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{
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{
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{
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"structure_string": "Li8 Al6 Cu12\n1.0\n2.451813 -4.246665 0.000000\n2.451813 4.246665 0.000000\n0.000000 0.000000 17.428545\nLi Al Cu\n8 6 12\ndirect\n0.333333 0.666667 0.521324 Li\n0.666667 0.333333 0.478676 Li\n0.666667 0.333333 0.021324 Li\n0.333333 0.666667 0.978676 Li\n0.333333 0.666667 0.250000 Li\n0.666667 0.333333 0.750000 Li\n0.000000 0.000000 0.250000 Li\n0.000000 0.000000 0.750000 Li\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.333333 0.666667 0.671392 Al\n0.666667 0.333333 0.328608 Al\n0.666667 0.333333 0.171392 Al\n0.333333 0.666667 0.828608 Al\n0.168527 0.337054 0.117059 Cu\n0.831473 0.662946 0.882942 Cu\n0.662946 0.831473 0.117059 Cu\n0.831473 0.662946 0.617058 Cu\n0.337054 0.168527 0.882942 Cu\n0.168527 0.337054 0.382941 Cu\n0.168527 0.831473 0.117059 Cu\n0.337054 0.168527 0.617058 Cu\n0.831473 0.168527 0.882942 Cu\n0.662946 0.831473 0.382941 Cu\n0.831473 0.168527 0.617058 Cu\n0.168527 0.831473 0.382941 Cu\n",
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{
"id": "mp-1520867",
"created_at": "2022-09-04T14:48:15.219156Z",
"structure_string": "Na1 Gd1 Mg1 Fe1 O6\n1.0\n-3.262947 -0.000000 4.714704\n1.974142 -2.772874 4.746445\n1.974142 2.772874 4.746445\nNa Gd Mg Fe O\n1 1 1 1 6\ndirect\n0.958085 0.664993 0.664993 Na\n0.412875 0.143392 0.143392 Gd\n0.780926 0.405863 0.405863 Mg\n0.282076 0.823025 0.823025 Fe\n0.479814 0.364726 0.364726 O\n0.606396 0.625413 0.625413 O\n0.414378 0.134820 0.737945 O\n0.075536 0.054573 0.545251 O\n0.075536 0.545251 0.054573 O\n0.414378 0.737945 0.134820 O\n",
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"spacegroup": 8
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{
"id": "mp-1032731",
"created_at": "2022-09-04T14:48:14.545482Z",
"structure_string": "Y1 Mg6 Co1 O8\n1.0\n8.796801 0.000000 0.000000\n0.000000 4.382886 0.000000\n0.000000 0.000000 4.382886\nY Mg Co O\n1 6 1 8\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.259828 0.000000 0.500000 Mg\n0.740172 0.000000 0.500000 Mg\n0.259828 0.500000 0.000000 Mg\n0.740172 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Co\n0.261201 0.000000 0.000000 O\n0.738799 0.000000 0.000000 O\n0.265530 0.500000 0.500000 O\n0.734470 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
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{
"id": "mp-1220151",
"created_at": "2022-09-04T14:48:14.218194Z",
"structure_string": "Ni1 Te8 Mo6\n1.0\n7.154926 0.000000 0.000000\n-0.005979 7.183097 0.000000\n-0.688707 -0.155053 7.202995\nNi Te Mo\n1 8 6\ndirect\n0.827929 0.931670 0.507218 Ni\n0.792468 0.773510 0.805907 Te\n0.205029 0.228732 0.210850 Te\n0.902592 0.255905 0.637661 Te\n0.106031 0.750845 0.374474 Te\n0.269372 0.626473 0.866732 Te\n0.731403 0.373479 0.129195 Te\n0.587883 0.887013 0.243629 Te\n0.388739 0.119486 0.739327 Te\n0.590458 0.443623 0.747439 Mo\n0.413985 0.546690 0.246326 Mo\n0.756514 0.570965 0.457667 Mo\n0.248122 0.423515 0.541808 Mo\n0.459884 0.760293 0.576971 Mo\n0.547791 0.243302 0.423198 Mo\n",
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{
