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"created_at": "2022-09-04T14:37:53.744554Z",
"updated_at": "2022-09-04T14:37:53.744574Z",
"structure_string": "Rb2 Sn2 I2 O12\n1.0\n2.686736 -4.653563 0.000000\n2.686736 4.653563 0.000000\n0.000000 -0.000000 12.460027\nRb Sn I O\n2 2 2 12\ndirect\n0.000000 0.000000 0.000000 Rb\n0.000000 0.000000 0.500000 Rb\n0.666668 0.333334 0.250000 Sn\n0.333334 0.666668 0.750000 Sn\n0.333334 0.666668 0.250000 I\n0.666668 0.333334 0.750000 I\n0.974893 0.369797 0.660766 O\n0.605097 0.630205 0.339234 O\n0.025109 0.630204 0.160766 O\n0.394904 0.025108 0.660766 O\n0.394905 0.369797 0.839234 O\n0.630204 0.025109 0.839234 O\n0.974893 0.605097 0.839234 O\n0.630205 0.605097 0.660766 O\n0.369797 0.394905 0.160766 O\n0.025108 0.394904 0.339234 O\n0.605097 0.974893 0.160766 O\n0.369797 0.974893 0.339234 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Rb",
"Sn",
"I",
"O"
],
"chemical_system": "I-O-Rb-Sn",
"density": 4.552263613357291,
"density_atomic": 0.05777140553323321,
"volume": 311.57282454631354,
"volume_molar": 10.42408559115935,
"formula_full": "Rb2 Sn2 I2 O12",
"formula_reduced": "RbSnIO6",
"formula_anonymous": "ABCD6",
"energy_above_hull": 1.666620997222222,
"spacegroup": 182
}
]
}