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"created_at": "2022-09-04T14:36:37.067100Z",
"updated_at": "2022-09-04T14:36:37.067131Z",
"structure_string": "Ba1 Y1 Cu1 Ag1 O5\n1.0\n3.987332 0.000000 0.000000\n0.000000 3.987332 0.000000\n-0.000000 0.000000 7.775524\nBa Y Cu Ag O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.016877 Ba\n0.000000 0.000000 0.544557 Y\n0.500000 0.500000 0.758202 Cu\n0.500000 0.500000 0.309443 Ag\n0.500000 0.000000 0.363665 O\n0.000000 0.500000 0.363665 O\n0.500000 0.000000 0.719890 O\n0.000000 0.500000 0.719890 O\n0.500000 0.500000 0.015858 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Ba",
"Y",
"Cu",
"Ag",
"O"
],
"chemical_system": "Ag-Ba-Cu-O-Y",
"density": 6.415920990048719,
"density_atomic": 0.07280279402290857,
"volume": 123.62162909802618,
"volume_molar": 8.271853904542505,
"formula_full": "Ba1 Y1 Cu1 Ag1 O5",
"formula_reduced": "BaYCuAgO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 1.631177403333333,
"spacegroup": 99
}
]
}