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{
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{
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{
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"structure_string": "Li10 V6 Cu2 P8 O32\n1.0\n6.105801 4.880277 0.000000\n-6.105801 4.880277 0.000000\n0.000000 0.046605 10.618292\nLi V Cu P O\n10 6 2 8 32\ndirect\n0.039851 0.300793 0.861597 Li\n0.260460 0.528721 0.507014 Li\n0.528721 0.260460 0.507014 Li\n0.755039 0.506237 0.995458 Li\n0.506237 0.755039 0.995458 Li\n0.300793 0.039851 0.861597 Li\n0.165675 0.165675 0.075784 Li\n0.724707 0.976790 0.461366 Li\n0.976790 0.724707 0.461366 Li\n0.881363 0.881363 0.674302 Li\n0.367881 0.367881 0.227859 V\n0.861573 0.355129 0.267113 V\n0.355129 0.861573 0.267113 V\n0.851086 0.851086 0.212027 V\n0.143112 0.645463 0.776975 V\n0.645463 0.143112 0.776975 V\n0.199248 0.199248 0.645780 Cu\n0.619073 0.619073 0.717292 Cu\n0.083067 0.565739 0.088649 P\n0.427736 0.427736 0.916811 P\n0.574270 0.574270 0.403719 P\n0.064114 0.064114 0.395048 P\n0.431367 0.920460 0.592309 P\n0.920460 0.431367 0.592309 P\n0.565739 0.083067 0.088649 P\n0.919058 0.919058 0.914741 P\n0.268323 0.268323 0.915967 O\n0.081955 0.391585 0.670999 O\n0.113078 0.392989 0.156502 O\n0.026241 0.518481 0.949887 O\n0.486851 0.486851 0.052757 O\n0.383642 0.590212 0.848612 O\n0.078991 0.880030 0.838544 O\n0.590212 0.383642 0.848612 O\n0.240417 0.718980 0.100258 O\n0.611733 0.406190 0.337164 O\n0.406190 0.611733 0.337164 O\n0.098513 0.895561 0.326102 O\n0.279254 0.759916 0.603949 O\n0.759916 0.279254 0.603949 O\n0.518863 0.518863 0.539730 O\n0.002632 0.002632 0.530216 O\n0.982356 0.468798 0.453494 O\n0.468798 0.982356 0.453494 O\n0.220742 0.220742 0.390484 O\n0.732290 0.732290 0.392191 O\n0.761645 0.761645 0.914380 O\n0.610634 0.899478 0.649900 O\n0.391585 0.081955 0.670999 O\n0.899478 0.610634 0.649900 O\n0.599521 0.913214 0.157405 O\n0.392989 0.113078 0.156502 O\n0.913214 0.599521 0.157405 O\n0.518481 0.026241 0.949887 O\n0.977739 0.977739 0.049681 O\n0.880030 0.078991 0.838544 O\n0.718980 0.240417 0.100258 O\n0.895561 0.098513 0.326102 O\n",
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"formula_full": "Li10 V6 Cu2 P8 O32",
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"spacegroup": 8
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{
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"created_at": "2022-09-04T14:42:16.546008Z",
