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{
"id": "mp-12899",
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{
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"structure_string": "Rb1 Sc5 Te8\n1.0\n2.089044 10.779876 0.000000\n-2.089044 10.779876 0.000000\n0.000000 2.586184 10.027131\nRb Sc Te\n1 5 8\ndirect\n0.000000 0.000000 0.000000 Rb\n0.205549 0.205549 0.155942 Sc\n0.500000 0.500000 0.500000 Sc\n0.844196 0.844196 0.478299 Sc\n0.155804 0.155804 0.521701 Sc\n0.794451 0.794451 0.844058 Sc\n0.924932 0.924932 0.665354 Te\n0.075068 0.075068 0.334646 Te\n0.584516 0.584516 0.683956 Te\n0.415484 0.415484 0.316044 Te\n0.664718 0.664718 0.003312 Te\n0.335282 0.335282 0.996688 Te\n0.738223 0.738223 0.341675 Te\n0.261777 0.261777 0.658325 Te\n",
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{
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"structure_string": "Ho4 Mg2 S8\n1.0\n0.000000 5.567989 5.567989\n5.567989 0.000000 5.567989\n5.567989 5.567989 0.000000\nHo Mg S\n4 2 8\ndirect\n0.625000 0.125000 0.625000 Ho\n0.625000 0.625000 0.125000 Ho\n0.125000 0.625000 0.625000 Ho\n0.625000 0.625000 0.625000 Ho\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Mg\n0.379853 0.379853 0.379853 S\n0.860441 0.379853 0.379853 S\n0.379853 0.860441 0.379853 S\n0.379853 0.379853 0.860441 S\n0.870147 0.870147 0.389559 S\n0.870147 0.389559 0.870147 S\n0.389559 0.870147 0.870147 S\n0.870147 0.870147 0.870147 S\n",
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{
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{
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"structure_string": "Sr5 Fe1 Mo4 O15\n1.0\n2.881064 8.601403 0.000000\n-2.881064 8.601403 0.000000\n0.000000 1.906247 6.740726\nSr Fe Mo O\n5 1 4 15\ndirect\n0.808203 0.808203 0.285151 Sr\n0.594188 0.594188 0.091541 Sr\n0.191797 0.191797 0.714849 Sr\n0.405812 0.405812 0.908459 Sr\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Fe\n0.599552 0.599552 0.599566 Mo\n0.198566 0.198566 0.201822 Mo\n0.801434 0.801434 0.798178 Mo\n0.400448 0.400448 0.400434 Mo\n0.198778 0.701863 0.203275 O\n0.000000 0.500000 0.000000 O\n0.604713 0.097585 0.601053 O\n0.801222 0.298137 0.796725 O\n0.395287 0.902415 0.398947 O\n0.303277 0.303277 0.303626 O\n0.098153 0.098153 0.095928 O\n0.696723 0.696723 0.696374 O\n0.901847 0.901847 0.904072 O\n0.500000 0.500000 0.500000 O\n0.097585 0.604713 0.601053 O\n0.902415 0.395287 0.398947 O\n0.500000 0.000000 0.000000 O\n0.701863 0.198778 0.203275 O\n0.298137 0.801222 0.796725 O\n",
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{
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"structure_string": "K4 Ba2 Na4 Ti8 Mn1 Si16 W8 O58\n1.0\n7.142158 7.824797 0.000000\n-7.142158 7.824797 0.000000\n0.000000 6.048685 13.214019\nK Ba Na Ti Mn Si W O\n4 2 4 8 1 16 8 58\ndirect\n0.410209 0.410209 0.182328 K\n0.589791 0.589791 0.817672 K\n0.912590 0.912590 0.692761 K\n0.087410 0.087410 0.307239 K\n0.603983 0.603983 0.329762 Ba\n0.396017 0.396017 0.670238 Ba\n0.478017 0.971086 0.385294 Na\n0.521983 0.028914 0.614706 Na\n0.028914 0.521983 0.614706 Na\n0.971086 0.478017 0.385294 Na\n0.727215 0.272785 0.500000 Ti\n0.272785 0.727215 0.500000 Ti\n0.765420 0.234580 0.000000 Ti\n0.234580 0.765420 0.000000 Ti\n0.737764 0.264235 0.257179 Ti\n0.262236 0.735765 0.742821 Ti\n0.735765 0.262236 0.742821 Ti\n0.264235 0.737764 0.257179 Ti\n0.000000 0.000000 0.000000 Mn\n0.263107 0.043296 0.061115 Si\n0.736893 0.956704 0.938885 Si\n0.956704 0.736893 0.938885 Si\n0.043296 0.263107 0.061115 Si\n0.520051 0.735113 0.063378 Si\n0.479949 0.264887 0.936622 Si\n0.264887 0.479949 0.936622 Si\n0.735113 0.520051 0.063378 Si\n0.764624 