[
  {
    "molid": "mol14111",
    "smiles": "C=C(C)C1=C(O)CC(C)CC1",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "C=C(C)C1=C(O)C[C@@H](C)CC1",
        "std_free_energy": -7.748836517333984,
        "relative_population": 1.0
      },
      {
        "id": "-1_1",
        "charge": -1,
        "smiles": "C=C(C)C1=C([O-])C[C@@H](C)CC1",
        "std_free_energy": 5.027408599853516,
        "relative_population": 1.0
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 11.95,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "Datawarrior"
      },
      {
        "pka_value": 11.9499998092651,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "QSARToolbox"
      }
    ]
  }
]