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{
"id": "mp-1030196",
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{
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{
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{
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"structure_string": "Mg4 Co4 N8\n1.0\n5.623730 0.000000 0.000000\n0.000000 6.399499 0.000000\n0.000000 0.000000 5.038392\nMg Co N\n4 4 8\ndirect\n0.598948 0.878456 0.993003 Mg\n0.401052 0.121544 0.493003 Mg\n0.901052 0.378456 0.493003 Mg\n0.098948 0.621544 0.993003 Mg\n0.578563 0.369113 0.004264 Co\n0.421437 0.630887 0.504264 Co\n0.921437 0.869113 0.504264 Co\n0.078563 0.130887 0.004264 Co\n0.554865 0.399484 0.357343 N\n0.445135 0.600516 0.857343 N\n0.945135 0.899484 0.857343 N\n0.054865 0.100516 0.357343 N\n0.607826 0.852630 0.415389 N\n0.392174 0.147370 0.915389 N\n0.892174 0.352630 0.915389 N\n0.107826 0.647370 0.415389 N\n",
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{
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"spacegroup": 191
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{
"id": "mp-1226313",
"created_at": "2022-09-04T14:43:22.742568Z",
"structure_string": "Cr1 Mo1 O3\n1.0\n3.027264 -2.568794 0.000000\n3.027264 2.568794 0.000000\n0.847507 0.000000 3.878758\nCr Mo O\n1 1 3\ndirect\n0.800402 0.800402 0.800402 Cr\n0.192028 0.192028 0.192028 Mo\n0.971394 0.721049 0.315127 O\n0.721049 0.315127 0.971394 O\n0.315127 0.971394 0.721049 O\n",
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{
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"created_at": "2022-09-04T14:43:22.742401Z",
"structure_string": "Tb1 Cd1 Au2\n1.0\n0.000000 3.504964 3.504964\n3.504964 0.000000 3.504964\n3.504964 3.504964 0.000000\nTb Cd Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.500000 Cd\n0.750000 0.750000 0.750000 Au\n0.250000 0.250000 0.250000 Au\n",
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{
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"structure_string": "Li4 Ti3 Co5 O16\n1.0\n2.902018 4.937116 0.000000\n-2.902018 4.937116 0.000000\n0.000000 0.059036 9.309858\nLi Ti Co O\n4 3 5 16\ndirect\n0.671100 0.671100 0.888427 Li\n0.987985 0.987985 0.994689 Li\n0.993914 0.993914 0.499110 Li\n0.337168 0.337168 0.395715 Li\n0.832908 0.339138 0.212011 Ti\n0.339138 0.832908 0.212011 Ti\n0.170483 0.170483 0.712701 Ti\n0.667174 0.667174 0.484777 Co\n0.826596 0.826596 0.214071 Co\n0.336319 0.336319 0.979143 Co\n0.661870 0.166971 0.708931 Co\n0.166971 0.661870 0.708931 Co\n0.828654 0.335882 0.602833 O\n0.524189 0.524189 0.345268 O\n0.665303 0.665303 0.097757 O\n0.995341 0.995341 0.310692 O\n0.994201 0.994201 0.807239 O\n0.335882 0.828654 0.602833 O\n0.958268 0.526540 0.346799 O\n0.526540 0.958268 0.346799 O\n0.170811 0.170811 0.100815 O\n0.833289 0.833289 0.608329 O\n0.484660 0.044923 0.843195 O\n0.044923 0.484660 0.843195 O\n0.337415 0.337415 0.601996 O\n0.664908 0.171593 0.102505 O\n0.479519 0.479519 0.833144 O\n0.171593 0.664908 0.102505 O\n",
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{
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"structure_string": "Ca2 Cu1 O3\n1.0\n-1.644905 1.916113 6.091885\n1.644905 -1.916113 6.091885\n1.644905 1.916113 -6.091885\nCa Cu O\n2 1 3\ndirect\n0.850846 0.350846 0.500000 Ca\n0.149154 0.649154 0.500000 Ca\n0.500000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 O\n0.339443 0.839443 0.500000 O\n0.660557 0.160557 0.500000 O\n",
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{
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"structure_string": "Mn6 Si2 W4\n1.0\n2.390454 -4.140388 0.000000\n2.390454 4.140388 0.000000\n0.000000 0.000000 7.732912\nMn Si W\n6 2 4\ndirect\n0.828405 0.171595 0.750000 Mn\n0.828405 0.656809 0.750000 Mn\n0.343191 0.171595 0.750000 Mn\n0.171595 0.828405 0.250000 Mn\n0.171595 0.343191 0.250000 Mn\n0.656809 0.828405 0.250000 Mn\n0.000000 0.000000 0.000000 Si\n0.000000 0.000000 0.500000 Si\n0.333333 0.666667 0.937127 W\n0.666667 0.333333 0.062873 W\n0.666667 0.333333 0.437127 W\n0.333333 0.666667 0.562873 W\n",
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{
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{
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"structure_string": "Cr4 In2 Pd4\n1.0\n7.266974 0.000000 0.000000\n0.000000 7.266974 0.000000\n0.000000 0.000000 3.280804\nCr In Pd\n4 2 4\ndirect\n0.659323 0.159323 0.500000 Cr\n0.340677 0.840677 0.500000 Cr\n0.159323 0.340677 0.500000 Cr\n0.840677 0.659323 0.500000 Cr\n0.500000 0.500000 0.000000 In\n0.000000 0.000000 0.000000 In\n0.137187 0.637187 0.000000 Pd\n0.862813 0.362813 0.000000 Pd\n0.637187 0.862813 0.000000 Pd\n0.362813 0.137187 0.000000 Pd\n",
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]
}