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{
"id": "mp-1224837",
"created_at": "2022-09-04T14:43:47.018655Z",
"structure_string": "Ga2 Cu1 Ag1 Se4\n1.0\n-2.919732 2.919732 5.624299\n2.919732 -2.919732 5.624299\n2.919732 2.919732 -5.624299\nGa Cu Ag Se\n2 1 1 4\ndirect\n0.750000 0.250000 0.500000 Ga\n0.500000 0.500000 0.000000 Ga\n0.000000 0.000000 0.000000 Cu\n0.250000 0.750000 0.500000 Ag\n0.646128 0.618869 0.501498 Se\n0.117371 0.144630 0.498502 Se\n0.855370 0.353872 0.972740 Se\n0.381131 0.882629 0.027260 Se\n",
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{
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"elements": [
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{
"id": "mp-558838",
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"structure_string": "Ni1 Pt1 F6\n1.0\n4.823535 -2.529293 0.000000\n4.823535 2.529293 0.000000\n3.497262 0.000000 4.175281\nNi Pt F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Pt\n0.107947 0.744974 0.399304 F\n0.744974 0.399304 0.107947 F\n0.600696 0.892053 0.255026 F\n0.255026 0.600696 0.892053 F\n0.892053 0.255026 0.600696 F\n0.399304 0.107947 0.744974 F\n",
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{
"id": "mp-759539",
"created_at": "2022-09-04T14:43:47.054219Z",
"structure_string": "Li8 V4 F20\n1.0\n6.398683 0.000000 0.000000\n0.000000 7.619869 0.000000\n0.000000 0.000000 8.129872\nLi V F\n8 4 20\ndirect\n0.987042 0.588686 0.974782 Li\n0.789962 0.251153 0.282132 Li\n0.710038 0.748847 0.782132 Li\n0.512958 0.411314 0.474782 Li\n0.487042 0.911314 0.025218 Li\n0.289962 0.248847 0.717868 Li\n0.210038 0.751153 0.217868 Li\n0.012958 0.088686 0.525218 Li\n0.767496 0.753019 0.351734 V\n0.732504 0.246981 0.851734 V\n0.267496 0.746981 0.648266 V\n0.232504 0.253019 0.148266 V\n0.989934 0.232188 0.724925 F\n0.915586 0.747878 0.144580 F\n0.918415 0.252188 0.059738 F\n0.791043 0.003788 0.389811 F\n0.761238 0.500932 0.377526 F\n0.708957 0.996212 0.889811 F\n0.738762 0.499068 0.877526 F\n0.581585 0.747812 0.559738 F\n0.584414 0.252122 0.644580 F\n0.510066 0.767812 0.224925 F\n0.489934 0.267812 0.275075 F\n0.415586 0.752122 0.855420 F\n0.418415 0.247812 0.940262 F\n0.291043 0.496212 0.610189 F\n0.261238 0.999068 0.622474 F\n0.238762 0.000932 0.122474 F\n0.208957 0.503788 0.110189 F\n0.081585 0.752188 0.440262 F\n0.084414 0.247878 0.355420 F\n0.010066 0.732188 0.775075 F\n",
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{
"id": "mp-753905",
"created_at": "2022-09-04T14:43:54.324865Z",
"structure_string": "Tm4 Zr4 O14\n1.0\n0.000000 5.252907 5.252907\n5.252907 0.000000 5.252907\n5.252907 5.252907 0.000000\nTm Zr O\n4 4 14\ndirect\n0.625000 0.125000 0.125000 Tm\n0.125000 0.125000 0.125000 Tm\n0.125000 0.625000 0.125000 Tm\n0.125000 0.125000 0.625000 Tm\n0.625000 0.625000 0.125000 Zr\n0.625000 0.625000 0.625000 Zr\n0.625000 0.125000 0.625000 Zr\n0.125000 0.625000 0.625000 Zr\n0.718907 0.281093 0.281093 O\n0.718907 0.718907 0.281093 O\n0.281093 0.718907 0.281093 O\n0.000000 0.000000 0.000000 O\n0.718907 0.281093 0.718907 O\n0.968907 0.531093 0.531093 O\n0.281093 0.718907 0.718907 O\n0.531093 0.968907 0.531093 O\n0.250000 0.250000 0.250000 O\n0.968907 0.531093 0.968907 O\n0.531093 0.531093 0.968907 O\n0.968907 0.968907 0.531093 O\n0.531093 0.968907 0.968907 O\n0.281093 0.281093 0.718907 O\n",
"nsites": 22,
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"elements": [
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"spacegroup": 227
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{
"id": "mp-1200674",
"created_at": "2022-09-04T14:43:49.924637Z",
"structure_string": "Sr4 Te4 H8 O16\n1.0\n0.000000 -7.256890 0.000000\n-7.627358 0.000000 2.343109\n0.028793 0.000000 -8.403987\nSr Te H O\n4 4 8 16\ndirect\n0.861038 0.600757 0.837049 Sr\n0.361038 0.399243 0.662951 Sr\n0.138962 0.399243 0.162951 Sr\n0.638962 0.600757 0.337049 Sr\n0.672412 0.219152 0.993727 Te\n0.172412 0.780848 0.506273 Te\n0.327588 0.780848 0.006273 Te\n0.827588 0.219152 0.493727 Te\n0.942605 0.806291 0.204940 H\n0.442605 0.193709 0.295060 H\n0.057395 0.193709 0.795060 H\n0.557395 0.806291 0.704940 H\n0.914045 0.986240 0.161369 H\n0.414045 0.013760 0.338631 H\n0.085955 0.013760 0.838631 H\n0.585955 0.986240 0.661369 H\n0.802932 0.435261 0.050324 O\n0.302932 0.564739 0.449676 O\n0.197068 0.564739 0.949676 O\n0.697068 0.435261 0.550324 O\n0.477316 0.306117 0.148048 O\n0.977316 0.693883 0.351952 O\n0.522684 0.693883 0.851952 O\n0.022684 0.306117 0.648048 O\n0.572452 0.221490 0.786776 O\n0.072452 0.778510 0.713224 O\n0.427548 0.778510 0.213224 O\n0.927548 0.221490 0.286776 O\n0.912606 0.856049 0.112140 O\n0.412606 0.143951 0.387860 O\n0.087394 0.143951 0.887860 O\n0.587394 0.856049 0.612140 O\n",
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"H",
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],
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"formula_full": "Sr4 Te4 H8 O16",
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{
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"created_at": "2022-09-04T14:43:49.710202Z",
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{
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"structure_string": "Al2 As2\n1.0\n2.022765 -3.503531 0.000000\n2.022765 3.503531 0.000000\n0.000000 0.000000 6.649241\nAl As\n2 2\ndirect\n0.333333 0.666667 0.000760 Al\n0.666667 0.333333 0.500760 Al\n0.333333 0.666667 0.375240 As\n0.666667 0.333333 0.875240 As\n",
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{
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}