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{
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{
"id": "mp-1097226",
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{
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},
{
"id": "mp-1217131",
"created_at": "2022-09-04T14:46:11.416833Z",
"structure_string": "U2 B9 O22\n1.0\n6.518910 -0.023686 -0.300309\n-3.280739 5.643123 -0.848864\n-0.052577 0.005742 11.194270\nU B O\n2 9 22\ndirect\n0.873168 0.753215 0.725789 U\n0.127600 0.247551 0.274165 U\n0.393541 0.854722 0.778721 B\n0.614652 0.140178 0.228401 B\n0.197351 0.415573 0.724430 B\n0.798577 0.581496 0.267997 B\n0.473332 0.267073 0.788250 B\n0.528375 0.736216 0.207341 B\n0.748558 0.142898 0.682603 B\n0.246487 0.850853 0.316764 B\n0.492586 0.890476 0.024386 B\n0.183316 0.617271 0.726226 O\n0.815210 0.381401 0.271664 O\n0.453925 0.868207 0.903359 O\n0.545622 0.100981 0.098390 O\n0.704205 0.152838 0.554935 O\n0.302112 0.853962 0.444706 O\n0.417849 0.435165 0.741984 O\n0.579457 0.558521 0.243918 O\n0.707075 0.327558 0.746186 O\n0.293229 0.669636 0.257360 O\n0.603752 0.909933 0.714963 O\n0.396341 0.087291 0.286039 O\n0.515973 0.330615 0.920506 O\n0.479354 0.706487 0.077081 O\n0.902218 0.811380 0.887671 O\n0.085572 0.180277 0.112638 O\n0.837908 0.690975 0.563834 O\n0.172460 0.316191 0.436641 O\n0.995378 0.193962 0.708041 O\n0.002836 0.802796 0.287605 O\n0.302237 0.016187 0.753174 O\n0.702744 0.984116 0.261232 O\n",
"nsites": 33,
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"formula_full": "U2 B9 O22",
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"spacegroup": 1
},
{
"id": "mp-1206029",
"created_at": "2022-09-04T14:46:11.419322Z",
"structure_string": "Ba2 Tm1 Ta1 O6\n1.0\n0.000000 4.234160 4.234160\n4.234160 0.000000 4.234160\n4.234160 4.234160 0.000000\nBa Tm Ta O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Tm\n0.000000 0.000000 0.000000 Ta\n0.762181 0.237819 0.237819 O\n0.237819 0.762181 0.762181 O\n0.237819 0.762181 0.237819 O\n0.762181 0.237819 0.762181 O\n0.237819 0.237819 0.762181 O\n0.762181 0.762181 0.237819 O\n",
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"O"
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"volume": 151.8209801441106,
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"formula_full": "Ba2 Tm1 Ta1 O6",
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"formula_anonymous": "ABC2D6",
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"updated_at": "2021-11-28T01:37:22.404000Z",
"spacegroup": 225
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{
"id": "mp-865209",
"created_at": "2022-09-04T14:46:11.421912Z",
"structure_string": "Tm1 Hf1 Os2\n1.0\n0.000000 3.303786 3.303786\n3.303786 0.000000 3.303786\n3.303786 3.303786 0.000000\nTm Hf Os\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 Hf\n0.250000 0.250000 0.250000 Os\n0.750000 0.750000 0.750000 Os\n",
"nsites": 4,
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"elements": [
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"Os"
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"formula_full": "Tm1 Hf1 Os2",
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"updated_at": "2021-11-28T01:37:24.118000Z",
"spacegroup": 225
},
{
"id": "mp-1086673",
"created_at": "2022-09-04T14:46:11.423617Z",
"structure_string": "Dy2 Te6\n1.0\n2.172590 -12.983875 0.000000\n2.172590 12.983875 0.000000\n0.000000 0.000000 4.345676\nDy Te\n2 6\ndirect\n0.169779 0.830221 0.750000 Dy\n0.830221 0.169779 0.250000 Dy\n0.925359 0.074641 0.750000 Te\n0.074641 0.925359 0.250000 Te\n0.574695 0.425305 0.750000 Te\n0.425305 0.574695 0.250000 Te\n0.293586 0.706414 0.750000 Te\n0.706414 0.293586 0.250000 Te\n",
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"volume": 245.17119348771791,
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"formula_full": "Dy2 Te6",
