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{
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{
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{
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"structure_string": "Lu20 Pt16\n1.0\n7.313658 0.000000 0.000000\n0.000000 7.405419 0.000000\n0.000000 0.000000 14.600293\nLu Pt\n20 16\ndirect\n0.624905 0.163659 0.618578 Lu\n0.124905 0.336341 0.881422 Lu\n0.375095 0.836341 0.118578 Lu\n0.875095 0.663659 0.381422 Lu\n0.375095 0.836341 0.381422 Lu\n0.875095 0.663659 0.118578 Lu\n0.624905 0.163659 0.881422 Lu\n0.124905 0.336341 0.618578 Lu\n0.471976 0.674954 0.598877 Lu\n0.971976 0.825046 0.901123 Lu\n0.528024 0.325046 0.098877 Lu\n0.028024 0.174954 0.401123 Lu\n0.528024 0.325046 0.401123 Lu\n0.028024 0.174954 0.098877 Lu\n0.471976 0.674954 0.901123 Lu\n0.971976 0.825046 0.598877 Lu\n0.790967 0.504443 0.750000 Lu\n0.290967 0.995557 0.750000 Lu\n0.209033 0.495557 0.250000 Lu\n0.709033 0.004443 0.250000 Lu\n0.711808 0.974132 0.455897 Pt\n0.211808 0.525868 0.044103 Pt\n0.288192 0.025868 0.955897 Pt\n0.788192 0.474132 0.544103 Pt\n0.288192 0.025868 0.544103 Pt\n0.788192 0.474132 0.955897 Pt\n0.711808 0.974132 0.044103 Pt\n0.211808 0.525868 0.455897 Pt\n0.424027 0.377426 0.750000 Pt\n0.924027 0.122574 0.750000 Pt\n0.575973 0.622574 0.250000 Pt\n0.075973 0.877426 0.250000 Pt\n0.658721 0.857691 0.750000 Pt\n0.158721 0.642309 0.750000 Pt\n0.341279 0.142309 0.250000 Pt\n0.841279 0.357691 0.250000 Pt\n",
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"formula_full": "Lu20 Pt16",
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{
"id": "mp-1203227",
"created_at": "2022-09-04T14:42:47.159008Z",
"structure_string": "Gd16 C8 Cl12\n1.0\n3.706976 0.000000 0.000000\n0.000000 10.694477 0.000000\n0.000000 0.000000 19.947072\nGd C Cl\n16 8 12\ndirect\n0.250000 0.139316 0.572342 Gd\n0.250000 0.639316 0.927658 Gd\n0.750000 0.860684 0.427658 Gd\n0.750000 0.360684 0.072342 Gd\n0.250000 0.637971 0.756388 Gd\n0.250000 0.137971 0.743612 Gd\n0.750000 0.362029 0.243612 Gd\n0.750000 0.862029 0.256388 Gd\n0.250000 0.100274 0.331550 Gd\n0.250000 0.600274 0.168450 Gd\n0.750000 0.899726 0.668450 Gd\n0.750000 0.399726 0.831550 Gd\n0.250000 0.123769 0.163337 Gd\n0.250000 0.623769 0.336663 Gd\n0.750000 0.876231 0.836663 Gd\n0.750000 0.376231 0.663337 Gd\n0.250000 0.863579 0.348716 C\n0.250000 0.363579 0.151284 C\n0.750000 0.136421 0.651284 C\n0.750000 0.636421 0.848716 C\n0.250000 0.388700 0.749192 C\n0.250000 0.888700 0.750808 C\n0.750000 0.611300 0.250808 C\n0.750000 0.111300 0.249192 C\n0.250000 0.379962 0.951717 Cl\n0.250000 0.879962 0.548283 Cl\n0.750000 0.620038 0.048283 Cl\n0.750000 0.120038 0.451717 Cl\n0.250000 0.887593 0.946625 Cl\n0.250000 0.387593 0.553375 Cl\n0.750000 0.112407 0.053375 Cl\n0.750000 0.612407 0.446625 Cl\n0.250000 0.360053 0.355227 Cl\n0.250000 0.860053 0.144773 Cl\n0.750000 0.639947 0.644773 Cl\n0.750000 0.139947 0.855227 Cl\n",
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"elements": [
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"density": 6.378374164703327,
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{
"id": "mp-1096284",
"created_at": "2022-09-04T14:47:00.973104Z",
"structure_string": "Ta1 Ga1 Tc2\n1.0\n-4.749091 5.425196 7.673607\n4.749091 -5.425196 7.673607\n4.749091 5.425196 -7.673607\nTa Ga Tc\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Ta\n0.000000 0.000000 0.000000 Ga\n0.000000 0.264275 0.264275 Tc\n0.000000 0.735725 0.735725 Tc\n",
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{
"id": "mp-760244",
"created_at": "2022-09-04T14:43:35.041816Z",
