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"created_at": "2022-09-04T14:38:29.370169Z",
"updated_at": "2022-09-04T14:38:29.370184Z",
"structure_string": "Sm6 Sb10 O24\n1.0\n8.963803 0.000000 -3.169183\n-4.481902 7.762881 -3.169183\n-0.000000 -0.000000 9.507549\nSm Sb O\n6 10 24\ndirect\n0.500000 0.250000 0.750000 Sm\n0.500000 0.750000 0.250000 Sm\n0.250000 0.750000 0.500000 Sm\n0.750000 0.500000 0.250000 Sm\n0.250000 0.500000 0.750000 Sm\n0.750000 0.250000 0.500000 Sm\n0.278988 0.278988 0.000000 Sb\n0.721012 0.721012 0.000000 Sb\n0.000000 0.721012 0.721012 Sb\n0.000000 0.278988 0.278988 Sb\n0.721012 0.000000 0.721012 Sb\n0.486673 0.486673 0.486673 Sb\n0.513327 -0.000000 0.000000 Sb\n0.000000 0.513327 0.000000 Sb\n0.000000 0.000000 0.513327 Sb\n0.278988 0.000000 0.278988 Sb\n0.508412 0.708494 0.000000 O\n0.708494 0.508412 0.000000 O\n0.000000 0.708494 0.508412 O\n0.000000 0.508412 0.708494 O\n0.276647 0.800739 0.800740 O\n0.508412 0.000000 0.708494 O\n0.524092 0.524092 0.723353 O\n0.524092 0.723353 0.524092 O\n0.199260 0.000000 0.475908 O\n0.199260 0.475908 0.000000 O\n0.000000 0.199260 0.475908 O\n0.000000 0.475908 0.199261 O\n0.475908 0.199260 0.000000 O\n0.291506 0.799917 0.291506 O\n0.800739 0.800739 0.276648 O\n0.475908 0.000000 0.199261 O\n0.723352 0.524092 0.524092 O\n0.799916 0.291506 0.291506 O\n0.491588 0.491588 0.200084 O\n0.491588 0.200083 0.491588 O\n0.708494 0.000000 0.508412 O\n0.200083 0.491588 0.491588 O\n0.800739 0.276647 0.800740 O\n0.291506 0.291506 0.799917 O\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Sm",
"Sb",
"O"
],
"chemical_system": "O-Sb-Sm",
"density": 6.284279493865934,
"density_atomic": 0.06046111985230539,
"volume": 661.5821886480456,
"volume_molar": 9.960352660868514,
"formula_full": "Sm6 Sb10 O24",
"formula_reduced": "Sm3Sb5O12",
"formula_anonymous": "A3B5C12",
"energy_above_hull": 2.50867295625,
"spacegroup": 217
}
]
}