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{
"id": "mp-1232121",
"created_at": "2022-09-04T14:39:13.339915Z",
"structure_string": "Dy4 Mg2 S8\n1.0\n-4.093287 4.093287 4.255530\n4.093287 -4.093287 4.255530\n4.093287 4.093287 -4.255530\nDy Mg S\n4 2 8\ndirect\n0.875000 0.757193 0.382193 Dy\n0.507193 0.125000 0.882193 Dy\n0.375000 0.492807 0.617807 Dy\n0.242807 0.625000 0.117807 Dy\n0.000000 0.000000 0.000000 Mg\n0.750000 0.250000 0.500000 Mg\n0.506514 0.378624 0.262673 S\n0.756159 0.493486 0.872110 S\n0.115951 0.243841 0.737327 S\n0.621376 0.884049 0.127890 S\n0.243486 0.006159 0.372110 S\n0.993841 0.365951 0.237327 S\n0.634049 0.871376 0.627890 S\n0.128624 0.756514 0.762673 S\n",
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{
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{
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"structure_string": "Cd4 C28 S12 N16\n1.0\n9.557018 0.000000 0.000000\n0.000000 10.760586 0.000000\n0.000000 0.000000 14.051301\nCd C S N\n4 28 12 16\ndirect\n0.997580 0.577373 0.280729 Cd\n0.497580 0.422627 0.719271 Cd\n0.497580 0.922627 0.780729 Cd\n0.997580 0.077373 0.219271 Cd\n0.510380 0.764457 0.357634 C\n0.010380 0.235543 0.642366 C\n0.010380 0.735543 0.857634 C\n0.510380 0.264457 0.142366 C\n0.584358 0.917506 0.386889 C\n0.084358 0.082494 0.613111 C\n0.084358 0.582494 0.886889 C\n0.584358 0.417506 0.113111 C\n0.561190 0.809820 0.452257 C\n0.061190 0.190180 0.547743 C\n0.061190 0.690180 0.952257 C\n0.561190 0.309820 0.047743 C\n0.419805 0.867062 0.441720 C\n0.919805 0.132938 0.558280 C\n0.919805 0.632938 0.941720 C\n0.419805 0.367062 0.058280 C\n0.000300 0.852329 0.388241 C\n0.500300 0.147671 0.611759 C\n0.500300 0.647671 0.888241 C\n0.000300 0.352329 0.111759 C\n0.823040 0.804729 0.175184 C\n0.323040 0.195271 0.824816 C\n0.323040 0.695271 0.675184 C\n0.823040 0.304729 0.324816 C\n0.184475 0.807478 0.180734 C\n0.684475 0.192522 0.819266 C\n0.684475 0.692522 0.680734 C\n0.184475 0.307478 0.319266 C\n0.001979 0.721527 0.447264 S\n0.501979 0.278473 0.552736 S\n0.501979 0.778473 0.947264 S\n0.001979 0.221527 0.052736 S\n0.804695 0.934997 0.117104 S\n0.304695 0.065003 0.882896 S\n0.304695 0.565003 0.617104 S\n0.804695 0.434997 0.382896 S\n0.216175 0.941687 0.131517 S\n0.716175 0.058313 0.868483 S\n0.716175 0.558313 0.631517 S\n0.216175 0.441687 0.368483 S\n0.449724 0.889127 0.339283 N\n0.949724 0.110873 0.660717 N\n0.949724 0.610873 0.839283 N\n0.449724 0.389127 0.160717 N\n0.999391 0.946817 0.345649 N\n0.499391 0.053183 0.654351 N\n0.499391 0.553183 0.845649 N\n0.999391 0.446817 0.154351 N\n0.834936 0.710366 0.217489 N\n0.334936 0.289634 0.782511 N\n0.334936 0.789634 0.717489 N\n0.834936 0.210366 0.282511 N\n0.162173 0.709932 0.216663 N\n0.662173 0.290068 0.783337 N\n0.662173 0.790068 0.716663 N\n0.162173 0.209932 0.283337 N\n",
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{
