pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.12	AttenGpKa training set	0	-1	CC(C)(C)[C@]1(O)NS(=O)(=O)c2ccccc21	CC(C)(C)[C@]1([O-])NS(=O)(=O)c2ccccc21,CC(C)(C)[C@]1(O)[N-]S(=O)(=O)c2ccccc21	mol28434	CC(C)(C)C1(O)NS(=O)(=O)c2ccccc21