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{
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"results": [
{
"id": "mp-1219967",
"created_at": "2022-09-04T14:46:41.761917Z",
"structure_string": "Rb16 Nb16 Si16 O80\n1.0\n5.207698 20.421745 0.000000\n-5.207698 20.421745 0.000000\n0.000000 2.654666 10.071169\nRb Nb Si O\n16 16 16 80\ndirect\n0.990185 0.399373 0.555103 Rb\n0.740148 0.149450 0.305374 Rb\n0.600627 0.009815 0.444897 Rb\n0.850550 0.259852 0.694626 Rb\n0.795168 0.704755 0.763221 Rb\n0.295245 0.204832 0.236779 Rb\n0.532029 0.467971 0.000000 Rb\n0.058394 0.941606 0.500000 Rb\n0.097719 0.506890 0.947940 Rb\n0.347787 0.756817 0.197521 Rb\n0.493110 0.902281 0.052060 Rb\n0.243183 0.652213 0.802479 Rb\n0.626782 0.625026 0.399751 Rb\n0.895500 0.856307 0.079735 Rb\n0.143693 0.104500 0.920265 Rb\n0.374974 0.373218 0.600249 Rb\n0.960109 0.604679 0.332707 Nb\n0.194840 0.368623 0.602273 Nb\n0.961566 0.101873 0.101060 Nb\n0.693363 0.371450 0.335787 Nb\n0.631377 0.805160 0.397727 Nb\n0.395321 0.039891 0.667293 Nb\n0.898127 0.038433 0.898940 Nb\n0.628550 0.306637 0.664213 Nb\n0.875600 0.552006 0.153898 Nb\n0.143722 0.285263 0.918802 Nb\n0.142144 0.785504 0.151999 Nb\n0.377187 0.551760 0.418781 Nb\n0.714737 0.856278 0.081198 Nb\n0.447994 0.124400 0.846102 Nb\n0.214496 0.857856 0.848001 Nb\n0.448240 0.622813 0.581219 Nb\n0.765012 0.907161 0.764145 Si\n0.497206 0.174951 0.063247 Si\n0.530778 0.641423 0.798130 Si\n0.231662 0.940472 0.530370 Si\n0.825049 0.502794 0.936753 Si\n0.092839 0.234988 0.235855 Si\n0.358577 0.469222 0.201870 Si\n0.059528 0.768338 0.469630 Si\n0.613522 0.720940 0.718413 Si\n0.311188 0.023343 0.447714 Si\n0.576935 0.257559 0.983706 Si\n0.847611 0.986887 0.681314 Si\n0.976657 0.688812 0.552286 Si\n0.279060 0.386478 0.281587 Si\n0.742441 0.423065 0.016294 Si\n0.013113 0.152389 0.318686 Si\n0.814129 0.819059 0.903464 O\n0.409156 0.223356 0.964078 O\n0.391919 0.740637 0.886071 O\n0.331931 0.801217 0.481133 O\n0.776644 0.590844 0.035922 O\n0.180941 0.185871 0.096536 O\n0.259363 0.608081 0.113929 O\n0.198783 0.668069 0.518867 O\n0.061729 0.471323 0.483478 O\n0.811752 0.221303 0.233481 O\n0.528677 0.938271 0.516522 O\n0.778697 0.188248 0.766519 O\n0.565180 0.974861 0.979939 O\n0.315138 0.724902 0.729979 O\n0.025139 0.434820 0.020061 O\n0.275098 0.684862 0.270021 O\n0.518490 0.858215 0.765285 O\n0.448895 0.927158 0.358286 O\n0.529976 0.346753 0.846484 O\n0.936945 0.939096 0.777553 O\n0.072842 0.551105 0.641714 O\n0.141785 0.481510 0.234715 O\n0.653247 0.470024 0.153516 O\n0.060904 0.063055 0.222447 O\n0.796067 0.704432 0.055500 O\n0.295568 0.203933 0.944500 O\n0.239178 0.760822 0.000000 O\n0.350668 0.649332 0.500000 O\n0.722522 0.672311 0.286714 O\n0.262110 0.132534 0.818918 O\n0.008427 0.886390 0.032537 O\n0.476238 0.418421 0.572294 O\n0.867466 0.737890 