[
  {
    "molid": "mol32723",
    "smiles": "CC1=CCN2CCC(O)C12",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "CC1=CCN2CC[C@@H](O)[C@@H]12",
        "std_free_energy": -2.2634620666503906,
        "relative_population": 1.0
      },
      {
        "id": "1_2",
        "charge": 1,
        "smiles": "CC1=CC[NH+]2CC[C@@H](O)[C@@H]12",
        "std_free_energy": -9.311030387878418,
        "relative_population": 0.9997951685309995
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 9.6000004,
        "charge_state_pre": 1,
        "charge_state_post": 0,
        "data_source": "OCHEM"
      }
    ]
  }
]