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{
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"structure_string": "Mg4 Rh4 N8\n1.0\n5.879751 0.000000 0.000000\n0.000000 6.586661 0.000000\n0.000000 0.000000 5.342868\nMg Rh N\n4 4 8\ndirect\n0.593330 0.873482 0.996993 Mg\n0.406670 0.126518 0.496993 Mg\n0.906670 0.373482 0.496993 Mg\n0.093330 0.626518 0.996993 Mg\n0.582858 0.361241 0.008048 Rh\n0.417142 0.638759 0.508048 Rh\n0.917142 0.861241 0.508048 Rh\n0.082858 0.138759 0.008048 Rh\n0.572939 0.390118 0.369524 N\n0.427061 0.609882 0.869524 N\n0.927061 0.890118 0.869524 N\n0.072939 0.109882 0.369524 N\n0.600724 0.869259 0.395435 N\n0.399276 0.130741 0.895435 N\n0.899276 0.369259 0.895435 N\n0.100724 0.630741 0.395435 N\n",
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{
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{
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"structure_string": "Fe2 P8 O24\n1.0\n7.004779 -0.424015 2.746402\n-3.487485 6.650283 0.705108\n-0.196874 -0.372136 9.993286\nFe P O\n2 8 24\ndirect\n0.999999 0.000006 0.499992 Fe\n0.000010 0.500021 0.000005 Fe\n0.262489 0.262525 0.984542 P\n0.747290 0.247182 0.514890 P\n0.999010 0.668740 0.310979 P\n0.252689 0.752819 0.485118 P\n0.737516 0.737479 0.015459 P\n0.479843 0.309960 0.189062 P\n0.520172 0.690034 0.810930 P\n0.000978 0.331252 0.689033 P\n0.473148 0.456055 0.848866 O\n0.948322 0.338764 0.846266 O\n0.051674 0.661218 0.153746 O\n0.111654 0.333708 0.073303 O\n0.092837 0.815052 0.573672 O\n0.194600 0.677333 0.349558 O\n0.045747 0.163284 0.645797 O\n0.212596 0.547363 0.579635 O\n0.374003 0.208646 0.078960 O\n0.496818 0.904718 0.416720 O\n0.526864 0.543940 0.151129 O\n0.314928 0.204675 0.346029 O\n0.308635 0.691337 0.854032 O\n0.821314 0.913183 0.083696 O\n0.178679 0.086812 0.916315 O\n0.907154 0.184969 0.426312 O\n0.685089 0.795315 0.653963 O\n0.888364 0.666314 0.926692 O\n0.503167 0.095263 0.583285 O\n0.626007 0.791353 0.921035 O\n0.787380 0.452643 0.420379 O\n0.954257 0.836723 0.354187 O\n0.805379 0.322648 0.650452 O\n0.691387 0.308665 0.145956 O\n",
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"density": 11.663656875450496,
"density_atomic": 0.07625792515210635,
"volume": 209.8142582306812,
"volume_molar": 7.897068728250942,
"formula_full": "Sr2 Pt6 O8",
"formula_reduced": "SrPt3O4",
"formula_anonymous": "AB3C4",
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:36:19.161000Z",
"spacegroup": 223
},
{
"id": "mp-12965",
"created_at": "2022-09-04T14:43:43.507513Z",
"structure_string": "Er2 Ni8 B2\n1.0\n2.470716 -4.279405 0.000000\n2.470716 4.279405 0.000000\n0.000000 0.000000 6.945214\nEr Ni B\n2 8 2\ndirect\n0.000000 0.000000 0.500000 Er\n0.000000 0.000000 0.000000 Er\n0.333333 0.666667 0.000000 Ni\n0.666667 0.333333 0.000000 Ni\n0.500000 0.000000 0.291573 Ni\n0.500000 0.500000 0.291573 Ni\n0.000000 0.500000 0.291573 Ni\n0.500000 0.000000 0.708427 Ni\n0.500000 0.500000 0.708427 Ni\n0.000000 0.500000 0.708427 Ni\n0.666667 0.333333 0.500000 B\n0.333333 0.666667 0.500000 B\n",
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"formula_full": "Er2 Ni8 B2",
"formula_reduced": "ErNi4B",
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"updated_at": "2021-11-28T01:36:18.232000Z",
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}
]
}