pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.06	AttenGpKa training set	0	-1	Cc1n[nH]cc1[N+](=O)[O-]	Cc1n[n-]cc1[N+](=O)[O-]	mol6909	Cc1n[nH]cc1[N+](=O)[O-]
-1.25	AttenGpKa training set	1	0	Cc1[nH+][nH]cc1[N+](=O)[O-]	Cc1n[nH]cc1[N+](=O)[O-]	mol6909	Cc1n[nH]cc1[N+](=O)[O-]