[
  {
    "molid": "mol37319",
    "smiles": "O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1OP(=O)(O)O",
    "microspecies": [
      {
        "id": "-4_4",
        "charge": -4,
        "smiles": "O=P([O-])([O-])O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O)[C@H](OP(=O)([O-])O)[C@H]1OP(=O)([O-])O",
        "std_free_energy": -13.693502426147461,
        "relative_population": 0.3060261676063039
      },
      {
        "id": "-4_7",
        "charge": -4,
        "smiles": "O=P([O-])([O-])O[C@H]1[C@H](OP(=O)([O-])[O-])[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1OP(=O)(O)O",
        "std_free_energy": -13.382176399230957,
        "relative_population": 0.2241565264086424
      },
      {
        "id": "-4_11",
        "charge": -4,
        "smiles": "O=P([O-])([O-])O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O)[C@H](OP(=O)([O-])[O-])[C@H]1OP(=O)(O)O",
        "std_free_energy": -12.830806732177734,
        "relative_population": 0.12915005163907275
      },
      {
        "id": "-4_19",
        "charge": -4,
        "smiles": "O=P([O-])([O-])O[C@H]1[C@H](OP(=O)([O-])O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1OP(=O)([O-])O",
        "std_free_energy": -13.80073070526123,
        "relative_population": 0.3406647624705807
      },
      {
        "id": "-3_7",
        "charge": -3,
        "smiles": "O=P([O-])(O)O[C@H]1[C@H](OP(=O)([O-])O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1OP(=O)([O-])O",
        "std_free_energy": -13.436525344848633,
        "relative_population": 0.3921087701086484
      },
      {
        "id": "-3_14",
        "charge": -3,
        "smiles": "O=P([O-])([O-])O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O)[C@H](OP(=O)(O)O)[C@H]1OP(=O)([O-])O",
        "std_free_energy": -12.733182907104492,
        "relative_population": 0.19406571490413385
      },
      {
        "id": "-3_17",
        "charge": -3,
        "smiles": "O=P([O-])([O-])O[C@H]1[C@H](OP(=O)([O-])O)[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1OP(=O)(O)O",
        "std_free_energy": -12.862726211547852,
        "relative_population": 0.2209066342438725
      },
      {
        "id": "-3_19",
        "charge": -3,
        "smiles": "O=P([O-])([O-])O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O)[C@H](OP(=O)([O-])O)[C@H]1OP(=O)(O)O",
        "std_free_energy": -12.727239608764648,
        "relative_population": 0.19291574515458534
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 5.55999994277954,
        "charge_state_pre": -3,
        "charge_state_post": -4,
        "data_source": "QSARToolbox"
      }
    ]
  }
]