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{
"id": "mp-1192789",
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"structure_string": "Cr28\n1.0\n0.000000 0.000000 4.556398\n8.599451 0.000000 0.000000\n0.000000 8.599451 0.000000\nCr\n28\ndirect\n0.500000 0.102862 0.897138 Cr\n0.500000 0.897138 0.102862 Cr\n0.000000 0.397138 0.397138 Cr\n0.000000 0.602862 0.602862 Cr\n0.500000 0.373844 0.965382 Cr\n0.500000 0.626156 0.034618 Cr\n0.000000 0.126156 0.465382 Cr\n0.000000 0.873844 0.534618 Cr\n0.500000 0.965382 0.373844 Cr\n0.500000 0.034618 0.626156 Cr\n0.000000 0.465382 0.126156 Cr\n0.000000 0.534618 0.873844 Cr\n0.500000 0.444959 0.255676 Cr\n0.500000 0.555041 0.744324 Cr\n0.000000 0.055041 0.755676 Cr\n0.000000 0.944959 0.244324 Cr\n0.500000 0.255676 0.444959 Cr\n0.500000 0.744324 0.555041 Cr\n0.000000 0.755676 0.055041 Cr\n0.000000 0.244324 0.944959 Cr\n0.245789 0.312774 0.687226 Cr\n0.245789 0.687226 0.312774 Cr\n0.745789 0.187226 0.187226 Cr\n0.745789 0.812774 0.812774 Cr\n0.754211 0.687226 0.312774 Cr\n0.754211 0.312774 0.687226 Cr\n0.254211 0.812774 0.812774 Cr\n0.254211 0.187226 0.187226 Cr\n",
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{
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"structure_string": "Cr24 Pb12 N48\n1.0\n10.599926 0.000000 0.000000\n-0.000000 10.599926 -0.000000\n0.000000 -0.000000 10.599926\nCr Pb N\n24 12 48\ndirect\n0.368522 0.698535 0.363370 Cr\n0.631478 0.198535 0.136630 Cr\n0.131478 0.301465 0.863370 Cr\n0.868522 0.801465 0.636630 Cr\n0.363370 0.368522 0.698535 Cr\n0.136630 0.631478 0.198535 Cr\n0.863370 0.131478 0.301465 Cr\n0.636630 0.868522 0.801465 Cr\n0.698535 0.363370 0.368522 Cr\n0.198535 0.136630 0.631478 Cr\n0.301465 0.863370 0.131478 Cr\n0.801465 0.636630 0.868522 Cr\n0.631478 0.301465 0.636630 Cr\n0.368522 0.801465 0.863370 Cr\n0.868522 0.698535 0.136630 Cr\n0.131478 0.198535 0.363370 Cr\n0.636630 0.631478 0.301465 Cr\n0.863370 0.368522 0.801465 Cr\n0.136630 0.868522 0.698535 Cr\n0.363370 0.131478 0.198535 Cr\n0.301465 0.636630 0.631478 Cr\n0.801465 0.863370 0.368522 Cr\n0.698535 0.136630 0.868522 Cr\n0.198535 0.363370 0.131478 Cr\n0.500000 0.500000 0.000000 Pb\n0.500000 -0.000000 0.500000 Pb\n0.000000 0.500000 0.500000 Pb\n0.000000 -0.000000 0.000000 Pb\n0.121333 0.878667 0.378667 Pb\n0.878667 0.378667 0.121333 Pb\n0.378667 0.121333 0.878667 Pb\n0.621333 0.621333 0.621333 Pb\n0.878667 0.121333 0.621333 Pb\n0.121333 0.621333 0.878667 Pb\n0.621333 0.878667 0.121333 Pb\n0.378667 0.378667 0.378667 Pb\n0.362699 0.849904 0.286864 N\n0.637301 0.349904 0.213136 N\n0.137301 0.150096 0.786864 N\n0.862699 0.650096 0.713136 N\n0.286864 0.362699 0.849904 N\n0.213136 0.637301 0.349904 N\n0.786864 0.137301 0.150096 N\n0.713136 0.862699 0.650096 N\n0.849904 0.286864 0.362699 N\n0.349904 0.213136 0.637301 N\n0.150096 0.786864 0.137301 N\n0.650096 0.713136 0.862699 N\n0.637301 0.150096 0.713136 N\n0.362699 0.650096 0.786864 N\n0.862699 0.849904 0.213136 N\n0.137301 0.349904 0.286864 N\n0.713136 0.637301 0.150096 N\n0.786864 0.362699 0.650096 N\n0.213136 0.862699 0.849904 N\n0.286864 0.137301 