pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.3	AttenGpKa training set	0	-1	O/N=C(\c1ccccc1)c1ccccc1O	[O-]c1ccccc1/C(=N/O)c1ccccc1,[O-]/N=C(\c1ccccc1)c1ccccc1O	mol31623	O/N=C(\c1ccccc1)c1ccccc1O