0.181082 O\n0.327689 0.277478 0.713286 O\n0.113610 0.991573 0.967463 O\n0.581579 0.523762 0.427706 O\n0.794838 0.705666 0.428684 O\n0.294334 0.205162 0.571316 O\n0.866042 0.133958 0.000000 O\n0.723901 0.276099 0.500000 O\n0.834484 0.818864 0.639431 O\n0.409253 0.244017 0.207275 O\n0.655759 0.497514 0.885963 O\n0.087994 0.065350 0.460740 O\n0.755983 0.590747 0.792725 O\n0.181136 0.165516 0.360569 O\n0.502486 0.344241 0.114037 O\n0.934650 0.912006 0.539260 O\n0.605559 0.043621 0.749513 O\n0.634461 0.015195 0.101014 O\n0.545916 0.603767 0.660831 O\n0.193916 0.955226 0.689778 O\n0.984805 0.365539 0.898986 O\n0.956379 0.394441 0.250487 O\n0.396233 0.454084 0.339169 O\n0.044774 0.806084 0.310222 O\n0.612605 0.897194 0.244192 O\n0.487055 0.022662 0.746109 O\n0.051058 0.958683 0.807826 O\n0.549201 0.460573 0.682311 O\n0.977338 0.512945 0.253891 O\n0.102806 0.387395 0.755808 O\n0.041317 0.948942 0.192174 O\n0.539427 0.450799 0.317689 O\n0.936660 0.703127 0.419219 O\n0.293985 0.346547 0.440874 O\n0.876683 0.263826 0.001277 O\n0.854313 0.285504 0.358579 O\n0.653453 0.706015 0.559126 O\n0.296873 0.063340 0.580781 O\n0.736174 0.123317 0.998723 O\n0.714496 0.145687 0.641421 O\n0.777515 0.469234 0.006309 O\n0.060445 0.186274 0.245875 O\n0.288952 0.457801 0.235522 O\n0.049402 0.697316 0.518484 O\n0.542199 0.711048 0.764478 O\n0.302684 0.950598 0.481516 O\n0.530766 0.222485 0.993691 O\n0.813726 0.939555 0.754125 O\n",
"nsites": 128,
"nelements": 4,
"elements": [
"Rb",
"Nb",
"Si",
"O"
],
"chemical_system": "Nb-O-Rb-Si",
"density": 3.5528716193775116,
"density_atomic": 0.05975323878359403,
"volume": 2142.1432980992477,
"volume_molar": 10.078350366597117,
"formula_full": "Rb16 Nb16 Si16 O80",
"formula_reduced": "RbNbSiO5",
"formula_anonymous": "ABCD5",
"energy": -1047.18058268,
"energy_per_atom": -8.1810983021875,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -992.22058268,
"band_gap": 3.0692000000000004,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0324582,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:45.420000Z",
"spacegroup": 5
},
{
"id": "mp-849751",
"created_at": "2022-09-04T14:40:43.135494Z",
"structure_string": "Cs4 Co4 H96 S8 O80\n1.0\n12.345220 0.000000 0.000000\n0.000000 12.345220 0.000000\n0.000000 0.000000 12.345220\nCs Co H S O\n4 4 96 8 80\ndirect\n0.000000 0.000000 0.500000 Cs\n0.000000 0.500000 0.000000 Cs\n0.500000 0.500000 0.500000 Cs\n0.500000 0.000000 0.000000 Cs\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n0.997255 0.207326 0.282004 H\n0.997255 0.292674 0.782004 H\n0.019869 0.057301 0.201074 H\n0.019869 0.442699 0.701074 H\n0.030628 0.573677 0.687110 H\n0.030628 0.926323 0.187110 H\n0.057301 0.201074 0.019869 H\n0.057301 0.298926 0.519869 H\n0.073677 0.687110 0.469372 H\n0.073677 0.812890 0.969372 H\n0.120001 0.176354 0.284534 H\n0.120001 0.323646 0.784534 H\n0.176354 0.284534 0.120001 H\n0.176354 0.215466 0.620001 H\n0.187110 0.030628 0.926323 H\n0.187110 0.469372 0.426323 H\n0.207326 0.282004 0.997255 H\n0.207326 0.217996 0.497255 H\n0.201074 0.019869 0.057301 H\n0.201074 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"nsites": 192,
