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{
"id": "mp-1023163",
"created_at": "2022-09-04T14:46:06.106396Z",
"structure_string": "Li2 Ca2 Mg12\n1.0\n5.247358 0.000000 0.000000\n0.000000 6.580434 0.000000\n0.000000 0.000000 11.508486\nLi Ca Mg\n2 2 12\ndirect\n0.500000 0.500000 0.162488 Li\n0.500000 0.000000 0.662488 Li\n0.000000 0.500000 0.331112 Ca\n0.000000 0.000000 0.831112 Ca\n0.000000 0.744425 0.081518 Mg\n0.000000 0.255575 0.081518 Mg\n0.000000 0.000000 0.336354 Mg\n0.500000 0.243620 0.419749 Mg\n0.500000 0.756380 0.419749 Mg\n0.500000 0.000000 0.167513 Mg\n0.000000 0.244425 0.581518 Mg\n0.000000 0.755575 0.581518 Mg\n0.000000 0.500000 0.836354 Mg\n0.500000 0.743620 0.919749 Mg\n0.500000 0.256380 0.919749 Mg\n0.500000 0.500000 0.667513 Mg\n",
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{
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{
"id": "mp-21801",
"created_at": "2022-09-04T14:46:06.122895Z",
"structure_string": "Rb32 Pb8 O24\n1.0\n6.928915 0.000000 0.000000\n0.000000 12.251434 0.000000\n0.000000 0.000000 20.052157\nRb Pb O\n32 8 24\ndirect\n0.956448 0.385361 0.202873 Rb\n0.456448 0.114639 0.797127 Rb\n0.043552 0.885361 0.297127 Rb\n0.543552 0.614639 0.702873 Rb\n0.043552 0.614639 0.797127 Rb\n0.543552 0.885361 0.202873 Rb\n0.956448 0.114639 0.702873 Rb\n0.456448 0.385361 0.297127 Rb\n0.766358 0.188174 0.943342 Rb\n0.266358 0.311826 0.056658 Rb\n0.233642 0.688174 0.556658 Rb\n0.733642 0.811826 0.443342 Rb\n0.233642 0.811826 0.056658 Rb\n0.733642 0.688174 0.943342 Rb\n0.766358 0.311826 0.443342 Rb\n0.266358 0.188174 0.556658 Rb\n0.750366 0.055467 0.534870 Rb\n0.250366 0.444533 0.465130 Rb\n0.249634 0.555467 0.965130 Rb\n0.749634 0.944533 0.034870 Rb\n0.249634 0.944533 0.465130 Rb\n0.749634 0.555467 0.534870 Rb\n0.750366 0.444533 0.034870 Rb\n0.250366 0.055467 0.965130 Rb\n0.625973 0.173275 0.151646 Rb\n0.125973 0.326725 0.848354 Rb\n0.374027 0.673275 0.348354 Rb\n0.874027 0.826725 0.651646 Rb\n0.374027 0.826725 0.848354 Rb\n0.874027 0.673275 0.151646 Rb\n0.625973 0.326725 0.651646 Rb\n0.125973 0.173275 0.348354 Rb\n0.607792 0.062408 0.349133 Pb\n0.107792 0.437592 0.650867 Pb\n0.392208 0.562408 0.150867 Pb\n0.892208 0.937592 0.849133 Pb\n0.392208 0.937592 0.650867 Pb\n0.892208 0.562408 0.349133 Pb\n0.607792 0.437592 0.849133 Pb\n0.107792 0.062408 0.150867 Pb\n0.955072 0.356276 0.567331 O\n0.455072 0.143724 0.432669 O\n0.044928 0.856276 0.932669 O\n0.544928 0.643724 0.067331 O\n0.044928 0.643724 0.432669 O\n0.544928 0.856276 0.567331 O\n0.955072 0.143724 0.067331 O\n0.455072 0.356276 0.932669 O\n0.539241 0.400189 0.156572 O\n0.039241 0.099811 0.843428 O\n0.460759 0.900189 0.343428 O\n0.960759 0.599811 0.656572 O\n0.460759 0.599811 0.843428 O\n0.960759 0.900189 0.156572 O\n0.539241 0.099811 0.656572 O\n0.039241 0.400189 0.343428 O\n0.877829 0.485153 0.899622 O\n0.377829 0.014847 0.100378 O\n0.122171 0.985153 0.600378 O\n0.622171 0.514847 0.399622 O\n0.122171 0.514847 0.100378 O\n0.622171 0.985153 0.899622 O\n0.877829 0.014847 0.399622 O\n0.377829 0.485153 0.600378 O\n",
