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{
"id": "mp-961663",
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{
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{
"id": "mp-1235214",
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"structure_string": "Li1 Al4 Cd2 O8\n1.0\n-4.422444 -4.422444 0.000000\n-4.422444 0.000000 -4.422444\n0.000000 -4.422444 -4.422444\nLi Al Cd O\n1 4 2 8\ndirect\n0.375000 0.375000 0.375000 Li\n0.510922 0.510922 0.967233 Al\n0.510922 0.967233 0.510922 Al\n0.967233 0.510922 0.510922 Al\n0.510922 0.510922 0.510922 Al\n0.125000 0.125000 0.125000 Cd\n0.875000 0.875000 0.875000 Cd\n0.268084 0.268084 0.695747 O\n0.268084 0.695747 0.268084 O\n0.695747 0.268084 0.268084 O\n0.268084 0.268084 0.268084 O\n0.727433 0.727433 0.317700 O\n0.727433 0.317700 0.727433 O\n0.317700 0.727433 0.727433 O\n0.727433 0.727433 0.727433 O\n",
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{
"id": "mp-753446",
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"structure_string": "Li4 V2 Cr2 P4 H4 O20\n1.0\n-0.687489 -1.937786 4.748436\n8.070466 5.142063 4.698103\n-2.055699 7.072527 0.020234\nLi V Cr P H O\n4 2 2 4 4 20\ndirect\n0.545892 0.197767 0.626047 Li\n0.046905 0.697226 0.124182 Li\n0.953150 0.302841 0.875750 Li\n0.454116 0.802301 0.373905 Li\n0.500066 0.500030 0.499995 V\n0.000123 0.000000 0.000066 V\n0.500141 0.499838 0.000111 Cr\n0.999825 0.999952 0.499952 Cr\n0.496853 0.181141 0.052355 P\n0.997575 0.680916 0.552079 P\n0.002595 0.318981 0.448006 P\n0.503208 0.818827 0.947558 P\n0.329970 0.029617 0.313296 H\n0.829090 0.530588 0.813577 H\n0.170884 0.469480 0.186457 H\n0.669740 0.970432 0.686787 H\n0.814654 0.023976 0.697683 O\n0.315077 0.523395 0.197692 O\n0.685102 0.476566 0.802335 O\n0.185134 0.976047 0.302311 O\n0.625988 0.101942 0.279544 O\n0.126623 0.601734 0.779362 O\n0.873584 0.398241 0.220725 O\n0.373745 0.898117 0.720391 O\n0.131974 0.171049 0.487611 O\n0.633746 0.671017 0.987073 O\n0.366262 0.328902 0.012959 O\n0.867750 0.828825 0.512370 O\n0.244255 0.127079 0.947213 O\n0.744402 0.627230 0.446814 O\n0.255635 0.372817 0.553145 O\n0.755719 0.872982 0.052690 O\n0.715567 0.170398 0.948247 O\n0.216118 0.669853 0.447825 O\n0.783973 0.330222 0.552149 O\n0.284560 0.829672 0.051737 O\n",
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"spacegroup": 2
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{
"id": "mp-1213536",
"created_at": "2022-09-04T14:44:15.470326Z",
"structure_string": "Cs4 Mo12 Cl28\n1.0\n5.085914 -8.809062 0.000000\n5.085914 8.809062 0.000000\n0.000000 0.000000 15.094220\nCs Mo Cl\n4 12 28\ndirect\n0.000000 0.000000 0.995576 Cs\n0.000000 0.000000 0.495576 Cs\n0.666667 0.333333 0.710476 Cs\n0.333333 0.666667 0.210476 Cs\n0.486982 0.675449 0.783213 Mo\n0.188468 0.513018 0.783213 Mo\n0.811532 0.324551 0.283213 Mo\n0.324551 0.811532 0.783213 Mo\n0.675449 0.486982 0.283213 Mo\n0.513018 0.188468 0.283213 Mo\n0.476738 0.820958 0.641518 Mo\n0.344220 0.523262 0.641518 Mo\n0.655780 0.179042 0.141518 Mo\n0.179042 0.655780 0.641518 Mo\n0.820958 0.476738 0.141518 Mo\n0.523262 0.344220 0.141518 Mo\n0.626598 0.688520 0.643324 Cl\n0.061922 0.373402 0.643324 Cl\n0.938078 0.311480 0.143324 Cl\n0.311480 0.938078 0.643324 Cl\n0.688520 0.626598 0.143324 Cl\n0.373402 0.061922 0.143324 Cl\n0.985525 0.308829 0.869808 Cl\n0.323303 0.014475 0.869808 Cl\n0.676697 0.691171 0.369808 Cl\n0.691171 0.676697 0.869808 Cl\n0.308829 0.985525 0.369808 Cl\n0.014475 0.323303 0.369808 Cl\n0.666667 0.333333 0.010955 Cl\n0.333333 0.666667 0.510955 Cl\n0.666667 0.333333 0.413641 Cl\n0.333333 0.666667 0.913641 Cl\n0.607941 0.956888 0.781420 Cl\n0.348947 0.392059 0.781420 Cl\n0.651053 0.043112 0.281420 Cl\n0.043112 0.651053 0.781420 Cl\n0.956888 0.607941 0.281420 Cl\n0.392059 0.348947 0.281420 Cl\n0.668932 0.034113 0.554901 Cl\n0.365181 0.331068 0.554901 Cl\n0.634819 0.965887 0.054901 Cl\n0.965887 0.634819 0.554901 Cl\n0.034113 0.668932 0.054901 Cl\n0.331068 0.365181 0.054901 Cl\n",