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"elements": [
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"H",
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"density": 2.1187044402521082,
"density_atomic": 0.10204805401675118,
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"volume_molar": 5.901279370806488,
"formula_full": "Cs4 Co4 H96 S8 O80",
"formula_reduced": "CsCoH24(SO10)2",
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"energy": -1054.45479605,
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"updated_at": "2021-11-28T01:35:08.281000Z",
"spacegroup": 205
},
{
"id": "mp-729576",
"created_at": "2022-09-04T14:41:22.953843Z",
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"updated_at": "2021-11-28T01:35:27.198000Z",
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},
{
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{
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0.191675 H\n0.317182 0.712647 0.308325 H\n0.182818 0.212647 0.808325 H\n0.682818 0.287353 0.691675 H\n0.891237 0.871030 0.226485 H\n0.391237 0.628970 0.273515 H\n0.108763 0.128970 0.773515 H\n0.608763 0.371030 0.726485 H\n0.831473 0.012784 0.962366 H\n0.331473 0.487216 0.537634 H\n0.168527 0.987216 0.037634 H\n0.668527 0.512784 0.462366 H\n0.771718 0.940468 0.048631 H\n0.271718 0.559532 0.451369 H\n0.228282 0.059532 0.951369 H\n0.728282 0.440468 0.548631 H\n0.166748 0.411182 0.986557 H\n0.666748 0.088818 0.513443 H\n0.833252 0.588818 0.013443 H\n0.333252 0.911182 0.486557 H\n0.217408 0.504511 0.894313 H\n0.717408 0.995489 0.605687 H\n0.782592 0.495489 0.105687 H\n0.282592 0.004511 0.394313 H\n0.169522 0.699510 0.778409 H\n0.669522 0.800490 0.721591 H\n0.830478 0.300490 0.221591 H\n0.330478 0.199510 0.278409 H\n0.082371 0.732075 0.768676 H\n0.582371 0.767925 0.731324 H\n0.917629 0.267925 0.231324 H\n0.417629 0.232075 0.268676 H\n0.051992 0.434162 0.977537 H\n0.551992 0.065838 0.522463 H\n0.948008 0.565838 0.022463 H\n0.448008 0.934162 0.477537 H\n0.012666 0.593569 0.896452 H\n0.512666 0.906431 0.603548 H\n0.987334 0.406431 0.103548 H\n0.487334 0.093569 0.396452 H\n0.759953 0.003472 0.368159 C\n0.259953 0.496528 0.131841 C\n0.240047 0.996528 0.631841 C\n0.740047 0.503472 0.868159 C\n0.024779 0.585275 0.611896 C\n0.524779 0.914725 0.888104 C\n0.975221 0.414725 0.388104 C\n0.475221 0.085275 0.111896 C\n0.869597 0.951343 0.091877 C\n0.369597 0.548657 0.408123 C\n0.130403 0.048657 0.908123 C\n0.630403 0.451343 0.591877 C\n0.116034 0.566062 0.883888 C\n0.616034 