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{
"id": "mp-1222444",
"created_at": "2022-09-04T14:39:32.773280Z",
"structure_string": "Li3 Al3 Si3 O12\n1.0\n2.648610 -4.587527 0.000000\n2.648610 4.587527 0.000000\n0.000000 0.000000 11.448041\nLi Al Si O\n3 3 3 12\ndirect\n0.000000 0.000000 0.833333 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.166667 Li\n0.500000 0.500000 0.333333 Al\n0.500000 0.000000 0.000000 Al\n0.000000 0.500000 0.666667 Al\n0.500000 0.500000 0.833333 Si\n0.500000 0.000000 0.500000 Si\n0.000000 0.500000 0.166667 Si\n0.205695 0.805745 0.577782 O\n0.194255 0.399951 0.244449 O\n0.600049 0.794305 0.911116 O\n0.794305 0.194255 0.577782 O\n0.805745 0.600049 0.244449 O\n0.399951 0.205695 0.911116 O\n0.805745 0.205695 0.088884 O\n0.399951 0.194255 0.422218 O\n0.794305 0.600049 0.755551 O\n0.194255 0.794305 0.088884 O\n0.600049 0.805745 0.422218 O\n0.205695 0.399951 0.755551 O\n",
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{
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"structure_string": "Si24 As8 H144 C48 O12\n1.0\n0.000000 -0.000000 -9.955664\n-8.837432 -0.000000 -4.977833\n0.000000 34.289102 -4.977833\nSi As H C O\n24 8 144 48 12\ndirect\n0.253138 0.961310 0.408886 Si\n0.623334 0.038690 0.591114 Si\n0.964448 0.538690 0.908886 Si\n0.412024 0.461310 0.091114 Si\n0.258836 0.925530 0.317568 Si\n0.501935 0.074470 0.682432 Si\n0.934367 0.574470 0.817568 Si\n0.326404 0.425530 0.182432 Si\n0.817743 0.165154 0.420259 Si\n0.403156 0.834846 0.579741 Si\n0.732898 0.334846 0.920259 Si\n0.988002 0.665154 0.079741 Si\n0.825531 0.128340 0.328690 Si\n0.282562 0.871660 0.671310 Si\n0.703871 0.371660 0.828690 Si\n0.904221 0.628340 0.171310 Si\n0.037695 0.744298 0.431735 Si\n0.213728 0.255702 0.568265 Si\n0.531993 0.755702 0.931735 Si\n0.219430 0.244298 0.068265 Si\n0.044392 0.706478 0.340222 Si\n0.091092 0.293522 0.659778 Si\n0.500870 0.793522 0.840222 Si\n0.134615 0.206478 0.159778 Si\n0.033334 0.969847 0.449430 As\n0.452612 0.030153 0.550570 As\n0.753181 0.530153 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0.179751 H\n0.336343 0.123976 0.309160 H\n0.769479 0.876024 0.690840 H\n0.210319 0.376024 0.809160 H\n0.395503 0.623976 0.190840 H\n0.221452 0.141061 0.272270 H\n0.634783 0.858939 0.727730 H\n0.112513 0.358939 0.772270 H\n0.243722 0.641061 0.227730 H\n0.437289 0.803637 0.257388 H\n0.498314 0.196363 0.742612 H\n0.990926 0.696363 0.757388 H\n0.444677 0.303637 0.242612 H\n0.542970 0.783046 0.296739 H\n0.622755 0.216954 0.703261 H\n0.076016 0.716954 0.796739 H\n0.589709 0.283046 0.203261 H\n0.460014 0.664222 0.293724 H\n0.417961 0.335778 0.706276 H\n0.874236 0.835778 0.793724 H\n0.503738 0.164222 0.206276 H\n0.880055 0.369971 0.432195 H\n0.682222 0.630029 0.567805 H\n0.000027 0.130029 0.932195 H\n0.062250 0.869971 0.067805 H\n0.682248 0.444563 0.424984 H\n0.551794 0.555437 0.575016 H\n0.876811 0.055437 0.924984 H\n0.857232 0.944563 0.075016 H\n0.745587 0.360259 0.470407 H\n0.576252 0.639741 0.529593 H\n0.855846 0.139741 0.970407 H\n0.965994 0.860259 0.029593 H\n0.614850 0.145487 0.468232 H\n0.228569 0.854513 0.531768 H\n0.510337 0.354513 0.968232 H\n0.833082 0.645487 0.031768 H\n0.540968 