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{
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"structure_string": "Ca2 Cu2 F10\n1.0\n5.544288 0.000000 0.000000\n1.794180 5.257700 0.000000\n2.683163 1.953468 6.959995\nCa Cu F\n2 2 10\ndirect\n0.458258 0.543461 0.749641 Ca\n0.541742 0.456539 0.250359 Ca\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.928392 0.062946 0.254034 F\n0.071608 0.937054 0.745966 F\n0.250002 0.207500 0.378227 F\n0.785517 0.764343 0.113790 F\n0.306092 0.712965 0.022289 F\n0.287100 0.689159 0.478169 F\n0.693908 0.287035 0.977711 F\n0.712900 0.310841 0.521831 F\n0.214483 0.235657 0.886210 F\n0.749998 0.792500 0.621773 F\n",
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{
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{
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},
{
"id": "mp-1192365",
"created_at": "2022-09-04T14:44:15.468832Z",
"structure_string": "Dy12 Te12 N4\n1.0\n12.009691 0.000000 0.000000\n0.000000 8.131868 0.000000\n0.000000 2.829177 8.204199\nDy Te N\n12 12 4\ndirect\n0.022346 0.602704 0.137450 Dy\n0.522346 0.397296 0.362550 Dy\n0.977654 0.397296 0.862550 Dy\n0.477654 0.602704 0.637450 Dy\n0.411238 0.839250 0.205030 Dy\n0.911238 0.160750 0.294970 Dy\n0.588762 0.160750 0.794970 Dy\n0.088762 0.839250 0.705030 Dy\n0.708675 0.766795 0.342739 Dy\n0.208675 0.233205 0.157261 Dy\n0.291325 0.233205 0.657261 Dy\n0.791325 0.766795 0.842739 Dy\n0.978811 0.776080 0.415230 Te\n0.478811 0.223920 0.084770 Te\n0.021189 0.223920 0.584770 Te\n0.521189 0.776080 0.915230 Te\n0.265539 0.508202 0.315229 Te\n0.765539 0.491798 0.184771 Te\n0.734461 0.491798 0.684771 Te\n0.234461 0.508202 0.815229 Te\n0.310435 0.954702 0.484752 Te\n0.810435 0.045298 0.015248 Te\n0.689565 0.045298 0.515248 Te\n0.189565 0.954702 0.984752 Te\n0.534314 0.672513 0.376515 N\n0.034314 0.327487 0.123485 N\n0.465686 0.327487 0.623485 N\n0.965686 0.672513 0.876515 N\n",
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"formula_full": "Dy12 Te12 N4",
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},
{
"id": "mp-1210312",
"created_at": "2022-09-04T14:44:15.470532Z",
"structure_string": "Rb2 Na6 W4 O34\n1.0\n-4.390022 -7.603742 0.000000\n-4.390022 7.603742 0.000000\n0.000000 0.000000 -10.921458\nRb Na W O\n2 6 4 34\ndirect\n0.000000 0.000000 0.750000 Rb\n0.000000 0.000000 0.250000 Rb\n0.630313 0.093492 0.750000 Na\n0.369687 0.906508 0.250000 Na\n0.463179 0.369687 0.750000 Na\n0.536821 0.630313 0.250000 Na\n0.906508 0.536821 0.750000 Na\n0.093492 0.463179 0.250000 Na\n0.666667 0.333333 0.451992 W\n0.333333 0.666667 0.548008 W\n0.333333 0.666667 0.951992 W\n0.666667 0.333333 0.048008 W\n0.956603 0.303295 0.750000 O\n0.043397 0.696705 0.250000 O\n0.346691 0.043397 0.750000 O\n0.653309 0.956603 0.250000 O\n0.696705 0.653309 0.750000 O\n0.303295 0.346691 0.250000 O\n0.814750 0.058650 0.958220 O\n0.185250 0.941350 0.041780 O\n0.243900 0.185250 0.958220 O\n0.185250 0.941350 0.458220 O\n0.756100 0.814750 0.041780 O\n0.814750 0.058650 0.541780 O\n0.941350 0.756100 0.958220 O\n0.756100 0.814750 0.458220 O\n0.058650 0.243900 0.041780 O\n0.243900 0.185250 0.541780 O\n0.058650 0.243900 0.458220 O\n0.941350 0.756100 0.541780 O\n0.538212 0.687441 0.895500 O\n0.461788 0.312559 0.104500 O\n0.149229 0.461788 0.895500 O\n0.461788 0.312559 0.395500 O\n0.850771 0.538212 0.104500 O\n0.538212 0.687441 0.604500 O\n0.312559 0.850771 0.895500 O\n0.850771 0.538212 0.395500 O\n0.687441 0.149229 0.104500 O\n0.149229 0.461788 0.604500 O\n0.687441 0.149229 0.395500 O\n0.312559 0.850771 0.604500 O\n0.666667 0.333333 0.881994 O\n0.333333 0.666667 0.118006 O\n0.333333 0.666667 0.381994 O\n0.666667 0.333333 0.618006 O\n",
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}
]
}