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{
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{
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{
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{
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"formula_full": "Al6 Pt10",
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{
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{
"id": "mp-1070580",
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"structure_string": "Al3 Ru2\n1.0\n-1.552514 1.552514 7.163036\n1.552514 -1.552514 7.163036\n1.552514 1.552514 -7.163036\nAl Ru\n3 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.806502 0.806502 0.000000 Al\n0.193498 0.193498 0.000000 Al\n0.606287 0.606287 0.000000 Ru\n0.393713 0.393713 0.000000 Ru\n",
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{
"id": "mp-1069983",
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"structure_string": "Al3 Ru2\n1.0\n2.106293 -3.648206 0.000000\n2.106293 3.648206 0.000000\n0.000000 0.000000 5.110231\nAl Ru\n3 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.666667 0.333333 0.357425 Al\n0.333333 0.666667 0.642575 Al\n0.666667 0.333333 0.846852 Ru\n0.333333 0.666667 0.153148 Ru\n",
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{
"id": "mp-24601",
"created_at": "2022-09-04T14:47:27.089315Z",
"structure_string": "Al6 Si4 H6 O20\n1.0\n6.188624 0.000000 0.000000\n0.430501 7.326295 0.000000\n0.270505 3.340819 7.057604\nAl Si H O\n6 4 6 20\ndirect\n0.154356 0.149075 0.396362 Al\n0.845644 0.850925 0.603638 Al\n0.655989 0.648727 0.394160 Al\n0.344011 0.351273 0.605840 Al\n0.716098 0.745239 0.989918 Al\n0.283902 0.254761 0.010082 Al\n0.864296 0.221004 0.704350 Si\n0.135704 0.778996 0.295650 Si\n0.372624 0.725434 0.708723 Si\n0.627376 0.274566 0.291277 Si\n0.797652 0.235688 0.983957 H\n0.202348 0.764312 0.016043 H\n0.120524 0.499274 0.131917 H\n0.879476 0.500726 0.868083 H\n0.630079 0.999782 0.133379 H\n0.369921 0.000218 0.866621 H\n0.848768 0.111017 0.399377 O\n0.151232 0.888983 0.600623 O\n0.349869 0.609195 0.403406 O\n0.650131 0.390805 0.596594 O\n0.308333 0.488234 0.776145 O\n0.691667 0.511766 0.223855 O\n0.796655 0.986964 0.769590 O\n0.203345 0.013036 0.230410 O\n0.366011 0.138721 0.847338 O\n0.633989 0.861279 0.152662 O\n0.865771 0.638181 0.846393 O\n0.134229 0.361819 0.153607 O\n0.576907 0.238208 0.104611 O\n0.423093 0.761792 0.895389 O\n0.087113 0.745451 0.104229 O\n0.912887 0.254549 0.895771 O\n0.431815 0.214813 0.440596 O\n0.568185 0.785187 0.559404 O\n0.934558 0.716585 0.435915 O\n0.065442 0.283415 0.564085 O\n",
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{
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"structure_string": "Al6 Si6 Ag8 I2 O24\n1.0\n9.072877 0.000000 0.000000\n0.000000 9.072877 0.000000\n0.000000 0.000000 9.072877\nAl Si Ag I O\n6 6 8 2 24\ndirect\n0.250000 0.000000 0.500000 Al\n0.750000 0.000000 0.500000 Al\n0.500000 0.250000 0.000000 Al\n0.500000 0.750000 0.000000 Al\n0.000000 0.500000 0.250000 Al\n0.000000 0.500000 0.750000 Al\n0.250000 0.500000 0.000000 Si\n0.750000 0.500000 0.000000 Si\n0.000000 0.250000 0.500000 Si\n0.000000 0.750000 0.500000 Si\n0.500000 0.000000 0.250000 Si\n0.500000 0.000000 0.750000 Si\n0.175152 0.175152 0.175152 Ag\n0.824848 0.824848 0.175152 Ag\n0.824848 0.175152 0.824848 Ag\n0.675152 0.675152 0.675152 Ag\n0.175152 0.824848 0.824848 Ag\n0.324848 0.324848 0.675152 Ag\n0.675152 0.324848 0.324848 Ag\n0.324848 0.675152 0.324848 Ag\n0.000000 0.000000 0.000000 I\n0.500000 0.500000 0.500000 I\n0.138532 0.148803 0.442930 O\n0.861468 0.851197 0.442930 O\n0.861468 0.148803 0.557070 O\n0.442930 0.138532 0.148803 O\n0.648803 0.638532 0.942930 O\n0.138532 0.851197 0.557070 O\n0.442930 0.861468 0.851197 O\n0.351197 0.361468 0.942930 O\n0.557070 0.861468 0.148803 O\n0.648803 0.361468 0.057070 O\n0.557070 0.138532 0.851197 O\n0.351197 0.638532 0.057070 O\n0.148803 0.442930 0.138532 O\n0.638532 0.942930 0.648803 O\n0.148803 0.557070 0.861468 O\n0.361468 0.057070 0.648803 O\n0.851197 0.557070 0.138532 O\n0.638532 0.057070 0.351197 O\n0.851197 0.442930 0.861468 O\n0.361468 0.942930 0.351197 O\n0.942930 0.648803 0.638532 O\n0.942930 0.351197 0.361468 O\n0.057070 0.351197 0.638532 O\n0.057070 0.648803 0.361468 O\n",
