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"created_at": "2022-09-04T14:37:26.721310Z",
"updated_at": "2022-09-04T14:37:26.721481Z",
"structure_string": "Ru6 Cl18\n1.0\n5.966511 -0.000000 0.000000\n-2.983255 5.167149 0.000000\n0.000000 -0.000000 17.160256\nRu Cl\n6 18\ndirect\n0.558422 0.116844 0.166667 Ru\n0.883155 0.441578 0.500000 Ru\n0.558422 0.441578 0.833333 Ru\n0.224771 0.449542 0.166667 Ru\n0.550457 0.775229 0.500000 Ru\n0.224771 0.775229 0.833333 Ru\n0.545568 0.437344 0.088116 Cl\n0.891776 0.437344 0.245218 Cl\n0.562656 0.108224 0.421449 Cl\n0.237937 0.129319 0.245573 Cl\n0.216855 0.762700 0.578370 Cl\n0.870681 0.108617 0.578906 Cl\n0.562656 0.454432 0.578551 Cl\n0.237300 0.454157 0.911703 Cl\n0.891383 0.129319 0.087761 Cl\n0.545843 0.783144 0.245037 Cl\n0.237937 0.108617 0.754427 Cl\n0.216856 0.454157 0.421630 Cl\n0.870680 0.762063 0.421094 Cl\n0.545568 0.108224 0.911884 Cl\n0.891382 0.762063 0.912239 Cl\n0.545843 0.762700 0.754963 Cl\n0.891776 0.454432 0.754782 Cl\n0.237300 0.783144 0.088297 Cl\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Ru",
"Cl"
],
"chemical_system": "Cl-Ru",
"density": 3.9063812646334335,
"density_atomic": 0.04536449164963242,
"volume": 529.04814155885,
"volume_molar": 13.27500990534917,
"formula_full": "Ru6 Cl18",
"formula_reduced": "RuCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.057358175625,
"spacegroup": 151
}
]
}