0 B36R5.1364411203 OC1=C(Oc2c(C1=O)c(O)cc3OC(=O)CC(c32)c4cc[n]cc4)c5cc(O)c(O)cc5 Amb22503147 [0,0,0,0,0,0|0,0,0]=0 1 B36R5.1364411203 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5c[n]ccc5 Amb22503427 [0,0,0,0,0,0|2,0,0]=2 2 B36R5.1364411203 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5ccccc5 Amb22503450 [0,0,0,0,0,0|1,0,0]=1 3 B35R5.251999923 Oc1cc(ccc1O)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5c[n]ccc5 Amb22407592 [1,0,0,0,0,0|2,0,0]=3 4 B35R5.251999923 Oc1cc(ccc1O)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5cc[n]cc5 Amb22407369 [1,0,0,0,0,0|0,0,0]=1 5 B35R5.251999923 Oc1ccc(cc1O)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5ccccc5 Amb22407634 [1,0,0,0,0,0|1,0,0]=2 6 B37R5.224920386 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5ccccc5Br Amb22503103 [0,1,0,0,0,0|1,0,0]=2 7 B37R5.224920386 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5ccccc5F Amb22503087 [0,1,0,0,0,0|1,0,0]=2 8 B37R5.353974713 OC1=C(Oc2c(C1=O)c(O)cc3OC(=O)CC(c32)c4ccc(F)cc4)c5cc(O)c(O)cc5 Amb22503300 [0,1,0,0,0,0|1,0,0]=2 9 B37R5.353974713 Oc1ccc(cc1)C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503436 [0,1,0,0,0,0|1,0,0]=2 10 B37R5.876632673 Oc1cc(ccc1)C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503510 [0,1,0,0,0,0|1,0,0]=2 11 B37R5.876632673 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5cc(Cl)ccc5 Amb22503168 [0,1,0,0,0,0|1,0,0]=2 12 B35R5.1140319045 OC1=C(Oc2c(C1=O)c(O)cc3OC(=O)CC(c32)c4c[s]cc4)c5cc(O)c(O)cc5 Amb22503426 [0,0,0,0,1,0|1,0,0]=2 13 B35R5.1140319045 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5ccc[s]5 Amb22503596 [0,0,0,0,1,0|1,0,0]=2 14 B35R5.1140319045 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5ccco5 Amb22503173 [0,0,0,0,1,0|1,0,0]=2 15 B34R5.116043024 Oc1ccc(cc1)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5c[n]ccc5 Amb22744015 [2,0,0,0,0,0|2,0,0]=4 16 B34R5.116043024 Oc1ccc(cc1)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5cc[n]cc5 Amb22744087 [2,0,0,0,0,0|0,0,0]=2 17 B34R5.116043024 Oc1ccc(cc1)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5ccccc5 Amb22743689 [2,0,0,0,0,0|1,0,0]=3 18 B36R5.385554831 Oc1cc(ccc1)C2CC(=O)Oc3cc(O)c4c(OC(=CC4=O)c5cc(O)c(O)cc5)c32 Amb22408270 [1,1,0,0,0,0|1,0,0]=3 19 B36R5.401734210 Oc1cc(ccc1O)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5ccccc5Br Amb22408012 [1,1,0,0,0,0|1,0,0]=3 20 B36R5.585217279 Oc1ccc(cc1)C2CC(=O)Oc3cc(O)c4c(OC(=CC4=O)c5cc(O)c(O)cc5)c32 Amb22407781 [1,1,0,0,0,0|1,0,0]=3 21 B36R5.695787597 COc1ccc(cc1O)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5c[n]ccc5 Amb22743736 [1,1,0,0,0,0|2,0,0]=4 22 B36R5.695787597 COc1ccc(cc1O)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5cc[n]cc5 Amb22743735 [1,1,0,0,0,0|0,0,0]=2 23 B36R5.695787597 COc1ccc(cc1O)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5ccccc5 Amb22743975 [1,1,0,0,0,0|1,0,0]=3 24 B36R5.198156719 C[n]1[n]ccc1C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503494 [0,1,0,0,1,0|1,0,0]=3 25 B36R5.361603040 C[n]1cc(c[n]1)C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503061 [0,1,0,0,1,0|1,0,0]=3 26 B36R5.361603040 Cc1ccc(o1)C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503180 [0,1,0,0,1,0|1,0,0]=3 27 B38R5.912071050 COc1ccccc1C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503329 [0,2,0,0,0,0|1,0,0]=3 28 B38R5.2043786359 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5cccc(Cl)c5F Amb22503411 [0,2,0,0,0,0|1,0,0]=3 29 B38R5.2100009745 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5ccc(Cl)cc5Cl Amb22503255 [0,2,0,0,0,0|1,0,0]=3 30 B38R5.2100009745 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5ccc(F)cc5Cl Amb22503079 [0,2,0,0,0,0|1,0,0]=3 31 B38R5.1094839028 COc1ccc(cc1)C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503591 [0,2,0,0,0,0|1,0,0]=3 32 B38R5.1094839028 CSc1ccc(cc1)C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503501 [0,2,0,0,0,0|1,0,0]=3 33 B38R5.2818910713 Cc1ccc(cc1C)C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503611 [0,2,0,0,0,0|1,0,0]=3 34 B38R5.2818910713 Oc1cc(ccc1O)C=2Oc3c(C(=O)C2O)c(O)cc4OC(=O)CC(c43)c5cc(Cl)c(O)cc5 Amb22503330 [0,2,0,0,0,0|1,0,0]=3 35 B38R5.1779522757 COc1cc(ccc1)C2CC(=O)Oc3cc(O)c4c(OC(c5cc(O)c(O)cc5)=C(O)C4=O)c32 Amb22503056 [0,2,0,0,0,0|1,0,0]=3 36 B34R5.440711594 Oc1cc(ccc1O)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5c[s]cc5 Amb22408584 [1,0,0,0,1,0|1,0,0]=3 37 B34R5.440711594 Oc1cc(ccc1O)C2=CC(=O)c3c(O2)c4C(CC(=O)Oc4cc3O)c5ccco5 Amb22407175 [1,0,0,0,1,0|1,0,0]=3