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{
"id": "mp-1213128",
"created_at": "2022-09-04T14:48:14.539389Z",
"structure_string": "Mn8 Al16 Si8 O40\n1.0\n0.000000 0.000000 -5.484732\n-7.328042 -13.277737 0.000000\n-7.328042 13.277737 0.000000\nMn Al Si O\n8 16 8 40\ndirect\n0.760474 0.810340 0.143041 Mn\n0.760474 0.189660 0.856959 Mn\n0.239526 0.856959 0.189660 Mn\n0.739526 0.689660 0.356959 Mn\n0.239526 0.143041 0.810340 Mn\n0.739526 0.310340 0.643041 Mn\n0.260474 0.643041 0.310340 Mn\n0.260474 0.356959 0.689660 Mn\n0.664314 0.526223 0.598945 Al\n0.664314 0.473777 0.401055 Al\n0.335686 0.401055 0.473777 Al\n0.835686 0.973777 0.901055 Al\n0.335686 0.598945 0.526223 Al\n0.835686 0.026223 0.098945 Al\n0.164314 0.098945 0.026223 Al\n0.164314 0.901055 0.973777 Al\n0.663038 0.570914 0.102437 Al\n0.663038 0.429086 0.897563 Al\n0.336962 0.897563 0.429086 Al\n0.836962 0.929086 0.397563 Al\n0.336962 0.102437 0.570914 Al\n0.836962 0.070914 0.602437 Al\n0.163038 0.602437 0.070914 Al\n0.163038 0.397563 0.929086 Al\n0.855404 0.567009 0.814537 Si\n0.855404 0.432991 0.185463 Si\n0.144596 0.185463 0.432991 Si\n0.644596 0.932991 0.685463 Si\n0.144596 0.814537 0.567009 Si\n0.644596 0.067009 0.314537 Si\n0.355404 0.314537 0.067009 Si\n0.355404 0.685463 0.932991 Si\n0.838062 0.559091 0.704186 O\n0.838062 0.440909 0.295814 O\n0.161938 0.295814 0.440909 O\n0.661938 0.940909 0.795814 O\n0.161938 0.704186 0.559091 O\n0.661938 0.059091 0.204186 O\n0.338062 0.204186 0.059091 O\n0.338062 0.795814 0.940909 O\n0.875506 0.671627 0.121366 O\n0.875506 0.328373 0.878634 O\n0.124494 0.878634 0.328373 O\n0.624494 0.828373 0.378634 O\n0.124494 0.121366 0.671627 O\n0.624494 0.171626 0.621366 O\n0.375506 0.621366 0.171626 O\n0.375506 0.378634 0.828373 O\n0.630336 0.639620 0.890351 O\n0.630336 0.360380 0.109649 O\n0.369664 0.109649 0.360380 O\n0.869664 0.860380 0.609649 O\n0.369664 0.890351 0.639620 O\n0.869664 0.139620 0.390351 O\n0.130336 0.390351 0.139620 O\n0.130336 0.609649 0.860380 O\n0.827255 0.452232 0.801947 O\n0.827255 0.547768 0.198053 O\n0.172745 0.198053 0.547768 O\n0.672745 0.047768 0.698053 O\n0.172745 0.801947 0.452232 O\n0.672745 0.952232 0.301947 O\n0.327255 0.301947 0.952232 O\n0.327255 0.698053 0.047768 O\n0.827775 0.902933 0.969916 O\n0.827775 0.097067 0.030084 O\n0.172225 0.030084 0.097067 O\n0.672225 0.597067 0.530084 O\n0.172225 0.969916 0.902933 O\n0.672225 0.402933 0.469916 O\n0.327775 0.469916 0.402933 O\n0.327775 0.530084 0.597067 O\n",
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"formula_full": "Mn8 Al16 Si8 O40",
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"updated_at": "2021-11-28T01:38:45.694000Z",
"spacegroup": 68
},
{
"id": "mp-867543",
"created_at": "2022-09-04T14:43:24.574927Z",
