0,0,0,0,0|1,0,1]=3 169 B11R1.1 C1=CC(=CC=C1C=CC=O)Br T102188 [0,1,0,0,0,0|1,0,1]=3 170 B11R1.1 C1=CC(=CC=C1C=CC=O)Cl E193580 [0,1,0,0,0,0|1,0,1]=3 171 B11R1.1 C1=CC(=CC=C1C=CC=O)F F156576 [0,1,0,0,0,0|1,0,1]=3 172 B11R1.1 C1=CC(=CC=C1CCCN)Cl C191754 [0,1,0,0,0,0|2,0,1]=4 173 B11R1.1 C1=CC(=CC=C1CCCO)Br B135402 [0,1,0,0,0,0|1,0,2]=4 174 B11R1.1 C1=CC(=CC=C1CCCO)Cl C405534 [0,1,0,0,0,0|1,0,2]=4 175 B11R1.1 C1=CC(=CC=C1CCCO)O W132591 [0,1,0,0,0,0|1,0,2]=4 176 B11R1.1 C1=CC(=CC=C1CN=C=O)Br B352069 [0,1,0,0,0,0|1,0,1]=3 177 B11R1.1 CC1=CC=C(C=C1)C=CC=O E589502 [0,1,0,0,0,0|1,0,1]=3 178 B11R1.1 CC1=CC=C(C=C1)OCC=C A151094 [0,1,0,0,0,0|3,0,0]=4 179 B11R1.1 CCCCC1=CC=C(C=C1)Br B115516 [0,1,0,0,0,0|2,0,1]=4 180 B11R1.1 CCCCC1=CC=C(C=C1)Cl B167540 [0,1,0,0,0,0|2,0,1]=4 181 B11R1.1 CCCCC1=CC=C(C=C1)I B124312 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.1 CCCCC1=CC=C(C=C1)N B100731 [0,1,0,0,0,0|2,0,1]=4 183 B11R1.1 CCCCC1=CC=C(C=C1)O B152848 [0,1,0,0,0,0|2,0,1]=4 184 B11R1.1 CCOCC1=CC=C(C=C1)O E194029 [0,1,0,0,0,0|1,0,1]=3 185 B11R1.1 COCCC1=CC=C(C=C1)O M136398 [0,1,0,0,0,0|3,0,0]=4 186 B11R1.16 C1=CC=C(C=C1)C(=O)OCCl C331582 [0,1,0,0,0,0|1,0,2]=4 187 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C123100 [0,1,0,0,0,0|2,0,1]=4 188 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C123101 [0,1,0,0,0,0|2,0,1]=4 189 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C153387 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101338 [0,1,0,0,0,0|1,0,2]=4 191 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101343 [0,1,0,0,0,0|1,0,2]=4 192 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101349 [0,1,0,0,0,0|1,0,2]=4 193 B11R1.16 C=CCC(C1=CC=CC=C1)O P160315 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.16 C=COC(=O)C1=CC=CC=C1 V162943 [0,1,0,0,0,0|1,0,1]=3 195 B11R1.16 CC(C1=CC=CC=C1)N=C=O I132137 [0,1,0,0,0,0|1,0,1]=3 196 B11R1.16 CC(C1=CC=CC=C1)N=C=O R160892 [0,1,0,0,0,0|1,0,1]=3 197 B11R1.16 CC(C1=CC=CC=C1)N=C=S R300627 [0,1,0,0,0,0|1,1,1]=4 198 B11R1.16 CC(CC=O)C1=CC=CC=C1 P468811 [0,1,0,0,0,0|1,0,0]=2 199 B11R1.16 CC(CCO)C1=CC=CC=C1 P169190 [0,1,0,0,0,0|1,0,2]=4 200 B11R1.16 CC(CCO)C1=CC=CC=C1 P638679 [0,1,0,0,0,0|1,0,2]=4 201 B11R1.16 CC(CNC)C1=CC=CC=C1 P342591 [0,1,0,0,0,0|3,0,0]=4 202 B11R1.16 CC=CC(=O)C1=CC=CC=C1 P122944 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.16 CCCC(C1=CC=CC=C1)O P160157 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.16 CCCC(C1=CC=CC=C1)O R468963 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.16 CCCC(C1=CC=CC=C1)O S468962 [0,1,0,0,0,0|2,0,1]=4 206 B11R1.16 CCOC(=N)C1=CC=CC=C1 E170842 [0,1,0,0,0,0|1,0,2]=4 207 B11R1.16 CCOC(=O)C1=CC=CC=C1 E103424 [0,1,0,0,0,0|1,0,2]=4 208 B11R1.16 CCOC(=O)C1=CC=CC=C1 E103425 [0,1,0,0,0,0|1,0,2]=4 209 B11R1.16 CCOC(=O)C1=CC=CC=C1 E103426 [0,1,0,0,0,0|1,0,2]=4 210 B11R1.16 CCO[P+](=O)C1=CC=CC=C1 E133085 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.16 CNCC(C1=CC=CC=C1)O M351446 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.16 CNOC(=O)C1=CC=CC=C1 O159914 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.16 COCC(C1=CC=CC=C1)N R185788 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.17 C1=CC=C(C(=C1)C=CC=O)Br E302788 [0,1,0,0,0,0|1,0,1]=3 215 B11R1.17 C1=CC=C(C(=C1)C=CC=O)O H157419 [0,1,0,0,0,0|1,0,1]=3 216 B11R1.17 C1=CC=C(C(=C1)CCC#N)Cl C194792 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.17 C1=CC=C(C(=C1)CCCO)Br B193732 [0,1,0,0,0,0|1,0,2]=4 218 B11R1.17 C1=CC=C(C(=C1)CN=C=O)F F166980 [0,1,0,0,0,0|1,0,1]=3 219 B11R1.17 C1=CC=C(C(=C1)CSC#N)Cl C153807 [0,1,0,0,0,0|1,1,1]=4 220 B11R1.17 CC1=CC=CC=C1OCC=C A354200 [0,1,0,0,0,0|3,0,0]=4 221 B11R1.17 CCCCC1=CC=CC=C1N B151822 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.24 C1=CC(=CC(=C1)Cl)CCC=O C167090 [0,1,0,0,0,0|1,0,0]=2 223 B11R1.24 C1=CC(=CC(=C1)F)CCCBr B587429 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.24 CC1=CC(=CC=C1)C=CC=O E590785 [0,1,0,0,0,0|1,0,1]=3 225 B11R1.24 CC1=CC(=CC=C1)CN=C=O M352458 [0,1,0,0,0,0|1,0,1]=3 226 B11R1.24 CCNCC1=CC(=CC=C1)F N187982 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.28 C#CCOCC1=CC=CC=C1 P589024 [0,1,0,0,0,0|1,0,1]=3 228 B11R1.28 C1=CC=C(C=C1)CCCCBr B140194 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.28 C1=CC=C(C=C1)CCCCCl P404858 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.28 C1=CC=C(C=C1)CCCCN B292880 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.28 C1=CC=C(C=C1)CCCCN P160136 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.28 C1=CC=C(C=C1)CCCCN P160137 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.28 C1=CC=C(C=C1)CCCCN P493282 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.28 C1=CC=C(C=C1)CCCCO P138687 [0,1,0,0,0,0|1,0,2]=4 235 B11R1.28 C1=CC=C(C=C1)CCN=C=O P160767 [0,1,0,0,0,0|1,0,1]=3 236 B11R1.28 C1=CC=C(C=C1)CCN=C=S P102544 [0,1,0,0,0,0|1,1,1]=4 237 B11R1.28 C1=CC=C(C=C1)CCNC=O I168819 [0,1,0,0,0,0|1,0,0]=2 238 B11R1.28 C1=CC=C(C=C1)CCOC=O F302132 [0,1,0,0,0,0|0,0,0]=1 239 B11R1.28 C1=CC=C(C=C1)CNCCN B124211 [0,1,0,0,0,0|2,0,1]=4 240 B11R1.28 C1=CC=C(C=C1)CNCCO B111181 [0,1,0,0,0,0|1,0,2]=4 241 B11R1.28 C1=CC=C(C=C1)COCC=O B136421 [0,1,0,0,0,0|0,0,0]=1 242 B11R1.28 C1=CC=C(C=C1)COCCBr B107737 [0,1,0,0,0,0|1,0,1]=3 243 B11R1.28 C1=CC=C(C=C1)COCCCl B132425 [0,1,0,0,0,0|1,0,1]=3 244 B11R1.28 C1=CC=C(C=C1)COCCN B193115 [0,1,0,0,0,0|1,0,1]=3 245 B11R1.28 C1=CC=C(C=C1)COCCO B111396 [0,1,0,0,0,0|0,0,2]=3 246 B11R1.28 C1=CC=C(C=C1)CSCCO B140387 [0,1,0,0,0,0|0,1,2]=4 247 B11R1.28 C1=CC=C(C=C1)NCCC#N A151772 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.28 C1=CC=C(C=C1)NCCCO A151778 [0,1,0,0,0,0|1,0,2]=4 249 B11R1.28 C1=CC=C(C=C1)OCCCBr P160566 [0,1,0,0,0,0|2,0,1]=4 250 B11R1.28 C1=CC=C(C=C1)OCCCN P353595 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.28 C1=CC=C(C=C1)OCCCO P160296 [0,1,0,0,0,0|1,0,2]=4 252 B11R1.28 C1=CC=C(C=C1)SCN=[N+]=[N-] A342137 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.28 C=CCNCC1=CC=CC=C1 N158987 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.28 C=CCOCC1=CC=CC=C1 A151095 [0,1,0,0,0,0|1,0,0]=2 255 B11R1.28 CCCCCC1=CC=CC=C1 A151374 [0,1,0,0,0,0|2,0,1]=4 256 B11R1.28 CCCCNC1=CC=CC=C1 B140175 [0,1,0,0,0,0|2,0,1]=4 257 B11R1.28 CCCCNC1=CC=CC=C1 N590954 [0,1,0,0,0,0|2,0,1]=4 258 B11R1.28 CCCCOC1=CC=CC=C1 B153006 [0,1,0,0,0,0|2,0,1]=4 259 B11R1.28 CCCNCC1=CC=CC=C1 N191934 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.28 CCOC=NC1=CC=CC=C1 E156427 [0,1,0,0,0,0|1,0,2]=4 261 B11R1.28 CNCCOC1=CC=CC=C1 N169984 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.28 OCCSCc1ccccc1 H109405 [0,1,0,0,0,0|0,1,2]=4 263 B11R1.40 C1=CC=C(C=C1)C=C(C=O)Br B102162 [0,1,0,0,0,0|1,0,1]=3 264 B11R1.40 C1=CC=C(C=C1)C=C(C=O)Cl C102191 [0,1,0,0,0,0|1,0,1]=3 265 B11R1.40 C1=CC=C(C=C1)CC(=O)NN P160484 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.40 C1=CC=C(C=C1)CC(CO)N P100530 [0,1,0,0,0,0|1,0,2]=4 267 B11R1.40 C1=CC=C(C=C1)CC(CO)N P109244 [0,1,0,0,0,0|1,0,2]=4 268 B11R1.40 C1=CC=C(C=C1)CC(CO)N S160981 [0,1,0,0,0,0|1,0,2]=4 269 B11R1.40 C=CC(=O)NC1=CC=CC=C1 N159041 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.40 C=CC(=O)OC1=CC=CC=C1 P122863 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.40 CC(=CC1=CC=CC=C1)C=O M102181 [0,1,0,0,0,0|1,0,1]=3 272 B11R1.40 CC(=CC1=CC=CC=C1)C=O M302967 [0,1,0,0,0,0|1,0,1]=3 273 B11R1.40 CCC(=O)CC1=CC=CC=C1 P160130 [0,1,0,0,0,0|2,0,1]=4 274 B11R1.40 CCC(CC1=CC=CC=C1)N P344719 [0,1,0,0,0,0|2,0,1]=4 275 B11R1.40 CCC(CC1=CC=CC=C1)O E352402 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.40 COC(=O)CC1=CC=CC=C1 M106997 [0,1,0,0,0,0|3,0,0]=4 277 B11R1.91 B(CCC1=CC=CC=C1)(O)O P119631 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.91 C1=CC(=CN=C1)C=CC(=O)O P160635 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.91 C1=CC(=CN=C1)C=CC(=O)O T138424 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.91 C1=CC(=CN=C1)CCC(=O)O P136290 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.91 C1=CC=C(C=C1)C#CC(=O)N P589991 [0,1,0,0,0,0|1,0,1]=3 