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{
"id": "mp-1189510",
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"structure_string": "Zr10 Sn6 S2\n1.0\n4.293772 -7.437031 0.000000\n4.293772 7.437031 0.000000\n0.000000 0.000000 6.018276\nZr Sn S\n10 6 2\ndirect\n0.666667 0.333333 0.000000 Zr\n0.333333 0.666667 0.000000 Zr\n0.333333 0.666667 0.500000 Zr\n0.666667 0.333333 0.500000 Zr\n0.748005 0.748005 0.750000 Zr\n0.251995 0.000000 0.750000 Zr\n0.000000 0.251995 0.750000 Zr\n0.251995 0.251995 0.250000 Zr\n0.748005 0.000000 0.250000 Zr\n0.000000 0.748005 0.250000 Zr\n0.398990 0.398990 0.750000 Sn\n0.601010 0.000000 0.750000 Sn\n0.000000 0.601010 0.750000 Sn\n0.601010 0.601010 0.250000 Sn\n0.398990 0.000000 0.250000 Sn\n0.000000 0.398990 0.250000 Sn\n0.000000 0.000000 0.000000 S\n0.000000 0.000000 0.500000 S\n",
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{
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"formula_full": "Li9 Co9 O17",
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"spacegroup": 1
},
{
"id": "mp-1244983",
"created_at": "2022-09-04T14:40:22.989369Z",
"structure_string": "Fe40 O40\n1.0\n10.625443 -0.815077 0.225835\n-0.794983 10.421934 -0.328808\n0.186648 -0.317377 9.938067\nFe O\n40 40\ndirect\n0.114982 0.855735 0.106376 Fe\n0.238320 0.645732 0.834401 Fe\n0.997912 0.057635 0.842628 Fe\n0.840013 0.980933 0.150545 Fe\n0.059962 0.983699 0.427887 Fe\n0.136866 0.854298 0.668495 Fe\n0.894985 0.566506 0.070166 Fe\n0.845537 0.754345 0.308046 Fe\n0.316216 0.468353 0.117156 Fe\n0.403274 0.416315 0.788998 Fe\n0.570079 0.448352 0.278073 Fe\n0.677809 0.304148 0.593623 Fe\n0.475229 0.789783 0.699670 Fe\n0.564726 0.938180 0.287790 Fe\n0.173049 0.183524 0.641788 Fe\n0.881988 0.269620 0.051153 Fe\n0.887619 0.384193 0.774986 Fe\n0.282457 0.951052 0.919888 Fe\n0.873391 0.197612 0.423023 Fe\n0.140320 0.670418 0.330634 Fe\n0.576025 0.963797 0.989974 Fe\n0.457876 0.692797 0.356420 Fe\n0.729171 0.096475 0.773076 Fe\n0.124692 0.335329 0.898451 Fe\n0.347343 0.506927 0.536795 Fe\n0.715457 0.812888 0.838142 Fe\n0.685444 0.580327 0.559068 Fe\n0.317297 0.911186 0.445764 Fe\n0.398625 0.767762 0.092028 Fe\n0.601525 0.308793 0.972058 Fe\n0.957426 0.737631 0.864804 Fe\n0.649712 0.189309 0.264611 Fe\n0.676970 0.920278 0.538347 Fe\n0.997698 0.540907 0.574869 Fe\n0.619169 0.607441 0.028070 Fe\n0.835509 0.481928 0.341477 Fe\n0.134480 0.356480 0.396184 Fe\n0.121102 0.154850 0.176337 Fe\n0.416282 0.105716 0.155765 Fe\n0.418246 0.208408 0.506809 Fe\n0.388639 0.585544 0.718316 O\n0.536136 0.459084 0.919131 O\n0.064123 0.660599 0.729293 O\n0.963407 0.622129 0.257110 O\n0.245217 0.038553 0.097658 O\n0.277429 0.064024 0.555032 O\n0.040891 0.017340 0.651193 O\n0.793539 0.665026 0.937032 O\n0.524144 0.552626 0.446474 O\n0.526347 0.282967 0.152278 O\n0.689745 0.350799 0.394970 O\n0.778380 0.973050 0.962555 O\n0.262553 0.316964 0.517099 O\n0.549385 0.754909 0.966217 O\n0.669028 0.759690 0.649025 O\n0.195324 0.350220 0.214248 O\n0.959682 0.387060 0.437663 O\n0.299967 0.830799 0.766205 O\n0.029507 0.273153 0.735228 O\n0.747209 0.122343 0.570126 O\n0.985490 0.911909 0.236983 O\n0.059334 0.163096 0.376885 O\n0.756659 0.256982 0.892976 O\n0.578507 0.967952 0.787324 O\n0.255687 0.486917 0.935840 O\n0.488140 0.850063 0.483422 O\n0.316639 0.775633 0.276311 O\n0.504906 0.328179 0.652882 O\n0.484467 0.096279 0.352502 O\n0.730579 0.886641 0.325034 O\n0.042788 0.187071 0.000426 O\n0.179190 0.542576 0.465274 O\n0.973858 0.431419 0.962042 O\n0.803935 0.481575 0.650436 O\n0.267873 0.260122 0.802603 O\n0.066151 0.901018 0.910140 O\n0.466950 0.590552 0.171502 O\n0.719730 0.553482 0.169467 O\n0.828117 0.175747 0.215848 O\n0.126736 0.825737 0.464301 O\n",
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"formula_full": "Fe40 O40",
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},
{
"id": "mp-1176675",
"created_at": "2022-09-04T14:40:22.993108Z",
