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{
"id": "mp-1185403",
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{
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{
"id": "mp-1096957",
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"structure_string": "Cr24 N48\n1.0\n5.557330 0.000000 0.000000\n0.000000 9.009159 0.000000\n0.000000 0.000000 29.151278\nCr N\n24 48\ndirect\n0.108598 0.806761 0.861346 Cr\n0.891402 0.306761 0.638654 Cr\n0.391402 0.193239 0.361346 Cr\n0.608598 0.693239 0.138654 Cr\n0.002123 0.185720 0.861425 Cr\n0.997877 0.685720 0.638575 Cr\n0.497877 0.814280 0.361425 Cr\n0.502123 0.314280 0.138575 Cr\n0.116285 0.687004 0.973118 Cr\n0.883715 0.187004 0.526882 Cr\n0.383715 0.312996 0.473118 Cr\n0.616285 0.812996 0.026882 Cr\n0.007256 0.311128 0.972123 Cr\n0.992744 0.811128 0.527877 Cr\n0.492744 0.688872 0.472123 Cr\n0.507256 0.188872 0.027877 Cr\n0.608292 0.686665 0.805851 Cr\n0.391708 0.186665 0.694149 Cr\n0.891708 0.313335 0.305851 Cr\n0.108292 0.813335 0.194149 Cr\n0.503566 0.306825 0.804601 Cr\n0.496434 0.806825 0.695399 Cr\n0.996434 0.693175 0.304601 Cr\n0.003566 0.193175 0.195399 Cr\n0.555359 0.487606 0.805331 N\n0.444641 0.987606 0.694669 N\n0.944641 0.512394 0.305331 N\n0.055359 0.012394 0.194669 N\n0.065176 0.988972 0.862164 N\n0.934824 0.488972 0.637836 N\n0.434824 0.011028 0.362164 N\n0.565176 0.511028 0.137836 N\n0.062853 0.496764 0.974044 N\n0.937147 0.996764 0.525956 N\n0.437147 0.503236 0.474044 N\n0.562853 0.003236 0.025956 N\n0.088526 0.740815 0.917376 N\n0.911474 0.240815 0.582624 N\n0.411474 0.259185 0.417376 N\n0.588526 0.759185 0.082624 N\n0.956375 0.249369 0.916156 N\n0.043625 0.749369 0.583844 N\n0.543625 0.750631 0.416156 N\n0.456375 0.250631 0.083844 N\n0.434711 0.248159 0.748804 N\n0.565289 0.748159 0.751196 N\n0.065289 0.751841 0.248804 N\n0.934711 0.251841 0.251196 N\n0.893703 0.724087 0.826447 N\n0.106297 0.224087 0.673553 N\n0.606297 0.275913 0.326447 N\n0.393703 0.775913 0.173553 N\n0.751972 0.216511 0.827294 N\n0.248028 0.716511 0.672706 N\n0.748028 0.783489 0.327294 N\n0.251972 0.283489 0.172706 N\n0.400084 0.762898 0.840236 N\n0.599916 0.262898 0.659764 N\n0.099916 0.237102 0.340236 N\n0.900084 0.737102 0.159764 N\n0.247949 0.265352 0.839135 N\n0.752051 0.765352 0.660865 N\n0.252051 0.734648 0.339135 N\n0.747949 0.234648 0.160865 N\n0.902883 0.772334 0.006758 N\n0.097117 0.272334 0.493242 N\n0.597117 0.227666 0.506758 N\n0.402883 0.727666 0.993242 N\n0.752272 0.276908 0.006049 N\n0.247728 0.776908 0.493951 N\n0.747728 0.723092 0.506049 N\n0.252272 0.223092 0.993951 N\n",
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{
"id": "mp-23704",
"created_at": "2022-09-04T14:47:09.070244Z",
"structure_string": "Na2 Al2 H8\n1.0\n-2.492059 2.492059 5.545934\n2.492059 -2.492059 5.545934\n2.492059 2.492059 -5.545934\nNa Al H\n2 2 8\ndirect\n0.750000 0.250000 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.250000 0.750000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.723492 0.816802 0.378395 H\n0.566802 0.688407 0.593310 H\n0.095097 0.973492 0.406690 H\n0.438407 0.345097 0.621605 H\n0.311593 0.904903 0.878395 H\n0.654903 0.276508 0.093310 H\n0.183198 0.561593 0.906690 H\n0.026508 0.433198 0.121605 H\n",
