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{
"id": "mp-1199762",
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"structure_string": "Al36 P36 O144\n1.0\n0.036941 0.000000 -17.006216\n-9.362936 -16.230126 0.020390\n-9.362936 16.230126 0.020390\nAl P O\n36 36 144\ndirect\n0.871904 0.002409 0.576850 Al\n0.871904 0.576850 0.002409 Al\n0.866190 0.433071 0.433071 Al\n0.903335 0.169805 0.506099 Al\n0.903335 0.506099 0.169805 Al\n0.625798 0.999639 0.413429 Al\n0.625798 0.413429 0.999639 Al\n0.643501 0.168336 0.658474 Al\n0.643501 0.658474 0.168336 Al\n0.647574 0.329002 0.506638 Al\n0.647574 0.506638 0.329002 Al\n0.404204 0.010426 0.589650 Al\n0.404204 0.589650 0.010426 Al\n0.409422 0.426176 0.426176 Al\n0.372229 0.179847 0.504215 Al\n0.372229 0.504215 0.179847 Al\n0.152481 0.002408 0.424605 Al\n0.152481 0.424605 0.002408 Al\n0.136308 0.171148 0.669473 Al\n0.136308 0.669473 0.171148 Al\n0.126831 0.342863 0.503372 Al\n0.126831 0.503372 0.342863 Al\n0.886459 0.832672 0.336663 Al\n0.886459 0.336663 0.832672 Al\n0.898356 0.667694 0.504254 Al\n0.898356 0.504254 0.667694 Al\n0.644407 0.818105 0.489854 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"elements": [
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"formula_full": "Al36 P36 O144",
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},
{
"id": "mp-1198182",
"created_at": "2022-09-04T14:40:35.538425Z",
"structure_string": "Ca2 H24 S4 O18\n1.0\n5.815516 0.000000 0.000000\n0.407668 7.474072 0.000000\n1.582271 3.410266 10.715778\nCa H S O\n2 24 4 18\ndirect\n0.414652 0.107780 0.734765 Ca\n0.585348 0.892220 0.265235 Ca\n0.414283 0.168426 0.454744 H\n0.585717 0.831574 0.545256 H\n0.664656 0.217369 0.472871 H\n0.335344 0.782631 0.527129 H\n0.683674 0.155810 0.933679 H\n0.316326 0.844190 0.066321 H\n0.859341 0.152005 0.815494 H\n0.140659 0.847995 0.184506 H\n0.061784 0.435180 0.644779 H\n0.938216 0.564820 0.355221 H\n0.036364 0.274883 0.585977 H\n0.963636 0.725117 0.414023 H\n0.641816 0.464665 0.740345 H\n0.358184 0.535335 0.259655 H\n0.530747 0.532755 0.615368 H\n0.469253 0.467245 0.384632 H\n0.245050 0.726334 0.895223 H\n0.754950 0.273666 0.104777 H\n0.517494 0.726713 0.898283 H\n0.482506 0.273287 0.101717 H\n0.145032 0.315208 0.896593 H\n0.854968 0.684792 0.103407 H\n0.204233 0.121888 0.996483 H\n0.795767 0.878112 0.003517 H\n0.885345 0.605985 0.852598 S\n0.114655 0.394015 0.147402 S\n0.950396 0.800131 0.682003 S\n0.049604 0.199869 0.317997 S\n0.141624 0.921754 0.682889 O\n0.858376 0.078246 0.317111 O\n0.020231 0.700379 0.587101 O\n0.979769 0.299621 0.412899 O\n0.732621 0.911841 0.654155 O\n0.267379 0.088159 0.345845 O\n0.497520 0.232594 0.500019 O\n0.502480 0.767406 0.499981 O\n0.719286 0.090899 0.869234 O\n0.280714 0.909101 0.130766 O\n0.069437 0.297550 0.662778 O\n0.930563 0.702450 0.337222 O\n0.540393 0.424738 0.691164 O\n0.459607 0.575262 0.308836 O\n0.370817 0.796247 0.911157 O\n0.629183 0.203753 0.088843 O\n0.195273 0.184558 0.907241 O\n0.804727 0.815442 0.092759 O\n",
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{
