pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
-3.13	AttenGpKa training set	2	1	O=S(=O)(O)c1ccc(/[NH+]=[NH+]/c2ccccc2)cc1	O=S(=O)([O-])c1ccc(/[NH+]=[NH+]/c2ccccc2)cc1	mol24896	O=S(=O)(O)c1ccc(/N=N/c2ccccc2)cc1