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{
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"created_at": "2022-09-04T14:47:09.077433Z",
"structure_string": "Mg1 Sn3\n1.0\n-1.688683 2.728191 5.644625\n1.688683 -2.728191 5.644625\n1.688683 2.728191 -5.644625\nMg Sn\n1 3\ndirect\n0.668674 0.000000 0.668674 Mg\n0.169507 0.500000 0.669507 Sn\n0.251824 0.254247 0.997577 Sn\n0.743329 0.745753 0.997577 Sn\n",
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{
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"structure_string": "Al39 Ru12\n1.0\n4.109123 7.974228 0.000000\n-4.109123 7.974228 0.000000\n0.000000 3.905141 12.188718\nAl Ru\n39 12\ndirect\n0.500000 0.500000 0.500000 Al\n0.749490 0.250510 0.000000 Al\n0.250510 0.749490 0.000000 Al\n0.932413 0.932413 0.174558 Al\n0.067587 0.067587 0.825442 Al\n0.677576 0.677576 0.283116 Al\n0.322424 0.322424 0.716884 Al\n0.764137 0.764137 0.539102 Al\n0.235863 0.235863 0.460898 Al\n0.927872 0.927872 0.580212 Al\n0.072128 0.072128 0.419788 Al\n0.760558 0.760558 0.956926 Al\n0.239442 0.239442 0.043074 Al\n0.518631 0.518631 0.829556 Al\n0.481369 0.481369 0.170444 Al\n0.690063 0.690063 0.773682 Al\n0.309937 0.309937 0.226318 Al\n0.917682 0.917682 0.785760 Al\n0.082318 0.082318 0.214240 Al\n0.593805 0.034439 0.109849 Al\n0.965561 0.406195 0.890151 Al\n0.406195 0.965561 0.890151 Al\n0.034439 0.593805 0.109849 Al\n0.416807 0.849145 0.108950 Al\n0.150855 0.583193 0.891050 Al\n0.583193 0.150855 0.891050 Al\n0.849145 0.416807 0.108950 Al\n0.599327 0.042867 0.335326 Al\n0.957133 0.400673 0.664674 Al\n0.400673 0.957133 0.664674 Al\n0.042867 0.599327 0.335326 Al\n0.276630 0.742053 0.329524 Al\n0.257947 0.723370 0.670476 Al\n0.723370 0.257947 0.670476 Al\n0.742053 0.276630 0.329524 Al\n0.413228 0.858837 0.480461 Al\n0.141163 0.586772 0.519539 Al\n0.586772 0.141163 0.519539 Al\n0.858837 0.413228 0.480461 Al\n0.914703 0.914703 0.382984 Ru\n0.085297 0.085297 0.617016 Ru\n0.598627 0.598627 0.624461 Ru\n0.401373 0.401373 0.375539 Ru\n0.908101 0.908101 0.987550 Ru\n0.091899 0.091899 0.012450 Ru\n0.599513 0.599513 0.984689 Ru\n0.400487 0.400487 0.015311 Ru\n0.384434 0.976943 0.278414 Ru\n0.023057 0.615566 0.721586 Ru\n0.615566 0.023057 0.721586 Ru\n0.976943 0.384434 0.278414 Ru\n",
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{
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{