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"structure_string": "Ba16 Ge32 O80\n1.0\n13.269719 0.000000 0.000000\n0.000000 9.695599 0.000000\n0.000000 0.946841 13.373131\nBa Ge O\n16 32 80\ndirect\n0.753660 0.878792 0.366025 Ba\n0.990396 0.387824 0.131624 Ba\n0.490396 0.612176 0.368376 Ba\n0.486089 0.387013 0.132948 Ba\n0.247546 0.862616 0.384334 Ba\n0.246340 0.121208 0.633975 Ba\n0.752454 0.137384 0.615666 Ba\n0.513911 0.612987 0.867052 Ba\n0.747546 0.137384 0.115666 Ba\n0.013911 0.387013 0.632948 Ba\n0.009604 0.612176 0.868376 Ba\n0.509604 0.387824 0.631624 Ba\n0.746340 0.878792 0.866025 Ba\n0.252454 0.862616 0.884334 Ba\n0.253660 0.121208 0.133975 Ba\n0.986089 0.612987 0.367052 Ba\n0.500184 0.012487 0.761391 Ge\n0.393549 0.749810 0.613373 Ge\n0.367898 0.240708 0.879628 Ge\n0.632102 0.759292 0.120372 Ge\n0.131115 0.240240 0.908597 Ge\n0.254571 0.474300 0.516858 Ge\n0.867898 0.759292 0.620372 Ge\n0.893549 0.250190 0.886627 Ge\n0.348482 0.735469 0.108399 Ge\n0.132102 0.240708 0.379628 Ge\n0.726565 0.480614 0.239477 Ge\n0.151518 0.735469 0.608399 Ge\n0.745429 0.525700 0.483142 Ge\n0.848482 0.264531 0.391601 Ge\n0.000000 0.000000 0.000000 Ge\n0.499816 0.987513 0.238609 Ge\n0.226565 0.519386 0.260523 Ge\n0.754571 0.525700 0.983142 Ge\n0.651518 0.264531 0.891601 Ge\n0.000184 0.987513 0.738609 Ge\n0.868885 0.759760 0.091403 Ge\n0.999816 0.012487 0.261391 Ge\n0.000000 0.000000 0.500000 Ge\n0.500000 0.000000 0.500000 Ge\n0.773435 0.480614 0.739477 Ge\n0.368885 0.240240 0.408597 Ge\n0.245429 0.474300 0.016858 Ge\n0.273435 0.519386 0.760523 Ge\n0.631115 0.759760 0.591403 Ge\n0.500000 0.000000 0.000000 Ge\n0.606451 0.250190 0.386627 Ge\n0.106451 0.749810 0.113373 Ge\n0.350458 0.327637 0.518399 O\n0.649542 0.672363 0.481601 O\n0.052495 0.822760 0.987555 O\n0.652971 0.385584 0.989481 O\n0.632156 0.413459 0.446737 O\n0.289661 0.518653 0.379649 O\n0.650715 0.665372 0.005603 O\n0.507487 0.102504 0.127743 O\n0.971880 0.688649 0.162107 O\n0.857381 0.362173 0.278395 O\n0.850458 0.672363 0.981601 O\n0.262493 0.219468 0.331815 O\n0.125412 0.067589 0.963730 O\n0.232824 0.417742 0.658585 O\n0.058559 0.945443 0.150146 O\n0.040912 0.827112 0.570881 O\n0.367844 0.586541 0.553263 O\n0.459088 0.827112 0.070881 O\n0.736655 0.162792 0.411884 O\n0.762493 0.780532 0.168185 O\n0.415660 0.156852 0.764455 O\n0.552495 0.177240 0.512445 O\n0.732824 0.582258 0.841415 O\n0.263345 0.837208 0.588116 O\n0.847752 0.318467 0.756354 O\n0.447505 0.822760 0.487555 O\n0.152248 0.681533 0.243646 O\n0.584340 0.843148 0.235545 O\n0.870490 0.931662 0.535128 O\n0.084340 0.156852 0.264455 O\n0.625412 0.932411 0.536270 O\n0.149542 0.327637 0.018399 O\n0.847029 0.385584 0.489481 O\n0.028120 0.311351 0.837893 O\n0.142619 0.637827 0.721605 O\n0.374588 0.067589 0.463730 O\n0.789661 0.481347 0.120351 O\n0.737507 0.780532 0.668185 O\n0.540912 0.172888 0.929119 O\n0.007487 0.897496 0.372257 O\n0.941441 0.054557 0.849854 O\n0.347752 0.681533 0.743646 O\n0.629510 0.931662 0.035128 O\n0.349285 0.334628 0.994397 O\n0.767176 0.582258 0.341415 O\n0.236655 0.837208 0.088116 O\n0.992513 0.102504 0.627743 O\n0.528120 0.688649 0.662107 O\n0.915660 0.843148 0.735545 O\n0.441441 0.945443 0.650146 O\n0.710339 0.481347 0.620351 O\n0.492513 0.897496 0.872257 O\n0.237507 0.219468 0.831815 O\n0.849285 0.665372 0.505603 O\n0.867844 0.413459 0.946737 O\n0.471880 0.311351 0.337893 O\n0.210339 0.518653 0.879649 O\n0.152971 0.614416 0.510519 O\n0.347029 0.614416 0.010519 O\n0.642619 0.362173 0.778395 O\n0.874588 0.932411 0.036270 O\n0.652248 0.318467 0.256354 O\n0.357381 0.637827 0.221605 O\n0.558559 0.054557 0.349854 O\n0.626118 0.051948 0.745346 O\n0.370490 0.068338 0.964872 O\n0.947505 0.177240 0.012445 O\n0.889448 0.585907 0.697255 O\n0.267176 0.417742 0.158585 O\n0.110552 0.414093 0.302745 O\n0.389448 0.414093 0.802745 O\n0.126118 0.948052 0.754654 O\n0.129510 0.068338 0.464872 O\n0.959088 0.172888 0.429119 O\n0.610552 0.585907 0.197255 O\n0.873882 0.051948 0.245346 O\n0.763345 0.162792 0.911884 O\n0.373882 0.948052 0.254654 O\n0.150715 0.334628 0.494397 O\n0.132156 0.586541 0.053263 O\n",
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]
}