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"structure_string": "K3 Cu2 P4 H1 O14\n1.0\n5.322973 0.000000 0.000000\n-2.532863 4.997339 0.000000\n-2.276517 -1.283750 12.638063\nK Cu P H O\n3 2 4 1 14\ndirect\n0.000000 0.000000 0.500000 K\n0.797540 0.151383 0.936670 K\n0.202460 0.848617 0.063330 K\n0.027293 0.772878 0.779105 Cu\n0.972707 0.227122 0.220895 Cu\n0.413182 0.470229 0.839718 P\n0.586818 0.529771 0.160282 P\n0.441621 0.708804 0.648239 P\n0.558379 0.291196 0.351761 P\n0.500000 0.500000 0.500000 H\n0.346341 0.439096 0.710730 O\n0.653659 0.560904 0.289270 O\n0.745640 0.624383 0.875872 O\n0.254360 0.375617 0.124128 O\n0.269567 0.637529 0.872949 O\n0.730433 0.362471 0.127051 O\n0.288353 0.188405 0.875564 O\n0.711647 0.811595 0.124436 O\n0.766367 0.887468 0.689552 O\n0.233633 0.112532 0.310448 O\n0.258862 0.844766 0.668774 O\n0.741138 0.155234 0.331226 O\n0.369252 0.606176 0.530630 O\n0.630748 0.393824 0.469370 O\n",
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{
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"structure_string": "Ba1 Ca1 Nb4 O12\n1.0\n4.027957 -4.024057 0.000000\n4.027957 4.024057 0.000000\n0.000000 0.000000 8.044547\nBa Ca Nb O\n1 1 4 12\ndirect\n0.500000 0.500000 -0.000000 Ba\n0.000000 -0.000000 0.500000 Ca\n0.000000 0.500000 0.253119 Nb\n0.000000 0.500000 0.746881 Nb\n0.500000 -0.000000 0.253119 Nb\n0.500000 -0.000000 0.746881 Nb\n0.254751 0.254751 0.255099 O\n0.254751 0.254751 0.744901 O\n0.745249 0.745249 0.255099 O\n0.745249 0.745249 0.744901 O\n0.761085 0.238915 0.743473 O\n0.761085 0.238915 0.256527 O\n0.238915 0.761085 0.256527 O\n0.238915 0.761085 0.743473 O\n0.000000 0.500000 -0.000000 O\n0.000000 0.500000 0.500000 O\n0.500000 -0.000000 -0.000000 O\n0.500000 -0.000000 0.500000 O\n",
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"structure_string": "Cd6 I12\n1.0\n2.165695 -3.751094 0.000000\n2.165695 3.751094 0.000000\n0.000000 0.000000 44.484754\nCd I\n6 12\ndirect\n0.000000 0.000000 0.333332 Cd\n0.333333 0.666667 0.166669 Cd\n0.666667 0.333333 0.833331 Cd\n0.000000 0.000000 0.500000 Cd\n0.000000 0.000000 0.000000 Cd\n0.000000 0.000000 0.666668 Cd\n0.333333 0.666667 0.872183 I\n0.666667 0.333333 0.961209 I\n0.666667 0.333333 0.461207 I\n0.000000 0.000000 0.205479 I\n0.333333 0.666667 0.372158 I\n0.333333 0.666667 0.538793 I\n0.666667 0.333333 0.127817 I\n0.333333 0.666667 0.705508 I\n0.000000 0.000000 0.794521 I\n0.666667 0.333333 0.627842 I\n0.666667 0.333333 0.294492 I\n0.333333 0.666667 0.038791 I\n",
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{
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"structure_string": "Ti34 N12 O48\n1.0\n10.399948 0.000000 0.000000\n0.981482 10.665573 0.000000\n5.198104 0.009312 10.032714\nTi N O\n34 12 48\ndirect\n0.242951 0.877108 0.922029 Ti\n0.932181 0.787335 0.073417 Ti\n0.733516 0.878491 0.929963 Ti\n0.746783 0.787296 0.445052 Ti\n0.122280 0.899463 0.249710 Ti\n0.912122 0.878667 0.570864 Ti\n0.405165 0.552617 0.923594 Ti\n0.576809 0.551174 0.577365 Ti\n0.442336 0.788542 0.055128 Ti\n0.255459 0.788870 0.426420 Ti\n0.416438 0.876494 0.576686 Ti\n0.625085 