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"created_at": "2022-09-04T14:36:44.088921Z",
"updated_at": "2022-09-04T14:36:44.088948Z",
"structure_string": "H16 C20\n1.0\n7.112449 0.000000 -3.096578\n0.000000 5.850792 0.000000\n-0.080266 0.000000 7.941571\nH C\n16 20\ndirect\n0.475855 0.069372 0.840776 H\n0.345912 0.809954 0.380407 H\n0.654088 0.190046 0.619593 H\n0.654088 0.309954 0.119593 H\n0.978474 0.078067 0.830424 H\n0.021526 0.921932 0.169575 H\n0.021525 0.578067 0.669575 H\n0.978474 0.421933 0.330424 H\n0.345911 0.690046 0.880407 H\n0.720008 0.832333 0.907422 H\n0.720008 0.667666 0.407422 H\n0.279991 0.332333 0.592577 H\n0.475856 0.430627 0.340776 H\n0.524144 0.569372 0.659224 H\n0.524144 0.930627 0.159224 H\n0.279992 0.167666 0.092577 H\n0.962858 0.608423 0.011158 C\n0.740529 0.194301 0.229512 C\n0.259470 0.805699 0.770488 C\n0.921496 0.242790 0.846364 C\n0.078503 0.757210 0.153636 C\n0.078503 0.742790 0.653636 C\n0.921497 0.257210 0.346364 C\n0.037141 0.391577 0.988842 C\n0.962858 0.891576 0.511158 C\n0.667068 0.980094 0.251707 C\n0.224421 0.332721 0.110105 C\n0.775579 0.667279 0.889894 C\n0.775579 0.832721 0.389895 C\n0.224420 0.167279 0.610105 C\n0.332932 0.480094 0.248293 C\n0.667067 0.519906 0.751707 C\n0.740529 0.305699 0.729511 C\n0.332932 0.019906 0.748293 C\n0.037142 0.108423 0.488842 C\n0.259471 0.694301 0.270488 C\n",
"nsites": 36,
"nelements": 2,
"elements": [
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],
"chemical_system": "C-H",
"density": 1.2937258642830565,
"density_atomic": 0.10941516560956237,
"volume": 329.0220308989211,
"volume_molar": 5.503936064484368,
"formula_full": "H16 C20",
"formula_reduced": "H4C5",
"formula_anonymous": "A4B5",
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"spacegroup": 14
}
]
}