pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.35	AttenGpKa training set	0	-1	CC(C)(C)c1ccc(C(=O)O)o1	CC(C)(C)c1ccc(C(=O)[O-])o1	mol25897	CC(C)(C)c1ccc(C(=O)O)o1
