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"created_at": "2022-09-04T14:38:31.060222Z",
"updated_at": "2022-09-04T14:38:31.060245Z",
"structure_string": "Na2 Sr6 Ta2 O12\n1.0\n6.874179 -0.003676 -0.149777\n-0.152995 6.872477 -0.149777\n-0.003597 -0.003676 6.875809\nNa Sr Ta O\n2 6 2 12\ndirect\n0.250000 0.250000 0.250000 Na\n0.749999 0.749999 0.749999 Na\n0.249999 0.898732 0.601267 Sr\n0.601267 0.249999 0.898732 Sr\n0.898732 0.601267 0.249999 Sr\n0.750000 0.101267 0.398732 Sr\n0.398732 0.750000 0.101267 Sr\n0.101267 0.398732 0.750000 Sr\n0.499999 0.500000 0.500000 Ta\n0.000000 0.000000 0.000000 Ta\n0.426048 0.220614 0.554046 O\n0.720613 0.926048 0.054045 O\n0.945954 0.279385 0.073951 O\n0.073951 0.945954 0.279385 O\n0.279385 0.073951 0.945954 O\n0.779385 0.445953 0.573951 O\n0.573951 0.779386 0.445953 O\n0.445953 0.573951 0.779385 O\n0.054045 0.720614 0.926048 O\n0.926048 0.054045 0.720614 O\n0.554046 0.426048 0.220614 O\n0.220613 0.554046 0.426048 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Na",
"Sr",
"Ta",
"O"
],
"chemical_system": "Na-O-Sr-Ta",
"density": 5.754213214957167,
"density_atomic": 0.06772983865023954,
"volume": 324.81990860201455,
"volume_molar": 8.891414596598484,
"formula_full": "Na2 Sr6 Ta2 O12",
"formula_reduced": "NaSr3TaO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.7887580118181818,
"spacegroup": 167
}
]
}