Index	SMILES	Probability	Label
Compound_1	COc1ccc(cc1)C(c1ccc(cc1)OC)(C)C	0.94	1.0
Compound_2	O=C/C=C(\C=C/C(=O)O)/CO	0.55	1.0
Compound_3	OC(=O)/C=C\C(=C/C(=O)O)\C	0.34	0.0
Compound_4	OC(=O)C/C(=C\C(=O)O)/C(c1cc(O)c(c(c1)O)O)(C)C	0.53	1.0
Compound_5	COC/C=C\C(=C/C(=O)O)\C(c1ccc(cc1)OC(=O)O)(C)C	0.54	1.0
Compound_6	O=C/C=C(/C(/C(=C/C(=O)O)/CC(=O)O)(C)C)\C=C/C(=O)O	0.46	0.0
Compound_7	OC(=O)/C=C(/C(c1ccc(cc1)O)(C)C)\C=C/C(=O)O	0.65	1.0
Compound_8	O=CC/C(=C\C(=O)O)/C(c1ccc(cc1)O)(C)C	0.64	1.0
Compound_9	COc1ccc(cc1)C(c1ccc(c(c1)O)OC(O)O)(C)C	0.64	1.0
Compound_10	COc1ccc(cc1)C(/C(=C/C(=O)O)/C=C\C(=O)O)(C)C	0.6	1.0
Compound_11	OCOc1ccc(cc1O)C(c1ccc(c(c1)O)OC)(C)C	0.61	1.0
Compound_12	OCOc1ccc(cc1O)C(c1ccc(cc1)OC)(C)C	0.61	1.0
Compound_13	O=COc1ccc(cc1O)C(c1ccc(cc1)OC)(C)C	0.58	1.0
Compound_14	OCOc1ccc(cc1)C(c1ccc(cc1)OC)(C)C	0.71	1.0
Compound_15	COc1ccc(cc1)C(c1ccc(c(c1)O)OC)(C)C	0.85	1.0
Compound_16	Oc1ccc(cc1)S(=O)(=O)c1ccc(cc1)O	0.84	1.0
Compound_17	OC(=O)/C=C\C(=C/C(=O)O)\S(=O)(=O)O	0.45	0.0
Compound_18	OC(=O)/C=C(/S(=O)(=O)C1=CC(=O)C(=O)C=C1)\C=C/C(=O)O	0.46	0.0
Compound_19	C/C=C(/S(=O)(=O)c1ccc(cc1)O)\C(=O)O	0.44	0.0
Compound_20	OC(=O)C(CC(S(=O)(=O)c1ccc(c(c1)O)O)C)O	0.59	1.0
Compound_21	OCCCC(S(=O)(=O)c1ccc(c(c1)O)O)C(=O)O	0.47	0.0
Compound_22	O=C/C=C\C(=C)S(=O)(=O)c1ccc(cc1)O	0.5	0.0
Compound_23	O/C=C/C(=C\CC(=O)O)/S(=O)(=O)c1ccc(cc1)O	0.47	0.0
Compound_24	O=C/C=C(/S(=O)(=O)c1ccc(cc1)O)\C=O	0.52	1.0
Compound_25	Oc1ccc(cc1)S(=O)(=O)c1ccc(c(c1)O)O	0.78	1.0
Compound_26	Oc1ccc(cc1)Cc1ccc(cc1)O	0.96	1.0
Compound_27	C=C(Cc1ccc(cc1)O)/C=C\C(=O)O	0.58	1.0
Compound_28	C=C/C=C\C(=O)O	0.86	1.0
Compound_29	OC(=O)/C=C(\C(=O)O)/Cc1ccc(cc1)O	0.62	1.0
Compound_30	OCc1ccc(cc1)O	0.87	1.0
Compound_31	OC(=O)/C=C(/Cc1ccc(cc1)O)\C=C/C(=O)O	0.59	1.0
Compound_32	O=C/C=C(\C(=O)C=O)/CC1=CC(=O)C(=O)C=C1	0.52	1.0
Compound_33	O=C/C=C\C(=C/C(=O)O)\Cc1ccc(cc1)O	0.59	1.0
Compound_34	O=Cc1ccc(cc1)O	0.97	1.0
Compound_35	O/C=C/C=C(/Cc1ccc(cc1)O)\CC(=O)O	0.59	1.0
Compound_36	Oc1ccc(cc1)C(O)C	0.97	1.0
Compound_37	C/C=C\C(=C/C(=O)O)\CC1=CC(=O)C(=O)C=C1	0.43	0.0
Compound_38	C/C=C\C(=C/C=O)\CC1=CC(=O)C(=O)C=C1	0.47	0.0
Compound_39	CC(c1ccc(cc1)O)c1ccc(cc1)O	0.97	1.0
Compound_40	OC(=O)/C=C\C(=C/C(=O)O)\C(O)C	0.33	0.0
Compound_41	C=C/C=C\C(=O)O	0.86	1.0
Compound_42	OC/C=C(/Cc1ccc(cc1)O)\C=C/C=O	0.71	1.0