282 B11R1.91 C1=CC=C(C=C1)C#CC(=O)O P133964 [0,1,0,0,0,0|1,0,1]=3 283 B11R1.91 C1=CC=C(C=C1)C=CC(=O)Cl C106841 [0,1,0,0,0,0|1,0,1]=3 284 B11R1.91 C1=CC=C(C=C1)C=CC(=O)Cl T347639 [0,1,0,0,0,0|1,0,1]=3 285 B11R1.91 C1=CC=C(C=C1)C=CC(=O)N C101731 [0,1,0,0,0,0|1,0,1]=3 286 B11R1.91 C1=CC=C(C=C1)C=CC(=O)O C108494 [0,1,0,0,0,0|1,0,1]=3 287 B11R1.91 C1=CC=C(C=C1)C=CC(=O)O C108495 [0,1,0,0,0,0|1,0,1]=3 288 B11R1.91 C1=CC=C(C=C1)C=CC(=O)O C108496 [0,1,0,0,0,0|1,0,1]=3 289 B11R1.91 C1=CC=C(C=C1)C=CC(=O)O C108497 [0,1,0,0,0,0|1,0,1]=3 290 B11R1.91 C1=CC=C(C=C1)C=CC(=O)O P478163 [0,1,0,0,0,0|1,0,1]=3 291 B11R1.91 C1=CC=C(C=C1)C=CC(=O)O T421496 [0,1,0,0,0,0|1,0,1]=3 292 B11R1.91 C1=CC=C(C=C1)C=CC(=O)[O-] C167677 [0,1,0,0,0,0|1,0,1]=3 293 B11R1.91 C1=CC=C(C=C1)C=CC(=O)[O-] C170870 [0,1,0,0,0,0|1,0,1]=3 294 B11R1.91 C1=CC=C(C=C1)C=C[N+](=O)[O-] N122699 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.91 C1=CC=C(C=C1)CCC(=O)Cl P101406 [0,1,0,0,0,0|1,0,0]=2 296 B11R1.91 C1=CC=C(C=C1)CCC(=O)N P160460 [0,1,0,0,0,0|1,0,0]=2 297 B11R1.91 C1=CC=C(C=C1)CCC(=O)O P109276 [0,1,0,0,0,0|1,0,0]=2 298 B11R1.91 C1=CC=C(C=C1)CCC(=O)O P109277 [0,1,0,0,0,0|1,0,0]=2 299 B11R1.91 C1=CC=C(C=C1)CCC(=O)O P424323 [0,1,0,0,0,0|1,0,0]=2 300 B11R1.91 C1=CC=C(C=C1)CN=C(N)N B588431 [0,1,0,0,0,0|2,0,0]=3 301 B11R1.91 C1=CC=C(C=C1)CNC(=O)N B136656 [0,1,0,0,0,0|1,0,0]=2 302 B11R1.91 C1=CC=C(C=C1)CNC(=S)N B152324 [0,1,0,0,0,0|1,1,0]=3 303 B11R1.91 C1=CC=C(C=C1)COC(=O)Cl B105737 [0,1,0,0,0,0|0,0,0]=1 304 B11R1.91 C1=CC=C(C=C1)COC(=O)N B152709 [0,1,0,0,0,0|0,0,0]=1 305 B11R1.91 C1=CC=C(C=C1)CSC(=N)N B105227 [0,1,0,0,0,0|1,1,0]=3 306 B11R1.91 C1=CC=C(C=C1)NCC(=O)N A357212 [0,1,0,0,0,0|2,0,0]=3 307 B11R1.91 C1=CC=C(C=C1)NCC(=O)O P111407 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.91 C1=CC=C(C=C1)NCC(=O)[O-] N133268 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.91 C1=CC=C(C=C1)NNC(=O)N P160542 [0,1,0,0,0,0|2,0,0]=3 310 B11R1.91 C1=CC=C(C=C1)NNC(=S)N P160248 [0,1,0,0,0,0|2,1,0]=4 311 B11R1.91 C1=CC=C(C=C1)OCC(=N)N B301361 [0,1,0,0,0,0|3,0,0]=4 312 B11R1.91 C1=CC=C(C=C1)OCC(=O)Cl P160117 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.91 C1=CC=C(C=C1)OCC(=O)N P300417 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.91 C1=CC=C(C=C1)OCC(=O)O P107024 [0,1,0,0,0,0|2,0,0]=3 315 B11R1.91 C1=CC=C(C=C1)OCC(=O)O P107025 [0,1,0,0,0,0|2,0,0]=3 316 B11R1.91 C1=CC=C(C=C1)OCC(=O)[O-] S563686 [0,1,0,0,0,0|2,0,0]=3 317 B11R1.91 C1=CC=C(C=C1)SCC(=O)Cl B301376 [0,1,0,0,0,0|2,0,0]=3 318 B11R1.91 C1=CC=C(C=C1)SCC(=O)O P101811 [0,1,0,0,0,0|2,0,0]=3 319 B11R1.91 C1=CC=NC(=C1)C=CC(=O)O E189192 [0,1,0,0,0,0|2,0,1]=4 320 B11R1.91 C1=CC=NC(=C1)CCC(=O)O P167476 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.91 C1=CN=CC=C1C=CC(=O)O P160631 [0,1,0,0,0,0|2,0,1]=4 322 B11R1.91 C1=CN=CC=C1C=CC(=O)O T189221 [0,1,0,0,0,0|2,0,1]=4 323 B11R1.91 C1=CN=CC=C1CCC(=O)O P171257 [0,1,0,0,0,0|2,0,0]=3 324 B11R1.91 C1=CN=CC=C1SCC(=O)O P109703 [0,1,0,0,0,0|3,0,0]=4 325 B11R1.91 CC(=C)COC1=CC=CC=C1 M420042 [0,1,0,0,0,0|3,0,0]=4 326 B11R1.91 CC(=O)C#CC1=CC=CC=C1 P160127 [0,1,0,0,0,0|1,0,1]=3 327 B11R1.91 CC(=O)C=CC1=CC=CC=C1 P111783 [0,1,0,0,0,0|1,0,1]=3 328 B11R1.91 CC(=O)C=CC1=CC=CC=C1 P111784 [0,1,0,0,0,0|1,0,1]=3 329 B11R1.91 CC(=O)C=CC1=CC=CC=C1 T121970 [0,1,0,0,0,0|1,0,1]=3 330 B11R1.91 CC(=O)CCC1=CC=CC=C1 P106914 [0,1,0,0,0,0|1,0,0]=2 331 B11R1.91 CC(=O)COC1=CC=CC=C1 P160134 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.91 CC(=O)NCC1=CC=CC=C1 N159297 [0,1,0,0,0,0|1,0,0]=2 333 B11R1.91 CC(=O)NNC1=CC=CC=C1 A100226 [0,1,0,0,0,0|2,0,0]=3 334 B11R1.91 CC(=O)OCC1=CC=CC=C1 B109251 [0,1,0,0,0,0|0,0,0]=1 335 B11R1.91 CC(=O)OCC1=CC=CC=C1 B109253 [0,1,0,0,0,0|0,0,0]=1 336 B11R1.91 CC(C)NCC1=CC=CC=C1 B100437 [0,1,0,0,0,0|2,0,1]=4 337 B11R1.91 CC(CCC1=CC=CC=C1)N M168739 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.91 CC(CCC1=CC=CC=C1)O I168710 [0,1,0,0,0,0|1,0,2]=4 339 B11R1.91 CC(CCC1=CC=CC=C1)O I170111 [0,1,0,0,0,0|1,0,2]=4 340 B11R1.91 CC(CCC1=CC=CC=C1)O P160159 [0,1,0,0,0,0|1,0,2]=4 341 B11R1.91 CN(C)CCC1=CC=CC=C1 N302096 [0,1,0,0,0,0|3,0,0]=4 342 B11R2.1 B1(C2=CC=CC=C2CO1)O H340686 [0,0,0,1,0,0|1,0,1]=3 343 B11R2.1 C1=CC2=C(NN=C2C=C1)Br B589034 [0,0,0,1,0,0|3,0,0]=4 344 B11R2.1 C1=CC2=C(NN=C2C=C1)Cl C169319 [0,0,0,1,0,0|3,0,0]=4 345 B11R2.1 C1=CC2=C(NNC2=O)N=C1 H192577 [0,0,0,1,0,0|3,0,0]=4 346 B11R2.1 C1=CC2=NNC(=O)N2C=C1 T161636 [0,0,0,1,0,0|3,0,0]=4 347 B11R2.1 C1=CC2=NO[N+](=C2C=C1)[O-] B152907 [0,0,0,1,0,0|2,0,1]=4 348 B11R2.1 C1=CC=C2C(=C1)C(=CO2)Br B194097 [0,0,0,1,0,0|3,0,0]=4 349 B11R2.1 C1=CC=C2C(=C1)C(=CS2)Br B189193 [0,0,0,1,0,0|3,0,0]=4 350 B11R2.1 C1=CC=C2C(=C1)C(=NN2)N A134463 [0,0,0,1,0,0|3,0,0]=4 351 B11R2.1 C1=CC=C2C(=C1)C(=NO2)Cl C181887 [0,0,0,1,0,0|3,0,0]=4 352 B11R2.1 C1=CC=C2C(=C1)C(=NS2)Cl C134023 [0,0,0,1,0,0|3,0,0]=4 353 B11R2.1 C1=CC=C2C(=C1)C(=O)NN2 H134010 [0,0,0,1,0,0|2,0,0]=3 354 B11R2.1 C1=CC=C2C(=C1)C(=O)NO2 B138497 [0,0,0,1,0,0|2,0,0]=3 355 B11R2.1 C1=CC=C2C(=C1)C(=O)NS2 B107479 [0,0,0,1,0,0|2,0,0]=3 356 B11R2.1 C1=CC=C2C(=C1)C(=O)NS2 B406425 [0,0,0,1,0,0|2,0,0]=3 357 B11R2.1 C1=CC=C2C(=C1)C(=O)NS2 B598939 [0,0,0,1,0,0|2,0,0]=3 358 B11R2.1 C1C(=O)C2=CC=CC=C2O1 B119781 [0,0,0,1,0,0|2,0,0]=3 359 B11R2.1 C1C2=C(C=CC=N2)C(=O)N1 D589008 [0,0,0,1,0,0|2,0,0]=3 360 B11R2.1 C1C2=C(C=NC=C2)C(=O)N1 H176399 [0,0,0,1,0,0|2,0,0]=3 361 B11R2.1 C1C2=CC=CC=C2C(=O)N1 I170551 [0,0,0,1,0,0|1,0,0]=2 362 B11R2.1 C1C2=CC=CC=C2C(=O)O1 P104476 [0,0,0,1,0,0|0,0,0]=1 363 B11R2.1 C1CC(=O)C2=CC=CC=C21 I106436 [0,0,0,1,0,0|1,0,0]=2 364 B11R2.1 C1CC(=O)C2=CC=CC=C21 I426156 [0,0,0,1,0,0|1,0,0]=2 365 B11R2.1 C1CC2=CC=CC=C2C1N A114505 [0,0,0,1,0,0|2,0,1]=4 366 B11R2.1 C1CC2=CC=CC=C2C1N D186125 [0,0,0,1,0,0|2,0,1]=4 367 B11R2.1 C1CC2=CC=CC=C2C1N S192732 [0,0,0,1,0,0|2,0,1]=4 368 B11R2.1 C1CC2=CC=CC=C2C1N S469445 [0,0,0,1,0,0|2,0,1]=4 369 B11R2.1 C1CC2=CC=CC=C2C1O H157335 [0,0,0,1,0,0|1,0,2]=4 370 B11R2.1 C1CC2=CC=CC=C2C1O H419517 [0,0,0,1,0,0|1,0,2]=4 371 B11R2.1 C1CC2=CC=CC=C2C1O H592262 [0,0,0,1,0,0|1,0,2]=4 372 B11R2.1 CC1=CNC2=CC=CC=C12 M426157 [0,0,0,1,0,0|3,0,0]=4 373 B11R2.1 CC1=CNC2=CC=CC=C12 S104736 [0,0,0,1,0,0|3,0,0]=4 374 B11R2.1 CC1=CSC2=CC=CC=C12 M101861 [0,0,0,1,0,0|3,0,0]=4 375 B11R2.1 CC1CCC2=CC=CC=C12 M304586 [0,0,0,1,0,0|2,0,1]=4 376 B11R2.4 C1C(C1N)C2=CC=CC=C2 R132818 [0,0,0,1,0,0|2,0,1]=4 377 B11R2.4 C1C(C1N)C2=CC=CC=C2 T275460 [0,0,0,1,0,0|2,0,1]=4 378 B11R2.4 C1C(C1N)C2=CC=CC=C2 T422413 [0,0,0,1,0,0|2,0,1]=4 379 B11R2.20 C1=CC=C2C(=C1)C=CC=N2 Q110656 [0,0,0,1,0,0|2,0,1]=4 380 B11R2.20 C1=CC=C2C(=C1)C=CC=N2 Q110657 [0,0,0,1,0,0|2,0,1]=4 381 B11R2.20 C1=CC=C2C(=C1)C=CC=N2 Q110658 [0,0,0,1,0,0|2,0,1]=4 382 B11R2.20 C1=CC=C2C(=C1)C=CC=N2 Q134192 [0,0,0,1,0,0|2,0,1]=4 383 B11R2.20 C1=CC=C2C(=C1)C=CC=[NH+]2 Q160825 [0,0,0,1,0,0|2,0,1]=4 384 B11R2.20 C1=CC=C2C(=C1)C=NC=N2 Q107983 [0,0,0,1,0,0|2,0,1]=4 385 B11R2.20 C1=CC=C2C(=C1)N=CC=N2 Q160826 [0,0,0,1,0,0|3,0,0]=4 386 B11R2.20 C1=CC=C2C=CC=CC2=C1 N110796 [0,0,0,1,0,0|2,0,1]=4 387 B11R2.20 C1=CC=C2C=CC=CC2=C1 N110798 [0,0,0,1,0,0|2,0,1]=4 388 B11R2.20 C1=CC=C2C=CC=CC2=C1 N110799 [0,0,0,1,0,0|2,0,1]=4 389 B11R2.20 C1=CC=C2C=CC=CC2=C1 N110801 [0,0,0,1,0,0|2,0,1]=4 390 B11R2.20 C1=CC=C2C=CC=CC2=C1 N114091 [0,0,0,1,0,0|2,0,1]=4 391 B11R2.20 C1=CC=C2C=CC=CC2=C1 N119547 [0,0,0,1,0,0|2,0,1]=4 392 B11R2.20 C1=CC=C2C=CC=CC2=C1 N128175 [0,0,0,1,0,0|2,0,1]=4 393 B11R2.20 C1=CC=C2C=CC=CC2=C1 N141241 [0,0,0,1,0,0|2,0,1]=4 394 B11R2.20 C1=CC=C2C=NC=CC2=C1 I105573 [0,0,0,1,0,0|2,0,1]=4 395 B11R2.20 C1=CC=C2C=[C-]C=CC2=C1 N140702 [0,0,0,1,0,0|2,0,1]=4 396 B11R2.20 C1=CC=C2[C-]=CC=CC2=C1 N140777 [0,0,0,1,0,0|2,0,1]=4 397 B11R2.20 C1C=CCC2=CC=CC=C21 D155281 [0,0,0,1,0,0|2,0,0]=3 398 B11R2.20 C1CC2=CC=CC=C2C=C1 D155011 [0,0,0,1,0,0|2,0,0]=3 399 B11R2.20 C1CC2=CC=CC=C2NC1 T107484 [0,0,0,1,0,0|2,0,1]=4 400 B11R2.20 C1CCC2=CC=CC=C2C1 T100976 [0,0,0,1,0,0|2,0,1]=4 401 B11R2.20 C1CCC2=CC=CC=C2C1 T100978 [0,0,0,1,0,0|2,0,1]=4 402 B11R2.20 C1CCC2=CC=CC=C2C1 T100979 [0,0,0,1,0,0|2,0,1]=4 403 B11R2.20 C1CCC2=CC=CC=C2C1 T100981 [0,0,0,1,0,0|2,0,1]=4 404 B11R2.20 C1CCC2=CC=CC=C2C1 T119673 [0,0,0,1,0,0|2,0,1]=4 405 B11R2.20 C1CN=CC2=CC=CC=C21 D169557 [0,0,0,1,0,0|3,0,0]=4 406 B11R2.20 C1CNCC2=CC=CC=C21 T139420 [0,0,0,1,0,0|2,0,1]=4 407 B11R2.20 C1COCC2=CC=CC=C21 I122961 [0,0,0,1,0,0|1,0,1]=3 408 B11R2.238 C1C(N1)CC2=CC=CC=C2 S304496 [0,0,0,1,0,0|2,0,1]=4 409 B11R2.238 C1C(O1)CC2=CC=CC=C2 E472459 [0,0,0,1,0,0|1,0,2]=4 410 B9R1.12 C1=COC(=C1)C=CC=O F103082 [0,0,0,0,1,0|2,0,1]=4 411 B9R1.12 C1=COC(=C1)CN=C=O B301379 [0,0,0,0,1,0|2,0,1]=4 412 B9R1.12 C1=COC(=C1)CSC=O S161330 [0,0,0,0,1,0|1,1,0]=3 413 B8R1.2 C#CC1=CC=CC=C1 P107030 [2,0,0,0,0,0|0,0,2]=4 414 B8R1.2 C#CC1=CC=CC=C1 P332820 [2,0,0,0,0,0|0,0,2]=4 415 B8R1.2 C1=C(C=NC=N1)C=O P123455 [2,0,0,0,0,0|2,0,0]=4 416 B8R1.2 C1=CC(=CN=C1)C=O P106877 [2,0,0,0,0,0|1,0,0]=3 417 B8R1.2 C1=CC(=CN=C1)CBr B137612 [2,0,0,0,0,0|2,0,0]=4 418 B8R1.2 C1=CC(=CN=C1)CCl P135883 [2,0,0,0,0,0|2,0,0]=4 419 B8R1.2 C1=CC(=CN=C1)CN P160053 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.2 C1=CC(=CN=C1)CO P106580 [2,0,0,0,0,0|1,0,0]=3 421 B8R1.2 C1=CC=C(C=C1)C#N B104457 [2,0,0,0,0,0|1,0,1]=4 422 B8R1.2 C1=CC=C(C=C1)C#N B104458 [2,0,0,0,0,0|1,0,1]=4 423 B8R1.2 C1=CC=C(C=C1)C#N B110114 [2,0,0,0,0,0|1,0,1]=4 424 B8R1.2 C1=CC=C(C=C1)C#N B113726 [2,0,0,0,0,0|1,0,1]=4 425 B8R1.2 C1=CC=C(C=C1)C#N B119686 [2,0,0,0,0,0|1,0,1]=4 426 B8R1.2 C1=CC=C(C=C1)C#N B121683 [2,0,0,0,0,0|1,0,1]=4 427 B8R1.2 C1=CC=C(C=C1)C=O B110459 [2,0,0,0,0,0|0,0,0]=2 428 B8R1.2 C1=CC=C(C=C1)C=O B110460 [2,0,0,0,0,0|0,0,0]=2 429 B8R1.2 C1=CC=C(C=C1)C=O B110463 [2,0,0,0,0,0|0,0,0]=2 430 B8R1.2 C1=CC=C(C=C1)C=O B110464 [2,0,0,0,0,0|0,0,0]=2 431 B8R1.2 C1=CC=C(C=C1)C=O B266083 [2,0,0,0,0,0|0,0,0]=2 432 B8R1.2 C1=CC=C(C=C1)C=O B420281 [2,0,0,0,0,0|0,0,0]=2 433 B8R1.2 C1=CC=C(C=C1)C=O B472001 [2,0,0,0,0,0|0,0,0]=2 434 B8R1.2 C1=CC=C(C=C1)CBr B108549 [2,0,0,0,0,0|1,0,0]=3 435 B8R1.2 C1=CC=C(C=C1)CBr B471999 [2,0,0,0,0,0|1,0,0]=3 436 B8R1.2 C1=CC=C(C=C1)CBr B472021 [2,0,0,0,0,0|1,0,0]=3 437 B8R1.2 C1=CC=C(C=C1)CCl B110580 [2,0,0,0,0,0|1,0,0]=3 438 B8R1.2 C1=CC=C(C=C1)CCl B110581 [2,0,0,0,0,0|1,0,0]=3 439 B8R1.2 C1=CC=C(C=C1)CCl B110582 [2,0,0,0,0,0|1,0,0]=3 440 B8R1.2 C1=CC=C(C=C1)CCl B141153 [2,0,0,0,0,0|1,0,0]=3 441 B8R1.2 C1=CC=C(C=C1)CCl B431204 [2,0,0,0,0,0|1,0,0]=3 442 B8R1.2 C1=CC=C(C=C1)CCl B472028 [2,0,0,0,0,0|1,0,0]=3 443 B8R1.2 C1=CC=C(C=C1)CCl B472041 [2,0,0,0,0,0|1,0,0]=3 444 B8R1.2 C1=CC=C(C=C1)CN A348464 [2,0,0,0,0,0|1,0,0]=3 445 B8R1.2 C1=CC=C(C=C1)CN B108477 [2,0,0,0,0,0|1,0,0]=3 446 B8R1.2 C1=CC=C(C=C1)CN B152179 [2,0,0,0,0,0|1,0,0]=3 447 B8R1.2 C1=CC=C(C=C1)CN B152887 [2,0,0,0,0,0|1,0,0]=3 448 B8R1.2 C1=CC=C(C=C1)CN B152949 [2,0,0,0,0,0|1,0,0]=3 449 B8R1.2 C1=CC=C(C=C1)CN B304428 [2,0,0,0,0,0|1,0,0]=3 450 B8R1.2 C1=CC=C(C=C1)CN B485378 [2,0,0,0,0,0|1,0,0]=3 451 B8R1.2 C1=CC=C(C=C1)CN P493007 [2,0,0,0,0,0|1,0,0]=3 452 B8R1.2 C1=CC=C(C=C1)CN P493016 [2,0,0,0,0,0|1,0,0]=3 453 B8R1.2 C1=CC=C(C=C1)CN P493100 [2,0,0,0,0,0|1,0,0]=3 454 B8R1.2 C1=CC=C(C=C1)CO B108199 [2,0,0,0,0,0|0,0,0]=2 455 B8R1.2 C1=CC=C(C=C1)CO B108202 [2,0,0,0,0,0|0,0,0]=2 456 B8R1.2 C1=CC=C(C=C1)CO B108203 [2,0,0,0,0,0|0,0,0]=2 457 B8R1.2 C1=CC=C(C=C1)CO B108204 [2,0,0,0,0,0|0,0,0]=2 458 B8R1.2 C1=CC=C(C=C1)CO B108205 [2,0,0,0,0,0|0,0,0]=2 459 B8R1.2 C1=CC=C(C=C1)CO B163018 [2,0,0,0,0,0|0,0,0]=2 460 B8R1.2 C1=CC=C(C=C1)CO B346959 [2,0,0,0,0,0|0,0,0]=2 461 B8R1.2 C1=CC=C(C=C1)CO B420278 [2,0,0,0,0,0|0,0,0]=2 462 B8R1.2 C1=CC=C(C=C1)CO B472101 [2,0,0,0,0,0|0,0,0]=2 463 B8R1.2 C1=CC=C(C=C1)CS B109256 [2,0,0,0,0,0|0,1,0]=3 464 B8R1.2 C1=CC=C(C=C1)I=O I157626 [2,0,0,0,0,0|1,0,0]=3 465 B8R1.2 C1=CC=C(C=C1)N=O N159156 [2,0,0,0,0,0|1,0,0]=3 466 B8R1.2 C1=CC=C(C=C1)NN P104684 [2,0,0,0,0,0|2,0,0]=4 467 B8R1.2 C1=CC=C(C=C1)NN P108563 [2,0,0,0,0,0|2,0,0]=4 468 B8R1.2 C1=CC=C(C=C1)NN P112739 [2,0,0,0,0,0|2,0,0]=4 469 B8R1.2 C1=CC=C(C=C1)NN P579459 [2,0,0,0,0,0|2,0,0]=4 470 B8R1.2 C1=CC=C(C=C1)NO N131374 [2,0,0,0,0,0|1,0,0]=3 471 B8R1.2 C1=CC=C(C=C1)ON O464484 [2,0,0,0,0,0|1,0,0]=3 472 B8R1.2 C1=CC=C(C=C1)[As]=O P336440 [2,0,0,0,0,0|1,0,0]=3 473 B8R1.2 C1=CC=C(C=C1)[Hg]Cl P598721 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.2 C1=CC=C(C=C1)[Se]Cl P160704 [2,0,0,0,0,0|1,1,0]=4 475 B8R1.2 C1=CC=NC(=C1)C=O P105912 [2,0,0,0,0,0|1,0,0]=3 476 B8R1.2 C1=CC=NC(=C1)CBr B169474 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.2 C1=CC=NC(=C1)CCl C117226 [2,0,0,0,0,0|2,0,0]=4 478 B8R1.2 C1=CC=NC(=C1)CN P107146 [2,0,0,0,0,0|2,0,0]=4 479 B8R1.2 C1=CC=NC(=C1)CO P106578 [2,0,0,0,0,0|1,0,0]=3 480 B8R1.2 C1=CN=C(C=N1)C=O P176847 [2,0,0,0,0,0|2,0,0]=4 481 B8R1.2 C1=CN=C(N=C1)CO P176469 [2,0,0,0,0,0|2,0,0]=4 482 B8R1.2 C1=CN=CC=C1C=O P105913 [2,0,0,0,0,0|1,0,0]=3 483 B8R1.2 C1=CN=CC=C1CBr B135280 [2,0,0,0,0,0|2,0,0]=4 484 B8R1.2 C1=CN=CC=C1CCl C107154 [2,0,0,0,0,0|2,0,0]=4 485 B8R1.2 C1=CN=CC=C1CN A107215 [2,0,0,0,0,0|2,0,0]=4 486 B8R1.2 C1=CN=CC=C1CN P194376 [2,0,0,0,0,0|2,0,0]=4 487 B8R1.2 C1=CN=CC=C1CO P107414 [2,0,0,0,0,0|1,0,0]=3 488 B8R1.2 C1=CN=CN=C1CO P176166 [2,0,0,0,0,0|2,0,0]=4 489 B8R1.2 C=CC1=CC=CC=C1 A304890 [2,0,0,0,0,0|0,0,1]=3 490 B8R1.2 C=CC1=CC=CC=C1 P107084 [2,0,0,0,0,0|0,0,1]=3 491 B8R1.2 C=CC1=CC=CC=C1 P107085 [2,0,0,0,0,0|0,0,1]=3 492 B8R1.2 C=CC1=CC=CC=C1 P107086 [2,0,0,0,0,0|0,0,1]=3 493 B8R1.2 C=CC1=CC=CC=C1 P107087 [2,0,0,0,0,0|0,0,1]=3 494 B8R1.2 C=CC1=CC=CC=C1 P107088 [2,0,0,0,0,0|0,0,1]=3 495 B8R1.2 C=CC1=CC=CC=C1 P107089 [2,0,0,0,0,0|0,0,1]=3 496 B8R1.2 C=CC1=CC=CC=C1 P107090 [2,0,0,0,0,0|0,0,1]=3 497 B8R1.2 C=CC1=CC=CC=C1 P107091 [2,0,0,0,0,0|0,0,1]=3 498 B8R1.2 C=CC1=CC=CC=C1 P107772 [2,0,0,0,0,0|0,0,1]=3 499 B8R1.2 C=CC1=CC=CC=C1 P107773 [2,0,0,0,0,0|0,0,1]=3 500 B8R1.2 C=CC1=CC=CC=C1 P107774 [2,0,0,0,0,0|0,0,1]=3 501 B8R1.2 C=CC1=CC=CC=C1 P107775 [2,0,0,0,0,0|0,0,1]=3 502 B8R1.2 C=CC1=CC=CC=C1 P107776 [2,0,0,0,0,0|0,0,1]=3 503 B8R1.2 C=CC1=CC=CC=C1 P107777 [2,0,0,0,0,0|0,0,1]=3 504 B8R1.2 C=CC1=CC=CC=C1 P107778 [2,0,0,0,0,0|0,0,1]=3 505 B8R1.2 C=CC1=CC=CC=C1 P107779 [2,0,0,0,0,0|0,0,1]=3 506 B8R1.2 C=CC1=CC=CC=C1 P107780 [2,0,0,0,0,0|0,0,1]=3 507 B8R1.2 C=CC1=CC=CC=C1 P107782 [2,0,0,0,0,0|0,0,1]=3 508 B8R1.2 C=CC1=CC=CC=C1 P107783 [2,0,0,0,0,0|0,0,1]=3 509 B8R1.2 C=CC1=CC=CC=C1 P107784 [2,0,0,0,0,0|0,0,1]=3 510 B8R1.2 C=CC1=CC=CC=C1 P107786 [2,0,0,0,0,0|0,0,1]=3 511 B8R1.2 C=CC1=CC=CC=C1 P107787 [2,0,0,0,0,0|0,0,1]=3 512 B8R1.2 C=CC1=CC=CC=C1 P107789 [2,0,0,0,0,0|0,0,1]=3 513 B8R1.2 C=CC1=CC=CC=C1 P107790 [2,0,0,0,0,0|0,0,1]=3 514 B8R1.2 C=CC1=CC=CC=C1 P107791 [2,0,0,0,0,0|0,0,1]=3 515 B8R1.2 C=CC1=CC=CC=C1 P107792 [2,0,0,0,0,0|0,0,1]=3 516 B8R1.2 C=CC1=CC=CC=C1 P107793 [2,0,0,0,0,0|0,0,1]=3 517 B8R1.2 C=CC1=CC=CC=C1 P107794 [2,0,0,0,0,0|0,0,1]=3 518 B8R1.2 C=CC1=CC=CC=C1 P107795 [2,0,0,0,0,0|0,0,1]=3 519 B8R1.2 C=CC1=CC=CC=C1 P107796 [2,0,0,0,0,0|0,0,1]=3 520 B8R1.2 C=CC1=CC=CC=C1 P107797 [2,0,0,0,0,0|0,0,1]=3 521 B8R1.2 C=CC1=CC=CC=C1 P107798 [2,0,0,0,0,0|0,0,1]=3 522 B8R1.2 C=CC1=CC=CC=C1 P107801 [2,0,0,0,0,0|0,0,1]=3 523 B8R1.2 C=CC1=CC=CC=C1 P107802 [2,0,0,0,0,0|0,0,1]=3 524 B8R1.2 C=CC1=CC=CC=C1 P107803 [2,0,0,0,0,0|0,0,1]=3 525 B8R1.2 C=CC1=CC=CC=C1 P107804 [2,0,0,0,0,0|0,0,1]=3 526 B8R1.2 C=CC1=CC=CC=C1 P107805 [2,0,0,0,0,0|0,0,1]=3 527 B8R1.2 C=CC1=CC=CC=C1 P107806 [2,0,0,0,0,0|0,0,1]=3 528 B8R1.2 C=CC1=CC=CC=C1 P107807 [2,0,0,0,0,0|0,0,1]=3 529 B8R1.2 C=CC1=CC=CC=C1 P107808 [2,0,0,0,0,0|0,0,1]=3 530 B8R1.2 C=CC1=CC=CC=C1 P107809 [2,0,0,0,0,0|0,0,1]=3 531 B8R1.2 C=CC1=CC=CC=C1 P107810 [2,0,0,0,0,0|0,0,1]=3 532 B8R1.2 C=CC1=CC=CC=C1 P107811 [2,0,0,0,0,0|0,0,1]=3 533 B8R1.2 C=CC1=CC=CC=C1 P107812 [2,0,0,0,0,0|0,0,1]=3 534 B8R1.2 C=CC1=CC=CC=C1 P107813 [2,0,0,0,0,0|0,0,1]=3 535 B8R1.2 C=CC1=CC=CC=C1 P107814 [2,0,0,0,0,0|0,0,1]=3 536 B8R1.2 C=CC1=CC=CC=C1 P119494 [2,0,0,0,0,0|0,0,1]=3 537 B8R1.2 C=CC1=CC=CC=C1 P119495 [2,0,0,0,0,0|0,0,1]=3 538 B8R1.2 C=CC1=CC=CC=C1 P119496 [2,0,0,0,0,0|0,0,1]=3 539 B8R1.2 C=CC1=CC=CC=C1 P119498 [2,0,0,0,0,0|0,0,1]=3 540 B8R1.2 C=CC1=CC=CC=C1 P119572 [2,0,0,0,0,0|0,0,1]=3 541 B8R1.2 C=CC1=CC=CC=C1 P304886 [2,0,0,0,0,0|0,0,1]=3 542 B8R1.2 