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"updated_at": "2021-11-28T01:37:23.834000Z",
"spacegroup": 61
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{
"id": "mp-1220444",
"created_at": "2022-09-04T14:46:06.124730Z",
"structure_string": "Nb6 Cd1 S8\n1.0\n4.855732 -8.410375 0.000000\n4.855732 8.410375 0.000000\n0.000000 0.000000 3.380338\nNb Cd S\n6 1 8\ndirect\n0.113734 0.627450 0.249893 Nb\n0.513716 0.886266 0.249893 Nb\n0.372550 0.486284 0.249893 Nb\n0.886266 0.372550 0.750107 Nb\n0.486284 0.113734 0.750107 Nb\n0.627450 0.513716 0.750107 Nb\n0.000000 0.000000 0.500000 Cd\n0.666667 0.333333 0.249940 S\n0.333333 0.666667 0.750060 S\n0.287343 0.943421 0.250336 S\n0.656079 0.712657 0.250336 S\n0.056579 0.343921 0.250336 S\n0.712657 0.056579 0.749664 S\n0.343921 0.287343 0.749664 S\n0.943421 0.656079 0.749664 S\n",
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"formula_full": "Nb6 Cd1 S8",
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{
"id": "mp-1217332",
"created_at": "2022-09-04T14:46:06.128403Z",
"structure_string": "Th2 C1 N1\n1.0\n6.175765 -1.871878 0.000000\n6.175765 1.871878 0.000000\n5.608398 0.000000 3.192158\nTh C N\n2 1 1\ndirect\n0.249605 0.249605 0.249605 Th\n0.750395 0.750395 0.750395 Th\n0.000000 0.000000 0.000000 C\n0.500000 0.500000 0.500000 N\n",
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{
"id": "mp-1080261",
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"structure_string": "Ce4 Se8\n1.0\n6.703671 9.379440 0.000000\n-6.703671 9.379440 0.000000\n0.000000 3.163971 7.770042\nCe Se\n4 8\ndirect\n0.746833 0.962893 0.330131 Ce\n0.037107 0.253167 0.169869 Ce\n0.253167 0.037107 0.669869 Ce\n0.962893 0.746833 0.830131 Ce\n0.180866 0.819134 0.750000 Se\n0.819134 0.180866 0.250000 Se\n0.220698 0.109414 0.964420 Se\n0.890586 0.779302 0.535580 Se\n0.779302 0.890586 0.035580 Se\n0.109414 0.220698 0.464420 Se\n0.000000 0.500000 0.000000 Se\n0.500000 0.000000 0.500000 Se\n",
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{
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{
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"structure_string": "Tb12 Ti8 Al86\n1.0\n5.548735 -9.610692 0.000000\n5.548735 9.610692 0.000000\n0.000000 0.000000 17.831307\nTb Ti Al\n12 8 86\ndirect\n0.530585 0.000000 0.596390 Tb\n0.469415 0.000000 0.403610 Tb\n0.000000 0.530585 0.596390 Tb\n0.469415 0.000000 0.096390 Tb\n0.000000 0.530585 0.903610 Tb\n0.000000 0.469415 0.403610 Tb\n0.530585 0.000000 0.903610 Tb\n0.000000 0.469415 0.096390 Tb\n0.469415 0.469415 0.596390 Tb\n0.530585 0.530585 0.403610 Tb\n0.530585 0.530585 0.096390 Tb\n0.469415 0.469415 0.903610 Tb\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.727378 0.000000 0.750000 Ti\n0.272622 0.000000 0.250000 