pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.17	OCHEM	1	0	CC1(C)[C@H]2CC[C@]1(C[NH3+])CC2	CC1(C)[C@H]2CC[C@]1(CN)CC2	mol33171	CC1(C)C2CCC1(CN)CC2