C=CC1=CC=CC=C1 P304889 [2,0,0,0,0,0|0,0,1]=3 543 B8R1.2 C=CC1=CC=CC=C1 P434446 [2,0,0,0,0,0|0,0,1]=3 544 B8R1.2 C=CC1=CC=CC=C1 P434450 [2,0,0,0,0,0|0,0,1]=3 545 B8R1.2 C=CC1=CC=CC=C1 P434455 [2,0,0,0,0,0|0,0,1]=3 546 B8R1.2 C=CC1=CC=CC=C1 P476626 [2,0,0,0,0,0|0,0,1]=3 547 B8R1.2 C=CC1=CC=CC=C1 P490073 [2,0,0,0,0,0|0,0,1]=3 548 B8R1.2 C=CC1=CC=CC=C1 P638578 [2,0,0,0,0,0|0,0,1]=3 549 B8R1.2 C=CC1=CC=CC=C1 S110374 [2,0,0,0,0,0|0,0,1]=3 550 B8R1.2 C=CC1=CC=CC=C1 S110375 [2,0,0,0,0,0|0,0,1]=3 551 B8R1.2 C=CC1=CC=CC=C1 S110376 [2,0,0,0,0,0|0,0,1]=3 552 B8R1.2 C=CC1=CC=CC=C1 S110377 [2,0,0,0,0,0|0,0,1]=3 553 B8R1.2 C=CC1=CC=CC=C1 S110378 [2,0,0,0,0,0|0,0,1]=3 554 B8R1.2 C=CC1=CC=CC=C1 S121282 [2,0,0,0,0,0|0,0,1]=3 555 B8R1.2 C=CC1=CC=CC=N1 V106227 [2,0,0,0,0,0|1,0,1]=4 556 B8R1.2 C=CC1=CC=NC=C1 P303219 [2,0,0,0,0,0|1,0,1]=4 557 B8R1.2 C=CC1=CC=NC=C1 P303220 [2,0,0,0,0,0|1,0,1]=4 558 B8R1.2 C=CC1=CC=NC=C1 P466518 [2,0,0,0,0,0|1,0,1]=4 559 B8R1.2 C=CC1=CC=NC=C1 V105595 [2,0,0,0,0,0|1,0,1]=4 560 B8R1.2 C=CC1=CN=CC=C1 V138030 [2,0,0,0,0,0|1,0,1]=4 561 B8R1.2 CCC1=CC=CC=C1 E108144 [2,0,0,0,0,0|0,0,1]=3 562 B8R1.2 CCC1=CC=CC=C1 E108145 [2,0,0,0,0,0|0,0,1]=3 563 B8R1.2 CCC1=CC=CC=C1 E108146 [2,0,0,0,0,0|0,0,1]=3 564 B8R1.2 CCC1=CC=CC=C1 E108148 [2,0,0,0,0,0|0,0,1]=3 565 B8R1.2 CCC1=CC=CC=C1 E108149 [2,0,0,0,0,0|0,0,1]=3 566 B8R1.2 CCC1=CC=CC=C1 E117364 [2,0,0,0,0,0|0,0,1]=3 567 B8R1.2 CCC1=CC=CC=N1 E156565 [2,0,0,0,0,0|1,0,1]=4 568 B8R1.2 CCC1=CC=NC=C1 E106225 [2,0,0,0,0,0|1,0,1]=4 569 B8R1.2 CCC1=CN=CC=C1 E156048 [2,0,0,0,0,0|1,0,1]=4 570 B8R1.2 CC[N+]1=CC=CC=C1 E102660 [2,0,0,0,0,0|1,0,1]=4 571 B8R1.2 CC[N+]1=CC=CC=C1 E102661 [2,0,0,0,0,0|1,0,1]=4 572 B8R1.2 CNC1=CC=CC=C1 M109539 [2,0,0,0,0,0|1,0,1]=4 573 B8R1.2 CNC1=CC=CC=C1 M109540 [2,0,0,0,0,0|1,0,1]=4 574 B8R1.2 COC1=CC=CC=C1 A103680 [2,0,0,0,0,0|0,0,1]=3 575 B8R1.2 COC1=CC=CC=C1 A103683 [2,0,0,0,0,0|0,0,1]=3 576 B8R1.2 COC1=CC=CC=C1 A103684 [2,0,0,0,0,0|0,0,1]=3 577 B8R1.2 COC1=CC=CC=C1 A105952 [2,0,0,0,0,0|0,0,1]=3 578 B8R1.2 COC1=CC=CC=C1 A472026 [2,0,0,0,0,0|0,0,1]=3 579 B8R1.2 COC1=CC=CC=N1 M120557 [2,0,0,0,0,0|1,0,1]=4 580 B8R1.2 COC1=CC=NC=C1 M120571 [2,0,0,0,0,0|1,0,1]=4 581 B8R1.2 COC1=CN=CC=C1 M134006 [2,0,0,0,0,0|1,0,1]=4 582 B8R1.2 CSC1=CC=CC=C1 T107511 [2,0,0,0,0,0|0,1,1]=4 583 B8R1.2 C[Si]C1=CC=CC=C1 M338232 [2,0,0,0,0,0|0,1,1]=4 584 B8R1.2 [C-]#CC1=CC=CC=C1 C282525 [2,0,0,0,0,0|0,0,2]=4 585 B8R1.2 [C-]#CC1=CC=CC=C1 P331408 [2,0,0,0,0,0|0,0,2]=4 586 B10R1.1 C1=CC(=CC=C1CC#N)Br B100849 [1,1,0,0,0,0|1,0,1]=4 587 B10R1.1 C1=CC(=CC=C1CC#N)Cl C124714 [1,1,0,0,0,0|1,0,1]=4 588 B10R1.1 C1=CC(=CC=C1CC#N)F F156616 [1,1,0,0,0,0|1,0,1]=4 589 B10R1.1 C1=CC(=CC=C1CC#N)I I170725 [1,1,0,0,0,0|1,0,1]=4 590 B10R1.1 C1=CC(=CC=C1CC#N)N A107271 [1,1,0,0,0,0|1,0,1]=4 591 B10R1.1 C1=CC(=CC=C1CC#N)O H121848 [1,1,0,0,0,0|1,0,1]=4 592 B10R1.1 C1=CC(=CC=C1CCBr)Br B167924 [1,1,0,0,0,0|1,0,1]=4 593 B10R1.1 C1=CC(=CC=C1CCBr)Cl C121844 [1,1,0,0,0,0|1,0,1]=4 594 B10R1.1 C1=CC(=CC=C1CCBr)F F121611 [1,1,0,0,0,0|1,0,1]=4 595 B10R1.1 C1=CC(=CC=C1CCBr)O H167212 [1,1,0,0,0,0|1,0,1]=4 596 B10R1.1 C1=CC(=CC=C1CCCl)F F156671 [1,1,0,0,0,0|1,0,1]=4 597 B10R1.1 C1=CC(=CC=C1CCN)Br B101709 [1,1,0,0,0,0|1,0,1]=4 598 B10R1.1 C1=CC(=CC=C1CCN)Br B494194 [1,1,0,0,0,0|1,0,1]=4 599 B10R1.1 C1=CC(=CC=C1CCN)Br B494196 [1,1,0,0,0,0|1,0,1]=4 600 B10R1.1 C1=CC(=CC=C1CCN)Cl C153968 [1,1,0,0,0,0|1,0,1]=4 601 B10R1.1 C1=CC(=CC=C1CCN)Cl C493551 [1,1,0,0,0,0|1,0,1]=4 602 B10R1.1 C1=CC(=CC=C1CCN)F F131906 [1,1,0,0,0,0|1,0,1]=4 603 B10R1.1 C1=CC(=CC=C1CCN)F F292669 [1,1,0,0,0,0|1,0,1]=4 604 B10R1.1 C1=CC(=CC=C1CCN)F F302836 [1,1,0,0,0,0|1,0,1]=4 605 B10R1.1 C1=CC(=CC=C1CCN)F F493198 [1,1,0,0,0,0|1,0,1]=4 606 B10R1.1 C1=CC(=CC=C1CCN)N A151503 [1,1,0,0,0,0|1,0,1]=4 607 B10R1.1 C1=CC(=CC=C1CCN)O T105543 [1,1,0,0,0,0|1,0,1]=4 608 B10R1.1 C1=CC(=CC=C1CCN)O T107153 [1,1,0,0,0,0|1,0,1]=4 609 B10R1.1 C1=CC(=CC=C1CCN)O T424437 [1,1,0,0,0,0|1,0,1]=4 610 B10R1.1 C1=CC(=CC=C1CCO)Br B153115 [1,1,0,0,0,0|0,0,2]=4 611 B10R1.1 C1=CC(=CC=C1CCO)Cl C121856 [1,1,0,0,0,0|0,0,2]=4 612 B10R1.1 C1=CC(=CC=C1CCO)F F136730 [1,1,0,0,0,0|0,0,2]=4 613 B10R1.1 C1=CC(=CC=C1CCO)N A151120 [1,1,0,0,0,0|0,0,2]=4 614 B10R1.1 C1=CC(=CC=C1CCO)O H106325 [1,1,0,0,0,0|0,0,2]=4 615 B10R1.1 C1=CC(=CC=C1CCO)O H118576 [1,1,0,0,0,0|0,0,2]=4 616 B10R1.1 C1=CC(=CC=C1CCO)O H424324 [1,1,0,0,0,0|0,0,2]=4 617 B10R1.1 C1=CC(=CC=C1CON)F A184897 [1,1,0,0,0,0|1,0,0]=3 618 B10R1.1 C1=CC(=CC=C1N=C=O)Br B120150 [1,1,0,0,0,0|1,0,1]=4 619 B10R1.1 C1=CC(=CC=C1N=C=O)Cl C102129 [1,1,0,0,0,0|1,0,1]=4 620 B10R1.1 C1=CC(=CC=C1N=C=O)F F156778 [1,1,0,0,0,0|1,0,1]=4 621 B10R1.1 C1=CC(=CC=C1N=C=O)I I352477 [1,1,0,0,0,0|1,0,1]=4 622 B10R1.1 C1=CC(=CC=C1NC=O)Br N342559 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.1 C1=CC(=CC=C1NC=O)Cl N159268 [1,1,0,0,0,0|1,0,0]=3 624 B10R1.1 C1=CC(=CC=C1NC=O)F N159255 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.1 C=CCC1=CC=C(C=C1)O A589273 [1,1,0,0,0,0|1,0,0]=3 626 B10R1.1 CC1=CC=C(C=C1)CC#N P160068 [1,1,0,0,0,0|1,0,1]=4 627 B10R1.1 CC1=CC=C(C=C1)CC=C A169644 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.1 CC1=CC=C(C=C1)CC=O P586228 [1,1,0,0,0,0|0,0,0]=2 629 B10R1.1 CC1=CC=C(C=C1)CCBr M469504 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.1 CC1=CC=C(C=C1)CCN M493506 [1,1,0,0,0,0|1,0,1]=4 631 B10R1.1 CC1=CC=C(C=C1)CCN P101999 [1,1,0,0,0,0|1,0,1]=4 632 B10R1.1 CC1=CC=C(C=C1)CCO I135268 [1,1,0,0,0,0|0,0,2]=4 633 B10R1.1 CC1=CC=C(C=C1)CNC N300479 [1,1,0,0,0,0|1,0,1]=4 634 B10R1.1 CC1=CC=C(C=C1)N=C=O T106835 [1,1,0,0,0,0|1,0,1]=4 635 B10R1.1 CC1=CC=C(C=C1)NC=O M158337 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.1 CCCC1=CC=C(C=C1)Br B101884 [1,1,0,0,0,0|1,0,1]=4 637 B10R1.1 CCCC1=CC=C(C=C1)C P160392 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.1 CCCC1=CC=C(C=C1)Cl C303901 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.1 CCCC1=CC=C(C=C1)N P136525 [1,1,0,0,0,0|1,0,1]=4 640 B10R1.1 CCCC1=CC=C(C=C1)O P136692 [1,1,0,0,0,0|1,0,1]=4 641 B10R1.1 CCOC1=CC=C(C=C1)Br B113334 [1,1,0,0,0,0|1,0,1]=4 642 B10R1.1 CCOC1=CC=C(C=C1)Cl C304178 [1,1,0,0,0,0|1,0,1]=4 643 B10R1.1 CCOC1=CC=C(C=C1)F F156673 [1,1,0,0,0,0|1,0,1]=4 644 B10R1.1 CCOC1=CC=C(C=C1)I I111883 [1,1,0,0,0,0|1,0,1]=4 645 B10R1.1 CCOC1=CC=C(C=C1)N E108459 [1,1,0,0,0,0|1,0,1]=4 646 B10R1.1 CCOC1=CC=C(C=C1)N P160470 [1,1,0,0,0,0|1,0,1]=4 647 B10R1.1 CCOC1=CC=C(C=C1)O E124314 [1,1,0,0,0,0|1,0,1]=4 648 B10R1.1 CNCC1=CC=C(C=C1)Br B186104 [1,1,0,0,0,0|1,0,1]=4 649 B10R1.1 CNCC1=CC=C(C=C1)Cl C153967 [1,1,0,0,0,0|1,0,1]=4 650 B10R1.1 CNCC1=CC=C(C=C1)F F156709 [1,1,0,0,0,0|1,0,1]=4 651 B10R1.1 COCC1=CC=C(C=C1)Br B181671 [1,1,0,0,0,0|0,0,1]=3 652 B10R1.1 COCC1=CC=C(C=C1)O M170858 [1,1,0,0,0,0|0,0,1]=3 653 B10R1.4 C1=CC=C(C(=C1)CC#N)Br B468900 [1,1,0,0,0,0|1,0,1]=4 654 B10R1.4 C1=CC=C(C(=C1)CC#N)Cl C140252 [1,1,0,0,0,0|1,0,1]=4 655 B10R1.4 C1=CC=C(C(=C1)CC#N)F F133645 [1,1,0,0,0,0|1,0,1]=4 656 B10R1.4 C1=CC=C(C(=C1)CC#N)I I170176 [1,1,0,0,0,0|1,0,1]=4 657 B10R1.4 C1=CC=C(C(=C1)CC#N)N A133628 [1,1,0,0,0,0|1,0,1]=4 658 B10R1.4 C1=CC=C(C(=C1)CCBr)Cl C167804 [1,1,0,0,0,0|1,0,1]=4 659 B10R1.4 C1=CC=C(C(=C1)CCBr)F F469846 [1,1,0,0,0,0|1,0,1]=4 660 B10R1.4 C1=CC=C(C(=C1)CCN)Br B122727 [1,1,0,0,0,0|1,0,1]=4 661 B10R1.4 C1=CC=C(C(=C1)CCN)Cl C153971 [1,1,0,0,0,0|1,0,1]=4 662 B10R1.4 C1=CC=C(C(=C1)CCN)F F292844 [1,1,0,0,0,0|1,0,1]=4 663 B10R1.4 C1=CC=C(C(=C1)CCN)F W135956 [1,1,0,0,0,0|1,0,1]=4 664 B10R1.4 C1=CC=C(C(=C1)CCN)N A189849 [1,1,0,0,0,0|1,0,1]=4 665 B10R1.4 C1=CC=C(C(=C1)CCN)O A191948 [1,1,0,0,0,0|1,0,1]=4 666 B10R1.4 C1=CC=C(C(=C1)CCO)Br B102011 [1,1,0,0,0,0|0,0,2]=4 667 B10R1.4 C1=CC=C(C(=C1)CCO)Cl C135333 [1,1,0,0,0,0|0,0,2]=4 668 B10R1.4 C1=CC=C(C(=C1)CCO)F F134481 [1,1,0,0,0,0|0,0,2]=4 669 B10R1.4 C1=CC=C(C(=C1)CCO)N A151124 [1,1,0,0,0,0|0,0,2]=4 670 B10R1.4 C1=CC=C(C(=C1)CCO)O H139263 [1,1,0,0,0,0|0,0,2]=4 671 B10R1.4 C1=CC=C(C(=C1)CON)F O192052 [1,1,0,0,0,0|1,0,0]=3 672 B10R1.4 C1=CC=C(C(=C1)N=C=O)Br B153169 [1,1,0,0,0,0|1,0,1]=4 673 B10R1.4 C1=CC=C(C(=C1)N=C=O)Cl C107898 [1,1,0,0,0,0|1,0,1]=4 