0.236026 0.424252 H\n0.201246 0.763974 0.575748 H\n0.526994 0.263974 0.924252 H\n0.715221 0.736026 0.075748 H\n0.658082 0.035701 0.425834 H\n0.119617 0.964299 0.574166 H\n0.443783 0.464299 0.925834 H\n0.833916 0.535701 0.074166 H\n0.748920 0.284539 0.268919 H\n0.302378 0.715461 0.731081 H\n0.783459 0.215461 0.768919 H\n0.767839 0.784539 0.231081 H\n0.697504 0.399018 0.310846 H\n0.407368 0.600982 0.689154 H\n0.846522 0.100982 0.810846 H\n0.758350 0.899018 0.189154 H\n0.892232 0.309209 0.287531 H\n0.488972 0.690791 0.712469 H\n0.951441 0.190791 0.787531 H\n0.929763 0.809209 0.212469 H\n0.661443 0.008908 0.352936 H\n0.023288 0.991092 0.647064 H\n0.420351 0.491092 0.852936 H\n0.764380 0.508908 0.147064 H\n0.545558 0.204743 0.342398 H\n0.092699 0.795257 0.657602 H\n0.500301 0.295257 0.842398 H\n0.637956 0.704743 0.157602 H\n0.638093 0.070823 0.303640 H\n0.012556 0.929177 0.696360 H\n0.458916 0.429177 0.803640 H\n0.691732 0.570823 0.196360 H\n0.775157 0.812891 0.469228 H\n0.057276 0.187109 0.530772 H\n0.338048 0.687109 0.969228 H\n0.994385 0.312891 0.030772 H\n0.885521 0.616872 0.457589 H\n0.959982 0.383128 0.542411 H\n0.252393 0.883128 0.957589 H\n0.093110 0.116872 0.042411 H\n0.929165 0.690038 0.496223 H\n0.115426 0.309962 0.503777 H\n0.369203 0.809962 0.996223 H\n0.175388 0.190038 0.003777 H\n0.267924 0.573538 0.465692 H\n0.307154 0.426462 0.534308 H\n0.591463 0.926462 0.965692 H\n0.483616 0.073538 0.034308 H\n0.236643 0.473294 0.430936 H\n0.140872 0.526706 0.569064 H\n0.459937 0.026706 0.930936 H\n0.417579 0.973294 0.069064 H\n0.324895 0.586979 0.415006 H\n0.326880 0.413021 0.584994 H\n0.661874 0.913021 0.915006 H\n0.489900 0.086979 0.084994 H\n0.937786 0.611625 0.294903 H\n0.844314 0.388375 0.705097 H\n0.299411 0.888375 0.794903 H\n0.982689 0.111625 0.205097 H\n0.900755 0.564219 0.344200 H\n0.809173 0.435781 0.655800 H\n0.214974 0.935781 0.844200 H\n0.994955 0.064219 0.155800 H\n0.783702 0.750279 0.326925 H\n0.860907 0.249721 0.673075 H\n0.283982 0.749721 0.826925 H\n0.860627 0.250279 0.173075 H\n0.331003 0.556312 0.342495 H\n0.229810 0.443688 0.657505 H\n0.637315 0.943688 0.842495 H\n0.423498 0.056312 0.157505 H\n0.241836 0.439526 0.348648 H\n0.030009 0.560474 0.651352 H\n0.431362 0.060474 0.848648 H\n0.340484 0.939526 0.151352 H\n0.277760 0.504649 0.301341 H\n0.083750 0.495351 0.698659 H\n0.532409 0.995351 0.801341 H\n0.329101 0.004649 0.198659 H\n0.229518 0.157201 0.405880 C\n0.792599 0.842799 0.594120 C\n0.136719 0.342799 0.905880 C\n0.385398 0.657201 0.094120 C\n0.432318 0.835737 0.432775 C\n0.700831 0.164263 0.567225 C\n0.018055 0.664263 0.932775 C\n0.615093 0.335737 0.067225 C\n0.233891 0.117474 0.303375 C\n0.654740 0.882526 0.696625 C\n0.101365 0.382526 0.803375 C\n0.287266 0.617474 0.196625 C\n0.441479 0.779809 0.288745 C\n0.510033 0.220191 0.711255 C\n0.971288 0.720191 0.788745 C\n0.480224 0.279809 0.211255 C\n0.778889 0.352114 0.438684 C\n0.569687 0.647886 0.561316 C\n0.881003 0.147886 0.938684 C\n0.967573 0.852114 0.061316 C\n0.641951 0.142751 0.436333 C\n0.221034 0.857249 0.563667 C\n0.534701 0.357249 0.936333 C\n0.828283 0.642751 0.063667 C\n0.789394 0.295004 0.295828 C\n0.380225 0.704996 0.704172 C\n0.834397 0.204996 