Compound_43	OC(=O)/C=C(/C(c1ccc(cc1)O)C)\C(=O)O	0.64	1.0
Compound_44	CC(=O)c1ccc(cc1)O	0.96	1.0
Compound_45	O=CC(c1ccc(cc1)O)/C(=C/C(=O)O)/C=C\C(=O)O	0.64	1.0
Compound_46	OC(=O)/C=C(/C(c1ccc(cc1)O)(O)C)\C=C/C(=O)O	0.65	1.0
Compound_47	O=C/C=C(/C(c1ccc(cc1)O)C=O)\C=O	0.73	1.0
Compound_48	OC(=O)/C=C(/C(c1ccc(cc1)O)C)\C=C(/C(=O)O)\O	0.67	1.0
Compound_49	Oc1ccc(cc1)C(O)C	0.97	1.0
Compound_50	OC(=O)/C=C(/C(c1ccc(cc1)O)C)\C=C/C(=O)O	0.64	1.0
Compound_51	O=CC(/C(=C/C)/C(=O)O)c1ccc(cc1)O	0.64	1.0
Compound_52	O=C/C=C(/C(c1ccc(cc1)O)C)\C=O	0.63	1.0
Compound_53	OC/C=C(/C(c1ccc(cc1)O)C)\C=C/C(=O)O	0.68	1.0
Compound_54	O=C/C=C(/C(c1ccc(cc1)O)C)\C(=O)O	0.64	1.0
Compound_55	Oc1ccc(cc1)C(c1cc(O)c(c(c1)O)O)C	0.94	1.0
Compound_56	O=C/C=C\C(=O)C(c1ccc(cc1)O)C	0.69	1.0
Compound_57	OC(c1ccc(c(c1)O)O)O	0.7	1.0
Compound_58	Oc1ccc(cc1)C(c1ccc(c(c1)O)O)C	0.99	1.0
Compound_59	CCC(c1ccc(cc1)O)(c1ccc(cc1)O)C	0.99	1.0
Compound_60	OC(=O)/C=C(/C(c1ccc(c(c1)O)O)(C)C)\C(=O)O	0.55	1.0
Compound_61	OC(=O)/C=C(/C(c1ccc(c(c1)O)O)(C(O)C)C)\C(=O)O	0.56	1.0
Compound_62	Oc1ccc(cc1)C(c1cc(O)c(c(c1)O)O)(C(O)C)C	0.81	1.0
Compound_63	OCC(c1ccc(cc1)O)(c1ccc(cc1)O)C	0.97	1.0
Compound_64	CCC(c1ccc(cc1)O)(/C(=C/C(=O)O)/C=C\C(=O)O)C	0.65	1.0
Compound_65	O=C/C=C(/C(C1=CC(=O)C(=O)C=C1)(C(=O)C)C)\C=O	0.46	0.0
Compound_66	Oc1ccc(cc1O)C(C)(C)C	0.92	1.0
Compound_67	CCC(c1cc(O)c(c(c1)O)O)(c1ccc(c(c1)O)O)C	0.75	1.0
Compound_68	CCC(/C(=C/C=O)/C(=O)O)(c1ccc(cc1)O)C	0.64	1.0
Compound_69	CCC(c1ccc(c(c1)O)O)(c1ccc(cc1)O)C	0.93	1.0
Compound_70	CC(c1ccc(cc1)O)(c1ccc(cc1)O)C	1.0	1.0
Compound_71	OCC(c1cc(O)c(c(c1)O)O)(O)C	0.44	0.0
Compound_72	Oc1ccc(cc1O)C(c1cc(O)c(c(c1)O)O)(C)C	0.8	1.0
Compound_73	Oc1ccc(cc1)C(c1ccc(c(c1)O)O)(O)C	0.9	1.0
Compound_74	Oc1ccc(cc1O)C(O)(C)C	0.87	1.0
Compound_75	OC(=O)/C=C(/C(c1ccc(c(c1)O)O)(C)C)\C=C/C(=O)O	0.55	1.0
Compound_76	OC(=O)/C=C(/C(c1ccc(cc1)O)(C)C)\C=C/C(=O)O	0.65	1.0
Compound_77	CC(c1ccc(c(c1)O)O)C	0.95	1.0
Compound_78	Oc1ccc(cc1)C(c1cc(O)c(c(c1)O)O)(O)C	0.87	1.0
Compound_79	Oc1ccc(cc1)C(=O)c1cc(O)c(c(c1)O)O	0.99	1.0
Compound_80	O=C/C=C(/C(c1ccc(cc1)O)(C)C)\C=C(/C(=O)O)\O	0.57	1.0
Compound_81	O/C=C/C(=C\CC(=O)O)/Cc1ccc(cc1)O	0.58	1.0
Compound_82	C=C/C(=C\C(C(=O)O)O)/Cc1ccc(cc1)O	0.63	1.0
Compound_83	Oc1ccc(cc1)C(=C)c1cc(O)c(c(c1)O)O	0.92	1.0
Compound_84	Oc1ccc(cc1)C(c1ccc(c(c1)O)O)(C)C	0.91	1.0