"structure_string": "Li4 Lu4 O8\n1.0\n6.125548 0.000000 0.000000\n0.000000 5.992638 0.000000\n0.000000 2.852722 5.326357\nLi Lu O\n4 4 8\ndirect\n0.147463 0.721547 0.545579 Li\n0.647463 0.278453 0.954421 Li\n0.352537 0.721547 0.045579 Li\n0.852537 0.278453 0.454421 Li\n0.871461 0.761119 0.985940 Lu\n0.628539 0.761119 0.485940 Lu\n0.371461 0.238881 0.514060 Lu\n0.128539 0.238881 0.014060 Lu\n0.157135 0.000542 0.821612 O\n0.342865 0.000542 0.321612 O\n0.887529 0.541558 0.765595 O\n0.387529 0.458442 0.734405 O\n0.612471 0.541558 0.265595 O\n0.112471 0.458442 0.234405 O\n0.657135 0.999458 0.678388 O\n0.842865 0.999458 0.178388 O\n",
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"formula_full": "Li4 Lu4 O8",
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},
{
"id": "mp-760796",
"created_at": "2022-09-04T14:40:22.994382Z",
"structure_string": "Li7 Cr1 Fe3 P6 O24\n1.0\n7.594571 -4.415617 0.000000\n7.594571 4.415617 0.000000\n5.027254 0.000000 7.204297\nLi Cr Fe P O\n7 1 3 6 24\ndirect\n0.706396 0.345727 0.163823 Li\n0.163823 0.706396 0.345727 Li\n0.345727 0.163823 0.706396 Li\n0.520502 0.520502 0.520502 Li\n0.755475 0.939516 0.197446 Li\n0.939516 0.197446 0.755475 Li\n0.197446 0.755475 0.939516 Li\n0.855322 0.855322 0.855322 Cr\n0.348287 0.348287 0.348287 Fe\n0.146037 0.146037 0.146037 Fe\n0.646744 0.646744 0.646744 Fe\n0.461873 0.749439 0.042705 P\n0.749439 0.042705 0.461873 P\n0.042705 0.461873 0.749439 P\n0.953807 0.546562 0.247853 P\n0.247853 0.953807 0.546562 P\n0.546562 0.247853 0.953807 P\n0.264651 0.896458 0.092749 O\n0.621838 0.802904 0.999003 O\n0.461860 0.570608 0.214523 O\n0.723834 0.872832 0.471189 O\n0.896458 0.092749 0.264651 O\n0.570608 0.214523 0.461860 O\n0.872832 0.471189 0.723834 O\n0.214523 0.461860 0.570608 O\n0.994508 0.385940 0.193633 O\n0.929963 0.737550 0.084188 O\n0.471189 0.723834 0.872832 O\n0.193633 0.994508 0.385940 O\n0.802904 0.999003 0.621838 O\n0.535404 0.280916 0.115516 O\n0.092749 0.264651 0.896458 O\n0.999003 0.621838 0.802904 O\n0.771168 0.562899 0.415707 O\n0.115516 0.535404 0.280916 O\n0.415707 0.771168 0.562899 O\n0.084188 0.929963 0.737550 O\n0.280916 0.115516 0.535404 O\n0.385940 0.193633 0.994508 O\n0.562899 0.415707 0.771168 O\n0.737550 0.084188 0.929963 O\n",
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{
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},
{
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"structure_string": "Na2 Nd16 Se24\n1.0\n-4.473394 4.473394 13.466945\n4.473394 -4.473394 13.466945\n4.473394 4.473394 -13.466945\nNa Nd Se\n2 16 24\ndirect\n0.500000 0.500000 0.000000 Na\n0.250000 0.750000 0.500000 Na\n0.213138 0.831378 0.125759 Nd\n0.494860 0.625000 0.369860 Nd\n0.917723 0.417723 0.500000 Nd\n0.255140 0.125000 0.630140 Nd\n0.705619 0.087379 0.874241 Nd\n0.832277 0.832277 0.000000 Nd\n0.536862 0.162621 0.118239 Nd\n0.837379 0.955619 0.374241 Nd\n0.581378 0.463138 0.625759 Nd\n0.044381 0.418622 0.881761 Nd\n0.167723 0.167723 0.000000 Nd\n0.875000 0.505140 0.130140 Nd\n0.168622 0.294381 0.381761 Nd\n0.582277 0.082277 0.500000 Nd\n0.912621 0.786862 0.618239 Nd\n0.375000 0.744860 0.869860 Nd\n0.841687 0.438336 0.247623 Se\n0.405936 0.158313 0.596649 Se\n0.190713 0.594064 0.752377 Se\n0.217347 0.470446 0.893440 Se\n0.577007 0.323907 0.106560 Se\n0.006761 0.108268 0.248362 Se\n0.561664 0.809287 0.403351 Se\n0.172993 0.779554 0.246901 Se\n0.859906 0.758398 0.751638 Se\n0.743239 0.491602 0.601508 Se\n0.532653 0.926093 0.753099 Se\n0.559287 0.811664 0.903351 Se\n0.908313 0.655936 0.096649 Se\n0.890094 0.141732 0.398492 Se\n0.344064 0.440713 0.252377 Se\n0.508398 0.109906 0.251638 Se\n0.188336 0.091687 0.747623 Se\n0.073907 0.827007 0.606560 Se\n0.858268 0.256761 0.748362 Se\n0.891732 0.140094 0.898492 Se\n0.241602 0.993239 0.101508 Se\n0.676093 0.782653 0.253099 Se\n0.220446 0.467347 0.393440 Se\n0.529554 0.422993 0.746901 Se\n",
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},
{
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