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"updated_at": "2022-09-04T14:36:20.039149Z",
"structure_string": "V6 O11 F1\n1.0\n4.586413 -0.051162 0.000000\n-0.051162 4.586413 -0.000000\n0.000000 -0.000000 8.670405\nV O F\n6 11 1\ndirect\n0.012574 0.987426 0.015371 V\n0.995954 0.004046 0.333333 V\n0.012574 0.987426 0.651295 V\n0.508304 0.491696 0.169053 V\n0.469738 0.530262 0.833333 V\n0.508304 0.491696 0.497614 V\n0.799757 0.200243 0.164941 O\n0.698473 0.702101 0.670747 O\n0.703035 0.700342 0.333333 O\n0.698473 0.702101 0.995920 O\n0.297899 0.301527 0.670747 O\n0.189695 0.810304 0.833333 O\n0.297899 0.301527 0.995920 O\n0.799757 0.200243 0.501726 O\n0.203842 0.796158 0.501235 O\n0.203842 0.796158 0.165433 O\n0.299658 0.296965 0.333333 O\n0.800222 0.199778 0.833333 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.558728015685382,
"density_atomic": 0.09870538505020568,
"volume": 182.3608710998336,
"volume_molar": 6.101126860441189,
"formula_full": "V6 O11 F1",
"formula_reduced": "V6O11F",
"formula_anonymous": "AB6C11",
"energy_above_hull": 3.5223474434722224,
"spacegroup": 38
}
]
}