pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.69	AttenGpKa training set	0	-1	O=C(NO)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	O=C(N[O-])c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1,O=C([N-]O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	mol31451	O=C(NO)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1