pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.13	Datawarrior	0	-1	Brc1nnn[nH]1	Brc1nnn[n-]1	mol15834	Brc1nnn[nH]1
2.1300001	OCHEM	0	-1	Brc1nnn[nH]1	Brc1nnn[n-]1	mol15834	Brc1nnn[nH]1
-5.2	AttenGpKa training set	1	0	Brc1n[nH+]n[nH]1,Brc1[nH]nn[nH+]1,Brc1nn[nH+][nH]1	Brc1nnn[nH]1	mol15834	Brc1nnn[nH]1