"structure_string": "Li14 Ni4 P14 O48\n1.0\n5.067770 0.000000 0.000000\n0.000000 12.217515 0.000000\n0.000000 1.865742 14.997540\nLi Ni P O\n14 4 14 48\ndirect\n0.272514 0.480666 0.057995 Li\n0.174171 0.112506 0.136182 Li\n0.727486 0.980666 0.057995 Li\n0.825829 0.612506 0.136182 Li\n0.843017 0.441289 0.407177 Li\n0.156983 0.941289 0.407177 Li\n0.298432 0.250000 0.500000 Li\n0.701568 0.750000 0.500000 Li\n0.843017 0.058711 0.592823 Li\n0.156983 0.558711 0.592823 Li\n0.174171 0.387494 0.863818 Li\n0.272514 0.019334 0.942005 Li\n0.825829 0.887494 0.863818 Li\n0.727486 0.519334 0.942005 Li\n0.361950 0.291221 0.284015 Ni\n0.638050 0.791221 0.284015 Ni\n0.361950 0.208779 0.715985 Ni\n0.638050 0.708779 0.715985 Ni\n0.556410 0.250000 0.000000 P\n0.443590 0.750000 0.000000 P\n0.865345 0.343914 0.138532 P\n0.134655 0.843914 0.138532 P\n0.620401 0.050215 0.272643 P\n0.379599 0.550215 0.272643 P\n0.853827 0.194152 0.393146 P\n0.146173 0.694152 0.393146 P\n0.853827 0.305848 0.606854 P\n0.146173 0.805848 0.606854 P\n0.620401 0.449785 0.727357 P\n0.379599 0.949785 0.727357 P\n0.865345 0.156086 0.861468 P\n0.134655 0.656086 0.861468 P\n0.408441 0.141722 0.015478 O\n0.591559 0.641722 0.015478 O\n0.759795 0.246923 0.081758 O\n0.868746 0.452797 0.076718 O\n0.240205 0.746923 0.081758 O\n0.131254 0.952797 0.076718 O\n0.135124 0.297414 0.168280 O\n0.742498 0.015959 0.188410 O\n0.676502 0.348987 0.215963 O\n0.864876 0.797414 0.168280 O\n0.257502 0.515959 0.188410 O\n0.393245 0.132857 0.247809 O\n0.323498 0.848987 0.215963 O\n0.606755 0.632857 0.247809 O\n0.863012 0.114909 0.314370 O\n0.136988 0.614909 0.314370 O\n0.037351 0.292359 0.360868 O\n0.467361 0.458139 0.344360 O\n0.566809 0.232646 0.401133 O\n0.962649 0.792359 0.360868 O\n0.532639 0.958139 0.344360 O\n0.433191 0.732646 0.401133 O\n0.967625 0.125824 0.475077 O\n0.032375 0.625824 0.475077 O\n0.967625 0.374176 0.524923 O\n0.032375 0.874176 0.524923 O\n0.566809 0.267354 0.598867 O\n0.467361 0.041861 0.655640 O\n0.037351 0.207641 0.639132 O\n0.433191 0.767354 0.598867 O\n0.532639 0.541861 0.655640 O\n0.962649 0.707641 0.639132 O\n0.863012 0.385091 0.685630 O\n0.136988 0.885091 0.685630 O\n0.393245 0.367143 0.752191 O\n0.676502 0.151013 0.784037 O\n0.606755 0.867143 0.752191 O\n0.742498 0.484041 0.811590 O\n0.135124 0.202586 0.831720 O\n0.323498 0.651013 0.784037 O\n0.257502 0.984041 0.811590 O\n0.864876 0.702586 0.831720 O\n0.868746 0.047203 0.923282 O\n0.759795 0.253077 0.918242 O\n0.131254 0.547203 0.923282 O\n0.240205 0.753077 0.918242 O\n0.408441 0.358278 0.984522 O\n0.591559 0.858278 0.984522 O\n",
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"formula_full": "Li14 Ni4 P14 O48",
"formula_reduced": "Li7Ni2P7O24",
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{
"id": "mp-1237531",
"created_at": "2022-09-04T14:39:38.794421Z",
