pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.5	AttenGpKa training set	0	-1	CC(=O)/C(C)=C(/C)O	CC(=O)/C(C)=C(/C)[O-],[CH2-]/C(O)=C(\C)C(C)=O	mol31107	CC(=O)/C(C)=C(/C)O