[
  {
    "molid": "mol35100",
    "smiles": "C[C@]1(C(F)(F)F)C[C@](O)(C(F)(F)F)CC(O)(C(F)(F)F)O1",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "C[C@]1(C(F)(F)F)C[C@](O)(C(F)(F)F)C[C@@](O)(C(F)(F)F)O1",
        "std_free_energy": -4.722476959228516,
        "relative_population": 1.0
      },
      {
        "id": "-1_2",
        "charge": -1,
        "smiles": "C[C@]1(C(F)(F)F)C[C@](O)(C(F)(F)F)C[C@@]([O-])(C(F)(F)F)O1",
        "std_free_energy": -4.214824199676514,
        "relative_population": 0.9836411485840051
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 9.39999961853027,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "QSARToolbox"
      }
    ]
  }
]