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{
"id": "jvasp-52134",
"created_at": "2022-09-04T14:37:18.409247Z",
"updated_at": "2022-09-04T14:37:18.409268Z",
"structure_string": "H4 O2\n1.0\n3.404757 0.000000 0.000000\n0.000000 3.404757 0.000000\n0.000000 0.000000 3.224045\nH O\n4 2\ndirect\n0.334963 0.334963 0.324818 H\n0.665038 0.665038 0.324818 H\n0.834964 0.165037 0.824818 H\n0.165037 0.834964 0.824818 H\n0.000000 0.000000 0.010362 O\n0.500000 0.500000 0.510361 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"H",
"O"
],
"chemical_system": "H-O",
"density": 1.6008357403841806,
"density_atomic": 0.16053802381473764,
"volume": 37.374323275114286,
"volume_molar": 3.7512239262080405,
"formula_full": "H4 O2",
"formula_reduced": "H2O",
"formula_anonymous": "AB2",
"energy_above_hull": 1.9091878333333328,
"spacegroup": 102
}
]
}