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"created_at": "2022-09-04T14:36:33.850348Z",
"updated_at": "2022-09-04T14:36:33.850373Z",
"structure_string": "Y4 Mn4 O14\n1.0\n6.095601 -0.000000 3.519297\n2.031867 5.746988 3.519297\n-0.000000 -0.000000 7.038593\nY Mn O\n4 4 14\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.500000 0.500000 Y\n0.500000 0.000000 0.500000 Y\n0.500000 0.500000 0.000000 Y\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.078146 0.671854 0.078146 O\n0.671854 0.078146 0.671854 O\n0.671854 0.078146 0.078147 O\n0.625000 0.625000 0.625000 O\n0.921854 0.328146 0.328147 O\n0.328146 0.921854 0.328146 O\n0.328146 0.328146 0.921854 O\n0.921854 0.921854 0.328147 O\n0.921854 0.328146 0.921854 O\n0.078146 0.671854 0.671854 O\n0.328146 0.921854 0.921854 O\n0.375000 0.375000 0.375000 O\n0.671854 0.671854 0.078147 O\n0.078146 0.078146 0.671853 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Y",
"Mn",
"O"
],
"chemical_system": "Mn-O-Y",
"density": 5.383351475223675,
"density_atomic": 0.08922365411877291,
"volume": 246.5713853269672,
"volume_molar": 6.74948904466907,
"formula_full": "Y4 Mn4 O14",
"formula_reduced": "Y2Mn2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 3.1700899893416925,
"spacegroup": 227
}
]
}