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{
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"structure_string": "Al12 Si12 Pb8 O52\n1.0\n5.892232 0.000000 0.000000\n0.000000 10.950143 0.000000\n0.000000 0.000000 15.904283\nAl Si Pb O\n12 12 8 52\ndirect\n0.750000 0.840331 0.885248 Al\n0.750000 0.659669 0.385248 Al\n0.250000 0.159669 0.114752 Al\n0.250000 0.340331 0.614752 Al\n0.996179 0.684895 0.742062 Al\n0.503821 0.815105 0.242062 Al\n0.496179 0.315105 0.257938 Al\n0.003821 0.184895 0.757938 Al\n0.003821 0.315105 0.257938 Al\n0.496179 0.184895 0.757938 Al\n0.503821 0.684895 0.742062 Al\n0.996179 0.815105 0.242062 Al\n0.250000 0.913369 0.406405 Si\n0.250000 0.586631 0.906405 Si\n0.750000 0.086631 0.593595 Si\n0.750000 0.413369 0.093595 Si\n0.750000 0.792124 0.576107 Si\n0.750000 0.707876 0.076107 Si\n0.250000 0.207876 0.423893 Si\n0.250000 0.292124 0.923893 Si\n0.250000 0.931050 0.836803 Si\n0.250000 0.568950 0.336803 Si\n0.750000 0.068950 0.163197 Si\n0.750000 0.431050 0.663197 Si\n0.250000 0.946662 0.630615 Pb\n0.250000 0.553338 0.130615 Pb\n0.750000 0.053338 0.369385 Pb\n0.750000 0.446662 0.869385 Pb\n0.250000 0.637752 0.547349 Pb\n0.250000 0.862248 0.047349 Pb\n0.750000 0.362248 0.452651 Pb\n0.750000 0.137752 0.952651 Pb\n0.474491 0.887644 0.349450 O\n0.025509 0.612356 0.849450 O\n0.974491 0.112356 0.650550 O\n0.525509 0.387644 0.150550 O\n0.525509 0.112356 0.650550 O\n0.974491 0.387644 0.150550 O\n0.025509 0.887644 0.349450 O\n0.474491 0.612356 0.849450 O\n0.480044 0.920212 0.894960 O\n0.019956 0.579788 0.394960 O\n0.980044 0.079788 0.105040 O\n0.519956 0.420212 0.605040 O\n0.519956 0.079788 0.105040 O\n0.980044 0.420212 0.605040 O\n0.019956 0.920212 0.894960 O\n0.480044 0.579788 0.394960 O\n0.974951 0.754495 0.631635 O\n0.525049 0.745505 0.131635 O\n0.474951 0.245505 0.368365 O\n0.025049 0.254495 0.868365 O\n0.025049 0.245505 0.368365 O\n0.474951 0.254495 0.868365 O\n0.525049 0.754495 0.631635 O\n0.974951 0.745505 0.131635 O\n0.750000 0.775613 0.783019 O\n0.750000 0.724387 0.283019 O\n0.250000 0.224387 0.216981 O\n0.250000 0.275613 0.716981 O\n0.250000 0.815411 0.768279 O\n0.250000 0.684589 0.268279 O\n0.750000 0.184589 0.231721 O\n0.750000 0.315411 0.731721 O\n0.250000 0.063426 0.785661 O\n0.250000 0.436574 0.285661 O\n0.750000 0.936574 0.214339 O\n0.750000 0.563426 0.714339 O\n0.250000 0.838768 0.494798 O\n0.250000 0.661232 0.994798 O\n0.750000 0.161232 0.505202 O\n0.750000 0.338768 0.005202 O\n0.750000 0.725998 0.486542 O\n0.750000 0.774002 0.986542 O\n0.250000 0.274002 0.513458 O\n0.250000 0.225998 0.013458 O\n0.750000 0.941786 0.563450 O\n0.750000 0.558214 0.063450 O\n0.250000 0.058214 0.436550 O\n0.250000 0.441786 0.936550 O\n0.250000 0.599952 0.704035 O\n0.250000 0.900048 0.204035 O\n0.750000 0.400048 0.295965 O\n0.750000 0.099952 0.795965 O\n",
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{
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"density": 8.539666738416763,
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"volume": 245.06743031345383,
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"formula_full": "Al3 Si1 Mo12",
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]
}