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"id": "mp-1206049",
"created_at": "2022-09-04T14:39:37.356897Z",
"structure_string": "Rb2 Sn1 F6\n1.0\n0.000000 0.000000 -5.060665\n-3.075976 -5.327746 0.000000\n-3.075976 5.327746 0.000000\nRb Sn F\n2 1 6\ndirect\n0.682773 0.666667 0.333333 Rb\n0.317227 0.333333 0.666667 Rb\n0.000000 0.000000 0.000000 Sn\n0.778907 0.156934 0.313868 F\n0.221093 0.843066 0.686132 F\n0.778907 0.156934 0.843066 F\n0.221093 0.843066 0.156934 F\n0.778907 0.686132 0.843066 F\n0.221093 0.313868 0.156934 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Sn",
"F"
],
"chemical_system": "F-Rb-Sn",
"density": 4.040870871566427,
"density_atomic": 0.05425983517124581,
"volume": 165.86854662561555,
"volume_molar": 11.098708171511998,
"formula_full": "Rb2 Sn1 F6",
"formula_reduced": "Rb2SnF6",
"formula_anonymous": "AB2C6",
"energy": -44.73812581999999,
"energy_per_atom": -4.9709028688888885,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -41.96612582,
"band_gap": 5.1882,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000684,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:30.499000Z",
"spacegroup": 164
}
]
}