"structure_string": "Ca16 Nb8 O36\n1.0\n5.848767 0.000000 0.000000\n0.000000 8.026339 0.000000\n0.000000 7.896576 16.846791\nCa Nb O\n16 8 36\ndirect\n0.499704 0.837070 0.665413 Ca\n0.055438 0.593176 0.662327 Ca\n0.551146 0.742970 0.507109 Ca\n0.448854 0.257030 0.492891 Ca\n0.944562 0.406824 0.337673 Ca\n0.500296 0.162930 0.334587 Ca\n0.064851 0.922223 0.332108 Ca\n0.564851 0.077777 0.167892 Ca\n0.000296 0.837070 0.165413 Ca\n0.444562 0.593176 0.162327 Ca\n0.948854 0.742970 0.007109 Ca\n0.051146 0.257030 0.992891 Ca\n0.555438 0.406824 0.837673 Ca\n0.999704 0.162930 0.834587 Ca\n0.435149 0.922223 0.832108 Ca\n0.935149 0.077777 0.667892 Ca\n0.487013 0.320527 0.670048 Nb\n0.000000 0.500000 0.500000 Nb\n0.000000 0.000000 0.500000 Nb\n0.512987 0.679473 0.329952 Nb\n0.012987 0.320527 0.170048 Nb\n0.500000 0.000000 0.000000 Nb\n0.500000 0.500000 0.000000 Nb\n0.987013 0.679473 0.829952 Nb\n0.554310 0.148862 0.622150 O\n0.804854 0.461607 0.595693 O\n0.829850 0.849199 0.598781 O\n0.287051 0.490596 0.563041 O\n0.287191 0.886791 0.556018 O\n0.038780 0.220457 0.533811 O\n0.961220 0.779543 0.466189 O\n0.712809 0.113209 0.443982 O\n0.712949 0.509404 0.436959 O\n0.170150 0.150801 0.401219 O\n0.195146 0.538393 0.404307 O\n0.445690 0.851138 0.377850 O\n0.546482 0.470395 0.300594 O\n0.791730 0.794612 0.278971 O\n0.822097 0.183593 0.259776 O\n0.322097 0.816407 0.240224 O\n0.291730 0.205388 0.221029 O\n0.046482 0.529605 0.199406 O\n0.945690 0.148862 0.122150 O\n0.695146 0.461607 0.095693 O\n0.670150 0.849199 0.098781 O\n0.212949 0.490596 0.063041 O\n0.212809 0.886791 0.056018 O\n0.461220 0.220457 0.033811 O\n0.538780 0.779543 0.966189 O\n0.787191 0.113209 0.943982 O\n0.787051 0.509404 0.936959 O\n0.329850 0.150801 0.901219 O\n0.304854 0.538393 0.904307 O\n0.054310 0.851138 0.877850 O\n0.953518 0.470395 0.800594 O\n0.708270 0.794612 0.778971 O\n0.677903 0.183593 0.759776 O\n0.177903 0.816407 0.740224 O\n0.208270 0.205388 0.721029 O\n0.453518 0.529605 0.699406 O\n",
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{
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"created_at": "2022-09-04T14:41:27.552480Z",
"structure_string": "Al1 V1 Cr2\n1.0\n-4.983998 5.443631 7.288202\n4.983998 -5.443631 7.288202\n4.983998 5.443631 -7.288202\nAl V Cr\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 V\n0.241833 0.000000 0.241833 Cr\n0.758167 0.000000 0.758167 Cr\n",
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{
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"structure_string": "K4 Zr4 P8 O32\n1.0\n5.443537 0.000000 0.000000\n0.000000 9.345863 0.000000\n0.000000 6.937877 15.546992\nK Zr P O\n4 4 8 32\ndirect\n0.063013 0.500000 0.750000 K\n0.936987 0.500000 0.250000 K\n0.945906 0.000000 0.750000 K\n0.054094 0.000000 0.250000 K\n0.770664 0.251859 0.497725 Zr\n0.770664 0.748141 0.002275 Zr\n0.229336 0.748141 0.502275 Zr\n0.229336 0.251859 0.997725 Zr\n0.724655 0.835361 0.614596 P\n0.724655 0.164639 0.885404 P\n0.275345 0.164639 0.385404 P\n0.275345 0.835361 0.114596 P\n0.273497 0.333120 0.611748 P\n0.273497 0.666880 0.888252 P\n0.726503 0.666880 0.388252 P\n0.726503 0.333120 0.111748 P\n0.747299 0.015406 0.583844 O\n0.747299 0.984594 0.916156 O\n0.252701 0.984594 0.416156 O\n0.252701 0.015406 0.083844 O\n0.484443 0.794521 0.580411 O\n0.484443 0.205479 0.919589 O\n0.515557 0.205479 0.419589 O\n0.515557 0.794521 0.080411 O\n0.946364 0.776276 0.578756 O\n0.946364 0.223724 0.921244 O\n0.053636 0.223724 0.421244 O\n0.053636 0.776276 0.078756 O\n0.512703 0.310711 0.569681 O\n0.512703 0.689289 0.930319 O\n0.487297 0.689289 0.430319 O\n0.487297 0.310711 0.069681 O\n0.771800 0.489889 0.412846 O\n0.771800 0.510111 0.087154 O\n0.228200 0.510111 0.587154 O\n0.228200 0.489889 0.912846 O\n0.053711 0.268334 0.578189 O\n0.053711 0.731666 0.921811 O\n0.946289 0.731666 0.421811 O\n0.946289 0.268334 0.078189 O\n0.738735 0.753579 0.713447 O\n0.738735 0.246421 0.786553 O\n0.261265 0.246421 0.286553 O\n0.261265 0.753579 0.213447 O\n0.282446 0.756625 0.789667 O\n0.282446 0.243375 0.710333 O\n0.717554 0.243375 0.210333 O\n0.717554 0.756625 0.289667 O\n",