0.349904 N\n0.150096 0.713136 0.637301 N\n0.650096 0.786864 0.362699 N\n0.849904 0.213136 0.862699 N\n0.349904 0.286864 0.137301 N\n0.408141 0.716939 0.524667 N\n0.591859 0.216939 0.975333 N\n0.091859 0.283061 0.024667 N\n0.908141 0.783061 0.475333 N\n0.524667 0.408141 0.716939 N\n0.975333 0.591859 0.216939 N\n0.024667 0.091859 0.283061 N\n0.475333 0.908141 0.783061 N\n0.716939 0.524667 0.408141 N\n0.216939 0.975333 0.591859 N\n0.283061 0.024667 0.091859 N\n0.783061 0.475333 0.908141 N\n0.591859 0.283061 0.475333 N\n0.408141 0.783061 0.024667 N\n0.908141 0.716939 0.975333 N\n0.091859 0.216939 0.524667 N\n0.475333 0.591859 0.283061 N\n0.024667 0.408141 0.783061 N\n0.975333 0.908141 0.716939 N\n0.524667 0.091859 0.216939 N\n0.283061 0.475333 0.591859 N\n0.783061 0.024667 0.408141 N\n0.716939 0.975333 0.908141 N\n0.216939 0.524667 0.091859 N\n",
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"elements": [
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"formula_full": "Cr24 Pb12 N48",
"formula_reduced": "Cr2PbN4",
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"spacegroup": 205
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{
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"created_at": "2022-09-04T14:43:15.186158Z",
"structure_string": "Cr24 P16 O64\n1.0\n8.631711 0.000000 0.000000\n0.000000 10.541040 0.000000\n0.000000 0.000000 14.466163\nCr P O\n24 16 64\ndirect\n0.967167 0.494933 0.459830 Cr\n0.203569 0.419670 0.089546 Cr\n0.154358 0.733914 0.762356 Cr\n0.845642 0.233914 0.737644 Cr\n0.703569 0.080330 0.910454 Cr\n0.796431 0.919670 0.410454 Cr\n0.654358 0.766086 0.237644 Cr\n0.605428 0.418194 0.611116 Cr\n0.691458 0.166902 0.143903 Cr\n0.843284 0.656566 0.868921 Cr\n0.308542 0.666902 0.356097 Cr\n0.345642 0.266086 0.262356 Cr\n0.343284 0.843434 0.131079 Cr\n0.105428 0.081806 0.388884 Cr\n0.394572 0.918194 0.888884 Cr\n0.191458 0.333098 0.856097 Cr\n0.296431 0.580330 0.589546 Cr\n0.808542 0.833098 0.643903 Cr\n0.894572 0.581806 0.111116 Cr\n0.532833 0.505067 0.959830 Cr\n0.656716 0.343434 0.368921 Cr\n0.032833 0.994933 0.040170 Cr\n0.467167 0.005067 0.540170 Cr\n0.156716 0.156566 0.631079 Cr\n0.148653 0.824073 0.535976 P\n0.531679 0.501224 0.188631 P\n0.851347 0.324073 0.964024 P\n0.968321 0.498776 0.688631 P\n0.799505 0.156692 0.528938 P\n0.468321 0.001224 0.311369 P\n0.964077 0.327859 0.260780 P\n0.351347 0.175927 0.035976 P\n0.299505 0.343308 0.471062 P\n0.031679 0.998776 0.811369 P\n0.700495 0.843308 0.028938 P\n0.464077 0.172141 0.739220 P\n0.648653 0.675927 0.464024 P\n0.200495 0.656692 0.971062 P\n0.535923 0.672141 0.760780 P\n0.035923 0.827859 0.239220 P\n0.549677 0.976529 0.406008 O\n0.577481 0.809039 0.103782 O\n0.477838 0.636887 0.453130 O\n0.807513 0.947971 0.066101 O\n0.932674 0.909966 0.752211 O\n0.215659 0.759319 0.626675 O\n0.743096 0.553749 0.484835 O\n0.243096 0.946251 0.515165 O\n0.117225 0.907419 0.159414 O\n0.256904 0.053749 0.015165 O\n0.882886 0.101202 0.441622 O\n0.067326 0.409966 0.747789 O\n0.994526 0.919547 0.321076 O\n0.309100 0.063074 0.323830 O\n0.387003 0.734824 0.798405 O\n0.054212 0.131319 