"structure_string": "Pr8 P12 H20 W4 O36\n1.0\n8.675915 0.000000 0.000000\n0.000000 9.328457 0.000000\n0.000000 5.186392 12.690318\nPr P H W O\n8 12 20 4 36\ndirect\n0.802335 0.919033 0.459689 Pr\n0.197665 0.080967 0.540311 Pr\n0.302335 0.080967 0.040311 Pr\n0.697665 0.919033 0.959689 Pr\n0.940887 0.685680 0.246145 Pr\n0.059113 0.314320 0.753855 Pr\n0.440887 0.314320 0.253855 Pr\n0.559113 0.685680 0.746145 Pr\n0.729623 0.559600 0.053762 P\n0.270377 0.440400 0.946238 P\n0.229623 0.440400 0.446238 P\n0.770377 0.559600 0.553762 P\n0.413648 0.941147 0.326860 P\n0.586352 0.058853 0.673140 P\n0.913648 0.058853 0.173140 P\n0.086352 0.941147 0.826860 P\n0.284533 0.733678 0.078598 P\n0.715467 0.266322 0.921402 P\n0.784533 0.266322 0.421402 P\n0.215467 0.733678 0.578598 P\n0.592603 0.741589 0.227975 H\n0.407397 0.258411 0.772025 H\n0.092603 0.258411 0.272025 H\n0.907397 0.741589 0.727975 H\n0.873971 0.498917 0.027365 H\n0.126029 0.501083 0.972635 H\n0.373971 0.501083 0.472635 H\n0.626029 0.498917 0.527365 H\n0.302004 0.832303 0.325473 H\n0.697996 0.167697 0.674527 H\n0.802004 0.167697 0.174527 H\n0.197996 0.832303 0.825473 H\n0.205921 0.735270 0.988802 H\n0.794079 0.264730 0.011198 H\n0.705921 0.264730 0.511198 H\n0.294079 0.735270 0.488802 H\n0.500460 0.498779 0.322222 H\n0.499540 0.501221 0.677778 H\n0.000460 0.501221 0.177778 H\n0.999540 0.498779 0.822222 H\n0.631248 0.623164 0.358754 W\n0.368752 0.376836 0.641246 W\n0.131248 0.376836 0.141246 W\n0.868752 0.623164 0.858754 W\n0.806734 0.439881 0.354794 O\n0.193266 0.560119 0.645206 O\n0.306734 0.560119 0.145206 O\n0.693266 0.439881 0.854794 O\n0.560789 0.844474 0.379325 O\n0.439211 0.155526 0.620675 O\n0.060789 0.155526 0.120675 O\n0.939211 0.844474 0.879325 O\n0.640513 0.422039 0.125352 O\n0.359487 0.577961 0.874648 O\n0.140513 0.577961 0.374648 O\n0.859487 0.422039 0.625352 O\n0.847385 0.664570 0.446300 O\n0.152615 0.335430 0.553700 O\n0.347385 0.335430 0.053700 O\n0.652615 0.664570 0.946300 O\n0.181827 0.818760 0.132215 O\n0.818173 0.181240 0.867785 O\n0.681827 0.181240 0.367785 O\n0.318173 0.818760 0.632215 O\n0.430241 0.837410 0.038516 O\n0.569759 0.162590 0.961484 O\n0.930241 0.162590 0.461484 O\n0.069759 0.837410 0.538516 O\n0.857428 0.964125 0.108930 O\n0.142572 0.035875 0.891070 O\n0.357428 0.035875 0.391070 O\n0.642572 0.964125 0.608930 O\n0.937141 0.946356 0.289072 O\n0.062859 0.053644 0.710928 O\n0.437141 0.053644 0.210928 O\n0.562859 0.946356 0.789072 O\n0.782023 0.679364 0.099949 O\n0.217977 0.320636 0.900051 O\n0.282023 0.320636 0.400051 O\n0.717977 0.679364 0.599949 O\n",
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],
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{
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"created_at": "2022-09-04T14:41:06.468397Z",
