pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.43	AttenGpKa training set	1	0	C[n+]1ccc(S)cc1	C[n+]1ccc([S-])cc1	mol25056	C[n+]1ccc(S)cc1