0.762900 O\n0.612997 0.234824 0.701595 O\n0.348589 0.276322 0.763388 O\n0.211621 0.219511 0.497891 O\n0.522162 0.136887 0.046870 O\n0.382775 0.092581 0.659414 O\n0.005474 0.419547 0.178924 O\n0.022162 0.363113 0.953130 O\n0.945788 0.631319 0.737100 O\n0.809100 0.436926 0.676170 O\n0.715659 0.740681 0.373325 O\n0.190900 0.936926 0.823830 O\n0.432674 0.590034 0.247789 O\n0.756904 0.446251 0.984835 O\n0.450323 0.476529 0.093992 O\n0.692487 0.052029 0.566101 O\n0.165732 0.720977 0.461302 O\n0.334268 0.279023 0.961302 O\n0.049677 0.523471 0.593992 O\n0.651411 0.776322 0.736612 O\n0.788379 0.719511 0.002109 O\n0.711621 0.280489 0.502109 O\n0.112997 0.265176 0.298405 O\n0.567326 0.090034 0.252211 O\n0.284341 0.240681 0.126675 O\n0.117114 0.601202 0.058378 O\n0.617225 0.592581 0.840586 O\n0.505474 0.080453 0.821076 O\n0.690900 0.563074 0.176170 O\n0.848589 0.223678 0.236612 O\n0.834268 0.220977 0.038698 O\n0.882775 0.407419 0.340586 O\n0.617114 0.898798 0.941622 O\n0.192487 0.447971 0.433899 O\n0.665732 0.779023 0.538698 O\n0.887003 0.765176 0.201595 O\n0.977838 0.863113 0.546870 O\n0.494526 0.580453 0.678924 O\n0.784341 0.259319 0.873325 O\n0.382886 0.398798 0.558378 O\n0.151411 0.723678 0.263388 O\n0.554212 0.368681 0.237100 O\n0.445788 0.868681 0.262900 O\n0.950323 0.023471 0.906008 O\n0.288379 0.780489 0.997891 O\n0.422519 0.309039 0.396218 O\n0.307513 0.552029 0.933899 O\n0.077481 0.690961 0.896218 O\n0.922519 0.190961 0.603782 O\n",
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{
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"structure_string": "Cr24 P11 C1\n1.0\n0.000000 0.000000 -3.177376\n-3.098717 -5.367135 0.000000\n-18.588547 10.732102 0.000000\nCr P C\n24 11 1\ndirect\n0.500000 0.099675 0.250000 Cr\n0.500000 0.598315 0.500105 Cr\n0.500000 0.113478 0.750000 Cr\n0.500000 0.598315 0.999895 Cr\n0.500000 0.200270 0.099764 Cr\n0.500000 0.700406 0.350131 Cr\n0.500000 0.207904 0.603448 Cr\n0.500000 0.683611 0.843041 Cr\n0.500000 0.700406 0.149869 Cr\n0.500000 0.200270 0.400236 Cr\n0.500000 0.683611 0.656959 Cr\n0.500000 0.207904 0.896552 Cr\n0.000000 0.258769 0.998648 Cr\n0.000000 0.758356 0.250000 Cr\n0.000000 0.258769 0.501352 Cr\n0.000000 0.736690 0.750000 Cr\n0.000000 0.370646 0.185309 Cr\n0.000000 0.871188 0.435967 Cr\n0.000000 0.383026 0.692677 Cr\n0.000000 0.869926 0.932673 Cr\n0.000000 0.871188 0.064033 Cr\n0.000000 0.370646 0.314691 Cr\n0.000000 0.869926 0.567327 Cr\n0.000000 0.383026 0.807323 Cr\n0.000000 0.999707 0.166635 P\n0.000000 0.499486 0.416863 P\n0.000000 0.999628 0.668744 P\n0.000000 0.502028 0.914515 P\n0.000000 0.499486 0.083137 P\n0.000000 0.999707 0.333365 P\n0.000000 0.502028 0.585485 P\n0.000000 0.999628 0.831256 P\n0.500000 0.998687 0.998236 P\n0.500000 0.500062 0.250000 P\n0.500000 0.998687 0.501764 P\n0.500000 0.504145 0.750000 C\n",
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{
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{
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{
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{
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}