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{
"id": "mp-1522943",
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"structure_string": "Na1 Nd1 Eu1 W1 O6\n1.0\n-0.000000 -4.063613 -4.063613\n4.063613 0.000000 -4.063613\n4.063613 -4.063613 0.000000\nNa Nd Eu W O\n1 1 1 1 6\ndirect\n-0.000000 -0.000000 0.000000 Na\n0.750000 0.750000 0.750000 Nd\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 W\n0.737810 0.262190 0.262190 O\n0.262190 0.737810 0.737810 O\n0.737810 0.262190 0.737810 O\n0.262190 0.737810 0.262190 O\n0.737810 0.737810 0.262190 O\n0.262190 0.262190 0.737810 O\n",
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{
"id": "mp-996988",
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{
"id": "mp-1185978",
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"structure_string": "Mn2 Pt2 O5\n1.0\n3.562816 0.000000 0.000000\n0.000000 3.562816 0.000000\n0.000000 0.000000 8.684807\nMn Pt O\n2 2 5\ndirect\n0.500000 0.500000 0.263521 Mn\n0.500000 0.500000 0.736479 Mn\n0.000000 0.000000 0.000000 Pt\n0.000000 0.000000 0.500000 Pt\n0.500000 0.000000 0.139738 O\n0.500000 0.000000 0.860262 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.139738 O\n0.000000 0.500000 0.860262 O\n",
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"volume": 110.24196855003433,
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"formula_full": "Mn2 Pt2 O5",
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},
{
"id": "mp-1233782",
"created_at": "2022-09-04T14:42:23.916216Z",
"structure_string": "Mg1 Nb2 Te4 Cl10 O1\n1.0\n7.139316 -0.235357 0.470566\n2.215286 8.719804 1.374800\n-0.132165 -0.074070 9.163265\nMg Nb Te Cl O\n1 2 4 10 1\ndirect\n0.613457 0.363702 0.975541 Mg\n0.508838 0.652514 0.638494 Nb\n0.490632 0.363500 0.377904 Nb\n0.168162 0.907075 0.158924 Te\n0.103904 0.172963 0.966910 Te\n0.876305 0.816787 0.032014 Te\n0.824799 0.073147 0.825266 Te\n0.476957 0.196351 0.159692 Cl\n0.337189 0.496659 0.838929 Cl\n0.796413 0.207790 0.420189 Cl\n0.202622 0.521277 0.274253 Cl\n0.664148 0.506443 0.165712 Cl\n0.330246 0.204210 0.531747 Cl\n0.799620 0.467995 0.764550 Cl\n0.708159 0.769900 0.476641 Cl\n0.209812 0.790943 0.569250 Cl\n0.535687 0.818867 0.822026 Cl\n0.510458 0.498447 0.509102 O\n",
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"spacegroup": 1
},
{
"id": "mp-555743",
"created_at": "2022-09-04T14:42:23.920676Z",
"structure_string": "Li16 Zn16 P16 O64\n1.0\n4.943647 8.755470 0.000000\n-4.943647 8.755470 0.000000\n0.000000 2.521746 16.219151\nLi Zn P O\n16 16 16 64\ndirect\n0.859793 0.686812 0.498665 Li\n0.800433 0.187214 0.497213 Li\n0.919172 0.240340 0.746892 Li\n0.431166 0.796192 0.747578 Li\n0.298402 0.188693 0.496572 Li\n0.188693 0.298402 0.996572 Li\n0.423291 0.298060 0.747258 Li\n0.298060 0.423291 0.247258 Li\n0.796192 0.431166 0.247578 Li\n0.187214 0.800433 0.997213 Li\n0.686812 0.859793 0.998665 Li\n0.740054 0.925723 0.248489 Li\n0.240340 0.919172 0.246892 Li\n0.687334 0.360616 0.997439 Li\n0.360616 0.687334 0.497439 Li\n0.925723 0.740054 0.748489 Li\n0.054249 0.232557 0.370807 Zn\n0.674504 0.995724 0.622231 Zn\n0.494731 0.619366 0.121422 Zn\n0.120423 0.488695 0.621337 Zn\n0.729428 0.617999 0.872747 Zn\n0.617999 0.729428 0.372747 Zn\n0.488695 0.120423 0.121337 Zn\n0.619366 0.494731 0.621422 Zn\n0.991013 0.173953 0.120861 Zn\n0.232557 0.054249 0.870807 