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"created_at": "2022-09-04T14:38:44.125971Z",
"updated_at": "2022-09-04T14:38:44.126008Z",
"structure_string": "H8 C15 S2 O1\n1.0\n3.748039 -0.029212 0.031007\n0.018411 5.601699 0.423755\n0.019501 -0.183207 13.092749\nH C S O\n8 15 2 1\ndirect\n0.674022 0.123406 0.861556 H\n0.799461 0.956739 0.197040 H\n0.852866 0.206211 0.334838 H\n0.667414 0.882574 0.007313 H\n0.881981 0.153643 0.531827 H\n0.336120 0.857683 0.656960 H\n0.217196 0.826205 0.843146 H\n0.818578 0.159022 0.679838 H\n0.680619 0.305441 0.713460 C\n0.600342 0.283985 0.816395 C\n0.579992 0.509212 0.652165 C\n0.430085 0.469079 0.865095 C\n0.418333 0.697068 0.701672 C\n0.349805 0.679750 0.807272 C\n0.320264 0.404978 0.973215 C\n0.418580 0.541674 0.059174 C\n0.632964 0.502848 0.541623 C\n0.546744 0.613225 0.241221 C\n0.772773 0.312144 0.492346 C\n0.757551 0.339155 0.385359 C\n0.653994 0.801583 0.173889 C\n0.587014 0.759218 0.070534 C\n0.613959 0.554382 0.348953 C\n0.492493 0.722732 0.451006 S\n0.347568 0.389551 0.176802 S\n0.162292 0.209682 0.990858 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.6193354535087334,
"density_atomic": 0.09448305786209457,
"volume": 275.1816102094096,
"volume_molar": 6.373778427863529,
"formula_full": "H8 C15 S2 O1",
"formula_reduced": "H8C15S2O",
"formula_anonymous": "AB2C8D15",
"energy_above_hull": 5.773252826923076,
"spacegroup": 1
}
]
}