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"formula_anonymous": "AB3",
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{
"id": "mp-1245357",
"created_at": "2022-09-04T14:46:11.424850Z",
"structure_string": "Ba12 Mn24 N48\n1.0\n10.734644 0.000000 0.000000\n0.000000 10.734644 0.000000\n0.000000 0.000000 10.734644\nBa Mn N\n12 24 48\ndirect\n0.500000 0.500000 0.000000 Ba\n0.500000 0.000000 0.500000 Ba\n0.000000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.124797 0.875203 0.375203 Ba\n0.875203 0.375203 0.124797 Ba\n0.375203 0.124797 0.875203 Ba\n0.624797 0.624797 0.624797 Ba\n0.875203 0.124797 0.624797 Ba\n0.124797 0.624797 0.875203 Ba\n0.624797 0.875203 0.124797 Ba\n0.375203 0.375203 0.375203 Ba\n0.385468 0.693484 0.347224 Mn\n0.614532 0.193484 0.152776 Mn\n0.114532 0.306516 0.847224 Mn\n0.885468 0.806516 0.652776 Mn\n0.347224 0.385468 0.693484 Mn\n0.152776 0.614532 0.193484 Mn\n0.847224 0.114532 0.306516 Mn\n0.652776 0.885468 0.806516 Mn\n0.693484 0.347224 0.385468 Mn\n0.193484 0.152776 0.614532 Mn\n0.306516 0.847224 0.114532 Mn\n0.806516 0.652776 0.885468 Mn\n0.614532 0.306516 0.652776 Mn\n0.385468 0.806516 0.847224 Mn\n0.885468 0.693484 0.152776 Mn\n0.114532 0.193484 0.347224 Mn\n0.652776 0.614532 0.306516 Mn\n0.847224 0.385468 0.806516 Mn\n0.152776 0.885468 0.693484 Mn\n0.347224 0.114532 0.193484 Mn\n0.306516 0.652776 0.614532 Mn\n0.806516 0.847224 0.385468 Mn\n0.693484 0.152776 0.885468 Mn\n0.193484 0.347224 0.114532 Mn\n0.374270 0.830496 0.261252 N\n0.625730 0.330496 0.238748 N\n0.125730 0.169504 0.761252 N\n0.874270 0.669504 0.738748 N\n0.261252 0.374270 0.830496 N\n0.238748 0.625730 0.330496 N\n0.761252 0.125730 0.169504 N\n0.738748 0.874270 0.669504 N\n0.830496 0.261252 0.374270 N\n0.330496 0.238748 0.625730 N\n0.169504 0.761252 0.125730 N\n0.669504 0.738748 0.874270 N\n0.625730 0.169504 0.738748 N\n0.374270 0.669504 0.761252 N\n0.874270 0.830496 0.238748 N\n0.125730 0.330496 0.261252 N\n0.738748 0.625730 0.169504 N\n0.761252 0.374270 0.669504 N\n0.238748 0.874270 0.830496 N\n0.261252 0.125730 0.330496 N\n0.169504 0.738748 0.625730 N\n0.669504 0.761252 0.374270 N\n0.830496 0.238748 0.874270 N\n0.330496 0.261252 0.125730 N\n0.410777 0.726064 0.503426 N\n0.589223 0.226064 0.996574 N\n0.089223 0.273936 0.003426 N\n0.910777 0.773936 0.496574 N\n0.503426 0.410777 0.726064 N\n0.996574 0.589223 0.226064 N\n0.003426 0.089223 0.273936 N\n0.496574 0.910777 0.773936 N\n0.726064 0.503426 0.410777 N\n0.226064 0.996574 0.589223 N\n0.273936 0.003426 0.089223 N\n0.773936 0.496574 0.910777 N\n0.589223 0.273936 0.496574 N\n0.410777 0.773936 0.003426 N\n0.910777 0.726064 0.996574 N\n0.089223 0.226064 0.503426 N\n0.496574 0.589223 0.273936 N\n0.003426 0.410777 0.773936 N\n0.996574 0.910777 0.726064 N\n0.503426 0.089223 0.226064 N\n0.273936 0.496574 0.589223 N\n0.773936 0.003426 0.410777 N\n0.726064 0.996574 0.910777 N\n0.226064 0.503426 0.089223 N\n",
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"formula_full": "Ba12 Mn24 N48",
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{
"id": "mp-1215446",
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"structure_string": "Zn2 Se1 S1\n1.0\n6.563667 -1.979076 0.000000\n6.563667 1.979076 0.000000\n5.966937 0.000000 3.375520\nZn Se S\n2 1 1\ndirect\n0.003739 0.003739 0.003739 Zn\n0.496347 0.496347 0.496347 Zn\n0.624657 0.624657 0.624657 Se\n0.125257 0.125257 0.125257 S\n",
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{
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"structure_string": "Co1 Au1 O2\n1.0\n6.203305 -1.460570 0.000000\n6.203305 1.460570 0.000000\n5.859413 0.000000 2.506299\nCo Au O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Au\n0.885140 0.885140 0.885140 O\n0.114860 0.114860 0.114860 O\n",
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{
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{
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