Zn\n0.554491 0.230727 0.372579 Zn\n0.733007 0.115500 0.871894 Zn\n0.230727 0.554491 0.872579 Zn\n0.115500 0.733007 0.371894 Zn\n0.173953 0.991013 0.620861 Zn\n0.995724 0.674504 0.122231 Zn\n0.583183 0.956428 0.811074 P\n0.397936 0.081872 0.309141 P\n0.834686 0.518116 0.060173 P\n0.085349 0.898405 0.809065 P\n0.581604 0.455067 0.810796 P\n0.455067 0.581604 0.310796 P\n0.831519 0.017435 0.060179 P\n0.333376 0.961218 0.058218 P\n0.334795 0.462942 0.058719 P\n0.961218 0.333376 0.558218 P\n0.081872 0.397936 0.809141 P\n0.518116 0.834686 0.560173 P\n0.462942 0.334795 0.558719 P\n0.017435 0.831519 0.560179 P\n0.956428 0.583183 0.311074 P\n0.898405 0.085349 0.309065 P\n0.659005 0.860918 0.548467 O\n0.366151 0.993749 0.572886 O\n0.868685 0.992552 0.573859 O\n0.117323 0.557830 0.326546 O\n0.403514 0.155918 0.385349 O\n0.257630 0.580998 0.984339 O\n0.391682 0.193012 0.231928 O\n0.023532 0.214079 0.634543 O\n0.719894 0.529846 0.136708 O\n0.752220 0.067854 0.320427 O\n0.580998 0.257630 0.484339 O\n0.660693 0.336956 0.884965 O\n0.201593 0.891375 0.734653 O\n0.155918 0.403514 0.885349 O\n0.423196 0.471967 0.797962 O\n0.067854 0.752220 0.820427 O\n0.063088 0.252572 0.821163 O\n0.448694 0.491303 0.573505 O\n0.366918 0.797558 0.042047 O\n0.993749 0.366151 0.072886 O\n0.513909 0.759846 0.484146 O\n0.699868 0.889567 0.734516 O\n0.365394 0.300377 0.042400 O\n0.557603 0.615333 0.826582 O\n0.252573 0.063088 0.321163 O\n0.045020 0.922872 0.294972 O\n0.152890 0.907075 0.887098 O\n0.300377 0.365394 0.542400 O\n0.920331 0.547028 0.796968 O\n0.425575 0.973696 0.795731 O\n0.839297 0.656011 0.386667 O\n0.193012 0.391682 0.731928 O\n0.973696 0.425575 0.295731 O\n0.390818 0.691562 0.231616 O\n0.259825 0.078813 0.983115 O\n0.691562 0.390818 0.731616 O\n0.160995 0.853511 0.549259 O\n0.471967 0.423196 0.297962 O\n0.797558 0.366918 0.542047 O\n0.219854 0.525289 0.136650 O\n0.491303 0.448694 0.073505 O\n0.214079 0.023532 0.134543 O\n0.891375 0.201593 0.234653 O\n0.922872 0.045020 0.794972 O\n0.026576 0.714902 0.635107 O\n0.336956 0.660693 0.384965 O\n0.889567 0.699868 0.234516 O\n0.656011 0.839297 0.886667 O\n0.529846 0.719894 0.636708 O\n0.557830 0.117323 0.826546 O\n0.525289 0.219854 0.636650 O\n0.992552 0.868685 0.073859 O\n0.948040 0.488529 0.574840 O\n0.853511 0.160995 0.049259 O\n0.860918 0.659005 0.048467 O\n0.907075 0.152890 0.387098 O\n0.615333 0.557603 0.326582 O\n0.547028 0.920331 0.296968 O\n0.078813 0.259825 0.483115 O\n0.714902 0.026576 0.135107 O\n0.761714 0.010585 0.982833 O\n0.010585 0.761714 0.482833 O\n0.759846 0.513909 0.984146 O\n0.488529 0.948040 0.074840 O\n",
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{
"id": "mp-530701",
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"structure_string": "Ni5 Mo24 Se32\n1.0\n6.831870 0.000000 0.000000\n-0.093538 6.838018 0.000000\n-0.444909 -0.772495 27.231215\nNi Mo Se\n5 24 32\ndirect\n0.065321 0.502528 0.291251 Ni\n0.498535 0.160874 0.015347 Ni\n0.939623 0.496230 0.460092 Ni\n0.842915 0.928043 0.874412 Ni\n0.845377 0.931368 0.625184 Ni\n0.242884 0.412247 0.888115 Mo\n0.249108 0.412847 0.638374 Mo\n0.217865 0.416892 0.384933 Mo\n0.236922 0.416881 0.140090 Mo\n0.429129 0.532217 0.807873 Mo\n0.432051 0.536481 0.558452 Mo\n0.462411 0.761638 0.894459 Mo\n0.432175 0.554504 0.309364 Mo\n0.467734 0.765671 0.645855 Mo\n0.413441 0.541198 0.057430 Mo\n0.449313 