[
  {
    "molid": "mol805",
    "smiles": "CCc1ccc(O)c2c(CC)c(C)oc12",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "CCc1ccc(O)c2c(CC)c(C)oc12",
        "std_free_energy": -6.144547462463379,
        "relative_population": 1.0
      },
      {
        "id": "-1_1",
        "charge": -1,
        "smiles": "CCc1ccc([O-])c2c(CC)c(C)oc12",
        "std_free_energy": -0.26969313621520996,
        "relative_population": 1.0
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 9.94,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "Hunt"
      }
    ]
  }
]