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"created_at": "2022-09-04T14:37:32.079237Z",
"updated_at": "2022-09-04T14:37:32.079251Z",
"structure_string": "S8 Cl16\n1.0\n4.000067 0.000000 0.000000\n0.000000 9.089453 0.000000\n0.000000 0.000000 16.884043\nS Cl\n8 16\ndirect\n0.238756 0.301468 0.308193 S\n0.738757 0.198532 0.691807 S\n0.761244 0.801468 0.191807 S\n0.261244 0.698531 0.808192 S\n0.629576 0.288925 0.144196 S\n0.129576 0.211075 0.855804 S\n0.370424 0.788925 0.355804 S\n0.870425 0.711075 0.644196 S\n0.926939 0.368418 0.926388 Cl\n0.426939 0.131582 0.073611 Cl\n0.025412 0.521861 0.590543 Cl\n0.525412 0.978139 0.409457 Cl\n0.974589 0.021861 0.909457 Cl\n0.474589 0.478139 0.090543 Cl\n0.440440 0.502009 0.765641 Cl\n0.470574 0.706427 0.920463 Cl\n0.559560 0.002009 0.734359 Cl\n0.059560 0.497991 0.265641 Cl\n0.573062 0.631582 0.426389 Cl\n-0.029427 0.793573 0.079537 Cl\n0.529427 0.206427 0.579537 Cl\n0.029427 0.293573 0.420463 Cl\n0.940441 0.997991 0.234359 Cl\n0.073061 0.868417 0.573611 Cl\n",
"nsites": 24,
"nelements": 2,
"elements": [
"S",
"Cl"
],
"chemical_system": "Cl-S",
"density": 2.228294309992537,
"density_atomic": 0.039095770636740884,
"volume": 613.8771434638409,
"volume_molar": 15.40356069702485,
"formula_full": "S8 Cl16",
"formula_reduced": "SCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5837327116666668,
"spacegroup": 19
}
]
}