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{
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{
"id": "mp-1222242",
"created_at": "2022-09-04T14:43:03.401969Z",
"structure_string": "Mg1 Al8 Fe3 P8 O40\n1.0\n-6.279975 -0.015773 -3.507086\n6.369489 0.000383 -10.714488\n-0.014407 -7.420039 -0.007524\nMg Al Fe P O\n1 8 3 8 40\ndirect\n0.250000 0.250000 0.500000 Mg\n0.374541 0.111672 0.770464 Al\n0.876408 0.613635 0.772992 Al\n0.863196 0.133194 0.267631 Al\n0.372939 0.635320 0.272510 Al\n0.125459 0.388328 0.229536 Al\n0.623592 0.886365 0.227008 Al\n0.636804 0.366806 0.732369 Al\n0.127061 0.864680 0.727490 Al\n0.750000 0.750000 0.500000 Fe\n0.001476 0.999926 0.002187 Fe\n0.498524 0.500074 0.997813 Fe\n0.747653 0.003150 0.620302 P\n0.246300 0.501423 0.616388 P\n0.495407 0.245748 0.118436 P\n0.001536 0.746110 0.119952 P\n0.752347 0.496850 0.379698 P\n0.253700 0.998577 0.383612 P\n0.004593 0.254252 0.881564 P\n0.498464 0.753890 0.880048 P\n0.478778 0.247946 0.673733 O\n0.969891 0.747957 0.664062 O\n0.780345 0.001189 0.161367 O\n0.280832 0.503578 0.161438 O\n0.021222 0.252054 0.326267 O\n0.530109 0.752043 0.335938 O\n0.719655 0.498811 0.838633 O\n0.219168 0.996422 0.838562 O\n0.158013 0.209981 0.753485 O\n0.647240 0.707508 0.748329 O\n0.106283 0.045724 0.251672 O\n0.601940 0.542847 0.250226 O\n0.341987 0.290019 0.246515 O\n0.852760 0.792492 0.251671 O\n0.393717 0.454276 0.748328 O\n0.898060 0.957153 0.749774 O\n0.187461 0.407206 0.490442 O\n0.692303 0.906130 0.495335 O\n0.556922 0.343180 0.995695 O\n0.056718 0.843278 0.995102 O\n0.312539 0.092794 0.509558 O\n0.807697 0.593870 0.504665 O\n0.943078 0.156820 0.004305 O\n0.443282 0.656722 0.004898 O\n0.844003 0.288349 0.762964 O\n0.335618 0.788169 0.765591 O\n0.913885 0.463311 0.262480 O\n0.414513 0.961499 0.266570 O\n0.655997 0.211651 0.237036 O\n0.164382 0.711831 0.234409 O\n0.586115 0.036689 0.737520 O\n0.085487 0.538501 0.733430 O\n0.825139 0.094605 0.503399 O\n0.329723 0.593816 0.505233 O\n0.420257 0.154084 0.003807 O\n0.920863 0.655610 0.005497 O\n0.674861 0.405395 0.496601 O\n0.170277 0.906184 0.494767 O\n0.079743 0.345916 0.996193 O\n0.579137 0.844390 0.994503 O\n",
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"Al",
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"P",
"O"
],
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"formula_full": "Mg1 Al8 Fe3 P8 O40",
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"updated_at": "2021-11-28T01:35:57.632000Z",
"spacegroup": 2
},
{
"id": "mp-863443",
"created_at": "2022-09-04T14:40:12.404217Z",
"structure_string": "Li8 Fe12 Sn4 O32\n1.0\n8.521504 0.000000 0.000000\n0.000000 8.531404 0.000000\n0.000000 0.039372 8.537668\nLi Fe Sn O\n8 12 4 32\ndirect\n0.124843 0.379091 0.125515 Li\n0.252815 0.251211 0.501254 Li\n0.750107 0.251109 0.999390 Li\n0.876647 0.124262 0.629019 Li\n0.376647 0.875738 0.370981 Li\n0.250107 0.748891 0.000610 Li\n0.752815 0.748789 0.498746 Li\n0.624843 0.620909 0.874485 Li\n0.380215 0.386012 0.872988 Fe\n0.621311 0.380801 0.632546 Fe\n0.884681 0.375228 0.369378 Fe\n0.113573 0.123385 0.867942 Fe\n0.376212 0.119041 0.137313 Fe\n0.618286 0.112916 0.374102 Fe\n0.118286 0.887084 0.625898 Fe\n0.876212 0.880959 0.862687 Fe\n0.613573 0.876615 0.132058 Fe\n0.384681 0.624772 0.630622 Fe\n0.121311 