"structure_string": "Ca2 Pr2 Co4 O12\n1.0\n5.482468 0.000000 0.000000\n0.000000 5.438400 0.000000\n0.000000 5.355522 7.593460\nCa Pr Co O\n2 2 4 12\ndirect\n0.793378 0.238683 0.248468 Ca\n0.206622 0.238683 0.748468 Ca\n0.289856 0.759866 0.247371 Pr\n0.710144 0.759866 0.747371 Pr\n0.751017 0.000265 0.000213 Co\n0.751801 0.500959 0.499718 Co\n0.248983 0.000265 0.500213 Co\n0.248199 0.500959 0.999718 Co\n0.766469 0.324166 0.746129 O\n0.024343 0.167631 0.038918 O\n0.034212 0.752108 0.462771 O\n0.528493 0.836211 0.460961 O\n0.542894 0.234778 0.043182 O\n0.264674 0.664887 0.761032 O\n0.233531 0.324166 0.246129 O\n0.965788 0.752108 0.962771 O\n0.975657 0.167631 0.538918 O\n0.471507 0.836211 0.960961 O\n0.457106 0.234778 0.543182 O\n0.735326 0.664887 0.261032 O\n",
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{
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"created_at": "2022-09-04T14:42:16.548877Z",
"structure_string": "Fe3 As2 O16\n1.0\n5.911615 5.249408 0.000000\n-5.911615 5.249408 0.000000\n0.000000 1.319301 4.476678\nFe As O\n3 2 16\ndirect\n0.000000 0.000000 0.000000 Fe\n0.634370 0.365630 0.000000 Fe\n0.365630 0.634370 0.000000 Fe\n0.316616 0.316616 0.644365 As\n0.683384 0.683384 0.355635 As\n0.151468 0.151468 0.636837 O\n0.848532 0.848532 0.363163 O\n0.408535 0.408535 0.264262 O\n0.591465 0.591465 0.735738 O\n0.233023 0.477952 0.794560 O\n0.477952 0.233023 0.794560 O\n0.766977 0.522048 0.205440 O\n0.522048 0.766977 0.205440 O\n0.942867 0.204928 0.134338 O\n0.204928 0.942867 0.134338 O\n0.057133 0.795072 0.865662 O\n0.795072 0.057133 0.865662 O\n0.157085 0.677313 0.225720 O\n0.677313 0.157085 0.225720 O\n0.842915 0.322687 0.774280 O\n0.322687 0.842915 0.774280 O\n",
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{
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"structure_string": "Zn4 Fe8 O16\n1.0\n5.769485 0.000000 0.000000\n0.000000 4.977232 0.000000\n0.000000 0.173014 10.215596\nZn Fe O\n4 8 16\ndirect\n0.752246 0.648550 0.747583 Zn\n0.252246 0.351450 0.252417 Zn\n0.749015 0.974933 0.248635 Zn\n0.249015 0.025067 0.751365 Zn\n0.249275 0.988507 0.490103 Fe\n0.251414 0.988018 0.016170 Fe\n0.749275 0.011493 0.509897 Fe\n0.751414 0.011982 0.983830 Fe\n0.500226 0.499934 0.500008 Fe\n0.999181 0.499168 0.998706 Fe\n0.000226 0.500066 0.499992 Fe\n0.499181 0.500832 0.001294 Fe\n0.247497 0.647715 0.396022 O\n0.251615 0.642024 0.102160 O\n0.747497 0.352285 0.603978 O\n0.751615 0.357976 0.897840 O\n0.251718 0.305383 0.596853 O\n0.246856 0.311747 0.906670 O\n0.751718 0.694617 0.403147 O\n0.746856 0.688253 0.093330 O\n0.503008 0.829352 0.608502 O\n0.003037 0.822628 0.880362 O\n0.003008 0.170648 0.391498 O\n0.503037 0.177372 0.119638 O\n0.497404 0.168623 0.392332 O\n0.995879 0.165356 0.110656 O\n0.997404 0.831377 0.607668 O\n0.495879 0.834644 0.889344 O\n",
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{
"id": "mp-1027627",
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"structure_string": "Te2 Mo4 Se2 S4\n1.0\n1.654559 -2.865781 0.000000\n1.654559 2.865781 0.000000\n0.000000 0.000000 37.583810\nTe Mo Se S\n2 4 2 4\ndirect\n0.333333 0.666667 0.708379 Te\n0.333333 0.666667 0.606768 Te\n0.333333 0.666667 0.093917 Mo\n0.333333 0.666667 0.469622 Mo\n0.666667 0.333333 0.281807 Mo\n0.666667 0.333333 0.657600 Mo\n0.666667 0.333333 0.424988 Se\n0.666667 0.333333 0.514236 Se\n0.333333 0.666667 0.322483 S\n0.666667 0.333333 0.053244 S\n0.666667 0.333333 0.134610 S\n0.333333 0.666667 0.241094 S\n",