0.933938 0.616112 C\n0.883966 0.433938 0.116112 C\n0.383966 0.066062 0.383888 C\n0.252119 0.963103 0.201151 Br\n0.752119 0.536897 0.298849 Br\n0.747881 0.036897 0.798849 Br\n0.247881 0.463103 0.701151 Br\n0.977641 0.949949 0.325126 Br\n0.477641 0.550051 0.174874 Br\n0.022359 0.050051 0.674874 Br\n0.522359 0.449949 0.825126 Br\n0.091061 0.244977 0.127554 Br\n0.591061 0.255023 0.372446 Br\n0.908939 0.755023 0.872446 Br\n0.408939 0.744977 0.627554 Br\n0.155789 0.662021 0.401817 Br\n0.655789 0.837979 0.098183 Br\n0.844211 0.337979 0.598183 Br\n0.344211 0.162021 0.901817 Br\n0.076455 0.757053 0.148646 Br\n0.576455 0.742947 0.351354 Br\n0.923545 0.242947 0.851354 Br\n0.423545 0.257053 0.648646 Br\n0.148019 0.142376 0.385713 Br\n0.648019 0.357624 0.114287 Br\n0.851981 0.857624 0.614287 Br\n0.351981 0.642376 0.885713 Br\n0.784166 0.852866 0.402903 N\n0.284166 0.647134 0.097097 N\n0.215834 0.147134 0.597097 N\n0.715834 0.352866 0.902903 N\n0.725268 0.037089 0.290049 N\n0.225268 0.462911 0.209951 N\n0.274732 0.962911 0.709951 N\n0.774732 0.537089 0.790049 N\n0.772683 0.124124 0.410998 N\n0.272683 0.375876 0.089002 N\n0.227317 0.875876 0.589002 N\n0.727317 0.624124 0.910998 N\n0.986789 0.569776 0.686817 N\n0.486789 0.930224 0.813183 N\n0.013211 0.430224 0.313183 N\n0.513211 0.069776 0.186817 N\n0.061500 0.458637 0.597228 N\n0.561500 0.041363 0.902772 N\n0.938500 0.541363 0.402772 N\n0.438500 0.958637 0.097228 N\n0.028780 0.730563 0.552821 N\n0.528780 0.769437 0.947179 N\n0.971220 0.269437 0.447179 N\n0.471220 0.230563 0.052821 N\n0.931361 0.015779 0.071614 N\n0.431361 0.484221 0.428386 N\n0.068639 0.984221 0.928386 N\n0.568639 0.515779 0.571614 N\n0.857051 0.866319 0.176418 N\n0.357051 0.633681 0.323582 N\n0.142949 0.133681 0.823582 N\n0.642949 0.366319 0.676418 N\n0.820343 0.974989 0.029516 N\n0.320343 0.525011 0.470484 N\n0.179657 0.025011 0.970484 N\n0.679657 0.474989 0.529516 N\n0.171325 0.491884 0.925405 N\n0.671325 0.008116 0.574595 N\n0.828675 0.508116 0.074595 N\n0.328675 0.991884 0.425405 N\n0.122625 0.676606 0.805326 N\n0.622625 0.823394 0.694674 N\n0.877375 0.323394 0.194674 N\n0.377375 0.176606 0.305326 N\n0.055337 0.529432 0.922079 N\n0.555337 0.970568 0.577921 N\n0.944663 0.470568 0.077921 N\n0.444663 0.029432 0.422079 N\n",
"nsites": 188,
"nelements": 5,
"elements": [
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"H",
"C",
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"N"
],
"chemical_system": "Br-C-Cd-H-N",
"density": 2.270850474333187,
"density_atomic": 0.07723894423461468,
"volume": 2434.005304745578,
"volume_molar": 7.796767316896046,
"formula_full": "Cd4 H96 C16 Br24 N48",
"formula_reduced": "CdH24C4(BrN2)6",
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"energy": -1023.49105344,
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"updated_at": "2021-11-28T01:37:11.893000Z",