0.757486 0.396791 Mo\n0.439002 0.767143 0.145601 Mo\n0.555293 0.217754 0.854003 Mo\n0.559226 0.218282 0.604810 Mo\n0.585970 0.434249 0.940063 Mo\n0.556118 0.240381 0.354481 Mo\n0.592163 0.434372 0.690150 Mo\n0.548188 0.230260 0.107673 Mo\n0.573447 0.442493 0.441587 Mo\n0.578985 0.455072 0.193159 Mo\n0.776998 0.559303 0.861234 Mo\n0.781464 0.562657 0.612188 Mo\n0.786630 0.581241 0.366136 Mo\n0.758826 0.580364 0.114317 Mo\n0.129079 0.736460 0.846945 Se\n0.133935 0.739461 0.598792 Se\n0.125997 0.758252 0.348492 Se\n0.119546 0.733173 0.094369 Se\n0.231676 0.215043 0.806398 Se\n0.266935 0.621984 0.967486 Se\n0.237185 0.216540 0.557044 Se\n0.275349 0.620698 0.718700 Se\n0.229567 0.207548 0.306511 Se\n0.262410 0.620111 0.472108 Se\n0.205952 0.229569 0.056171 Se\n0.251497 0.622276 0.221033 Se\n0.372587 0.111413 0.934402 Se\n0.384660 0.120057 0.685130 Se\n0.367809 0.128575 0.432820 Se\n0.380623 0.127434 0.187101 Se\n0.616253 0.862802 0.810954 Se\n0.618502 0.867105 0.561672 Se\n0.635791 0.869707 0.318432 Se\n0.600859 0.875194 0.063755 Se\n0.746263 0.356563 0.780934 Se\n0.774541 0.765973 0.947125 Se\n0.756763 0.369590 0.529938 Se\n0.779708 0.767342 0.698285 Se\n0.743898 0.376585 0.279834 Se\n0.775780 0.791043 0.444536 Se\n0.749978 0.388902 0.030942 Se\n0.762401 0.781765 0.194392 Se\n0.888766 0.250212 0.906352 Se\n0.895149 0.252756 0.656563 Se\n0.879398 0.239642 0.402717 Se\n0.871227 0.263149 0.156498 Se\n",
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{
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"structure_string": "Cu6 Se6\n1.0\n1.975632 -3.421895 0.000000\n1.975632 3.421895 0.000000\n0.000000 0.000000 17.501483\nCu Se\n6 6\ndirect\n0.666667 0.333333 0.537722 Cu\n0.333333 0.666667 0.037722 Cu\n0.666667 0.333333 0.962278 Cu\n0.666667 0.333333 0.250000 Cu\n0.333333 0.666667 0.750000 Cu\n0.333333 0.666667 0.462278 Cu\n0.000000 0.000000 0.413104 Se\n0.000000 0.000000 0.913104 Se\n0.000000 0.000000 0.086896 Se\n0.333333 0.666667 0.250000 Se\n0.666667 0.333333 0.750000 Se\n0.000000 0.000000 0.586896 Se\n",
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{
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"structure_string": "Li9 Mn2 Co5 O16\n1.0\n1.437540 2.589977 0.000000\n-1.437540 2.589977 0.000000\n0.000000 1.138298 38.908128\nLi Mn Co O\n9 2 5 16\ndirect\n0.698995 0.698995 0.932706 Li\n0.053808 0.053808 0.813431 Li\n0.439782 0.439782 0.687444 Li\n0.804654 0.804654 0.564704 Li\n0.192031 0.192031 0.435216 Li\n0.563713 0.563713 0.312071 Li\n0.936076 0.936076 0.188030 Li\n0.309071 0.309071 0.065487 Li\n0.374352 0.374352 0.875437 Li\n0.002793 0.002793 0.000899 Mn\n0.498117 0.498117 0.499844 Mn\n0.750648 0.750648 0.749302 Co\n0.123750 0.123750 0.625421 Co\n0.876771 0.876771 0.374318 Co\n0.250463 0.250463 0.249917 Co\n0.623544 0.623544 0.125769 Co\n0.361158 0.361158 0.973864 O\n0.716360 0.716360 0.842716 O\n0.100103 0.100103 0.720626 O\n0.466821 0.466821 0.595953 O\n0.866883 0.866883 0.470940 O\n0.218850 0.218850 0.345723 O\n0.593630 0.593630 0.221070 O\n0.968429 0.968429 0.096111 O\n0.033883 0.033883 0.907598 O\n0.400910 0.400910 0.776590 O\n0.782561 0.782561 0.653925 O\n0.129368 0.129368 0.528574 O\n0.533056 0.533056 0.403720 O\n0.907228 0.907228 0.278754 O\n0.281216 0.281216 0.154261 O\n0.640975 0.640975 0.029580 O\n",
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