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{
"id": "mp-778965",
"created_at": "2022-09-04T14:42:16.709212Z",
"structure_string": "Li8 Mn12 B12 O36\n1.0\n6.348222 0.000000 0.000000\n-0.000671 8.232265 0.000000\n-3.147410 -0.002565 14.386489\nLi Mn B O\n8 12 12 36\ndirect\n0.253329 0.708911 0.010646 Li\n0.754451 0.710759 0.009231 Li\n0.572939 0.656984 0.639320 Li\n0.924573 0.630388 0.350462 Li\n0.007512 0.210662 0.510600 Li\n0.505950 0.207909 0.510053 Li\n0.319323 0.158596 0.140482 Li\n0.673704 0.129579 0.850527 Li\n0.248107 0.857906 0.494209 Mn\n0.745351 0.857671 0.494148 Mn\n0.097929 0.828072 0.190103 Mn\n0.595297 0.830493 0.188988 Mn\n0.402415 0.813417 0.815712 Mn\n0.911783 0.814750 0.817025 Mn\n0.498083 0.356497 0.994700 Mn\n0.999882 0.358310 0.993437 Mn\n0.341493 0.329861 0.688545 Mn\n0.851830 0.328911 0.690410 Mn\n0.158135 0.313785 0.316110 Mn\n0.660041 0.313205 0.315888 Mn\n0.999758 0.996102 0.000368 B\n0.499154 0.993823 0.000206 B\n0.078278 0.004128 0.663080 B\n0.583056 0.001044 0.665825 B\n0.919622 0.997072 0.334957 B\n0.416503 0.006241 0.335645 B\n0.252314 0.495469 0.500953 B\n0.751854 0.494636 0.500993 B\n0.670212 0.500529 0.832893 B\n0.169598 0.501103 0.837773 B\n0.330708 0.504318 0.164050 B\n0.835314 0.502249 0.165251 B\n0.533622 0.987600 0.570361 O\n0.033972 0.978488 0.568095 O\n0.369836 0.986403 0.238593 O\n0.874173 0.975189 0.239470 O\n0.947404 0.860402 0.392127 O\n0.446289 0.874922 0.393125 O\n0.109855 0.880231 0.726393 O\n0.608606 0.862314 0.720334 O\n0.023016 0.844785 0.044508 O\n0.519520 0.842343 0.044136 O\n0.188124 0.659124 0.873267 O\n0.686422 0.655222 0.870243 O\n0.350377 0.659661 0.200366 O\n0.852373 0.658388 0.202585 O\n0.295261 0.634737 0.552196 O\n0.761920 0.634141 0.552063 O\n0.181851 0.501687 0.405678 O\n0.723170 0.500783 0.405736 O\n0.785776 0.480946 0.069801 O\n0.280810 0.485272 0.068587 O\n0.117347 0.477421 0.742158 O\n0.624970 0.480394 0.735600 O\n0.201672 0.368801 0.895860 O\n0.697619 0.364022 0.889038 O\n0.360774 0.366836 0.220038 O\n0.868958 0.374767 0.227085 O\n0.278690 0.343696 0.544762 O\n0.771145 0.342748 0.545580 O\n0.936883 0.152107 0.372835 O\n0.432011 0.164707 0.371596 O\n0.092339 0.164574 0.694109 O\n0.607556 0.153416 0.708131 O\n0.043571 0.135891 0.051587 O\n0.507474 0.133144 0.051875 O\n0.471520 0.001512 0.904920 O\n0.932293 0.004058 0.905061 O\n",
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{
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{
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{
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