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{
"id": "mp-1192667",
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{
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"structure_string": "Sr4 La2 Cl14\n1.0\n10.600514 0.000000 0.000000\n0.000000 7.965855 0.000000\n0.000000 2.983163 7.907821\nSr La Cl\n4 2 14\ndirect\n0.028824 0.232384 0.237718 Sr\n0.471176 0.232384 0.237718 Sr\n0.528824 0.767616 0.762282 Sr\n0.971176 0.767616 0.762282 Sr\n0.250000 0.742025 0.204991 La\n0.750000 0.257975 0.795009 La\n0.250000 0.124049 0.070323 Cl\n0.991237 0.374913 0.861737 Cl\n0.508763 0.374913 0.861737 Cl\n0.076929 0.844774 0.420271 Cl\n0.423071 0.844774 0.420271 Cl\n0.750000 0.193973 0.152039 Cl\n0.750000 0.639509 0.614732 Cl\n0.250000 0.360491 0.385268 Cl\n0.250000 0.806027 0.847961 Cl\n0.576929 0.155226 0.579729 Cl\n0.923071 0.155226 0.579729 Cl\n0.491237 0.625087 0.138263 Cl\n0.008763 0.625087 0.138263 Cl\n0.750000 0.875951 0.929677 Cl\n",
"nsites": 20,
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{
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"created_at": "2022-09-04T14:39:10.241388Z",
"structure_string": "V2 Si14 N20\n1.0\n6.741152 0.000000 0.006172\n0.000000 6.901825 0.000000\n-2.593892 0.000000 9.367163\nV Si N\n2 14 20\ndirect\n0.996669 0.917715 0.701704 V\n0.996669 0.082285 0.201704 V\n0.538753 0.979116 0.821752 Si\n0.538753 0.020884 0.321752 Si\n0.349982 0.022178 0.018014 Si\n0.349982 0.977822 0.518014 Si\n0.112282 0.398500 0.072363 Si\n0.112282 0.601500 0.572363 Si\n0.659763 0.360273 0.990344 Si\n0.659763 0.639727 0.490344 Si\n0.843483 0.618562 0.810185 Si\n0.843483 0.381438 0.310185 Si\n0.297267 0.618163 0.880744 Si\n0.297267 0.381837 0.380744 Si\n0.484553 0.367346 0.685322 Si\n0.484553 0.632654 0.185322 Si\n0.743372 0.842865 0.814068 N\n0.743372 0.157135 0.314068 N\n0.555829 0.132893 0.968576 N\n0.555829 0.867107 0.468576 N\n0.307432 0.870764 0.860518 N\n0.307432 0.129236 0.360518 N\n0.156217 0.160725 0.042191 N\n0.156217 0.839275 0.542191 N\n0.287889 0.503529 0.722010 N\n0.287889 0.496471 0.222010 N\n0.445993 0.120899 0.668741 N\n0.445993 0.879101 0.168741 N\n0.885781 0.369840 0.132321 N\n0.885781 0.630160 0.632321 N\n0.077014 0.568263 0.934531 N\n0.077014 0.431737 0.434531 N\n0.700409 0.414993 0.824464 N\n0.700409 0.585007 0.324464 N\n0.499611 0.541034 0.021452 N\n0.499611 0.458966 0.521452 N\n",
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"formula_full": "V2 Si14 N20",
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{
"id": "mp-26837",
"created_at": "2022-09-04T14:39:10.281229Z",
"structure_string": "Li4 Mo4 P8 O28\n1.0\n8.456977 0.000000 0.000000\n0.000000 6.900095 0.000000\n0.000000 2.672759 9.134776\nLi Mo P O\n4 4 8 28\ndirect\n0.898486 0.769210 0.565962 Li\n0.601514 0.769210 0.065962 Li\n0.398486 0.230790 0.934038 Li\n0.101514 0.230790 0.434038 Li\n0.223716 0.717677 0.993421 Mo\n0.276284 0.717677 0.493421 Mo\n0.723716 0.282323 0.506579 Mo\n0.776284 0.282323 0.006579 Mo\n0.536540 0.051551 0.286959 P\n0.963460 0.051551 