0.896376 0.250472 Ti\n0.787342 0.565680 0.250941 Ti\n0.044506 0.768737 0.749817 Ti\n0.288892 0.569310 0.249347 Ti\n0.919180 0.452333 0.428098 Ti\n0.080820 0.547667 0.571902 Ti\n0.711108 0.430690 0.750653 Ti\n0.099315 0.453200 0.071950 Ti\n0.900685 0.546800 0.928050 Ti\n0.744541 0.211130 0.573580 Ti\n0.955494 0.231263 0.250183 Ti\n0.374915 0.103624 0.749528 Ti\n0.583562 0.123506 0.423314 Ti\n0.594835 0.447383 0.076406 Ti\n0.423191 0.448826 0.422635 Ti\n0.557664 0.211458 0.944872 Ti\n0.212658 0.434320 0.749059 Ti\n0.087878 0.121333 0.429136 Ti\n0.266484 0.121509 0.070037 Ti\n0.253217 0.212704 0.554948 Ti\n0.877720 0.100537 0.750290 Ti\n0.067819 0.212665 0.926583 Ti\n0.757049 0.122892 0.077971 Ti\n0.386038 0.919565 0.749308 N\n0.767562 0.756073 0.250222 N\n0.902439 0.911960 0.750376 N\n0.267648 0.757072 0.249924 N\n0.564851 0.559267 0.750432 N\n0.931633 0.423805 0.250098 N\n0.068367 0.576195 0.749902 N\n0.732352 0.242928 0.750076 N\n0.435149 0.440733 0.249568 N\n0.097561 0.088040 0.249624 N\n0.232438 0.243927 0.749778 N\n0.613962 0.080435 0.250692 N\n0.622811 0.935291 0.439133 O\n0.742141 0.818761 0.610152 O\n0.538532 0.724639 0.550515 O\n0.935294 0.849968 0.377822 O\n0.311637 0.936281 0.061992 O\n0.061837 0.851330 0.119799 O\n0.338489 0.725687 0.949162 O\n0.127948 0.937100 0.433588 O\n0.602598 0.818656 0.890056 O\n0.398528 0.487189 0.620318 O\n0.267774 0.484606 0.882321 O\n0.977696 0.604381 0.064874 O\n0.563134 0.849593 0.122224 O\n0.040399 0.729451 0.564534 O\n0.855292 0.728584 0.935954 O\n0.102621 0.816501 0.881362 O\n0.790744 0.604226 0.437318 O\n0.812276 0.935868 0.064966 O\n0.431665 0.851086 0.380511 O\n0.234193 0.816215 0.618447 O\n0.288879 0.605002 0.437095 O\n0.711121 0.394998 0.562905 O\n0.098448 0.515990 0.381735 O\n0.476461 0.604607 0.061177 O\n0.901552 0.484010 0.618265 O\n0.229270 0.513072 0.120827 O\n0.770730 0.486928 0.879173 O\n0.523539 0.395393 0.938823 O\n0.897379 0.183499 0.118638 O\n0.187724 0.064132 0.935034 O\n0.144708 0.271416 0.064046 O\n0.436866 0.150407 0.877776 O\n0.765807 0.183785 0.381553 O\n0.959601 0.270549 0.435466 O\n0.601472 0.512811 0.379682 O\n0.732226 0.515394 0.117679 O\n0.209256 0.395774 0.562682 O\n0.568335 0.148914 0.619489 O\n0.022304 0.395619 0.935126 O\n0.688363 0.063719 0.938008 O\n0.872052 0.062900 0.566412 O\n0.397402 0.181344 0.109944 O\n0.661511 0.274313 0.050838 O\n0.257859 0.181239 0.389848 O\n0.064706 0.150032 0.622178 O\n0.461468 0.275361 0.449485 O\n0.938163 0.148670 0.880201 O\n0.377189 0.064709 0.560867 O\n",
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{
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"structure_string": "Pm2 Ag1 Ir1\n1.0\n0.000000 3.612962 3.612962\n3.612962 0.000000 3.612962\n3.612962 3.612962 0.000000\nPm Ag Ir\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pm\n0.750000 0.750000 0.750000 Pm\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Ir\n",
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{
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