pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
13.725	AttenGpKa training set	-2	-3	O=C(CS(=O)(=O)[O-])CS(=O)(=O)[O-]	O=C([CH-]S(=O)(=O)[O-])[CH-]S(=O)(=O)O,O=C([CH-]S(=O)(=O)[O-])CS(=O)(=O)[O-]	mol26956	O=C(CS(=O)(=O)O)CS(=O)(=O)O
