pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.11	AttenGpKa training set	1	0	Nc1[nH+]ccnc1CO,Nc1ncc[nH+]c1CO,Nc1nccnc1C[OH2+],[NH3+]c1nccnc1CO	Nc1nccnc1CO	mol25702	Nc1nccnc1CO