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"structure_string": "Pm8 Mg4 Se16\n1.0\n6.938557 0.000000 0.000000\n0.000000 8.493157 0.000000\n0.000000 0.000000 14.524065\nPm Mg Se\n8 4 16\ndirect\n0.500000 0.000000 0.000000 Pm\n0.000000 0.000000 0.500000 Pm\n0.000000 0.500000 0.500000 Pm\n0.500000 0.500000 0.000000 Pm\n0.001419 0.750000 0.233517 Pm\n0.998581 0.250000 0.766483 Pm\n0.501419 0.250000 0.266483 Pm\n0.498581 0.750000 0.733517 Pm\n0.918078 0.250000 0.092423 Mg\n0.081922 0.750000 0.907577 Mg\n0.418078 0.750000 0.407577 Mg\n0.581922 0.250000 0.592423 Mg\n0.745184 0.011590 0.168737 Se\n0.254816 0.988410 0.831263 Se\n0.245184 0.988410 0.331263 Se\n0.754816 0.011590 0.668737 Se\n0.754816 0.488410 0.668737 Se\n0.245184 0.511590 0.331263 Se\n0.254816 0.511590 0.831263 Se\n0.745184 0.488410 0.168737 Se\n0.245874 0.750000 0.069872 Se\n0.754126 0.250000 0.930128 Se\n0.745874 0.250000 0.430128 Se\n0.254126 0.750000 0.569872 Se\n0.284462 0.250000 0.091962 Se\n0.715538 0.750000 0.908038 Se\n0.784462 0.750000 0.408038 Se\n0.215538 0.250000 0.591962 Se\n",
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{
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"structure_string": "La2 Al20 Fe4\n1.0\n4.507394 -5.120469 0.000000\n4.507394 5.120469 0.000000\n0.000000 0.000000 9.064165\nLa Al Fe\n2 20 4\ndirect\n0.877251 0.122749 0.750000 La\n0.122749 0.877251 0.250000 La\n0.624320 0.375680 0.546762 Al\n0.375680 0.624320 0.453238 Al\n0.375680 0.624320 0.046762 Al\n0.624320 0.375680 0.953238 Al\n0.230264 0.230264 0.500000 Al\n0.769736 0.769736 0.500000 Al\n0.769736 0.769736 0.000000 Al\n0.230264 0.230264 0.000000 Al\n0.838460 0.161540 0.099079 Al\n0.161540 0.838460 0.900921 Al\n0.161540 0.838460 0.599079 Al\n0.838460 0.161540 0.400921 Al\n0.866403 0.587355 0.750000 Al\n0.133597 0.412645 0.250000 Al\n0.412645 0.133597 0.750000 Al\n0.587355 0.866403 0.250000 Al\n0.221849 0.481080 0.750000 Al\n0.778151 0.518920 0.250000 Al\n0.518920 0.778151 0.750000 Al\n0.481080 0.221849 0.250000 Al\n0.000000 0.500000 0.500000 Fe\n0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.500000 0.000000 0.500000 Fe\n",
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{
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{
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},
{
"id": "mp-1247449",
"created_at": "2022-09-04T14:47:08.953822Z",
"structure_string": "Sr6 Ta2 N6\n1.0\n7.956085 -0.000193 0.000000\n-3.978208 6.890131 0.000000\n0.000000 0.000000 5.518796\nSr Ta N\n6 2 6\ndirect\n0.880252 0.643542 0.250000 Sr\n0.763276 0.119745 0.250000 Sr\n0.356450 0.236705 0.250000 Sr\n0.119748 0.356458 0.750000 Sr\n0.236724 0.880255 0.750000 Sr\n0.643550 0.763295 0.750000 Sr\n0.666666 0.333337 0.750000 Ta\n0.333334 0.666663 0.250000 Ta\n0.862442 0.608930 0.750000 N\n0.746471 0.137570 0.750000 N\n0.391075 0.253517 0.750000 N\n0.137558 0.391070 0.250000 N\n0.253529 0.862430 0.250000 N\n0.608925 0.746483 0.250000 N\n",
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"density": 5.33330554271354,
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"volume": 302.52770405758633,
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"formula_full": "Sr6 Ta2 N6",
"formula_reduced": "Sr3TaN3",
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"updated_at": "2021-11-28T01:37:53.172000Z",
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}
]
}