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{
"id": "mp-669317",
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"structure_string": "Cs12 Cd4 I20\n1.0\n10.330175 0.000000 0.000000\n0.000000 12.100006 0.000000\n0.000000 0.000000 15.326718\nCs Cd I\n12 4 20\ndirect\n0.578829 0.981505 0.329191 Cs\n0.921171 0.481505 0.829191 Cs\n0.579037 0.750000 0.050243 Cs\n0.921171 0.018495 0.829191 Cs\n0.421171 0.018495 0.670809 Cs\n0.078829 0.981505 0.170809 Cs\n0.079037 0.750000 0.449757 Cs\n0.578829 0.518495 0.329191 Cs\n0.078829 0.518495 0.170809 Cs\n0.420963 0.250000 0.949757 Cs\n0.920963 0.250000 0.550243 Cs\n0.421171 0.481505 0.670809 Cs\n0.689271 0.750000 0.609079 Cd\n0.189271 0.750000 0.890921 Cd\n0.310729 0.250000 0.390921 Cd\n0.810729 0.250000 0.109079 Cd\n0.956696 0.750000 0.991257 I\n0.043304 0.250000 0.008743 I\n0.456696 0.750000 0.508743 I\n0.630013 0.750000 0.788558 I\n0.543304 0.250000 0.491257 I\n0.675391 0.250000 0.764307 I\n0.130013 0.750000 0.711442 I\n0.824609 0.750000 0.264307 I\n0.313397 0.551647 0.937744 I\n0.175391 0.250000 0.735693 I\n0.813397 0.948353 0.562256 I\n0.813397 0.551647 0.562256 I\n0.313397 0.948353 0.937744 I\n0.324609 0.750000 0.235693 I\n0.686603 0.448353 0.062256 I\n0.186603 0.051647 0.437744 I\n0.186603 0.448353 0.437744 I\n0.869987 0.250000 0.288558 I\n0.369987 0.250000 0.211442 I\n0.686603 0.051647 0.062256 I\n",
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{
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"structure_string": "K10 Cu2 As4\n1.0\n2.893529 -5.011739 0.000000\n2.893529 5.011739 0.000000\n0.000000 0.000000 18.950080\nK Cu As\n10 2 4\ndirect\n0.333333 0.666667 0.549251 K\n0.666667 0.333333 0.049251 K\n0.666667 0.333333 0.450749 K\n0.333333 0.666667 0.950749 K\n0.000000 0.000000 0.145243 K\n0.000000 0.000000 0.645243 K\n0.000000 0.000000 0.854757 K\n0.000000 0.000000 0.354757 K\n0.333333 0.666667 0.750000 K\n0.666667 0.333333 0.250000 K\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.750000 Cu\n0.333333 0.666667 0.373281 As\n0.666667 0.333333 0.873281 As\n0.666667 0.333333 0.626719 As\n0.333333 0.666667 0.126719 As\n",
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{
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"structure_string": "Mg12 Zr2 Cu2\n1.0\n4.903000 0.000000 0.000000\n0.000000 6.086728 0.000000\n0.000000 0.000000 11.191049\nMg Zr Cu\n12 2 2\ndirect\n0.000000 0.254347 0.075004 Mg\n0.000000 0.745653 0.075004 Mg\n0.000000 0.000000 0.333217 Mg\n0.500000 0.744397 0.420716 Mg\n0.500000 0.255603 0.420716 Mg\n0.500000 0.000000 0.176251 Mg\n0.000000 0.754347 0.575004 Mg\n0.000000 0.245653 0.575004 Mg\n0.000000 0.500000 0.833217 Mg\n0.500000 0.244397 0.920716 Mg\n0.500000 0.755603 0.920716 Mg\n0.500000 0.500000 0.676251 Mg\n0.000000 0.500000 0.313651 Zr\n0.000000 0.000000 0.813651 Zr\n0.500000 0.500000 0.185441 Cu\n0.500000 0.000000 0.685441 Cu\n",
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{
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{
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{
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{
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"structure_string": "K2 Hg1 Au1 Br6\n1.0\n0.000000 5.521820 5.521820\n5.521820 0.000000 5.521820\n5.521820 5.521820 0.000000\nK Hg Au Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Au\n0.755594 0.244406 0.244406 Br\n0.244406 0.244406 0.755594 Br\n0.244406 0.755594 0.755594 Br\n0.244406 0.755594 0.244406 Br\n0.755594 0.244406 0.755594 Br\n0.755594 0.755594 0.244406 Br\n",
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],
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},
{
"id": "mp-1095943",