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{
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"formula_full": "Mn12 Al4 Si12 O48",
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},
{
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"created_at": "2022-09-04T14:40:02.130467Z",
"structure_string": "Rb4 P4 Pb4 S16\n1.0\n6.557832 0.000000 0.000000\n0.000000 6.833646 0.000000\n0.000000 0.000000 17.650358\nRb P Pb S\n4 4 4 16\ndirect\n0.018870 0.002944 0.043444 Rb\n0.518870 0.497056 0.956556 Rb\n0.981130 0.502944 0.456556 Rb\n0.481130 0.997056 0.543444 Rb\n0.218748 0.011344 0.346980 P\n0.281252 0.988656 0.846980 P\n0.718748 0.488656 0.653020 P\n0.781252 0.511344 0.153020 P\n0.285994 0.471495 0.230615 Pb\n0.785994 0.028505 0.769385 Pb\n0.714006 0.971495 0.269385 Pb\n0.214006 0.528505 0.730615 Pb\n0.348896 0.964382 0.732719 S\n0.151104 0.035618 0.232719 S\n0.397273 0.248071 0.374103 S\n0.897273 0.251929 0.625897 S\n0.887684 0.737340 0.633473 S\n0.956348 0.003807 0.410128 S\n0.043652 0.503807 0.089872 S\n0.112316 0.237340 0.866527 S\n0.651104 0.464382 0.767281 S\n0.102727 0.751929 0.874103 S\n0.602727 0.748071 0.125897 S\n0.848896 0.535618 0.267281 S\n0.387684 0.762660 0.366527 S\n0.456348 0.496193 0.589872 S\n0.543652 0.996193 0.910128 S\n0.612316 0.262660 0.133473 S\n",
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{
"id": "mp-1180012",
"created_at": "2022-09-04T14:48:12.136055Z",
"structure_string": "Os4 N20 Cl12\n1.0\n6.297641 0.000000 0.000000\n0.000000 7.394396 0.000000\n0.000000 0.000000 16.985885\nOs N Cl\n4 20 12\ndirect\n0.250000 0.339992 0.652319 Os\n0.250000 0.160008 0.152319 Os\n0.750000 0.660008 0.347681 Os\n0.750000 0.839992 0.847681 Os\n0.250000 0.149115 0.712130 N\n0.250000 0.350885 0.212130 N\n0.750000 0.850885 0.287870 N\n0.750000 0.649115 0.787870 N\n0.250000 0.530217 0.712358 N\n0.250000 0.969783 0.212358 N\n0.750000 0.469783 0.287642 N\n0.750000 0.030217 0.787642 N\n0.017425 0.338931 0.582288 N\n0.482575 0.161069 0.082288 N\n0.517425 0.661069 0.417712 N\n0.982575 0.838931 0.917712 N\n0.982575 0.661069 0.417712 N\n0.517425 0.838931 0.917712 N\n0.482575 0.338931 0.582288 N\n0.017425 0.161069 0.082288 N\n0.250000 0.129466 0.436661 N\n0.250000 0.370534 0.936661 N\n0.750000 0.870534 0.563339 N\n0.750000 0.629466 0.063339 N\n0.250000 0.666742 0.430756 Cl\n0.250000 0.833258 0.930756 Cl\n0.750000 0.333258 0.569244 Cl\n0.750000 0.166742 0.069244 Cl\n0.027728 0.350661 0.881774 Cl\n0.472272 0.149339 0.381774 Cl\n0.527728 0.649339 0.118226 Cl\n0.972272 0.850661 0.618226 Cl\n0.972272 0.649339 0.118226 Cl\n0.527728 0.850661 0.618226 Cl\n0.472272 0.350661 0.881774 Cl\n0.027728 0.149339 0.381774 Cl\n",
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{
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"created_at": "2022-09-04T14:44:52.589623Z",
"structure_string": "Ta1 Cr2 Re1\n1.0\n-4.716459 5.392366 7.775270\n4.716459 -5.392366 7.775270\n4.716459 5.392366 -7.775270\nTa Cr Re\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.000000 0.239991 0.239991 Cr\n0.000000 0.760009 0.760009 Cr\n0.000000 0.500000 0.500000 Re\n",
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]
}