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{
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{
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{
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{
"id": "mp-1106174",
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"structure_string": "Tb14 Rh6\n1.0\n4.928694 -8.536749 0.000000\n4.928694 8.536749 0.000000\n0.000000 0.000000 6.215690\nTb Rh\n14 6\ndirect\n0.333333 0.666667 0.458246 Tb\n0.666667 0.333333 0.958246 Tb\n0.124024 0.875976 0.254363 Tb\n0.751952 0.875976 0.254363 Tb\n0.124024 0.248048 0.254363 Tb\n0.875976 0.124024 0.754363 Tb\n0.248048 0.124024 0.754363 Tb\n0.875976 0.751952 0.754363 Tb\n0.540590 0.459410 0.444093 Tb\n0.918820 0.459410 0.444093 Tb\n0.540590 0.081180 0.444093 Tb\n0.459410 0.540590 0.944093 Tb\n0.081180 0.540590 0.944093 Tb\n0.459410 0.918820 0.944093 Tb\n0.809975 0.190025 0.179889 Rh\n0.380051 0.190025 0.179889 Rh\n0.809975 0.619949 0.179889 Rh\n0.190025 0.809975 0.679889 Rh\n0.619949 0.809975 0.679889 Rh\n0.190025 0.380051 0.679889 Rh\n",
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{
"id": "mp-1197145",
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"structure_string": "Hg2 H12 C8 N8 O4\n1.0\n4.616009 0.000000 -2.622752\n-4.545014 0.000000 -5.339857\n0.000000 11.027212 0.000000\nHg H C N O\n2 12 8 8 4\ndirect\n0.500000 0.000000 0.000000 Hg\n0.000000 0.500000 0.500000 Hg\n0.968647 0.325218 0.949899 H\n0.531353 0.174782 0.449899 H\n0.031353 0.674782 0.050101 H\n0.468647 0.825218 0.550101 H\n0.209733 0.447485 0.113947 H\n0.290267 0.052515 0.613947 H\n0.790267 0.552516 0.886053 H\n0.709733 0.947484 0.386053 H\n0.528787 0.445972 0.235969 H\n0.971213 0.054028 0.735969 H\n0.471213 0.554028 0.764031 H\n0.028787 0.945972 0.264031 H\n0.243340 0.321967 0.060734 C\n0.256660 0.178033 0.560734 C\n0.756660 0.678033 0.939266 C\n0.743340 0.821967 0.439266 C\n0.591219 0.316629 0.196870 C\n0.908781 0.183371 0.696870 C\n0.408781 0.683371 0.803130 C\n0.091219 0.816629 0.303130 C\n0.446107 0.240572 0.099997 N\n0.053893 0.259428 0.599997 N\n0.553893 0.759428 0.900003 N\n0.946107 0.740572 0.400003 N\n0.111417 0.249688 0.968418 N\n0.388583 0.250312 0.468418 N\n0.888583 0.750312 0.031582 N\n0.611417 0.749688 0.531582 N\n0.774262 0.250173 0.238073 O\n0.725738 0.249827 0.738073 O\n0.225738 0.749827 0.761927 O\n0.274262 0.750173 0.261927 O\n",
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"formula_full": "Hg2 H12 C8 N8 O4",
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{
"id": "mp-1225325",
"created_at": "2022-09-04T14:43:08.431688Z",
"structure_string": "Dy2 Ga3 Cu1\n1.0\n2.185248 -3.784960 0.000000\n2.185248 3.784960 0.000000\n0.000000 0.000000 7.192749\nDy Ga Cu\n2 3 1\ndirect\n0.333333 0.666667 0.730977 Dy\n0.333333 0.666667 0.260737 Dy\n0.666667 0.333333 0.475592 Ga\n0.666667 0.333333 0.045494 Ga\n0.000000 0.000000 0.950691 Ga\n0.000000 0.000000 0.536510 Cu\n",
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{