0.619199 0.367454 Fe\n0.880215 0.613988 0.127012 Fe\n0.497887 0.497809 0.253414 Sn\n0.497763 0.005250 0.753503 Sn\n0.997763 0.994750 0.246497 Sn\n0.997887 0.502191 0.746586 Sn\n0.873442 0.391688 0.139315 O\n0.114588 0.401976 0.377141 O\n0.396308 0.383606 0.634386 O\n0.611764 0.373196 0.850188 O\n0.853183 0.374522 0.614493 O\n0.636929 0.366278 0.394180 O\n0.374362 0.363290 0.109880 O\n0.136447 0.363707 0.874344 O\n0.867178 0.138733 0.375028 O\n0.625998 0.145492 0.614288 O\n0.361078 0.141298 0.888672 O\n0.137883 0.126334 0.113960 O\n0.386667 0.126327 0.360841 O\n0.613941 0.115778 0.136700 O\n0.889495 0.110474 0.878580 O\n0.126211 0.113290 0.638471 O\n0.626211 0.886710 0.361529 O\n0.389495 0.889526 0.121420 O\n0.113941 0.884222 0.863300 O\n0.886667 0.873673 0.639159 O\n0.637883 0.873666 0.886040 O\n0.861078 0.858702 0.111328 O\n0.125998 0.854508 0.385712 O\n0.367178 0.861267 0.624972 O\n0.636447 0.636293 0.125656 O\n0.874362 0.636710 0.890120 O\n0.136929 0.633722 0.605820 O\n0.353183 0.625478 0.385507 O\n0.111764 0.626804 0.149812 O\n0.896308 0.616394 0.365614 O\n0.614588 0.598024 0.622859 O\n0.373442 0.608312 0.860685 O\n",
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"elements": [
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],
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"volume": 620.6918215639979,
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"formula_full": "Li8 Fe12 Sn4 O32",
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"spacegroup": 4
},
{
"id": "mp-768771",
"created_at": "2022-09-04T14:45:56.897295Z",
"structure_string": "Li12 Bi4 B8 O24\n1.0\n9.188294 0.000000 0.000000\n0.000000 5.321280 0.000000\n0.000000 5.071281 10.881283\nLi Bi B O\n12 4 8 24\ndirect\n0.973362 0.518466 0.324133 Li\n0.651865 0.444214 0.386714 Li\n0.985081 0.925307 0.904560 Li\n0.151865 0.555786 0.113286 Li\n0.485081 0.074693 0.595440 Li\n0.473362 0.481534 0.175867 Li\n0.526638 0.518466 0.824133 Li\n0.514919 0.925307 0.404560 Li\n0.848135 0.444214 0.886714 Li\n0.014919 0.074693 0.095440 Li\n0.348135 0.555786 0.613286 Li\n0.026638 0.481534 0.675867 Li\n0.326518 0.973206 0.876136 Bi\n0.826518 0.026794 0.623864 Bi\n0.173482 0.973206 0.376136 Bi\n0.673482 0.026794 0.123864 Bi\n0.330987 0.461255 0.380321 B\n0.675866 0.963778 0.868380 B\n0.830987 0.538745 0.119679 B\n0.175866 0.036222 0.631620 B\n0.824134 0.963778 0.368380 B\n0.169013 0.461255 0.880321 B\n0.324134 0.036222 0.131620 B\n0.669013 0.538745 0.619679 B\n0.330598 0.813481 0.098834 O\n0.634949 0.333850 0.580124 O\n0.939660 0.714865 0.124082 O\n0.051616 0.173711 0.639268 O\n0.306979 0.129655 0.660160 O\n0.686640 0.558150 0.153410 O\n0.186640 0.441850 0.346590 O\n0.806979 0.870345 0.839840 O\n0.551616 0.826289 0.860732 O\n0.439660 0.285135 0.375918 O\n0.830598 0.186519 0.401166 O\n0.134949 0.666150 0.919876 O\n0.865051 0.333850 0.080124 O\n0.169402 0.813481 0.598834 O\n0.560340 0.714865 0.624082 O\n0.448384 0.173711 0.139268 O\n0.193021 0.129655 0.160160 O\n0.813360 0.558150 0.653410 O\n0.313360 0.441850 0.846590 O\n0.693021 0.870345 0.339840 O\n0.948384 0.826289 0.360732 O\n0.060340 0.285135 0.875918 O\n0.365051 0.666150 0.419876 O\n0.669402 0.186519 0.901166 O\n",
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"formula_full": "Li12 Bi4 B8 O24",