0.795828 C\n0.835222 0.795004 0.204172 C\n0.651339 0.099680 0.332325 C\n0.083344 0.900320 0.667675 C\n0.501019 0.400320 0.832325 C\n0.733664 0.599680 0.167675 C\n0.892562 0.714670 0.466925 C\n0.074156 0.285330 0.533075 C\n0.357232 0.785330 0.966925 C\n0.109487 0.214670 0.033075 C\n0.236059 0.579273 0.436307 C\n0.251639 0.420727 0.563693 C\n0.565332 0.920727 0.936307 C\n0.422366 0.079273 0.063693 C\n0.902723 0.654605 0.324943 C\n0.882271 0.345395 0.675057 C\n0.307327 0.845395 0.824943 C\n0.977666 0.154605 0.175057 C\n0.243237 0.536051 0.332318 C\n0.111605 0.463949 0.667682 C\n0.529287 0.963949 0.832318 C\n0.325555 0.036051 0.167682 C\n0.283130 0.894247 0.364341 O\n0.541718 0.105753 0.635659 O\n0.927377 0.605753 0.864341 O\n0.397471 0.394247 0.135659 O\n0.844770 0.172072 0.371987 O\n0.388829 0.827928 0.628013 O\n0.766842 0.327928 0.871987 O\n0.966757 0.672072 0.128013 O\n0.993525 0.746690 0.387321 O\n0.127537 0.253310 0.612679 O\n0.490216 0.753310 0.887321 O\n0.130847 0.246690 0.112679 O\n",
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],
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"formula_full": "Si24 As8 H144 C48 O12",
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"spacegroup": 43
},
{
"id": "mp-1035541",
"created_at": "2022-09-04T14:39:41.095715Z",
"structure_string": "Hf1 Mg14 Fe1 O16\n1.0\n8.647653 0.000000 0.000000\n0.000000 8.689691 0.000000\n-0.000000 0.000000 4.289432\nHf Mg Fe O\n1 14 1 16\ndirect\n0.000000 0.500000 -0.000000 Hf\n0.500000 0.000000 -0.000000 Mg\n0.500000 0.500000 -0.000000 Mg\n0.000000 0.233576 0.500000 Mg\n0.000000 0.766424 0.500000 Mg\n0.500000 0.247739 0.500000 Mg\n0.500000 0.752261 0.500000 Mg\n0.250465 0.000000 0.500000 Mg\n0.257689 0.500000 0.500000 Mg\n0.749535 0.000000 0.500000 Mg\n0.742311 0.500000 0.500000 Mg\n0.253891 0.240585 -0.000000 Mg\n0.253891 0.759415 -0.000000 Mg\n0.746109 0.240585 0.000000 Mg\n0.746109 0.759415 0.000000 Mg\n0.000000 0.000000 -0.000000 Fe\n0.264581 0.000000 0.000000 O\n0.254836 0.500000 0.000000 O\n0.735419 0.000000 -0.000000 O\n0.745164 0.500000 -0.000000 O\n0.248570 0.250336 0.500000 O\n0.248570 0.749664 0.500000 O\n0.751430 0.250336 0.500000 O\n0.751430 0.749664 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.264356 0.000000 O\n0.000000 0.735644 -0.000000 O\n0.500000 0.253075 -0.000000 O\n0.500000 0.746925 -0.000000 O\n",
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],
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"formula_full": "Hf1 Mg14 Fe1 O16",
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{
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"created_at": "2022-09-04T14:39:41.402445Z",
"structure_string": "Mg1 Mn1 F6\n1.0\n4.684569 -2.610240 0.000000\n4.684569 2.610240 0.000000\n3.230144 0.000000 4.280737\nMg Mn F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mn\n0.675121 0.848004 0.237120 F\n0.848004 0.237120 0.675121 F\n0.762880 0.324879 0.151996 F\n0.151996 0.762880 0.324879 F\n0.324879 0.151996 0.762880 F\n0.237120 0.675121 0.848004 F\n",
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{
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{
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}