[
  {
    "molid": "mol32923",
    "smiles": "CC(C)=CCN1CC[C@]2(C)c3cc(O)ccc3CC1C2C",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "CC(C)=CCN1CC[C@]2(C)c3cc(O)ccc3C[C@H]1[C@@H]2C",
        "std_free_energy": -3.014604330062866,
        "relative_population": 0.6904153464864113
      },
      {
        "id": "0_2",
        "charge": 0,
        "smiles": "CC(C)=CC[NH+]1CC[C@]2(C)c3cc([O-])ccc3C[C@H]1[C@@H]2C",
        "std_free_energy": -2.2125425338745117,
        "relative_population": 0.30958465351358877
      },
      {
        "id": "1_1",
        "charge": 1,
        "smiles": "CC(C)=CC[NH+]1CC[C@]2(C)c3cc(O)ccc3C[C@H]1[C@@H]2C",
        "std_free_energy": -9.653545379638672,
        "relative_population": 1.0
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 8.5,
        "charge_state_pre": 1,
        "charge_state_post": 0,
        "data_source": "OCHEM"
      }
    ]
  }
]