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"spacegroup": 14
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{
"id": "mp-770715",
"created_at": "2022-09-04T14:39:25.409016Z",
"structure_string": "Ga8 W4 O24\n1.0\n4.802895 0.000000 0.000000\n0.000000 7.229489 0.000000\n0.000000 0.784584 11.491654\nGa W O\n8 4 24\ndirect\n0.789706 0.000000 0.750000 Ga\n0.210294 0.000000 0.250000 Ga\n0.241938 0.757107 0.618321 Ga\n0.758062 0.757107 0.118321 Ga\n0.712166 0.500000 0.750000 Ga\n0.287834 0.500000 0.250000 Ga\n0.241938 0.242893 0.881679 Ga\n0.758062 0.242893 0.381679 Ga\n0.266449 0.743741 0.895861 W\n0.733551 0.743741 0.395861 W\n0.266449 0.256259 0.604139 W\n0.733551 0.256259 0.104139 W\n0.071847 0.987118 0.870657 O\n0.563779 0.832545 0.972756 O\n0.928153 0.987118 0.370657 O\n0.507931 0.812357 0.740492 O\n0.436221 0.832545 0.472756 O\n0.003727 0.683406 0.762197 O\n0.492069 0.812357 0.240492 O\n0.943877 0.669779 0.521074 O\n0.436705 0.497175 0.873394 O\n0.996273 0.683406 0.262197 O\n0.436705 0.502825 0.626606 O\n0.943877 0.330221 0.978926 O\n0.056123 0.669779 0.021074 O\n0.563295 0.497175 0.373394 O\n0.003727 0.316594 0.737803 O\n0.563295 0.502825 0.126606 O\n0.056123 0.330221 0.478926 O\n0.507931 0.187643 0.759508 O\n0.996273 0.316594 0.237803 O\n0.563779 0.167455 0.527244 O\n0.492069 0.187643 0.259508 O\n0.071847 0.012882 0.629343 O\n0.436221 0.167455 0.027244 O\n0.928153 0.012882 0.129343 O\n",
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{
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"structure_string": "V8 O12 F4\n1.0\n3.421676 4.413211 0.000000\n-3.421676 4.413211 0.000000\n0.000000 0.509148 8.808028\nV O F\n8 12 4\ndirect\n0.629165 0.620988 0.874755 V\n0.883732 0.866674 0.624895 V\n0.212029 0.287199 0.750774 V\n0.465465 0.534535 0.500000 V\n0.712801 0.787971 0.249226 V\n0.133326 0.116268 0.375105 V\n0.379012 0.370835 0.125245 V\n0.046251 0.953749 0.000000 V\n0.950138 0.552001 0.750817 O\n0.971867 0.971377 0.220791 O\n0.224219 0.217052 0.971692 O\n0.722526 0.722167 0.471201 O\n0.475055 0.466881 0.721399 O\n0.028623 0.028133 0.779209 O\n0.782948 0.775781 0.028308 O\n0.277833 0.277474 0.528799 O\n0.533119 0.524945 0.278601 O\n0.203130 0.796870 0.500000 O\n0.447999 0.049862 0.249183 O\n0.308758 0.691242 0.000000 O\n0.803269 0.196731 0.500000 F\n0.551633 0.947802 0.748821 F\n0.704903 0.295097 0.000000 F\n0.052198 0.448367 0.251179 F\n",
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{
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"structure_string": "Li4 Fe8 B8 O24\n1.0\n-5.313211 0.000000 0.000000\n-0.026401 -9.074964 0.000000\n2.431929 4.522237 10.114438\nLi Fe B O\n4 8 8 24\ndirect\n0.646903 0.290563 0.583115 Li\n0.387056 0.049424 0.097543 Li\n0.892228 0.546670 0.097190 Li\n0.576325 0.908273 0.841867 Li\n0.596366 0.588946 0.871622 Fe\n0.897315 0.902600 0.121924 Fe\n0.154923 0.484573 0.623668 Fe\n0.341520 0.013260 0.368354 Fe\n0.652013 0.962948 0.616613 Fe\n0.846960 0.514365 0.367073 Fe\n0.091835 0.106649 0.866516 Fe\n0.394335 0.405908 0.124009 Fe\n0.359440 0.355141 0.376076 B\n0.094002 0.775537 0.867455 B\n0.847313 0.851360 0.368018 B\n0.606606 0.259802 0.878442 B\n0.153541 0.153807 0.623962 B\n0.397561 0.731946 0.123233 B\n0.648051 0.632410 0.623589 B\n0.892495 0.227725 0.119513 