pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.35	AttenGpKa training set	0	-1	CC(O)(O)Oc1ccc([N+](=O)[O-])cc1	CC([O-])(O)Oc1ccc([N+](=O)[O-])cc1	mol31216	CC(O)(O)Oc1ccc([N+](=O)[O-])cc1