0.985605 0.440281 Si\n0.235375 0.014395 0.559719 Si\n0.014395 0.235376 0.559719 Si\n0.985605 0.764625 0.440281 Si\n0.458072 0.243322 0.439552 Si\n0.541928 0.756678 0.560448 Si\n0.756678 0.541928 0.560448 Si\n0.243322 0.458072 0.439552 Si\n0.751611 0.966907 0.214968 W\n0.248389 0.033093 0.785032 W\n0.033093 0.248389 0.785032 W\n0.966907 0.751611 0.214968 W\n0.495518 0.050749 0.164541 W\n0.504482 0.949251 0.835459 W\n0.949251 0.504482 0.835459 W\n0.050749 0.495518 0.164541 W\n0.613450 0.866057 0.028872 O\n0.386550 0.133943 0.971128 O\n0.133943 0.386550 0.971128 O\n0.866057 0.613450 0.028872 O\n0.320017 0.767163 0.353619 O\n0.679983 0.232837 0.646381 O\n0.232837 0.679983 0.646381 O\n0.767163 0.320017 0.353619 O\n0.151028 0.151028 0.099831 O\n0.848972 0.848972 0.900169 O\n0.612141 0.612141 0.030714 O\n0.387859 0.387859 0.969286 O\n0.639336 0.639336 0.605925 O\n0.360664 0.360664 0.394075 O\n0.445157 0.684498 0.184047 O\n0.554843 0.315502 0.815953 O\n0.315502 0.554843 0.815953 O\n0.684498 0.445157 0.184047 O\n0.789682 0.039906 0.997855 O\n0.210318 0.960094 0.002145 O\n0.960094 0.210318 0.002145 O\n0.039906 0.789682 0.997855 O\n0.633671 0.887483 0.482540 O\n0.366329 0.112517 0.517460 O\n0.112517 0.366329 0.517460 O\n0.887483 0.633671 0.482540 O\n0.731291 0.082646 0.510517 O\n0.268709 0.917354 0.489483 O\n0.917354 0.268709 0.489483 O\n0.082646 0.731291 0.510517 O\n0.581350 0.229426 0.004693 O\n0.418650 0.770574 0.995307 O\n0.770574 0.418650 0.995307 O\n0.229426 0.581350 0.004693 O\n0.527340 0.288581 0.509488 O\n0.472660 0.711419 0.490512 O\n0.711419 0.472660 0.490512 O\n0.288581 0.527340 0.509488 O\n0.697775 0.169572 0.150585 O\n0.302225 0.830428 0.849415 O\n0.830428 0.302225 0.849415 O\n0.169572 0.697775 0.150585 O\n0.554100 0.204688 0.341622 O\n0.445900 0.795312 0.658378 O\n0.795312 0.445900 0.658378 O\n0.204688 0.554100 0.341622 O\n0.791791 0.062819 0.319239 O\n0.208209 0.937181 0.680761 O\n0.937181 0.208209 0.680761 O\n0.062819 0.791791 0.319239 O\n0.313908 0.951834 0.157111 O\n0.686092 0.048166 0.842889 O\n0.048166 0.686092 0.842889 O\n0.951834 0.313908 0.157111 O\n0.953821 0.953821 0.157426 O\n0.046179 0.046179 0.842574 O\n0.896587 0.896587 0.457812 O\n0.103413 0.103413 0.542188 O\n",
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{
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},
{
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"structure_string": "Y1 Ga1 Cu2\n1.0\n-5.195131 5.464402 7.712773\n5.195131 -5.464402 7.712773\n5.195131 5.464402 -7.712773\nY Ga Cu\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Ga\n0.000000 0.231833 0.231833 Cu\n0.000000 0.768167 0.768167 Cu\n",
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{
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"structure_string": "Y4 Si2 Sn13 Sb2 O28\n1.0\n13.785738 3.145336 0.000000\n-13.785738 3.145336 0.000000\n0.000000 2.427880 9.500541\nY Si Sn Sb O\n4 2 13 2 28\ndirect\n0.057387 0.476497 0.643440 Y\n0.523503 0.942613 0.356560 Y\n0.942613 0.523503 0.356560 Y\n0.476497 0.057387 0.643440 Y\n0.169326 0.169326 0.285940 Si\n0.830674 0.830674 0.714060 Si\n0.883148 0.625632 0.659201 Sn\n0.657576 0.802099 0.335467 Sn\n0.374368 0.116852 0.340799 Sn\n0.116852 0.374368 0.340799 Sn\n0.342424 0.197901 0.664533 Sn\n0.299574 0.700426 0.000000 Sn\n0.197901 0.342424 0.664533 Sn\n0.000000 0.000000 0.000000 Sn\n0.430312 0.569688 0.000000 Sn\n0.802099 0.657576 0.335467 Sn\n0.625632 0.883148 0.659201 Sn\n0.569688 0.430312 0.000000 Sn\n0.700426 0.299574 0.000000 Sn\n0.856718 0.143282 0.000000 Sb\n0.143282 0.856718 0.000000 Sb\n0.761600 0.037693 0.385714 O\n0.161530 0.606913 0.388751 O\n0.913196 0.913196 0.264557 O\n0.332634 