"id": "mp-1246652",
"created_at": "2022-09-04T14:43:06.937409Z",
"structure_string": "Ca12 Ti8 N16\n1.0\n5.855083 0.000000 0.000000\n0.000000 10.118127 0.000000\n0.000000 0.000000 9.245065\nCa Ti N\n12 8 16\ndirect\n0.615938 0.156130 0.423125 Ca\n0.884062 0.843870 0.423125 Ca\n0.615938 0.343870 0.076875 Ca\n0.884062 0.656130 0.076875 Ca\n0.384062 0.843870 0.576875 Ca\n0.115938 0.156130 0.576875 Ca\n0.384062 0.656130 0.923125 Ca\n0.115938 0.343870 0.923125 Ca\n0.750000 0.500000 0.399153 Ca\n0.750000 0.000000 0.100847 Ca\n0.250000 0.500000 0.600847 Ca\n0.250000 0.000000 0.899153 Ca\n0.750000 0.500000 0.731757 Ti\n0.750000 0.000000 0.768243 Ti\n0.250000 0.500000 0.268243 Ti\n0.250000 0.000000 0.231757 Ti\n0.639872 0.250000 0.750000 Ti\n0.860128 0.750000 0.750000 Ti\n0.360128 0.750000 0.250000 Ti\n0.139872 0.250000 0.250000 Ti\n0.843980 0.348752 0.613074 N\n0.656020 0.651248 0.613074 N\n0.843980 0.151248 0.886926 N\n0.656020 0.848752 0.886926 N\n0.156020 0.651248 0.386926 N\n0.343980 0.348752 0.386926 N\n0.156020 0.848752 0.113074 N\n0.343980 0.151248 0.113074 N\n0.489211 0.414063 0.832838 N\n0.010789 0.585937 0.832838 N\n0.489211 0.085937 0.667162 N\n0.010789 0.914063 0.667162 N\n0.510789 0.585937 0.167162 N\n0.989211 0.414063 0.167162 N\n0.510789 0.914063 0.332838 N\n0.989211 0.085937 0.332838 N\n",
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{
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"structure_string": "Al40 O60\n1.0\n10.699725 -0.022599 0.108321\n-0.019261 10.257876 0.380291\n0.101516 0.375890 10.202892\nAl O\n40 60\ndirect\n0.252560 0.469516 0.287663 Al\n0.363758 0.981735 0.401771 Al\n0.492586 0.669864 0.689109 Al\n0.599444 0.949048 0.971026 Al\n0.403217 0.073892 0.829200 Al\n0.944012 0.410550 0.765296 Al\n0.347248 0.260405 0.564406 Al\n0.145198 0.997067 0.955702 Al\n0.365952 0.683983 0.961579 Al\n0.808210 0.472137 0.552180 Al\n0.642029 0.723976 0.436056 Al\n0.793283 0.313217 0.267375 Al\n0.962679 0.931485 0.376854 Al\n0.330901 0.720480 0.396281 Al\n0.136362 0.779558 0.531863 Al\n0.305393 0.195259 0.116533 Al\n0.976406 0.277092 0.004536 Al\n0.641829 0.239993 0.498826 Al\n0.674116 0.012792 0.431510 Al\n0.575760 0.150376 0.216592 Al\n0.007873 0.094455 0.182581 Al\n0.848271 0.000405 0.919532 Al\n0.736643 0.891218 0.184759 Al\n0.374169 0.906141 0.116659 Al\n0.126672 0.447451 0.522101 Al\n0.190959 0.162770 0.389450 Al\n0.665388 0.925482 0.690216 Al\n0.537500 0.410738 0.080655 Al\n0.499566 0.503665 0.489887 Al\n0.699407 0.585400 0.172827 Al\n0.239161 0.469587 0.026884 Al\n0.747995 0.625127 0.840781 Al\n0.193342 0.638875 0.748612 Al\n0.993331 0.493119 0.201822 Al\n0.193615 0.250647 0.798893 Al\n0.023081 0.606987 0.947784 Al\n0.438819 0.380169 0.820727 Al\n0.124410 0.757993 0.182565 Al\n0.711099 0.260326 0.953204 Al\n0.963157 0.840363 0.753250 Al\n0.011188 0.910358 0.209797 O\n0.390740 0.061549 0.012093 O\n0.531261 0.965290 0.802245 O\n0.473619 0.495507 0.679611 