pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.16	Datawarrior	1	0	Cc1cc(-c2[nH]cc[nH+]2)n[nH]1,Cc1cc(-c2ncc[nH]2)[nH+][nH]1	Cc1cc(-c2ncc[nH]2)n[nH]1	mol13982	Cc1cc(-c2ncc[nH]2)n[nH]1
6.1599998	OCHEM	1	0	Cc1cc(-c2[nH]cc[nH+]2)n[nH]1,Cc1cc(-c2ncc[nH]2)[nH+][nH]1	Cc1cc(-c2ncc[nH]2)n[nH]1	mol13982	Cc1cc(-c2ncc[nH]2)n[nH]1
1.5	Datawarrior	2	1	Cc1cc(-c2[nH]cc[nH+]2)[nH+][nH]1	Cc1cc(-c2[nH]cc[nH+]2)n[nH]1,Cc1cc(-c2ncc[nH]2)[nH+][nH]1	mol13982	Cc1cc(-c2ncc[nH]2)n[nH]1