0.332634 0.122936 O\n0.838470 0.393087 0.611249 O\n0.238400 0.962307 0.614286 O\n0.995734 0.612932 0.124823 O\n0.004266 0.387068 0.875177 O\n0.667366 0.667366 0.877064 O\n0.084549 0.256247 0.887052 O\n0.146451 0.248172 0.363301 O\n0.962307 0.238400 0.614286 O\n0.387068 0.004266 0.875177 O\n0.743753 0.915451 0.112948 O\n0.751828 0.853549 0.636699 O\n0.086804 0.086804 0.735443 O\n0.256247 0.084549 0.887052 O\n0.915451 0.743753 0.112948 O\n0.612932 0.995734 0.124823 O\n0.097695 0.386635 0.110889 O\n0.902305 0.613365 0.889111 O\n0.248172 0.146451 0.363301 O\n0.386635 0.097695 0.110889 O\n0.606913 0.161530 0.388751 O\n0.853549 0.751828 0.636699 O\n0.613365 0.902305 0.889111 O\n0.037693 0.761600 0.385714 O\n0.393087 0.838470 0.611249 O\n",
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{
"id": "mp-41742",
"created_at": "2022-09-04T14:43:54.145172Z",
"structure_string": "Ca2 Nd2 Ti2 Mn2 O12\n1.0\n5.673145 0.000000 0.000000\n0.000000 5.512429 0.000000\n0.000000 5.429051 7.600840\nCa Nd Ti Mn O\n2 2 2 2 12\ndirect\n0.701081 0.237958 0.249989 Ca\n0.298919 0.237958 0.749989 Ca\n0.197085 0.763471 0.249788 Nd\n0.802915 0.763471 0.749788 Nd\n0.744058 0.000685 0.000885 Ti\n0.255942 0.000685 0.500885 Ti\n0.747564 0.501883 0.499475 Mn\n0.252436 0.501883 0.999475 Mn\n0.773474 0.657761 0.254118 O\n0.032803 0.842762 0.953786 O\n0.051150 0.232899 0.546695 O\n0.551767 0.765784 0.952683 O\n0.535112 0.154746 0.546682 O\n0.275632 0.342052 0.245900 O\n0.226526 0.657761 0.754118 O\n0.967197 0.842762 0.453786 O\n0.948850 0.232899 0.046695 O\n0.448233 0.765784 0.452683 O\n0.464888 0.154746 0.046682 O\n0.724368 0.342052 0.745900 O\n",
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{
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"structure_string": "Mn13 Fe11 O32\n1.0\n3.012370 5.258840 0.000000\n-3.012370 5.258840 0.000000\n0.000000 3.326340 19.796844\nMn Fe O\n13 11 32\ndirect\n0.410150 0.410150 0.281349 Mn\n0.751967 0.751967 0.250205 Mn\n0.874592 0.874592 0.374396 Mn\n0.342625 0.342625 0.470178 Mn\n0.092516 0.092516 0.220230 Mn\n0.657375 0.657375 0.529822 Mn\n0.248033 0.248033 0.749795 Mn\n0.125408 0.125408 0.625604 Mn\n0.589850 0.589850 0.718651 Mn\n0.158658 0.158658 0.029368 Mn\n0.907484 0.907484 0.779770 Mn\n0.500000 0.500000 0.000000 Mn\n0.841342 0.841342 0.970632 Mn\n0.875445 0.370806 0.376635 Fe\n0.370806 0.875445 0.376635 Fe\n0.124555 0.629194 0.623365 Fe\n0.629194 0.124555 0.623365 Fe\n0.000000 0.000000 0.500000 Fe\n0.876126 0.376440 0.874650 Fe\n0.376440 0.876126 0.874650 Fe\n0.376880 0.376880 0.874357 Fe\n0.623120 0.623120 0.125643 Fe\n0.623560 0.123874 0.125350 Fe\n0.123874 0.623560 0.125350 Fe\n0.165590 0.711362 0.431288 O\n0.711362 0.165590 0.431288 O\n0.028099 0.591230 0.313732 O\n0.591230 0.028099 0.313732 O\n0.586185 0.586185 0.310631 O\n0.825469 0.825469 0.564458 O\n0.700687 0.700687 0.428038 O\n0.174531 0.174531 0.435542 O\n0.299313 0.299313 0.571962 O\n0.048716 0.048716 0.321736 O\n0.408770 0.971901 0.686268 O\n0.971901 0.408770 0.686268 O\n0.288638 0.834410 0.568712 O\n0.834410 0.288638 0.568712 O\n0.194178 0.194178 0.927824 O\n0.951284 0.951284 0.678264 O\n0.082968 0.082968 0.810700 O\n0.559781 0.559781 0.820253 O\n0.413815 0.413815 0.689369 O\n0.669661 0.669661 0.939326 O\n0.674166 0.220749 0.938471 O\n0.220749 0.674166 0.938471 O\n0.531124 0.078283 0.809409 O\n0.078283 0.531124 0.809409 O\n0.325834 0.779251 0.061529 O\n0.779251 0.325834 0.061529 O\n0.330339 0.330339 0.060674 O\n0.440219 0.440219 0.179747 O\n0.917032 0.917032 0.189300 O\n0.805822 0.805822 0.072176 O\n0.921717 0.468876 0.190591 O\n0.468876 0.921717 0.190591 O\n",
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}