Ti\n0.000000 0.727378 0.750000 Ti\n0.000000 0.272622 0.250000 Ti\n0.272622 0.272622 0.750000 Ti\n0.727378 0.727378 0.250000 Ti\n0.149884 0.597515 0.750000 Al\n0.850116 0.402485 0.250000 Al\n0.402485 0.552370 0.750000 Al\n0.597515 0.149884 0.750000 Al\n0.597515 0.447630 0.250000 Al\n0.402485 0.850116 0.250000 Al\n0.447630 0.850116 0.750000 Al\n0.552370 0.402485 0.750000 Al\n0.552370 0.149884 0.250000 Al\n0.447630 0.597515 0.250000 Al\n0.850116 0.447630 0.750000 Al\n0.149884 0.552370 0.250000 Al\n0.156922 0.000000 0.115863 Al\n0.843078 0.000000 0.884137 Al\n0.000000 0.156922 0.115863 Al\n0.843078 0.000000 0.615863 Al\n0.000000 0.156922 0.384137 Al\n0.000000 0.843078 0.884137 Al\n0.156922 0.000000 0.384137 Al\n0.000000 0.843078 0.615863 Al\n0.843078 0.843078 0.115863 Al\n0.156922 0.156922 0.884137 Al\n0.156922 0.156922 0.615863 Al\n0.843078 0.843078 0.384137 Al\n0.247286 0.494572 0.500000 Al\n0.752714 0.505428 0.500000 Al\n0.505428 0.752714 0.500000 Al\n0.752714 0.505428 0.000000 Al\n0.494572 0.247286 0.000000 Al\n0.494572 0.247286 0.500000 Al\n0.247286 0.494572 0.000000 Al\n0.505428 0.752714 0.000000 Al\n0.247286 0.752714 0.500000 Al\n0.752714 0.247286 0.500000 Al\n0.752714 0.247286 0.000000 Al\n0.247286 0.752714 0.000000 Al\n0.146447 0.000000 0.750000 Al\n0.853553 0.000000 0.250000 Al\n0.000000 0.146447 0.750000 Al\n0.000000 0.853553 0.250000 Al\n0.853553 0.853553 0.750000 Al\n0.146447 0.146447 0.250000 Al\n0.333333 0.666667 0.626143 Al\n0.666667 0.333333 0.373857 Al\n0.666667 0.333333 0.126143 Al\n0.666667 0.333333 0.873857 Al\n0.333333 0.666667 0.873857 Al\n0.333333 0.666667 0.126143 Al\n0.333333 0.666667 0.373857 Al\n0.666667 0.333333 0.626143 Al\n0.253553 0.000000 0.529097 Al\n0.746447 0.000000 0.470903 Al\n0.000000 0.253553 0.529097 Al\n0.746447 0.000000 0.029097 Al\n0.000000 0.253553 0.970903 Al\n0.000000 0.746447 0.470903 Al\n0.253553 0.000000 0.970903 Al\n0.000000 0.746447 0.029097 Al\n0.746447 0.746447 0.529097 Al\n0.253553 0.253553 0.470903 Al\n0.253553 0.253553 0.029097 Al\n0.746447 0.746447 0.970903 Al\n0.157987 0.393012 0.664771 Al\n0.842013 0.606988 0.335229 Al\n0.606988 0.764975 0.664771 Al\n0.842013 0.606988 0.164771 Al\n0.393012 0.157987 0.835229 Al\n0.393012 0.235025 0.335229 Al\n0.157987 0.393012 0.835229 Al\n0.606988 0.842013 0.164771 Al\n0.235025 0.842013 0.664771 Al\n0.393012 0.235025 0.164771 Al\n0.764975 0.606988 0.835229 Al\n0.764975 0.157987 0.335229 Al\n0.606988 0.764975 0.835229 Al\n0.235025 0.393012 0.164771 Al\n0.606988 0.842013 0.335229 Al\n0.393012 0.157987 0.664771 Al\n0.764975 0.157987 0.164771 Al\n0.235025 0.393012 0.335229 Al\n0.235025 0.842013 0.835229 Al\n0.764975 0.606988 0.664771 Al\n0.842013 0.235025 0.835229 Al\n0.157987 0.764975 0.164771 Al\n0.157987 0.764975 0.335229 Al\n0.842013 0.235025 0.664771 Al\n",
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{
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