0 B11R1.509 CC(C)(C)Oc1ccccc1 34a_100000210340_100000210625 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.509 FC(F)(F)Oc1ccccc1 34a_100000210340_200103152311 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.509 FC(F)(F)Oc1ccccc1 7a_100000210340_200000243211 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,0,0,0,0,0|3,0,0]=4 5 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.891 CC(C)(O)COc1ccccc1 34a_100000210340_100000764493 [0,0,0,0,0,1|3,0,0]=4 11 B12R1.891 CC(C)(O)COc1ccccc1 7a_100000210340_100000764493 [0,0,0,0,0,1|3,0,0]=4 12 B12R1.891 O=S(=O)([O-])COc1ccccc1 34a_100000210340_100009817235 [0,0,0,0,0,1|1,0,2]=4 13 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [2,0,0,0,0,0|2,0,0]=4 14 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [2,0,0,0,0,0|2,0,0]=4 15 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [2,0,0,0,0,0|2,0,0]=4 16 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [2,0,0,0,0,0|2,0,0]=4 17 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [1,1,0,0,0,0|2,0,0]=4 18 B11R1.40 CC(CO)Oc1ccccc1 34a_100000210340_100012180447 [1,1,0,0,0,0|2,0,0]=4 19 B11R1.40 CC(CO)Oc1ccccc1 7a_100000210340_100012180447 [1,1,0,0,0,0|2,0,0]=4 20 B11R1.40 O=C(CO)Cc1ccccc1 1458a_100000210174_100015291786 [1,1,0,0,0,0|2,0,0]=4 21 B11R1.40 O=C(CO)Nc1ccccc1 22a_100000106764_100000210174 [1,1,0,0,0,0|2,0,0]=4 22 B11R1.40 O=C(CO)Nc1ccccc1 527a_100000106764_100000210174 [1,1,0,0,0,0|2,0,0]=4 23 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [1,1,0,0,0,0|2,0,0]=4 24 B11R1.157 CC(=O)Oc1cccc(c1)O 271570a_203496583355_100009811612 [1,1,0,0,0,0|2,0,0]=4 25 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [1,0,0,1,0,0|2,0,0]=4 26 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [1,0,0,0,1,0|2,0,0]=4 27 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [1,0,0,0,1,0|2,0,0]=4 28 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [1,0,0,0,0,1|2,0,0]=4 29 B11R1.91 CC(O)COc1ccccc1 34a_100000210340_100011218427 [1,0,0,0,0,1|2,0,0]=4 30 B11R1.91 CC(O)COc1ccccc1 7a_100000210340_100011218427 [1,0,0,0,0,1|2,0,0]=4 31 B11R1.91 C[C@@H](O)COc1ccccc1 34a_100000210340_100009817552 [1,0,0,0,0,1|2,0,0]=4 32 B11R1.91 C[C@@H](O)COc1ccccc1 7a_100000210340_100009817552 [1,0,0,0,0,1|2,0,0]=4 33 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [1,0,0,0,0,1|2,0,0]=4 34 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [1,0,0,0,0,1|2,0,0]=4 35 B11R1.91 O=C([O-])COc1ccccc1 34a_100000210340_100020667443 [1,0,0,0,0,1|1,0,1]=4 36 B11R1.91 O=[N+]([O-])COc1ccccc1 34a_100000210340_100000761209 [1,0,0,0,0,1|0,1,1]=4 37 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [1,0,0,0,0,1|2,0,0]=4 38 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [3,0,0,0,0,0|1,0,0]=4 39 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [3,0,0,0,0,0|1,0,0]=4 40 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [3,0,0,0,0,0|1,0,0]=4 41 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [3,0,0,0,0,0|1,0,0]=4 42 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [2,1,0,0,0,0|1,0,0]=4 43 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [2,1,0,0,0,0|1,0,0]=4 44 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [2,1,0,0,0,0|1,0,0]=4 45 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [2,1,0,0,0,0|1,0,0]=4 46 B10R1.13 OB(O)c1ccc(cc1)O 271570a_203496583355_100000754493 [1,1,0,0,1,0|1,0,0]=4 47 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [1,1,0,0,1,0|1,0,0]=4 48 B10R1.113 OB(O)c1cccc(c1)O 271570a_203496583355_100000687717 [1,1,0,0,1,0|1,0,0]=4 49 B12R1.27 COC(=O)COc1ccccc1 34a_100000210340_100000747449 [1,1,0,0,0,1|1,0,0]=4 50 B12R1.27 COC(=O)COc1ccccc1 7a_100000210340_100000747449 [1,1,0,0,0,1|1,0,0]=4 51 B12R1.27 OCC(O)COc1ccccc1 34a_100000210340_100011219619 [1,1,0,0,0,1|1,0,0]=4 52 B12R1.27 OCC(O)COc1ccccc1 7a_100000210340_100011219619 [1,1,0,0,0,1|1,0,0]=4 53 B12R1.27 OC[C@H](O)COc1ccccc1 34a_100000210340_100009815848 [1,1,0,0,0,1|1,0,0]=4 54 B12R1.27 OC[C@H](O)COc1ccccc1 7a_100000210340_100009815848 [1,1,0,0,0,1|1,0,0]=4 55 B12R1.32 COCC(=O)Oc1ccccc1 34a_100138415774_100009813826 [1,2,0,0,0,0|1,0,0]=4 56 B14R1.3634 COP(=O)(Cc1ccc(cc1)O)OC 271570a_203496583355_100009814062 [0,3,0,0,0,0|1,0,0]=4