O\n0.285806 0.336879 0.910659 O\n0.298093 0.104561 0.515266 O\n0.220514 0.343155 0.648735 O\n0.793416 0.505580 0.720528 O\n0.905606 0.108651 0.040186 O\n0.468786 0.809154 0.016192 O\n0.421867 0.225863 0.732683 O\n0.042018 0.090713 0.366553 O\n0.819203 0.934203 0.752675 O\n0.498005 0.325738 0.494230 O\n0.602593 0.996802 0.143892 O\n0.691888 0.735722 0.264875 O\n0.672997 0.858796 0.525189 O\n0.829380 0.487839 0.236515 O\n0.900445 0.698871 0.856705 O\n0.459812 0.255684 0.150367 O\n0.693372 0.577784 0.001462 O\n0.234413 0.075940 0.819740 O\n0.199453 0.628771 0.930515 O\n0.847117 0.352763 0.914919 O\n0.293329 0.851073 0.508312 O\n0.117393 0.791341 0.712668 O\n0.486339 0.693544 0.506706 O\n0.246883 0.351969 0.165547 O\n0.058449 0.528287 0.795066 O\n0.359833 0.704477 0.779787 O\n0.691812 0.178798 0.340356 O\n0.415490 0.514061 0.984452 O\n0.362392 0.544896 0.390718 O\n0.035083 0.263271 0.832455 O\n0.754965 0.872732 0.014909 O\n0.160762 0.748592 0.352363 O\n0.569245 0.491642 0.224591 O\n0.186539 0.605281 0.574252 O\n0.139492 0.137151 0.063490 O\n0.251659 0.606370 0.158174 O\n0.217963 0.866962 0.060164 O\n0.946955 0.270397 0.199518 O\n0.003485 0.660059 0.116288 O\n0.571349 0.344980 0.914904 O\n0.086561 0.491704 0.342969 O\n0.393592 0.847725 0.280890 O\n0.774528 0.337682 0.464635 O\n0.517625 0.043696 0.375793 O\n0.051708 0.440777 0.040185 O\n0.978559 0.844071 0.526691 O\n0.233606 0.326565 0.420045 O\n0.634220 0.729623 0.752530 O\n0.675326 0.560727 0.486133 O\n0.802609 0.960990 0.324808 O\n0.690221 0.280890 0.125036 O\n0.007541 0.942628 0.886997 O\n0.969161 0.422345 0.583944 O\n0.666820 0.089008 0.586962 O\n0.283652 0.085559 0.267540 O\n0.701482 0.098644 0.907169 O\n",
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{
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"structure_string": "Sb4 C8 O20\n1.0\n5.741043 0.000000 0.000000\n0.000000 6.196560 0.000000\n0.000000 0.000000 11.228669\nSb C O\n4 8 20\ndirect\n0.307420 0.560169 0.750000 Sb\n0.692580 0.439831 0.250000 Sb\n0.192580 0.060169 0.250000 Sb\n0.807420 0.939831 0.750000 Sb\n0.107850 0.062569 0.523536 C\n0.892150 0.937431 0.476464 C\n0.392150 0.562569 0.476464 C\n0.892150 0.937431 0.023536 C\n0.607850 0.437431 0.523536 C\n0.107850 0.062569 0.976464 C\n0.607850 0.437431 0.976464 C\n0.392150 0.562569 0.023536 C\n0.481823 0.827583 0.750000 O\n0.518177 0.172417 0.250000 O\n0.018177 0.327583 0.250000 O\n0.981823 0.672417 0.750000 O\n0.110980 0.112751 0.632196 O\n0.889020 0.887249 0.367804 O\n0.389020 0.612751 0.367804 O\n0.889020 0.887249 0.132196 O\n0.610980 0.387249 0.632196 O\n0.110980 0.112751 0.867804 O\n0.610980 0.387249 0.867804 O\n0.389020 0.612751 0.132196 O\n0.267112 0.105513 0.050721 O\n0.732888 0.894487 0.949279 O\n0.232888 0.605513 0.949279 O\n0.732888 0.894487 0.550721 O\n0.767112 0.394487 0.050721 O\n0.267112 0.105513 0.449279 O\n0.767112 0.394487 0.449279 O\n0.232888 0.605513 0.550721 O\n",
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