"structure_string": "Li12 Bi8 P12 O48\n1.0\n9.363668 0.000000 0.000000\n0.000000 8.873665 0.000000\n0.000000 8.549167 13.005496\nLi Bi P O\n12 8 12 48\ndirect\n0.507516 0.594012 0.350760 Li\n0.492484 0.405988 0.649240 Li\n0.915528 0.775025 0.317031 Li\n0.218800 0.360967 0.815311 Li\n0.718800 0.639033 0.684689 Li\n0.415528 0.224975 0.182969 Li\n0.992484 0.594012 0.850760 Li\n0.007516 0.405988 0.149240 Li\n0.584472 0.775025 0.817031 Li\n0.084472 0.224975 0.682969 Li\n0.781200 0.639033 0.184689 Li\n0.281200 0.360967 0.315311 Li\n0.542833 0.334915 0.905465 Bi\n0.959914 0.129523 0.092150 Bi\n0.042833 0.665085 0.594535 Bi\n0.459914 0.870477 0.407850 Bi\n0.540086 0.129523 0.592150 Bi\n0.957167 0.334915 0.405465 Bi\n0.040086 0.870477 0.907850 Bi\n0.457167 0.665085 0.094535 Bi\n0.600745 0.291295 0.335346 P\n0.880866 0.934364 0.674865 P\n0.759087 0.552210 0.007717 P\n0.240913 0.447790 0.992283 P\n0.119134 0.065636 0.325135 P\n0.399255 0.708705 0.664654 P\n0.899255 0.291295 0.835346 P\n0.619134 0.934364 0.174865 P\n0.259087 0.447790 0.492283 P\n0.380866 0.065636 0.825135 P\n0.100745 0.708705 0.164654 P\n0.740913 0.552210 0.507717 P\n0.200788 0.353559 0.439193 O\n0.778998 0.909803 0.205548 O\n0.002055 0.363442 0.740921 O\n0.629951 0.677893 0.422668 O\n0.430925 0.257850 0.796641 O\n0.328702 0.629388 0.410770 O\n0.116397 0.915986 0.104361 O\n0.134934 0.465524 0.552626 O\n0.865066 0.534476 0.447374 O\n0.883603 0.084014 0.895639 O\n0.671298 0.370612 0.589230 O\n0.569075 0.742150 0.203359 O\n0.370049 0.322107 0.577332 O\n0.997945 0.636558 0.259079 O\n0.221002 0.090197 0.794452 O\n0.393148 0.927338 0.942055 O\n0.248778 0.614422 0.199157 O\n0.606852 0.072662 0.057945 O\n0.475121 0.005772 0.766650 O\n0.026634 0.659361 0.093101 O\n0.526634 0.340639 0.406899 O\n0.975121 0.994228 0.733350 O\n0.700788 0.646441 0.060807 O\n0.748778 0.385578 0.300843 O\n0.893148 0.072662 0.557945 O\n0.721002 0.909803 0.705548 O\n0.497945 0.363442 0.240921 O\n0.870049 0.677893 0.922668 O\n0.069075 0.257850 0.296641 O\n0.171298 0.629388 0.910770 O\n0.365066 0.465524 0.052626 O\n0.383603 0.915986 0.604361 O\n0.616397 0.084014 0.395639 O\n0.634934 0.534476 0.947374 O\n0.828702 0.370612 0.089230 O\n0.930925 0.742150 0.703359 O\n0.129951 0.322107 0.077332 O\n0.502055 0.636558 0.759079 O\n0.278998 0.090197 0.294452 O\n0.106852 0.927338 0.442055 O\n0.751222 0.385578 0.800843 O\n0.299212 0.353559 0.939193 O\n0.024879 0.005772 0.266650 O\n0.473366 0.659361 0.593101 O\n0.973366 0.340639 0.906899 O\n0.524879 0.994228 0.233350 O\n0.799212 0.646441 0.560807 O\n0.251222 0.614422 0.699157 O\n",
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"formula_full": "Li12 Bi8 P12 O48",
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},
{
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