pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.0	AttenGpKa training set	-2	-3	[O-]/N=C1\CCC/C(=N\[O-])C1=NO,[O-]N=C1/C(=N/[O-])CCC/C1=N\O	[O-]N=C1/C(=N/[O-])CCC/C1=N\[O-]	mol31577	ON=C1/C(=N/O)CCC/C1=N\O