674 B10R1.4 C1=CC=C(C(=C1)N=C=O)F F132280 [1,1,0,0,0,0|1,0,1]=4 675 B10R1.4 C=CCC1=CC=CC=C1Br A467291 [1,1,0,0,0,0|1,0,0]=3 676 B10R1.4 C=CCC1=CC=CC=C1N A151777 [1,1,0,0,0,0|1,0,0]=3 677 B10R1.4 C=CCC1=CC=CC=C1O A151090 [1,1,0,0,0,0|1,0,0]=3 678 B10R1.4 CC1=CC=CC=C1CC#N O160033 [1,1,0,0,0,0|1,0,1]=4 679 B10R1.4 CC1=CC=CC=C1CC=C A167621 [1,1,0,0,0,0|1,0,0]=3 680 B10R1.4 CC1=CC=CC=C1CCBr B587606 [1,1,0,0,0,0|1,0,1]=4 681 B10R1.4 CC1=CC=CC=C1CCO O159910 [1,1,0,0,0,0|0,0,2]=4 682 B10R1.4 CC1=CC=CC=C1CNC B301431 [1,1,0,0,0,0|1,0,1]=4 683 B10R1.4 CC1=CC=CC=C1N=C=O T113759 [1,1,0,0,0,0|1,0,1]=4 684 B10R1.4 CC1=CC=CC=C1NC=O M158338 [1,1,0,0,0,0|1,0,0]=3 685 B10R1.4 CCCC1=CC=CC=C1C P160377 [1,1,0,0,0,0|1,0,1]=4 686 B10R1.4 CCCC1=CC=CC=C1N P160189 [1,1,0,0,0,0|1,0,1]=4 687 B10R1.4 CCCC1=CC=CC=C1O P160564 [1,1,0,0,0,0|1,0,1]=4 688 B10R1.4 CCOC1=CC=CC=C1Cl C405475 [1,1,0,0,0,0|1,0,1]=4 689 B10R1.4 CCOC1=CC=CC=C1N E100407 [1,1,0,0,0,0|1,0,1]=4 690 B10R1.4 CCOC1=CC=CC=C1O E156224 [1,1,0,0,0,0|1,0,1]=4 691 B10R1.4 CNCC1=CC=CC=C1Br B194652 [1,1,0,0,0,0|1,0,1]=4 692 B10R1.4 CNCC1=CC=CC=C1Cl C469889 [1,1,0,0,0,0|1,0,1]=4 693 B10R1.4 CNCC1=CC=CC=C1O H156922 [1,1,0,0,0,0|1,0,1]=4 694 B10R1.10 C1=CC(=CC(=C1)Br)CC#N B122843 [1,1,0,0,0,0|1,0,1]=4 695 B10R1.10 C1=CC(=CC(=C1)Br)CCN B101708 [1,1,0,0,0,0|1,0,1]=4 696 B10R1.10 C1=CC(=CC(=C1)Br)CCO B102008 [1,1,0,0,0,0|0,0,2]=4 697 B10R1.10 C1=CC(=CC(=C1)Br)N=C=O B153167 [1,1,0,0,0,0|1,0,1]=4 698 B10R1.10 C1=CC(=CC(=C1)Cl)CC#N C132151 [1,1,0,0,0,0|1,0,1]=4 699 B10R1.10 C1=CC(=CC(=C1)Cl)CCBr C167806 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.10 C1=CC(=CC(=C1)Cl)CCN C153963 [1,1,0,0,0,0|1,0,1]=4 701 B10R1.10 C1=CC(=CC(=C1)Cl)CCO C153312 [1,1,0,0,0,0|0,0,2]=4 702 B10R1.10 C1=CC(=CC(=C1)Cl)N=C=O C107899 [1,1,0,0,0,0|1,0,1]=4 703 B10R1.10 C1=CC(=CC(=C1)F)CC#N F122867 [1,1,0,0,0,0|1,0,1]=4 704 B10R1.10 C1=CC(=CC(=C1)F)CCBr F135723 [1,1,0,0,0,0|1,0,1]=4 705 B10R1.10 C1=CC(=CC(=C1)F)CCN W133696 [1,1,0,0,0,0|1,0,1]=4 706 B10R1.10 C1=CC(=CC(=C1)F)CCO F156602 [1,1,0,0,0,0|0,0,2]=4 707 B10R1.10 C1=CC(=CC(=C1)F)N=C=O F156779 [1,1,0,0,0,0|1,0,1]=4 708 B10R1.10 C1=CC(=CC(=C1)I)CC#N I157675 [1,1,0,0,0,0|1,0,1]=4 709 B10R1.10 C1=CC(=CC(=C1)N)CCO A589356 [1,1,0,0,0,0|0,0,2]=4 710 B10R1.10 C1=CC(=CC(=C1)O)CC#N M350354 [1,1,0,0,0,0|1,0,1]=4 711 B10R1.10 C1=CC(=CC(=C1)O)CCO H167016 [1,1,0,0,0,0|0,0,2]=4 712 B10R1.10 CC1=CC(=CC=C1)CC#N M158779 [1,1,0,0,0,0|1,0,1]=4 713 B10R1.10 CC1=CC(=CC=C1)CC=C A169645 [1,1,0,0,0,0|1,0,0]=3 714 B10R1.10 CC1=CC(=CC=C1)CCBr M332837 [1,1,0,0,0,0|1,0,1]=4 715 B10R1.10 CC1=CC(=CC=C1)CCCl C193160 [1,1,0,0,0,0|1,0,1]=4 716 B10R1.10 CC1=CC(=CC=C1)CCN M170979 [1,1,0,0,0,0|1,0,1]=4 717 B10R1.10 CC1=CC(=CC=C1)CCO M157912 [1,1,0,0,0,0|0,0,2]=4 718 B10R1.10 CC1=CC(=CC=C1)CNC M158625 [1,1,0,0,0,0|1,0,1]=4 719 B10R1.10 CC1=CC(=CC=C1)N=C=O M103625 [1,1,0,0,0,0|1,0,1]=4 720 B10R1.10 CCCC1=CC=CC(=C1)C P160391 [1,1,0,0,0,0|1,0,1]=4 721 B10R1.10 CCOC1=CC(=CC=C1)Br B136517 [1,1,0,0,0,0|1,0,1]=4 722 B10R1.10 CCOC1=CC(=CC=C1)S E101783 [1,1,0,0,0,0|1,0,1]=4 723 B10R1.10 CCOC1=CC=CC(=C1)N E101872 [1,1,0,0,0,0|1,0,1]=4 724 B10R1.10 CCOC1=CC=CC(=C1)O E156223 [1,1,0,0,0,0|1,0,1]=4 725 B10R1.10 CNCC1=CC(=CC=C1)Br B121859 [1,1,0,0,0,0|1,0,1]=4 726 B10R1.10 CNCC1=CC(=CC=C1)Br B140813 [1,1,0,0,0,0|1,0,1]=4 727 B10R1.10 CNCC1=CC(=CC=C1)Cl C170092 [1,1,0,0,0,0|1,0,1]=4 728 B10R1.10 CNCC1=CC(=CC=C1)F F156708 [1,1,0,0,0,0|1,0,1]=4 729 B10R1.10 CNCC1=CC(=CC=C1)N A151692 [1,1,0,0,0,0|1,0,1]=4 730 B10R1.15 C#CC(C1=CC=CC=C1)O P107039 [1,1,0,0,0,0|1,0,1]=4 731 B10R1.15 C1=CC=C(C=C1)C(=O)C=O P165810 [1,1,0,0,0,0|0,0,1]=3 732 B10R1.15 C1=CC=C(C=C1)C(C#N)N P170863 [1,1,0,0,0,0|1,0,1]=4 733 B10R1.15 C1=CC=C(C=C1)C(CBr)Br D304999 [1,1,0,0,0,0|1,0,1]=4 734 B10R1.15 C1=CC=C(C=C1)C(CBr)O B192257 [1,1,0,0,0,0|1,0,1]=4 735 B10R1.15 C1=CC=C(C=C1)C(CCl)O R304018 [1,1,0,0,0,0|1,0,1]=4 736 B10R1.15 C1=CC=C(C=C1)C(CCl)O S304439 [1,1,0,0,0,0|1,0,1]=4 737 B10R1.15 C1=CC=C(C=C1)C(CN)O A102440 [1,1,0,0,0,0|1,0,1]=4 738 B10R1.15 C1=CC=C(C=C1)C(CN)O A151123 [1,1,0,0,0,0|1,0,1]=4 739 B10R1.15 C1=CC=C(C=C1)C(CN)O R138565 [1,1,0,0,0,0|1,0,1]=4 740 B10R1.15 C1=CC=C(C=C1)C(CO)N P109343 [1,1,0,0,0,0|0,0,2]=4 741 B10R1.15 C1=CC=C(C=C1)C(CO)N P117139 [1,1,0,0,0,0|0,0,2]=4 742 B10R1.15 C1=CC=C(C=C1)C(CO)N P160161 [1,1,0,0,0,0|0,0,2]=4 743 B10R1.15 C1=CC=C(C=C1)C(CO)O P100518 [1,1,0,0,0,0|0,0,2]=4 744 B10R1.15 C1=CC=C(C=C1)C(CO)O P100519 [1,1,0,0,0,0|0,0,2]=4 745 B10R1.15 C1=CC=C(C=C1)C(CO)O P112689 [1,1,0,0,0,0|0,0,2]=4 746 B10R1.15 C=CC(=O)C1=CC=CC=C1 P304587 [1,1,0,0,0,0|1,0,1]=4 747 B10R1.15 C=CC(C1=CC=CC=C1)Cl V303368 [1,1,0,0,0,0|1,0,0]=3 748 B10R1.15 C=CC(C1=CC=CC=C1)O V189138 [1,1,0,0,0,0|1,0,0]=3 749 B10R1.15 CC(C#N)C1=CC=CC=C1 M468313 [1,1,0,0,0,0|1,0,1]=4 750 B10R1.15 CC(C1=CC=CC=C1)NC I168221 [1,1,0,0,0,0|1,0,1]=4 751 B10R1.15 CC(C1=CC=CC=C1)NC I171118 [1,1,0,0,0,0|1,0,1]=4 752 B10R1.15 CC(C1=CC=CC=C1)NC I286935 [1,1,0,0,0,0|1,0,1]=4 753 B10R1.15 CC(C1=CC=CC=C1)[N+]#[C-] B300007 [1,1,0,0,0,0|1,0,1]=4 754 B10R1.15 CC(C=O)C1=CC=CC=C1 P160754 [1,1,0,0,0,0|0,0,0]=2 755 B10R1.15 CC(CN)C1=CC=CC=C1 P191947 [1,1,0,0,0,0|1,0,1]=4 756 B10R1.15 CC(CN)C1=CC=CC=C1 R160849 [1,1,0,0,0,0|1,0,1]=4 757 B10R1.15 CC(CO)C1=CC=CC=C1 P160710 [1,1,0,0,0,0|0,0,2]=4 758 B10R1.15 CC(CO)C1=CC=CC=C1 R489486 [1,1,0,0,0,0|0,0,2]=4 759 B10R1.15 CCC(C)C1=CC=CC=C1 B100253 [1,1,0,0,0,0|1,0,1]=4 760 B10R1.15 CCC(C)C1=CC=CC=C1 B100254 [1,1,0,0,0,0|1,0,1]=4 761 B10R1.15 CCC(C)C1=CC=CC=C1 B128164 [1,1,0,0,0,0|1,0,1]=4 762 B10R1.15 CCC(C1=CC=CC=C1)N E334013 [1,1,0,0,0,0|1,0,1]=4 763 B10R1.15 CCC(C1=CC=CC=C1)N R138647 [1,1,0,0,0,0|1,0,1]=4 764 B10R1.15 CCC(C1=CC=CC=C1)N R639496 [1,1,0,0,0,0|1,0,1]=4 765 B10R1.15 CCC(C1=CC=CC=C1)N S135110 [1,1,0,0,0,0|1,0,1]=4 766 B10R1.15 CCC(C1=CC=CC=C1)O P107008 [1,1,0,0,0,0|1,0,1]=4 767 B10R1.15 CCC(C1=CC=CC=C1)O R138307 [1,1,0,0,0,0|1,0,1]=4 768 B10R1.15 CCC(C1=CC=CC=C1)O S161360 [1,1,0,0,0,0|1,0,1]=4 769 B10R1.15 CN(C1=CC=CC=C1)N=O N134509 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.15 CN(C=O)C1=CC=CC=C1 M106700 [1,1,0,0,0,0|1,0,0]=3 771 B10R1.15 COC(=N)C1=CC=CC=C1 M158319 [1,1,0,0,0,0|0,0,2]=4 772 B10R1.15 COC(=O)C1=CC=CC=C1 M108588 [1,1,0,0,0,0|0,0,2]=4 773 B10R1.15 COC(=O)C1=CC=CC=C1 M108589 [1,1,0,0,0,0|0,0,2]=4 774 B10R1.15 COC(=O)C1=CC=CC=C1 M108590 [1,1,0,0,0,0|0,0,2]=4 775 B10R1.15 COC(=O)C1=CC=CC=C1 M108591 [1,1,0,0,0,0|0,0,2]=4 776 B10R1.15 COC(=O)C1=CC=CC=C1 M282394 [1,1,0,0,0,0|0,0,2]=4 777 B10R1.15 COS(=O)C1=CC=CC=C1 M158264 [1,1,0,0,0,0|1,0,1]=4 778 B10R1.15 C[C@H](CO)C1=CC=CC=C1 S489449 [1,1,0,0,0,0|0,0,2]=4 779 B10R1.15 C\C=C(\C)/C1=CC=CC=C1 C348081 [1,1,0,0,0,0|1,0,1]=4 780 B10R1.18 C1=CC(=CN=C1)CC(=O)N P193047 [1,1,0,0,0,0|1,0,0]=3 781 B10R1.18 C1=CC(=CN=C1)CC(=O)O P107547 [1,1,0,0,0,0|1,0,0]=3 782 B10R1.18 C1=CC=C(C=C1)CC(=N)N P192301 [1,1,0,0,0,0|1,0,0]=3 783 B10R1.18 C1=CC=C(C=C1)CC(=O)Cl P109202 [1,1,0,0,0,0|0,0,0]=2 784 B10R1.18 C1=CC=C(C=C1)CC(=O)N P160461 [1,1,0,0,0,0|0,0,0]=2 785 B10R1.18 C1=CC=C(C=C1)CC(=O)N P420433 [1,1,0,0,0,0|0,0,0]=2 786 B10R1.18 C1=CC=C(C=C1)CC(=O)O P346939 [1,1,0,0,0,0|0,0,0]=2 787 B10R1.18 C1=CC=C(C=C1)CC(=S)N P160307 [1,1,0,0,0,0|0,1,0]=3 788 B10R1.18 C1=CC=C(C=C1)C[N+](=O)[O-] N171226 [1,1,0,0,0,0|1,0,0]=3 789 B10R1.18 C1=CC=C(C=C1)N=C(N)N P131885 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.18 C1=CC=C(C=C1)NC(=O)N P105589 [1,1,0,0,0,0|1,0,0]=3 791 B10R1.18 C1=CC=C(C=C1)NC(=S)N P110661 [1,1,0,0,0,0|1,1,0]=4 792 B10R1.18 C1=CC=C(C=C1)OC(=O)Cl P106536 [1,1,0,0,0,0|0,0,0]=2 793 B10R1.18 C1=CC=C(C=C1)OC(=O)N P300418 [1,1,0,0,0,0|0,0,0]=2 794 B10R1.18 C1=CC=C(C=C1)OC(=S)Cl P119482 [1,1,0,0,0,0|0,1,0]=3 795 B10R1.18 C1=CC=C(C=C1)OC(F)F D404170 [1,1,0,0,0,0|1,0,1]=4 796 B10R1.18 C1=CC=C(C=C1)SC(=S)Cl P160306 [1,1,0,0,0,0|0,2,0]=4 797 B10R1.18 C1=CC=NC(=C1)CC(=O)O P106866 [1,1,0,0,0,0|1,0,0]=3 798 B10R1.18 C1=CC=[N+](C=C1)CC(=O)N C153758 [1,1,0,0,0,0|1,0,0]=3 799 B10R1.18 C1=CN=CC=C1CC(=O)O P101990 [1,1,0,0,0,0|1,0,0]=3 800 B10R1.18 CC(=CC1=CC=CC=C1)C M158507 [1,1,0,0,0,0|1,0,1]=4 801 B10R1.18 CC(=O)CC1=CC=NC=C1 P134516 [1,1,0,0,0,0|1,0,0]=3 802 B10R1.18 CC(=O)CC1=CN=CC=C1 A355123 [1,1,0,0,0,0|1,0,0]=3 803 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 A151480 [1,1,0,0,0,0|1,0,0]=3 804 B10R1.18 CC(=O)NC1=CC=CC=C1 A103954 [1,1,0,0,0,0|1,0,0]=3 805 B10R1.18 CC(=O)NC1=CC=CC=C1 A103955 [1,1,0,0,0,0|1,0,0]=3 806 B10R1.18 CC(=O)NC1=CC=CC=C1 A103956 [1,1,0,0,0,0|1,0,0]=3 807 B10R1.18 CC(=O)NC1=CC=CC=C1 A103957 [1,1,0,0,0,0|1,0,0]=3 808 B10R1.18 CC(=O)NC1=CC=CC=C1 A119548 [1,1,0,0,0,0|1,0,0]=3 809 B10R1.18 CC(=O)NC1=CC=CC=N1 A151788 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.18 CC(=O)NC1=CC=NC=C1 A151787 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.18 CC(=O)NC1=CN=CC=C1 A151789 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.18 CC(=O)OC1=CC=CC=C1 P108579 [1,1,0,0,0,0|0,0,0]=2 813 B10R1.18 CC(=O)OC1=CC=CC=C1 P342578 [1,1,0,0,0,0|0,0,0]=2 814 B10R1.18 CC(=O)OC1=CN=CC=C1 A151785 [1,1,0,0,0,0|1,0,0]=3 815 B10R1.18 CC(=O)SC1=CC=CC=C1 P101831 [1,1,0,0,0,0|0,1,0]=3 816 B10R1.18 CC(=S)NC1=CC=CC=C1 T161816 [1,1,0,0,0,0|1,1,0]=4 817 B10R1.18 CC(C)CC1=CC=CC=C1 I108918 [1,1,0,0,0,0|1,0,1]=4 818 B10R1.18 CC(C)CC1=CC=CC=C1 I108919 [1,1,0,0,0,0|1,0,1]=4 819 B10R1.18 CC(C)CC1=CC=CC=C1 I108920 [1,1,0,0,0,0|1,0,1]=4 820 B10R1.18 CC(C)OC1=CC=CC=C1 I183364 [1,1,0,0,0,0|1,0,1]=4 821 B10R1.18 CC(CC1=CC=CC=C1)Br B168545 [1,1,0,0,0,0|1,0,1]=4 822 B10R1.18 CC(CC1=CC=CC=C1)O P160708 [1,1,0,0,0,0|0,0,2]=4 823 B10R1.18 CN(C)CC1=CC=CC=C1 D110949 [1,1,0,0,0,0|1,0,1]=4 824 B10R1.18 CN(C)CC1=CC=CC=C1 D110950 [1,1,0,0,0,0|1,0,1]=4 825 B10R1.18 CS(=O)CC1=CC=CC=C1 M334699 [1,1,0,0,0,0|0,1,0]=3 826 B10R1.18 C[Si](C)CC1=CC=CC=C1 B305093 [1,1,0,0,0,0|1,0,1]=4 827 B10R1.16 CC1=CC=C(O1)CCC=O M157833 [0,1,0,0,1,0|2,0,0]=4 828 B10R1.66 C1=CN(C=C1)CCC(=O)O D304839 [0,1,0,0,1,0|2,0,0]=4 829 B10R1.66 C1=COC(=C1)CCC(=O)O F188394 [0,1,0,0,1,0|2,0,0]=4 830 B10R1.66 C1=COC(=C1)CNC(=O)N F339428 [0,1,0,0,1,0|2,0,0]=4 831 B10R1.66 C1=CSC(=C1)CCC(=O)O T472520 [0,1,0,0,1,0|2,0,0]=4 832 B10R1.66 CC(=O)OCC1=CC=CO1 F116599 [0,1,0,0,1,0|1,0,0]=3 833 B10R1.66 CC(=O)SCC1=CC=CO1 F103056 [0,1,0,0,1,0|1,1,0]=4 834 B12R1.1 C1=CC(=CC=C1CCN=C=O)F B301354 [0,2,0,0,0,0|1,0,1]=4 835 B12R1.16 C=CCC(C1=CC=C(C=C1)Cl)O C468752 [0,2,0,0,0,0|2,0,0]=4 836 B12R1.21 C1=CC(=CC=C1C#CC(=O)O)Br B405223 [0,2,0,0,0,0|1,0,1]=4 837 B12R1.21 C1=CC(=CC=C1C#CC(=O)O)Cl C404131 [0,2,0,0,0,0|1,0,1]=4 838 B12R1.21 C1=CC(=CC=C1C=CC(=O)Cl)F F102168 [0,2,0,0,0,0|1,0,1]=4 839 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)Br B104888 [0,2,0,0,0,0|1,0,1]=4 840 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)Cl C100659 [0,2,0,0,0,0|1,0,1]=4 841 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)F F101928 [0,2,0,0,0,0|1,0,1]=4 842 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)N A151768 [0,2,0,0,0,0|1,0,1]=4 843 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)O C108514 [0,2,0,0,0,0|1,0,1]=4 844 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)O C108515 [0,2,0,0,0,0|1,0,1]=4 845 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)O C304525 [0,2,0,0,0,0|1,0,1]=4 846 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)O C304526 [0,2,0,0,0,0|1,0,1]=4 847 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)O C304527 [0,2,0,0,0,0|1,0,1]=4 848 B12R1.21 C1=CC(=CC=C1C=CC(=O)O)O P424326 [0,2,0,0,0,0|1,0,1]=4 849 B12R1.21 C1=CC(=CC=C1CCC(=O)O)Br B123074 [0,2,0,0,0,0|1,0,0]=3 850 B12R1.21 C1=CC(=CC=C1CCC(=O)O)Cl C138442 [0,2,0,0,0,0|1,0,0]=3 851 B12R1.21 C1=CC(=CC=C1CCC(=O)O)F F156733 [0,2,0,0,0,0|1,0,0]=3 852 B12R1.21 C1=CC(=CC=C1CCC(=O)O)N A151460 [0,2,0,0,0,0|1,0,0]=3 853 B12R1.21 C1=CC(=CC=C1CCC(=O)O)O P106355 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.21 C1=CC(=CC=C1CCC(=O)O)O P424325 [0,2,0,0,0,0|1,0,0]=3 855 B12R1.21 C1=CC(=CC=C1N)OCC(=O)O A588272 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.21 C1=CC(=CC=C1N)SCC(=O)O A165606 [0,2,0,0,0,0|2,0,0]=4 857 B12R1.21 C1=CC(=CC=C1NCC(=O)O)F F169812 [0,2,0,0,0,0|2,0,0]=4 858 B12R1.21 C1=CC(=CC=C1OCC(=O)Cl)Cl C153889 [0,2,0,0,0,0|2,0,0]=4 859 B12R1.21 C1=CC(=CC=C1OCC(=O)O)Br B152378 [0,2,0,0,0,0|2,0,0]=4 860 B12R1.21 C1=CC(=CC=C1OCC(=O)O)Cl C102889 [0,2,0,0,0,0|2,0,0]=4 861 B12R1.21 C1=CC(=CC=C1OCC(=O)O)Cl C102890 [0,2,0,0,0,0|2,0,0]=4 862 B12R1.21 C1=CC(=CC=C1OCC(=O)O)F F170192 [0,2,0,0,0,0|2,0,0]=4 863 B12R1.21 C1=CC(=CC=C1OCC(=O)O)I I120189 [0,2,0,0,0,0|2,0,0]=4 864 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)O H169513 [0,2,0,0,0,0|1,0,1]=4 865 B12R1.21 CC(=O)CCC1=CC=C(C=C1)O H156889 [0,2,0,0,0,0|1,0,0]=3 866 B12R1.21 CC(=O)CSC1=CC=C(C=C1)Cl C169088 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)O M100698 [0,2,0,0,0,0|1,0,1]=4 868 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O P138270 [0,2,0,0,0,0|1,0,0]=3 869 B12R1.21 CC1=CC=C(C=C1)COC(=O)C M117867 [0,2,0,0,0,0|0,0,0]=2 870 B12R1.21 CC1=CC=C(C=C1)OCC(=O)O M158250 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.71 COC1=CC=C(C=C1)C=CC=O T135720 [0,2,0,0,0,0|1,0,1]=4 872 B12R1.71 COC1=CC=C(C=C1)CCC=O M122414 [0,2,0,0,0,0|1,0,0]=3 873 B12R1.71 COC1=CC=C(C=C1)CN=C=O M171017 [0,2,0,0,0,0|1,0,1]=4 874 B12R1.71 COC1=CC=C(C=C1)COC=O A302664 [0,2,0,0,0,0|0,0,0]=2 875 B12R1.30 C=CCOC(=O)C1=CC=CC=C1 A151101 [0,2,0,0,0,0|1,0,1]=4 876 B12R1.39 CC(CC=C)(C1=CC=CC=C1)O P133854 [0,2,0,0,0,0|2,0,0]=4 877 B12R1.107 C1=CC(=CN=C1)C(CC(=O)O)N A151148 [0,2,0,0,0,0|2,0,0]=4 878 B12R1.107 C1=CC=C(C=C1)C(CC(=O)O)N P113810 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.107 C1=CC=C(C=C1)C(CC(=O)O)N R160918 [0,2,0,0,0,0|1,0,0]=3 880 B12R1.107 C1=CC=C(C=C1)C(CC(=O)O)N S193296 [0,2,0,0,0,0|1,0,0]=3 881 B12R1.107 C1=CC=C(C=C1)C(CC(=O)O)O H157337 [0,2,0,0,0,0|1,0,0]=3 882 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 B103859 [0,2,0,0,0,0|1,0,1]=4 883 B12R1.107 CC(C1=CC=CC=C1)NC(=O)C D303544 [0,2,0,0,0,0|1,0,0]=3 884 B12R1.107 CC(C1=CC=CC=C1)OC(=O)C P195955 [0,2,0,0,0,0|0,0,0]=2 885 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 P133853 [0,2,0,0,0,0|1,0,0]=3 886 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 M192082 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.121 COC1=CC=CC=C1C=CC=O M414411 [0,2,0,0,0,0|1,0,1]=4 888 B12R1.125 C1=CC=C(C(=C1)C=CC(=O)Cl)Cl C300799 [0,2,0,0,0,0|1,0,1]=4 889 B12R1.125 C1=CC=C(C(=C1)C=CC(=O)O)Br B101936 [0,2,0,0,0,0|1,0,1]=4 890 B12R1.125 C1=CC=C(C(=C1)C=CC(=O)O)Cl C103595 [0,2,0,0,0,0|1,0,1]=4 891 B12R1.125 C1=CC=C(C(=C1)C=CC(=O)O)F F101930 [0,2,0,0,0,0|1,0,1]=4 892 B12R1.125 C1=CC=C(C(=C1)C=CC(=O)O)O H113425 [0,2,0,0,0,0|1,0,1]=4 893 B12R1.125 C1=CC=C(C(=C1)CCC(=O)O)Br B123075 [0,2,0,0,0,0|1,0,0]=3 894 B12R1.125 C1=CC=C(C(=C1)CCC(=O)O)Cl C138339 [0,2,0,0,0,0|1,0,0]=3 895 B12R1.125 C1=CC=C(C(=C1)CCC(=O)O)F W133245 [0,2,0,0,0,0|1,0,0]=3 896 B12R1.125 C1=CC=C(C(=C1)CCC(=O)O)I I469914 [0,2,0,0,0,0|1,0,0]=3 897 B12R1.125 C1=CC=C(C(=C1)CCC(=O)O)O H121639 [0,2,0,0,0,0|1,0,0]=3 898 B12R1.125 C1=CC=C(C(=C1)OCC(=O)O)Cl C115720 [0,2,0,0,0,0|2,0,0]=4 899 B12R1.125 CC1=CC=CC=C1C=CC(=O)O M158080 [0,2,0,0,0,0|1,0,1]=4 900 B12R1.125 CC1=CC=CC=C1CCC(=O)O M168695 [0,2,0,0,0,0|1,0,0]=3 901 B12R1.125 CC1=CC=CC=C1OCC(=O)O M168158 [0,2,0,0,0,0|2,0,0]=4 902 B12R1.267 C1=CC=C(C(=C1)CCN=C=O)F F300288 [0,2,0,0,0,0|1,0,1]=4 903 B12R1.226 C1=CC(=CC(=C1)Br)C=CC(=O)O B101938 [0,2,0,0,0,0|1,0,1]=4 904 B12R1.226 C1=CC(=CC(=C1)Br)C=CC(=O)O T162205 [0,2,0,0,0,0|1,0,1]=4 905 B12R1.226 C1=CC(=CC(=C1)Br)CCC(=O)O W135520 [0,2,0,0,0,0|1,0,0]=3 906 B12R1.226 C1=CC(=CC(=C1)Br)OCC(=O)O B587723 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.226 C1=CC(=CC(=C1)Cl)C=CC(=O)O C101735 [0,2,0,0,0,0|1,0,1]=4 908 B12R1.226 C1=CC(=CC(=C1)Cl)C=CC(=O)O C485689 [0,2,0,0,0,0|1,0,1]=4 909 B12R1.226 C1=CC(=CC(=C1)Cl)CCC(=O)O C132834 [0,2,0,0,0,0|1,0,0]=3 910 B12R1.226 C1=CC(=CC(=C1)Cl)OCC(=O)O C185405 [0,2,0,0,0,0|2,0,0]=4 911 B12R1.226 C1=CC(=CC(=C1)F)C=CC(=O)O F156726 [0,2,0,0,0,0|1,0,1]=4 912 B12R1.226 C1=CC(=CC(=C1)F)C=CC(=O)O I168436 [0,2,0,0,0,0|1,0,1]=4 913 B12R1.226 C1=CC(=CC(=C1)F)CCC(=O)O F138869 [0,2,0,0,0,0|1,0,0]=3 914 B12R1.226 C1=CC(=CC(=C1)N)C=CC(=O)O E405645 [0,2,0,0,0,0|1,0,1]=4 915 B12R1.226 C1=CC(=CC(=C1)N)CCC(=O)O A191401 [0,2,0,0,0,0|1,0,0]=3 916 B12R1.226 C1=CC(=CC(=C1)O)C=CC(=O)O H100569 [0,2,0,0,0,0|1,0,1]=4 917 B12R1.226 C1=CC(=CC(=C1)O)CCC(=O)O H194243 [0,2,0,0,0,0|1,0,0]=3 918 B12R1.226 C1=CC(=CC(=C1)O)CCC(=O)O H425147 [0,2,0,0,0,0|1,0,0]=3 919 B12R1.226 CC1=CC(=CC=C1)C=CC(=O)O M158083 [0,2,0,0,0,0|1,0,1]=4 920 B12R1.226 CC1=CC(=CC=C1)CCC(=O)O M470031 [0,2,0,0,0,0|1,0,0]=3 921 B12R1.226 CC1=CC(=CC=C1)OCC(=O)N M351510 [0,2,0,0,0,0|2,0,0]=4 922 B12R1.226 CC1=CC(=CC=C1)OCC(=O)O M132501 [0,2,0,0,0,0|2,0,0]=4 923 B12R1.382 COC1=CC=CC(=C1)CN=C=O M171043 [0,2,0,0,0,0|1,0,1]=4 924 B12R1.8 C1=CC=C(C=C1)C=CCOC=O C102138 [0,2,0,0,0,0|0,0,0]=2 925 B12R1.8 C1=CC=C(C=C1)CCCN=C=O B301366 [0,2,0,0,0,0|1,0,1]=4 926 B12R1.8 C1=CC=C(C=C1)COCCCBr B111397 [0,2,0,0,0,0|1,0,1]=4 927 B12R1.8 C1=CC=C(C=C1)COCCCBr B165144 [0,2,0,0,0,0|1,0,1]=4 928 B12R1.8 C1=CC=C(C=C1)COCCCO B151933 [0,2,0,0,0,0|0,0,2]=4 929 B12R1.27 C1=CC=C(C=C1)CNC(=O)CCl C169076 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.27 C1=CC=C(C=C1)COC(=O)CBr B104541 [0,2,0,0,0,0|0,0,0]=2 931 B12R1.27 C1=CC=C(C=C1)COC(=O)CCl B152737 [0,2,0,0,0,0|0,0,0]=2 932 B12R1.27 C1=CC=C(C=C1)COC(=O)CN G100449 [0,2,0,0,0,0|0,0,0]=2 933 B12R1.27 C1=CC=C(C=C1)COC(=O)CN G105480 [0,2,0,0,0,0|0,0,0]=2 934 B12R1.27 C1=CC=C(C=C1)COC(=O)CO B135438 [0,2,0,0,0,0|0,0,0]=2 935 B12R1.27 C1=CC=C(C=C1)COC(=O)NN B106008 [0,2,0,0,0,0|0,0,0]=2 936 B12R1.27 C1=CC=C(C=C1)COC(=O)NO N159551 [0,2,0,0,0,0|0,0,0]=2 937 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 B122888 [0,2,0,0,0,0|0,0,0]=2 938 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 B151902 [0,2,0,0,0,0|0,0,0]=2 939 B12R1.27 CCC(=O)OCC1=CC=CC=C1 B151869 [0,2,0,0,0,0|0,0,0]=2 940 B12R1.27 COC(=O)C#CC1=CC=CC=C1 M158709 [0,2,0,0,0,0|1,0,1]=4 941 B12R1.27 COC(=O)C=CC1=CC=CC=C1 M106187 [0,2,0,0,0,0|1,0,1]=4 942 B12R1.27 COC(=O)C=CC1=CC=CC=C1 M167947 [0,2,0,0,0,0|1,0,1]=4 943 B12R1.27 COC(=O)C=CC1=CC=CC=C1 M420410 [0,2,0,0,0,0|1,0,1]=4 944 B12R1.27 COC(=O)CCC1=CC=CC=C1 M103601 [0,2,0,0,0,0|1,0,0]=3 945 B12R1.27 COC(=O)CCC1=CC=CC=C1 M140616 [0,2,0,0,0,0|1,0,0]=3 946 B12R1.27 COC(=O)COC1=CC=CC=C1 M138460 [0,2,0,0,0,0|2,0,0]=4 947 B12R1.27 COC(=O)CSC1=CC=CC=C1 M101824 [0,2,0,0,0,0|2,0,0]=4 948 B12R1.32 CCOC(=O)CC1=CC=CC=C1 E103494 [0,2,0,0,0,0|1,0,1]=4 949 B12R1.32 CCOC(=O)CC1=CC=CC=C1 E103495 [0,2,0,0,0,0|1,0,1]=4 950 B12R1.252 C1=CC=C(C=C1)C=CCC(=O)O I168223 [0,2,0,0,0,0|1,0,1]=4 951 B12R1.252 C1=CC=C(C=C1)CCCC(=O)O P132032 [0,2,0,0,0,0|1,0,0]=3 952 B12R1.252 C1=CC=C(C=C1)CCCC(=O)O P422236 [0,2,0,0,0,0|1,0,0]=3 953 B12R1.252 C1=CC=C(C=C1)CCCC(=O)[O-] S305161 [0,2,0,0,0,0|1,0,0]=3 954 B12R1.252 C1=CC=C(C=C1)CNCC(=O)O B116988 [0,2,0,0,0,0|1,0,0]=3 955 B12R1.252 C1=CC=C(C=C1)CNCC(=O)O N131794 [0,2,0,0,0,0|1,0,0]=3 956 B12R1.252 C1=CC=C(C=C1)COCC(=O)Cl B113756 [0,2,0,0,0,0|0,0,0]=2 957 B12R1.252 C1=CC=C(C=C1)COCC(=O)O B124198 [0,2,0,0,0,0|0,0,0]=2 958 B12R1.252 C1=CC=C(C=C1)OCCC(=O)O P136846 [0,2,0,0,0,0|1,0,0]=3 959 B12R1.252 CC(=O)COCC1=CC=CC=C1 B168757 [0,2,0,0,0,0|0,0,0]=2 960 B12R1.252 CC(=O)NCCC1=CC=CC=C1 N159423 [0,2,0,0,0,0|1,0,0]=3 961 B12R1.252 CC(=O)OCCC1=CC=CC=C1 P160150 [0,2,0,0,0,0|0,0,0]=2 962 B12R1.252 CC(COCC1=CC=CC=C1)O B123078 [0,2,0,0,0,0|0,0,2]=4 963 B12R1.252 CC(COCC1=CC=CC=C1)O B123080 [0,2,0,0,0,0|0,0,2]=4 964 B12R1.43 C1=CC(=CN=C1)CC(C(=O)O)N H191553 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.43 C1=CC(=CN=C1)CC(C(=O)O)N P117036 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.43 C1=CC(=CN=C1)CC(C(=O)O)N P117038 [0,2,0,0,0,0|2,0,0]=4 967 B12R1.43 C1=CC(=CN=C1)CC(C(=O)O)N P137854 [0,2,0,0,0,0|2,0,0]=4 968 B12R1.43 C1=CC=C(C=C1)CC(=O)C(=O)O P107007 [0,2,0,0,0,0|1,0,0]=3 969 B12R1.43 C1=CC=C(C=C1)CC(=O)C(=O)O P421862 [0,2,0,0,0,0|1,0,0]=3 970 B12R1.43 C1=CC=C(C=C1)CC(C(=O)N)N H586335 [0,2,0,0,0,0|1,0,0]=3 971 B12R1.43 C1=CC=C(C=C1)CC(C(=O)N)N P105974 [0,2,0,0,0,0|1,0,0]=3 972 B12R1.43 C1=CC=C(C=C1)CC(C(=O)N)N S136991 [0,2,0,0,0,0|1,0,0]=3 973 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)Br B587562 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)N D425386 [0,2,0,0,0,0|1,0,0]=3 975 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)N L354493 [0,2,0,0,0,0|1,0,0]=3 976 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)N P103489 [0,2,0,0,0,0|1,0,0]=3 977 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)N P109094 [0,2,0,0,0,0|1,0,0]=3 978 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)N P110424 [0,2,0,0,0,0|1,0,0]=3 979 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)N P110425 [0,2,0,0,0,0|1,0,0]=3 980 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)O D425723 [0,2,0,0,0,0|1,0,0]=3 981 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)O P102441 [0,2,0,0,0,0|1,0,0]=3 982 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)O P102443 [0,2,0,0,0,0|1,0,0]=3 983 B12R1.43 C1=CC=C(C=C1)CC(C(=O)O)O P113801 [0,2,0,0,0,0|1,0,0]=3 984 B12R1.43 C1=CC=C(C=C1)NC(=O)C(=O)O A354609 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.43 C1=CC=NC(=C1)CC(C(=O)O)N A167909 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.43 C1=CC=NC(=C1)CC(C(=O)O)N P117035 [0,2,0,0,0,0|2,0,0]=4 987 B12R1.43 C1=CN=CC=C1CC(C(=O)O)N A107875 [0,2,0,0,0,0|2,0,0]=4 988 B12R1.43 C1=CN=CC=C1CC(C(=O)O)N A165279 [0,2,0,0,0,0|2,0,0]=4 989 B12R1.43 C1=CN=CC=C1CC(C(=O)O)N P160400 [0,2,0,0,0,0|2,0,0]=4 990 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O B152644 [0,2,0,0,0,0|1,0,0]=3 991 B12R1.43 CC(=CC1=CC=CC=C1)C(=O)O M102145 [0,2,0,0,0,0|1,0,1]=4 992 B12R1.43 CC(C(=O)Cl)OC1=CC=CC=C1 P160289 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.43 CC(C(=O)O)OC1=CC=CC=C1 P114961 [0,2,0,0,0,0|2,0,0]=4 994 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O M165389 [0,2,0,0,0,0|1,0,0]=3 995 B12R1.43 CC(CC1=CC=CC=N1)C(=O)O M586148 [0,2,0,0,0,0|2,0,0]=4 996 B12R1.891 C1=CC=C(C=C1)CCP(=O)(O)O P133714 [0,2,0,0,0,0|2,0,0]=4 997 B12R1.891 C[Si](C)(C)OCC1=CC=CC=C1 B346118 [0,2,0,0,0,0|1,1,0]=4 998 B10R1.172 C=CC1=CC(=CC=C1)C=O V168330 [0,0,1,1,0,0|1,0,1]=4 999 B10R2.6 C1C(N1)C2=CC=CC=C2 P357784 [1,0,0,1,0,0|1,0,1]=4 1000 B10R2.6 C1C(O1)C2=CC=CC=C2 I132554 [1,0,0,1,0,0|0,0,1]=3 1001 B10R2.6 C1C(O1)C2=CC=CC=C2 I133271 [1,0,0,1,0,0|0,0,1]=3 1002 B10R2.6 C1C(O1)C2=CC=CC=C2 I137101 [1,0,0,1,0,0|0,0,1]=3 1003 B10R2.6 C1C(O1)C2=CC=CC=C2 S106990 [1,0,0,1,0,0|0,0,1]=3 1004 B10R2.6 C1C(O1)C2=CC=CC=C2 S165282 [1,0,0,1,0,0|0,0,1]=3 1005 B10R2.6 C1CC1C2=CC=CC=C2 C300934 [1,0,0,1,0,0|1,0,1]=4 1006 B10R2.7 C1=CC2=CON=C2C=C1 A151655 [1,0,0,1,0,0|1,0,0]=3 1007 B10R2.7 C1=CC2=NON=C2C=C1 B135418 [1,0,0,1,0,0|2,0,0]=4 1008 B10R2.7 C1=CC=C2C(=C1)C=CN2 I104724 [1,0,0,1,0,0|1,0,1]=4 1009 B10R2.7 C1=CC=C2C(=C1)C=CN2 I104725 [1,0,0,1,0,0|1,0,1]=4 1010 B10R2.7 C1=CC=C2C(=C1)C=CN2 I104726 [1,0,0,1,0,0|1,0,1]=4 1011 B10R2.7 C1=CC=C2C(=C1)C=CN2 I104728 [1,0,0,1,0,0|1,0,1]=4 1012 B10R2.7 C1=CC=C2C(=C1)C=CN2 I420909 [1,0,0,1,0,0|1,0,1]=4 1013 B10R2.7 C1=CC=C2C(=C1)C=CO2 B107470 [1,0,0,1,0,0|1,0,0]=3 1014 B10R2.7 C1=CC=C2C(=C1)C=CS2 B107023 [1,0,0,1,0,0|0,1,1]=4 1015 B10R2.7 C1=CC=C2C(=C1)C=NN2 I157585 [1,0,0,1,0,0|2,0,0]=4 1016 B10R2.7 C1=CC=C2C(=C1)C=NO2 B151955 [1,0,0,1,0,0|2,0,0]=4 1017 B10R2.7 C1=CC=C2C(=C1)N=CO2 B152628 [1,0,0,1,0,0|1,0,0]=3 1018 B10R2.7 C1=CC=C2C(=C1)N=CS2 B104851 [1,0,0,1,0,0|1,1,0]=4 1019 B10R2.7 C1=CC=C2C(=C1)N=CS2 B104852 [1,0,0,1,0,0|1,1,0]=4 1020 B10R2.7 C1=CC=C2C(=C1)N=CS2 B104854 [1,0,0,1,0,0|1,1,0]=4 1021 B10R2.7 C1=CC=C2C(=C1)NC=N2 B106095 [1,0,0,1,0,0|2,0,0]=4 1022 B10R2.7 C1C2=CC=CC=C2CN1 I102308 [1,0,0,1,0,0|1,0,1]=4 1023 B10R2.7 C1C2=CC=CC=C2CN1 I123491 [1,0,0,1,0,0|1,0,1]=4 1024 B10R2.7 C1C=CC2=CC=CC=C21 I105567 [1,0,0,1,0,0|1,0,0]=3 1025 B10R2.7 C1C=CC2=CC=CC=C21 I105568 [1,0,0,1,0,0|1,0,0]=3 1026 B10R2.7 C1C=CC2=CC=CC=C21 I105569 [1,0,0,1,0,0|1,0,0]=3 1027 B10R2.7 C1CC2=CC=CC=C2C1 I105445 [1,0,0,1,0,0|1,0,1]=4 1028 B10R2.7 C1CNC2=CC=CC=C21 I103557 [1,0,0,1,0,0|1,0,1]=4 1029 B10R2.7 