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"created_at": "2022-09-04T14:36:18.610506Z",
"updated_at": "2022-09-04T14:36:18.610536Z",
"structure_string": "Na8 W4 O8 F16\n1.0\n5.037946 0.000000 0.000000\n0.000000 5.431786 0.000000\n0.000000 0.000000 18.480619\nNa W O F\n8 4 8 16\ndirect\n0.000000 0.750001 0.228297 Na\n0.500000 0.250000 0.271703 Na\n0.000000 0.250000 0.771703 Na\n0.500000 0.750001 0.728297 Na\n0.000000 0.750001 0.552372 Na\n0.500000 0.250000 0.947628 Na\n0.000000 0.250000 0.447628 Na\n0.500000 0.750001 0.052372 Na\n0.000000 0.750001 0.893349 W\n0.500000 0.250000 0.606651 W\n0.000000 0.250000 0.106651 W\n0.500000 0.750001 0.393349 W\n0.770661 0.385623 0.047091 O\n0.270661 0.614378 0.452909 O\n0.229340 0.114377 0.047091 O\n0.729340 0.885624 0.452909 O\n0.729340 0.385623 0.547091 O\n0.270661 0.114377 0.547091 O\n0.770661 0.885624 0.952909 O\n0.229340 0.614378 0.952909 O\n0.703490 0.895920 0.306160 F\n0.203489 0.104080 0.193840 F\n0.203489 0.604081 0.806160 F\n0.703490 0.395920 0.693840 F\n0.296511 0.104080 0.693840 F\n0.796512 0.895920 0.806160 F\n0.712286 0.456236 0.374051 F\n0.787715 0.956236 0.125949 F\n0.287715 0.043765 0.374051 F\n0.287715 0.543765 0.625949 F\n0.787715 0.456236 0.874051 F\n0.212285 0.043765 0.874051 F\n0.712286 0.956236 0.625949 F\n0.296511 0.604081 0.306160 F\n0.212285 0.543765 0.125949 F\n0.796512 0.395920 0.193840 F\n",
"nsites": 36,
"nelements": 4,
"elements": [
"Na",
"W",
"O",
"F"
],
"chemical_system": "F-Na-O-W",
"density": 4.436816077117411,
"density_atomic": 0.07118521935019517,
"volume": 505.72296227533224,
"volume_molar": 8.459819067739502,
"formula_full": "Na8 W4 O8 F16",
"formula_reduced": "Na2W(OF2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 1.1010440144444442,
"spacegroup": 60
}
]
}