pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.76	Datawarrior	1	0	ONc1cc[nH+]c2ccccc12	ONc1ccnc2ccccc12	mol12786	ONc1ccnc2ccccc12
6.7600002	OCHEM	1	0	ONc1cc[nH+]c2ccccc12	ONc1ccnc2ccccc12	mol12786	ONc1ccnc2ccccc12
6.71	AttenGpKa training set	1	0	ONc1cc[nH+]c2ccccc12	ONc1ccnc2ccccc12	mol12786	ONc1ccnc2ccccc12