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"updated_at": "2022-09-04T14:35:36.689252Z",
"structure_string": "Ca2 Fe2 Si4 O12\n1.0\n-0.000000 -0.000000 5.370000\n-4.709824 4.411000 1.333634\n-4.709824 -4.411000 1.333634\nCa Fe O Si\n2 2 12 4\ndirect\n0.250000 0.308200 0.691800 Ca\n0.750000 0.691800 0.308200 Ca\n0.250000 0.905800 0.094200 Fe\n0.750000 0.094200 0.905800 Fe\n0.865900 0.023500 0.198900 O\n0.634100 0.801100 0.976500 O\n0.134100 0.976500 0.801100 O\n0.365900 0.198900 0.023500 O\n0.679900 0.104600 0.622400 O\n0.820100 0.377600 0.895400 O\n0.320100 0.895400 0.377600 O\n0.179900 0.622400 0.104600 O\n0.012400 0.333400 0.373000 O\n0.487600 0.627000 0.666600 O\n0.987600 0.666600 0.627000 O\n0.512400 0.373000 0.333400 O\n0.776400 0.194000 0.382600 Si\n0.723600 0.617400 0.806000 Si\n0.223600 0.806000 0.617400 Si\n0.276400 0.382600 0.194000 Si\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Fe",
"O",
"Si"
],
"chemical_system": "Ca-Fe-O-Si",
"density": 3.6926915694634683,
"density_atomic": 0.0896363116922673,
"volume": 223.12386155136,
"volume_molar": 6.718416505885209,
"formula_full": "Ca2 Fe2 Si4 O12",
"formula_reduced": "CaFe(SiO3)2",
"formula_anonymous": "ABC2D6",
"mineral_name": "Esseneite",
"aflow_id": "ABC6D2_mC40_15_e_e_3f_f",
"pearson_symbol": "mC40",
"strukturbericht_symbol": "None",
"nsites_wyckoff": 6,
"spacegroup": 15
},
{
"id": 235,
"created_at": "2022-09-04T14:35:36.786942Z",
"updated_at": "2022-09-04T14:35:36.786959Z",
"structure_string": "B4 Pd10\n1.0\n-0.000000 4.955000 0.000000\n-0.000000 -0.000000 5.472000\n6.344893 -2.477500 -0.782802\nB Pd\n4 10\ndirect\n0.417000 0.077000 0.212000 B\n0.205000 0.423000 0.788000 B\n0.583000 0.923000 0.788000 B\n0.795000 0.577000 0.212000 B\n0.572700 0.250000 0.000000 Pd\n0.427300 0.750000 0.000000 Pd\n0.191000 0.421300 0.191600 Pd\n0.999400 0.078700 0.808400 Pd\n0.809000 0.578700 0.808400 Pd\n0.000600 0.921300 0.191600 Pd\n0.785300 0.313800 0.425400 Pd\n0.359900 0.186200 0.574600 Pd\n0.214700 0.686200 0.574600 Pd\n0.640100 0.813800 0.425400 Pd\n",
"nsites": 14,
"nelements": 2,
"elements": [
"B",
"Pd"
],
"chemical_system": "B-Pd",
"density": 10.689485977118283,
"density_atomic": 0.08137930669171355,
"volume": 172.03390602768002,
"volume_molar": 7.400088554223582,
"formula_full": "B4 Pd10",
"formula_reduced": "B2Pd5",
"formula_anonymous": "A2B5",
"mineral_name": null,
"aflow_id": "A2B5_mC28_15_f_e2f",
"pearson_symbol": "mC28",
"strukturbericht_symbol": "None",
"nsites_wyckoff": 4,
"spacegroup": 15
}
]
}