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"structure_string": "Ho4 Mn8 O20\n1.0\n5.783875 0.000000 0.000000\n0.000000 7.323717 0.000000\n0.000000 0.000000 8.553109\nHo Mn O\n4 8 20\ndirect\n0.000000 0.137896 0.170549 Ho\n0.000000 0.862104 0.829451 Ho\n0.000000 0.637896 0.329451 Ho\n0.000000 0.362104 0.670549 Ho\n0.253357 0.000000 0.500000 Mn\n0.746643 0.500000 0.000000 Mn\n0.746643 0.000000 0.500000 Mn\n0.253357 0.500000 0.000000 Mn\n0.500000 0.411949 0.348548 Mn\n0.500000 0.588051 0.651452 Mn\n0.500000 0.911949 0.151452 Mn\n0.500000 0.088051 0.848548 Mn\n0.269080 0.000000 0.000000 O\n0.730920 0.500000 0.500000 O\n0.730920 0.000000 0.000000 O\n0.269080 0.500000 0.500000 O\n0.000000 0.164636 0.442501 O\n0.000000 0.835364 0.557499 O\n0.000000 0.664636 0.057499 O\n0.000000 0.335364 0.942501 O\n0.500000 0.151647 0.431220 O\n0.500000 0.848353 0.568780 O\n0.500000 0.651647 0.068780 O\n0.500000 0.348353 0.931220 O\n0.239377 0.393323 0.207277 O\n0.239377 0.606677 0.792723 O\n0.760623 0.893323 0.292723 O\n0.760623 0.106677 0.707277 O\n0.760623 0.606677 0.792723 O\n0.760623 0.393323 0.207277 O\n0.239377 0.106677 0.707277 O\n0.239377 0.893323 0.292723 O\n",
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"formula_full": "Ho4 Mn8 O20",
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"updated_at": "2021-11-28T01:34:54.997000Z",
"spacegroup": 55
},
{
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"created_at": "2022-09-04T14:40:35.556989Z",
"structure_string": "Hf1 Mg6 Fe1 O8\n1.0\n8.909298 0.000000 0.000000\n0.000000 4.339659 0.000000\n0.000000 0.000000 4.339659\nHf Mg Fe O\n1 6 1 8\ndirect\n0.500000 0.000000 0.000000 Hf\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.230057 0.000000 0.500000 Mg\n0.769943 0.000000 0.500000 Mg\n0.230057 0.500000 0.000000 Mg\n0.769943 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Fe\n0.268372 0.000000 0.000000 O\n0.731628 0.000000 0.000000 O\n0.249262 0.500000 0.500000 O\n0.750738 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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"formula_full": "Hf1 Mg6 Fe1 O8",
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{
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"structure_string": "Li4 Cu4 Te4 O16\n1.0\n6.184649 0.000000 0.000000\n0.000000 6.184649 0.000000\n0.000000 0.000000 8.636541\nLi Cu Te O\n4 4 4 16\ndirect\n0.000000 0.209815 0.000000 Li\n0.000000 0.790185 0.500000 Li\n0.209815 0.000000 0.250000 Li\n0.790185 0.000000 0.750000 Li\n0.246145 0.246145 0.625000 Cu\n0.246145 0.753855 0.875000 Cu\n0.753855 0.246145 0.375000 Cu\n0.753855 0.753855 0.125000 Cu\n0.226674 0.500000 0.250000 Te\n0.500000 0.226674 0.000000 Te\n0.500000 0.773326 0.500000 Te\n0.773326 0.500000 0.750000 Te\n0.024875 0.265680 0.250660 O\n0.024875 0.734320 0.249340 O\n0.265680 0.024875 0.999340 O\n0.265680 0.975125 0.500660 O\n0.268513 0.483648 0.016309 O\n0.268513 0.516352 0.483691 O\n0.483648 0.268513 0.233691 O\n0.483648 0.731487 0.266309 O\n0.516352 0.268513 0.766309 O\n0.516352 0.731487 0.733691 O\n0.731487 0.516352 0.516309 O\n0.731487 0.483648 0.983691 O\n0.734320 0.024875 0.000660 O\n0.734320 0.975125 0.499340 O\n0.975125 0.265680 0.749340 O\n0.975125 0.734320 0.750660 O\n",
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