[
  {
    "molid": "mol32826",
    "smiles": "CNC1CC1(C)NC",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "CN[C@@H]1C[C@]1(C)NC",
        "std_free_energy": -3.0754494667053223,
        "relative_population": 1.0
      },
      {
        "id": "1_1",
        "charge": 1,
        "smiles": "CN[C@@]1(C)C[C@H]1[NH2+]C",
        "std_free_energy": -8.722855567932129,
        "relative_population": 0.508175598021116
      },
      {
        "id": "1_2",
        "charge": 1,
        "smiles": "CN[C@@H]1C[C@]1(C)[NH2+]C",
        "std_free_energy": -8.690150260925293,
        "relative_population": 0.49182440197888405
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 9.0500002,
        "charge_state_pre": 1,
        "charge_state_post": 0,
        "data_source": "OCHEM"
      }
    ]
  }
]