B\n0.861686 0.782571 0.905330 O\n0.537049 0.511793 0.651356 O\n0.746961 0.099649 0.113028 O\n0.460084 0.218088 0.380639 O\n0.136390 0.404009 0.421974 O\n0.205924 0.631711 0.814996 O\n0.733659 0.395298 0.888104 O\n0.977675 0.955790 0.333745 O\n0.307786 0.889247 0.165383 O\n0.381924 0.119713 0.579072 O\n0.027392 0.285573 0.619985 O\n0.631466 0.712600 0.084147 O\n0.374350 0.266110 0.916992 O\n0.625173 0.898730 0.414922 O\n0.713278 0.110023 0.837149 O\n0.048288 0.054703 0.672189 O\n0.253043 0.605796 0.119224 O\n0.810260 0.384122 0.165726 O\n0.862938 0.592380 0.567658 O\n0.556060 0.777834 0.651850 O\n0.933214 0.706310 0.355235 O\n0.232825 0.916825 0.885777 O\n0.480078 0.448841 0.329940 O\n0.125259 0.207547 0.077702 O\n",
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{
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"structure_string": "Ho2 H2 O4\n1.0\n3.646518 0.000000 0.000000\n0.000000 4.303628 0.000000\n0.000000 2.061104 5.650338\nHo H O\n2 2 4\ndirect\n0.750000 0.662804 0.689101 Ho\n0.250000 0.337196 0.310899 Ho\n0.750000 0.013005 0.095733 H\n0.250000 0.986995 0.904267 H\n0.750000 0.233636 0.548792 O\n0.250000 0.766364 0.451208 O\n0.750000 0.249971 0.067564 O\n0.250000 0.750029 0.932436 O\n",
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{
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{
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{
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{
"id": "mp-1029448",
"created_at": "2022-09-04T14:42:11.900030Z",
"structure_string": "Li10 Os2 N8\n1.0\n4.971830 0.000000 0.000000\n0.000000 6.630327 0.000000\n0.000000 0.000000 6.724861\nLi Os N\n10 2 8\ndirect\n0.756303 0.239586 0.300301 Li\n0.756303 0.239586 0.699699 Li\n0.756303 0.760414 0.300301 Li\n0.756303 0.760414 0.699699 Li\n0.243697 0.260414 0.199699 Li\n0.243697 0.260414 0.800301 Li\n0.243697 0.739586 0.199699 Li\n0.243697 0.739586 0.800301 Li\n0.310639 0.500000 0.500000 Li\n0.689361 0.000000 0.000000 Li\n0.278365 0.000000 0.500000 Os\n0.721635 0.500000 0.000000 Os\n0.072909 0.768381 0.500000 N\n0.072909 0.231619 0.500000 N\n0.927091 0.731619 0.000000 N\n0.927091 0.268381 0.000000 N\n0.517499 0.500000 0.229801 N\n0.517499 0.500000 0.770199 N\n0.482501 0.000000 0.270199 N\n0.482501 0.000000 0.729801 N\n",
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"formula_full": "Li10 Os2 N8",
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{
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"structure_string": "Na1 V4 Cd3 O12\n1.0\n-0.015564 -0.017697 5.354123\n5.400654 -0.017870 -0.015545\n-0.025723 7.666805 -0.025508\nNa V Cd O\n1 4 3 12\ndirect\n0.507563 0.533195 0.247871 Na\n0.994929 0.500951 0.993369 V\n0.493056 0.998221 0.499644 V\n0.990761 0.499766 0.483820 V\n0.502140 0.000911 0.002039 V\n0.996096 0.032730 0.249549 Cd\n0.487880 0.466029 0.745622 Cd\n0.007398 0.964081 0.745852 Cd\n0.807403 0.780614 0.049255 O\n0.720385 0.296389 0.462405 O\n0.200857 0.214015 0.551821 O\n0.306200 0.717442 0.958886 O\n0.199752 0.217391 0.959382 O\n0.287573 0.703011 0.546034 O\n0.805586 0.789770 0.453550 O\n0.705735 0.272973 0.039019 O\n0.418045 0.986156 0.260862 O\n0.077833 0.474468 0.258947 O\n0.585620 0.020694 0.742418 O\n0.905186 0.531195 0.749654 O\n",
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]
}