C1COC2=CC=CC=C21 D170588 [1,0,0,1,0,0|0,0,2]=4 1030 B10R2.7 C1OC2=CC=CC=C2O1 B101357 [1,0,0,1,0,0|0,0,2]=4 1031 B10R2.7 [B]1OC2=CC=CC=C2O1 C466137 [1,0,0,1,0,0|1,0,1]=4 1032 B10R2.320 C1C(C2=CC=CC=C21)Br W132718 [1,0,0,1,0,0|1,0,1]=4 1033 B12R2.24 C1=CC=C2C(=C1)C=CC(=O)N2 Q160822 [0,1,0,1,0,0|1,0,1]=4 1034 B12R2.24 C1=CC=C2C(=C1)C=CC(=O)O2 C104161 [0,1,0,1,0,0|1,0,1]=4 1035 B12R2.24 C1=CC=C2C(=C1)C=CC(=O)O2 C104165 [0,1,0,1,0,0|1,0,1]=4 1036 B12R2.24 C1=CC=C2C(=C1)C=CC(=O)O2 C104166 [0,1,0,1,0,0|1,0,1]=4 1037 B12R2.24 C1=CC=C2C(=C1)C=CC(=O)O2 C357823 [0,1,0,1,0,0|1,0,1]=4 1038 B12R2.24 C1=CC=C2C(=C1)C=CC(=O)O2 C426918 [0,1,0,1,0,0|1,0,1]=4 1039 B12R2.24 C1=CC=C2C(=C1)NC(=O)C=N2 Q102233 [0,1,0,1,0,0|2,0,0]=4 1040 B12R2.24 C1C(=O)NC2=CC=CC=C2O1 H157370 [0,1,0,1,0,0|2,0,0]=4 1041 B12R2.24 C1C(=O)NC2=CC=CC=C2S1 H157316 [0,1,0,1,0,0|2,0,0]=4 1042 B12R2.24 C1C2=CC=CC=C2COC1=O I138843 [0,1,0,1,0,0|0,0,0]=2 1043 B12R2.24 C1CC(=O)NC2=CC=CC=C21 D336131 [0,1,0,1,0,0|1,0,0]=3 1044 B12R2.24 C1CC(=O)OC2=CC=CC=C21 D107582 [0,1,0,1,0,0|1,0,0]=3 1045 B12R2.24 C1CC(=O)OC2=CC=CC=C21 D420880 [0,1,0,1,0,0|1,0,0]=3 1046 B12R2.24 C1CC2=CC=CC=C2CC1=O T107488 [0,1,0,1,0,0|1,0,0]=3 1047 B12R2.24 C1CN2C=CC=CC2=NC1=O D138970 [0,1,0,1,0,0|2,0,0]=4 1048 B12R2.132 B1(C2=C(CO1)C=CC(=C2)N)O A151641 [0,1,0,1,0,0|1,0,1]=4 1049 B12R2.132 B1(C2=C(CO1)C=CC(=C2)N)O A179798 [0,1,0,1,0,0|1,0,1]=4 1050 B12R2.132 C1=CC2=C(C=C1Cl)C(=O)NS2 C479077 [0,1,0,1,0,0|2,0,0]=4 1051 B12R2.132 C1C(=O)C2=C(O1)C=CC(=C2)Br B193858 [0,1,0,1,0,0|2,0,0]=4 1052 B12R2.132 C1C2=C(C=C(C=C2)Br)C(=O)N1 B177139 [0,1,0,1,0,0|1,0,0]=3 1053 B12R2.132 C1C2=C(C=C(C=C2)Br)C(=O)O1 B182454 [0,1,0,1,0,0|0,0,0]=2 1054 B12R2.132 C1C2=C(C=C(C=C2)Cl)C(=O)N1 C589550 [0,1,0,1,0,0|1,0,0]=3 1055 B12R2.132 C1C2=C(C=C(C=C2)F)C(=O)N1 F588786 [0,1,0,1,0,0|1,0,0]=3 1056 B12R2.132 C1C2=C(C=C(C=C2)F)C(=O)O1 F578892 [0,1,0,1,0,0|0,0,0]=2 1057 B12R2.132 C1C2=C(C=C(C=C2)N)C(=O)O1 A171047 [0,1,0,1,0,0|0,0,0]=2 1058 B12R2.132 C1CC(=O)C2=C1C=CC(=C2)Br B120499 [0,1,0,1,0,0|1,0,0]=3 1059 B12R2.132 C1CC(=O)C2=C1C=CC(=C2)Cl C119759 [0,1,0,1,0,0|1,0,0]=3 1060 B12R2.132 C1CC(=O)C2=C1C=CC(=C2)F F119757 [0,1,0,1,0,0|1,0,0]=3 1061 B12R2.132 C1CC(=O)C2=C1C=CC(=C2)N A479378 [0,1,0,1,0,0|1,0,0]=3 1062 B12R2.132 C1CC(=O)C2=C1C=CC(=C2)O H123324 [0,1,0,1,0,0|1,0,0]=3 1063 B12R2.132 C1CC(=O)C2=C1N=CC(=C2)Br B586551 [0,1,0,1,0,0|2,0,0]=4 1064 B12R2.132 CC1=CC2=C(CCC2=O)C=C1 M123330 [0,1,0,1,0,0|1,0,0]=3 1065 B12R2.2 C1=CC=C(C=C1)C2=CC=NO2 P160176 [0,1,0,1,0,0|1,0,1]=4 1066 B12R2.1081 C1=CC=C2C(=C1)C(=O)C=CN2 Q160821 [0,1,0,1,0,0|1,0,1]=4 1067 B12R2.1081 C1=CC=C2C(=C1)C(=O)C=CO2 C170570 [0,1,0,1,0,0|1,0,1]=4 1068 B12R2.1081 C1=CC=C2C(=C1)C(=O)NC=N2 H157172 [0,1,0,1,0,0|1,0,1]=4 1069 B12R2.1081 C1=CC=C2C(=C1)C(=O)NN=N2 D155481 [0,1,0,1,0,0|2,0,0]=4 1070 B12R2.1081 C1=CC=C2C(=C1)C(=O)O[Bi]O2 B107666 [0,1,0,1,0,0|1,0,0]=3 1071 B12R2.1081 C1=CC=C2C(=C1)C=CNC2=O I119399 [0,1,0,1,0,0|1,0,1]=4 1072 B12R2.1081 C1=CC=C2C(=C1)C=NNC2=O P138088 [0,1,0,1,0,0|1,0,1]=4 1073 B12R2.1081 C1CC2=C(C=CC=N2)C(=O)C1 T176711 [0,1,0,1,0,0|2,0,0]=4 1074 B12R2.1081 C1CC2=CC=CC=C2C(=O)C1 T106838 [0,1,0,1,0,0|1,0,0]=3 1075 B12R2.1081 C1CNC(=O)C2=CC=CC=C21 T172481 [0,1,0,1,0,0|1,0,0]=3 1076 B12R2.1081 C1CNC2=CC=CC=C2C1=O D303708 [0,1,0,1,0,0|1,0,0]=3 1077 B12R2.1081 C1CNC2=CC=CC=C2C1=O D589973 [0,1,0,1,0,0|1,0,0]=3 1078 B12R2.1081 C1COC(=O)C2=CC=CC=C21 I157658 [0,1,0,1,0,0|0,0,0]=2 1079 B12R2.1081 C1COC2=CC=CC=C2C1=O C115094 [0,1,0,1,0,0|1,0,0]=3 1080 B12R2.1081 C1CSC2=CC=CC=C2C1=O T169842 [0,1,0,1,0,0|1,0,0]=3 1081 B12R2.2028 C1=CC2=C(C(=O)OC2=O)N=C1 P119980 [0,1,0,1,0,0|1,0,1]=4 1082 B12R2.2028 C1=CC=C2C(=C1)C(=O)NC2=O P104066 [0,1,0,1,0,0|1,0,1]=4 1083 B12R2.2028 C1=CC=C2C(=C1)C(=O)NC2=O P104067 [0,1,0,1,0,0|1,0,1]=4 1084 B12R2.2028 C1=CC=C2C(=C1)C(=O)OC2=O P116466 [0,1,0,1,0,0|0,0,1]=3 1085 B12R2.2028 C1=CC=C2C(=C1)C(=O)OC2=O P116468 [0,1,0,1,0,0|0,0,1]=3 1086 B12R2.2028 C1=CC=C2C(=C1)C(=O)OI2Cl C589602 [0,1,0,1,0,0|1,0,0]=3 1087 B12R2.2028 C1=CC=C2C(=C1)C(=O)OI2O H586982 [0,1,0,1,0,0|1,0,0]=3 1088 B12R2.2028 C1=CC=C2C(=C1)C(=O)[N-]C2=O P106220 [0,1,0,1,0,0|1,0,1]=4 1089 B12R2.2028 C1=CC=C2C(=C1)C(=O)[N-]C2=O P141449 [0,1,0,1,0,0|1,0,1]=4 1090 B12R2.2028 C1=CC=C2C(=C1)C(OC2=O)Br B152853 [0,1,0,1,0,0|0,0,0]=2 1091 B12R2.2028 C1=CC=C2C(=C1)C(OC2=O)O H404581 [0,1,0,1,0,0|0,0,0]=2 1092 B12R2.2028 C1=CN=CC2=C1C(=O)OC2=O W135915 [0,1,0,1,0,0|1,0,1]=4 1093 B12R2.2028 C1C(=O)C2=CC=CC=C2C1=O I106831 [0,1,0,1,0,0|1,0,1]=4 1094 B12R2.2028 C1C(C2=CC=CC=C2C1=O)Br B184388 [0,1,0,1,0,0|1,0,0]=3 1095 B12R2.2028 CC1CC(=O)C2=CC=CC=C12 M123327 [0,1,0,1,0,0|1,0,0]=3 1096 B12R2.32 C1=CC=C2C(=C1)C=C(N2)C=O I124840 [0,1,0,1,0,0|1,0,1]=4 1097 B12R2.32 C1=CC=C2C(=C1)C=C(O2)C=O B469207 [0,1,0,1,0,0|1,0,1]=4 1098 B12R2.32 C1=CC=C2C(=C1)C=C(S2)C=O B123079 [0,1,0,1,0,0|1,0,1]=4 1099 B12R2.32 C1=CC=C2C(=C1)N=C(S2)C=O B134105 [0,1,0,1,0,0|2,0,0]=4 1100 B12R2.196 C1C2=C(C=CC=C2Br)C(=O)N1 B183819 [0,1,0,1,0,0|1,0,0]=3 1101 B12R2.196 C1C2=C(C=CC=C2N)C(=O)N1 A176282 [0,1,0,1,0,0|1,0,0]=3 1102 B12R2.196 C1C2=C(C=CC=C2N)C(=O)O1 A304090 [0,1,0,1,0,0|0,0,0]=2 1103 B12R2.196 C1CC(=O)C2=C1C(=CC=C2)Br B119745 [0,1,0,1,0,0|1,0,0]=3 1104 B12R2.196 C1CC(=O)C2=C1C(=CC=C2)F F119743 [0,1,0,1,0,0|1,0,0]=3 1105 B12R2.196 C1CC(=O)C2=C1C(=CC=C2)O H123323 [0,1,0,1,0,0|1,0,0]=3 1106 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 M123328 [0,1,0,1,0,0|1,0,0]=3 1107 B12R2.203 C1C2=C(C(=CC=C2)Br)C(=O)N1 B175484 [0,1,0,1,0,0|1,0,0]=3 1108 B12R2.203 C1C2=C(C(=CC=C2)N)C(=O)N1 A174905 [0,1,0,1,0,0|1,0,0]=3 1109 B12R2.203 C1CC(=O)C2=C1C=CC=C2Br B345896 [0,1,0,1,0,0|1,0,0]=3 1110 B12R2.203 C1CC(=O)C2=C1C=CC=C2Cl C183916 [0,1,0,1,0,0|1,0,0]=3 1111 B12R2.203 C1CC(=O)C2=C1C=CC=C2F F185819 [0,1,0,1,0,0|1,0,0]=3 1112 B12R2.203 C1CC(=O)C2=C1C=CC=C2O H139193 [0,1,0,1,0,0|1,0,0]=3 1113 B12R2.612 B1(C2=C(CO1)C=C(C=C2)F)O A125782 [0,1,0,1,0,0|1,0,1]=4 1114 B12R2.612 B1(C2=C(CO1)C=C(C=C2)F)O A422141 [0,1,0,1,0,0|1,0,1]=4 1115 B12R2.612 C1=CC2=C(C=C1F)NNC2=O D412511 [0,1,0,1,0,0|2,0,0]=4 1116 B12R2.612 C1C(=O)C2=C(O1)C=C(C=C2)F C356422 [0,1,0,1,0,0|2,0,0]=4 1117 B12R2.612 C1C(=O)C2=C(O1)C=C(C=C2)O H139103 [0,1,0,1,0,0|2,0,0]=4 1118 B12R2.612 C1C2=C(C=CC(=C2)Br)C(=O)N1 B138992 [0,1,0,1,0,0|1,0,0]=3 1119 B12R2.612 C1C2=C(C=CC(=C2)Br)C(=O)O1 B133970 [0,1,0,1,0,0|0,0,0]=2 1120 B12R2.612 C1C2=C(C=CC(=C2)Cl)C(=O)N1 C194866 [0,1,0,1,0,0|1,0,0]=3 1121 B12R2.612 C1C2=C(C=CC(=C2)Cl)C(=O)O1 C185101 [0,1,0,1,0,0|0,0,0]=2 1122 B12R2.612 C1C2=C(C=CC(=C2)F)C(=O)N1 F586841 [0,1,0,1,0,0|1,0,0]=3 1123 B12R2.612 C1C2=C(C=CC(=C2)F)C(=O)O1 F186112 [0,1,0,1,0,0|0,0,0]=2 1124 B12R2.612 C1C2=C(C=CC(=C2)N)C(=O)N1 A175776 [0,1,0,1,0,0|1,0,0]=3 1125 B12R2.612 C1C2=C(C=CC(=C2)N)C(=O)O1 A479320 [0,1,0,1,0,0|0,0,0]=2 1126 B12R2.612 C1C2=C(C=CC(=C2)O)C(=O)O1 H589460 [0,1,0,1,0,0|0,0,0]=2 1127 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)Br B103113 [0,1,0,1,0,0|1,0,0]=3 1128 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)Cl C107757 [0,1,0,1,0,0|1,0,0]=3 1129 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)F F123321 [0,1,0,1,0,0|1,0,0]=3 1130 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)I I342342 [0,1,0,1,0,0|1,0,0]=3 1131 B12R2.612 C1CC(=O)C2=C1C=C(C=C2)O H103118 [0,1,0,1,0,0|1,0,0]=3 1132 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 M123329 [0,1,0,1,0,0|1,0,0]=3 1133 B12R2.612 CC1=CC2=C(C=C1)C(=O)NO2 M194482 [0,1,0,1,0,0|2,0,0]=4 1134 B12R2.1 C1=CC=C2C(=C1)C(=CN2)C=O I106884 [0,1,0,1,0,0|1,0,1]=4 1135 B12R2.1 C1=CC=C2C(=C1)C(=CS2)C=O B152938 [0,1,0,1,0,0|1,0,1]=4 1136 B12R2.1 C1=CC=C2C(=C1)N=NN2C=O B301608 [0,1,0,1,0,0|2,0,0]=4 1137 B12R2.1 C1CC(=NO)C2=CC=CC=C21 I169661 [0,1,0,1,0,0|1,0,1]=4 1138 B12R2.18 C1=CC=C2C(=C1)C(=O)C(=O)N2 I104664 [0,1,0,1,0,0|2,0,0]=4 1139 B12R2.18 C1=CC=C2C(=C1)C(=O)C(=O)N2 I104665 [0,1,0,1,0,0|2,0,0]=4 1140 B12R2.18 C1=CC=C2C(=C1)C(=O)C(=O)N2 I426911 [0,1,0,1,0,0|2,0,0]=4 1141 B12R2.18 C1C2=CC=CC=C2C(=O)C1=O I119930 [0,1,0,1,0,0|1,0,0]=3 1142 B12R2.18 CC1CC2=CC=CC=C2C1=O M587676 [0,1,0,1,0,0|1,0,0]=3