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            "structure_string": "Zr2 Mo4 O16\n1.0\n6.003316 0.000000 0.000000\n0.000000 7.436438 0.000000\n0.000000 0.000000 9.333980\nZr Mo O\n2 4 16\ndirect\n0.000000 0.737896 0.000697 Zr\n0.500000 0.262104 0.500697 Zr\n0.000000 0.576359 0.400325 Mo\n0.000000 0.045301 0.677438 Mo\n0.500000 0.954699 0.177438 Mo\n0.500000 0.423641 0.900325 Mo\n0.000000 0.846428 0.795526 O\n0.000000 0.221576 0.796772 O\n0.255856 0.554922 0.948687 O\n0.500000 0.221712 0.993720 O\n0.755856 0.445078 0.448687 O\n0.000000 0.778288 0.493720 O\n0.244144 0.445078 0.448687 O\n0.254877 0.082615 0.574295 O\n0.245123 0.917385 0.074295 O\n0.745123 0.082615 0.574295 O\n0.500000 0.778424 0.296772 O\n0.500000 0.153572 0.295526 O\n0.500000 0.380089 0.709956 O\n0.000000 0.619911 0.209956 O\n0.754877 0.917385 0.074295 O\n0.744144 0.554922 0.948687 O\n",
            "nsites": 22,
            "nelements": 3,
            "elements": [
                "Zr",
                "Mo",
                "O"
            ],
            "chemical_system": "Mo-O-Zr",
            "density": 3.2764435749667298,
            "density_atomic": 0.052795833337093666,
            "volume": 416.6995501242157,
            "volume_molar": 11.406469752166831,
            "formula_full": "Zr2 Mo4 O16",
            "formula_reduced": "Zr(MoO4)2",
            "formula_anonymous": "AB2C8",
            "energy": -193.88740737,
            "energy_per_atom": -8.813063971363636,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -170.08740737,
            "band_gap": 3.1318,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0006448,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:38:09.141000Z",
            "spacegroup": 31
        }
    ]
}