0.786959 P\n0.413839 0.451419 0.295397 P\n0.913839 0.548581 0.204603 P\n0.463460 0.948449 0.713041 P\n0.036540 0.948449 0.213041 P\n0.586161 0.548581 0.704603 P\n0.086161 0.451419 0.795397 P\n0.588189 0.082055 0.125366 O\n0.948718 0.146562 0.159875 O\n0.673730 0.074018 0.386182 O\n0.400519 0.221612 0.284241 O\n0.411811 0.917945 0.874634 O\n0.051282 0.853438 0.840125 O\n0.326270 0.925982 0.613818 O\n0.599481 0.778388 0.715759 O\n0.088189 0.917945 0.374634 O\n0.448718 0.853438 0.340125 O\n0.173730 0.925982 0.113818 O\n0.900519 0.778388 0.215759 O\n0.087629 0.590425 0.637210 O\n0.232451 0.473004 0.886820 O\n0.928531 0.473658 0.865158 O\n0.428531 0.526342 0.634842 O\n0.732451 0.526996 0.613180 O\n0.587629 0.409575 0.862790 O\n0.412371 0.590425 0.137210 O\n0.267549 0.473004 0.386820 O\n0.571469 0.473658 0.365158 O\n0.071469 0.526342 0.134842 O\n0.767549 0.526996 0.113180 O\n0.912371 0.409575 0.362790 O\n0.099481 0.221612 0.784241 O\n0.826270 0.074018 0.886182 O\n0.551282 0.146562 0.659875 O\n0.911811 0.082055 0.625366 O\n",
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"formula_full": "Li4 Mo4 P8 O28",
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{
"id": "mp-696878",
"created_at": "2022-09-04T14:39:06.105295Z",
"structure_string": "K3 Ca1 P2 H1 O8\n1.0\n2.906137 4.991273 0.000000\n-2.906137 4.991273 0.000000\n0.000000 0.607040 7.497016\nK Ca P H O\n3 1 2 1 8\ndirect\n0.000000 0.000000 0.500000 K\n0.330307 0.330307 0.190493 K\n0.669693 0.669693 0.809507 K\n0.000000 0.000000 0.000000 Ca\n0.340249 0.340249 0.748614 P\n0.659751 0.659751 0.251386 P\n0.500000 0.500000 0.500000 H\n0.185181 0.185181 0.780911 O\n0.814819 0.814819 0.219089 O\n0.379190 0.379190 0.540223 O\n0.620810 0.620810 0.459777 O\n0.182227 0.620442 0.828272 O\n0.620442 0.182227 0.828272 O\n0.817773 0.379558 0.171728 O\n0.379558 0.817773 0.171728 O\n",
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"formula_full": "K3 Ca1 P2 H1 O8",
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{
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"structure_string": "Cs1 Nb1 O3\n1.0\n4.170919 0.000000 0.000000\n0.000000 4.170919 0.000000\n0.000000 0.000000 4.170919\nCs Nb O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Cs\n0.500000 0.500000 0.500000 Nb\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
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{
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"structure_string": "Li8 Zn8 B8 O24\n1.0\n5.082049 0.000000 0.000000\n-0.014874 8.859268 0.000000\n-0.081205 -0.002639 11.221704\nLi Zn B O\n8 8 8 24\ndirect\n0.675386 0.014506 0.166377 Li\n0.348312 0.997881 0.897597 Li\n0.336074 0.002560 0.352538 Li\n0.824336 0.509519 0.333115 Li\n0.103767 0.491515 0.725603 Li\n0.165178 0.509142 0.152855 Li\n0.152164 0.506343 0.534286 Li\n0.660874 0.993502 0.672366 Li\n0.854948 0.169118 0.890570 Zn\n0.160441 0.162420 0.621020 Zn\n0.661826 0.345010 0.101907 Zn\n0.344232 0.325716 0.352666 Zn\n0.651432 0.666414 0.650265 Zn\n0.839730 0.837705 0.394693 Zn\n0.366487 