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"structure_string": "Ag1 Sb1 Pd2\n1.0\n-5.036441 5.443273 7.713352\n5.036441 -5.443273 7.713352\n5.036441 5.443273 -7.713352\nAg Sb Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ag\n0.000000 0.500000 0.500000 Sb\n0.000000 0.262729 0.262729 Pd\n0.000000 0.737271 0.737271 Pd\n",
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],
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},
{
"id": "mp-1335878",
"created_at": "2022-09-04T14:42:50.059453Z",
"structure_string": "Li25 Ca5 La7 Nb8 O48\n1.0\n11.129803 0.000000 0.000000\n-3.777528 10.668684 0.000000\n-3.563362 -5.410376 9.289649\nLi Ca La Nb O\n25 5 7 8 48\ndirect\n0.243636 0.628224 0.622360 Li\n0.611398 0.230561 0.134125 Li\n0.344795 0.726403 0.809455 Li\n0.353862 0.649183 0.035802 Li\n0.582290 0.904794 0.823382 Li\n0.239654 0.140338 0.155321 Li\n0.258113 0.415864 0.067467 Li\n0.743672 0.884943 0.929512 Li\n0.803039 0.483745 0.364507 Li\n0.111090 0.354309 0.297680 Li\n0.573720 0.279470 0.557462 Li\n0.865802 0.328969 0.256304 Li\n0.648547 0.316239 0.290737 Li\n0.174338 0.431248 0.452851 Li\n0.283179 0.088869 0.977409 Li\n0.406704 0.967808 0.804220 Li\n0.875608 0.753185 0.383043 Li\n0.091752 0.522739 0.136150 Li\n0.844322 0.709726 0.773324 Li\n0.364231 0.144331 0.755270 Li\n0.185448 0.131978 0.715813 Li\n0.620415 0.889022 0.256011 Li\n0.621597 0.721760 0.850392 Li\n0.989014 0.152884 0.692650 Li\n0.222435 0.368675 0.638058 Li\n0.870053 0.249085 0.883586 Ca\n0.342990 0.241488 0.390412 Ca\n0.759862 0.636489 0.130959 Ca\n0.777411 0.170796 0.593172 Ca\n0.407588 0.652284 0.246006 Ca\n0.623301 0.385684 0.767769 La\n0.245590 0.880333 0.382202 La\n0.128936 0.859071 0.755276 La\n0.248907 0.370509 0.861478 La\n0.619199 0.759157 0.605071 La\n0.891864 0.102606 0.253620 La\n0.138702 0.766721 0.133330 La\n0.511449 0.018647 0.003419 Nb\n0.984216 0.983607 0.013684 Nb\n0.975946 0.499995 0.981070 Nb\n0.503865 0.013782 0.501153 Nb\n0.508914 0.474137 0.041269 Nb\n0.991498 0.995253 0.517412 Nb\n0.981226 0.510634 0.529799 Nb\n0.518049 0.524334 0.476923 Nb\n0.298469 0.980858 0.129949 O\n0.406391 0.330261 0.690082 O\n0.668896 0.600055 0.531528 O\n0.022971 0.699049 0.385712 O\n0.479927 0.895384 0.190170 O\n0.190964 0.611246 0.478522 O\n0.879320 0.483124 0.711336 O\n0.029588 0.832274 0.600315 O\n0.392544 0.332517 0.993541 O\n0.657818 0.572100 0.834968 O\n0.073240 0.196088 0.816433 O\n0.622767 0.932333 0.413037 O\n0.625701 0.210120 0.972042 O\n0.390519 0.570483 0.615882 O\n0.307506 0.831214 0.587725 O\n0.085408 0.467994 0.832015 O\n0.881130 0.907007 0.425877 O\n0.827675 0.022197 0.096558 O\n0.186901 0.077629 0.346488 O\n0.907282 0.619736 0.906571 O\n0.577930 0.389568 0.154226 O\n0.814497 0.303262 0.097407 O\n0.524850 0.920662 0.680489 O\n0.109525 0.118666 0.065791 O\n0.911581 0.878799 0.923368 O\n0.472902 0.104300 0.343507 O\n0.157622 0.679450 0.935508 O\n0.417153 0.607829 0.883105 O\n0.063354 0.361410 0.120968 O\n0.785240 0.889101 0.695866 O\n0.180925 0.985054 0.901221 O\n0.107207 0.090049 0.598794 O\n0.903334 0.515308 0.175907 O\n0.692827 0.192357 0.424427 O\n0.611945 0.432718 0.386247 O\n0.401384 0.842751 0.985000 O\n0.384467 0.082326 0.617446 O\n0.924630 0.805403 0.176135 O\n0.589296 0.670071 0.034954 O\n0.321944 0.421504 0.197070 O\n0.960276 0.161177 0.429846 O\n0.162697 0.559029 0.253208 O\n0.785124 0.391894 0.543806 O\n0.491915 0.134749 0.826093 O\n0.981906 0.321569 0.597464 O\n0.340550 0.425066 0.452106 O\n0.594713 0.692412 0.300049 O\n0.699463 0.039466 0.864927 O\n",
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],
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"formula_full": "Li25 Ca5 La7 Nb8 O48",
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"updated_at": "2021-11-28T01:35:49.780000Z",
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}
]
}