pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.6	Datawarrior	0	-1	Cc1cc(Br)cc(Br)c1O	Cc1cc(Br)cc(Br)c1[O-]	mol12931	Cc1cc(Br)cc(Br)c1O
7.5999999	OCHEM	0	-1	Cc1cc(Br)cc(Br)c1O	Cc1cc(Br)cc(Br)c1[O-]	mol12931	Cc1cc(Br)cc(Br)c1O
7.59999990463257	QSARToolbox	0	-1	Cc1cc(Br)cc(Br)c1O	Cc1cc(Br)cc(Br)c1[O-]	mol12931	Cc1cc(Br)cc(Br)c1O