0.654729 0.908374 Zn\n0.150368 0.839307 0.112059 Zn\n0.843638 0.168852 0.371341 B\n0.167341 0.170796 0.129892 B\n0.658018 0.335592 0.625407 B\n0.345429 0.326611 0.885095 B\n0.663813 0.672646 0.133741 B\n0.844597 0.831145 0.874178 B\n0.340007 0.670429 0.367193 B\n0.152092 0.826342 0.623001 B\n0.704981 0.036586 0.348857 O\n0.903272 0.169231 0.098791 O\n0.310494 0.038151 0.130928 O\n0.780745 0.198195 0.649136 O\n0.723015 0.307040 0.356964 O\n0.223123 0.191134 0.854126 O\n0.110663 0.161764 0.404135 O\n0.605209 0.325821 0.925177 O\n0.810660 0.467015 0.620775 O\n0.293435 0.306467 0.162221 O\n0.383855 0.344865 0.609500 O\n0.798830 0.539350 0.153757 O\n0.210801 0.460463 0.878434 O\n0.713564 0.700040 0.838146 O\n0.605227 0.665386 0.388929 O\n0.196947 0.533274 0.364018 O\n0.397154 0.664517 0.097025 O\n0.781883 0.810743 0.147284 O\n0.881788 0.835310 0.592795 O\n0.263916 0.682755 0.637603 O\n0.207217 0.804737 0.348024 O\n0.712356 0.967548 0.863138 O\n0.105617 0.828095 0.916793 O\n0.297220 0.956626 0.637037 O\n",
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{
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"structure_string": "Ca4 Cr8 Cu8 O32\n1.0\n8.677536 0.000000 0.000000\n0.000000 6.648789 0.000000\n0.000000 0.651324 12.323233\nCa Cr Cu O\n4 8 8 32\ndirect\n0.167486 0.128161 0.043485 Ca\n0.832514 0.871839 0.956515 Ca\n0.667486 0.871839 0.456515 Ca\n0.332514 0.128161 0.543485 Ca\n0.461987 0.099619 0.845370 Cr\n0.038013 0.099619 0.345370 Cr\n0.084927 0.606087 0.136364 Cr\n0.961987 0.900381 0.654630 Cr\n0.915073 0.393913 0.863636 Cr\n0.584927 0.393913 0.363636 Cr\n0.415073 0.606087 0.636364 Cr\n0.538013 0.900381 0.154630 Cr\n0.184886 0.761333 0.857116 Cu\n0.049497 0.392032 0.628693 Cu\n0.950503 0.607968 0.371307 Cu\n0.815114 0.238667 0.142884 Cu\n0.315114 0.761333 0.357116 Cu\n0.450503 0.392032 0.128693 Cu\n0.684886 0.238667 0.642884 Cu\n0.549497 0.607968 0.871307 Cu\n0.219806 0.023982 0.381419 O\n0.000944 0.680120 0.599639 O\n0.580634 0.199214 0.461302 O\n0.080634 0.800786 0.038698 O\n0.280194 0.023982 0.881419 O\n0.780194 0.976018 0.618581 O\n0.085806 0.088277 0.613155 O\n0.908804 0.503390 0.135272 O\n0.591196 0.503390 0.635272 O\n0.875761 0.320306 0.736636 O\n0.375761 0.679694 0.763364 O\n0.091196 0.496610 0.864728 O\n0.914194 0.911723 0.386845 O\n0.523159 0.870978 0.290811 O\n0.276342 0.441419 0.601333 O\n0.223658 0.441419 0.101333 O\n0.023159 0.129022 0.209189 O\n0.408804 0.496610 0.364728 O\n0.476841 0.129022 0.709189 O\n0.419366 0.800786 0.538698 O\n0.499056 0.680120 0.099639 O\n0.124239 0.679694 0.263364 O\n0.719806 0.976018 0.118581 O\n0.414194 0.088277 0.113155 O\n0.919366 0.199214 0.961302 O\n0.776342 0.558581 0.898667 O\n0.999056 0.319880 0.400361 O\n0.500944 0.319880 0.900361 O\n0.585806 0.911723 0.886845 O\n0.723658 0.558581 0.398667 O\n0.624239 0.320306 0.236636 O\n0.976841 0.870978 0.790811 O\n",
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{
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{
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}