"spacegroup": 14
},
{
"id": "mp-1076880",
"created_at": "2022-09-04T14:44:19.657707Z",
"structure_string": "La28 Sm4 Co20 Cu12 O80\n1.0\n0.000673 0.002853 10.778794\n11.389130 0.006767 0.000599\n-5.685622 16.133691 -5.384971\nLa Sm Co Cu O\n28 4 20 12 80\ndirect\n0.301876 0.064367 0.111407 La\n0.307130 0.063428 0.609514 La\n0.306091 0.567492 0.611935 La\n0.804835 0.064973 0.610417 La\n0.805871 0.567618 0.111384 La\n0.807000 0.567074 0.612283 La\n0.194310 0.433375 0.388435 La\n0.192943 0.435688 0.890336 La\n0.198122 0.933467 0.386729 La\n0.193991 0.933744 0.888832 La\n0.693789 0.435016 0.388680 La\n0.693370 0.932772 0.388367 La\n0.694656 0.933730 0.888957 La\n0.053909 0.295284 0.111694 La\n0.057556 0.296049 0.610117 La\n0.055884 0.796239 0.612131 La\n0.559166 0.294253 0.111246 La\n0.559093 0.297501 0.612706 La\n0.553310 0.797040 0.112435 La\n0.556839 0.794857 0.611833 La\n0.447833 0.204887 0.388505 La\n0.449079 0.206107 0.888829 La\n0.442923 0.702638 0.385975 La\n0.444682 0.703200 0.888538 La\n0.945900 0.203037 0.387134 La\n0.942614 0.205669 0.888927 La\n0.943976 0.703694 0.387862 La\n0.943963 0.702916 0.888994 La\n0.299568 0.568861 0.108552 Sm\n0.802776 0.066741 0.109392 Sm\n0.693284 0.433179 0.891845 Sm\n0.053897 0.792525 0.110170 Sm\n0.004006 0.997927 0.497982 Co\n0.255485 0.251347 0.001442 Co\n0.255443 0.250156 0.499681 Co\n0.754614 0.250560 0.499912 Co\n0.105414 0.093931 0.250375 Co\n0.109088 0.097937 0.750980 Co\n0.109265 0.595320 0.248364 Co\n0.108982 0.593389 0.750773 Co\n0.611060 0.095845 0.251624 Co\n0.608580 0.097259 0.750901 Co\n0.604631 0.593990 0.247701 Co\n0.609763 0.594150 0.752166 Co\n0.355587 0.404177 0.245090 Co\n0.358781 0.402927 0.748178 Co\n0.354895 0.903129 0.247738 Co\n0.359160 0.906076 0.750609 Co\n0.857633 0.403821 0.248831 Co\n0.854984 0.403192 0.748991 Co\n0.860610 0.905778 0.250207 Co\n0.859034 0.906243 0.750988 Co\n0.002702 0.999244 0.002208 Cu\n0.001794 0.500797 0.000632 Cu\n0.002887 0.500516 0.499289 Cu\n0.503557 0.000028 0.000928 Cu\n0.503529 0.999038 0.499809 Cu\n0.503233 0.501611 0.001192 Cu\n0.503079 0.500991 0.499926 Cu\n0.252647 0.751005 0.001182 Cu\n0.252985 0.748611 0.498876 Cu\n0.753388 0.249646 0.000350 Cu\n0.753542 0.751009 0.001605 Cu\n0.752148 0.748746 0.499045 Cu\n0.120820 0.119074 0.484307 O\n0.117777 0.118747 0.985924 O\n0.119803 0.620252 0.486555 O\n0.120558 0.623361 0.990936 O\n0.619796 0.119286 0.486541 O\n0.622297 0.120889 0.989472 O\n0.620237 0.620862 0.486707 O\n0.619970 0.617584 0.984162 O\n0.134613 0.384789 0.015990 O\n0.133016 0.380979 0.513074 O\n0.131740 0.878380 0.017417 O\n0.137535 0.879116 0.515754 O\n0.631736 0.378138 0.009720 O\n0.632430 0.380690 0.512602 O\n0.636843 0.883630 0.017136 O\n0.632386 0.878323 0.511811 O\n0.371841 0.114419 0.486173 O\n0.372099 0.114984 0.985594 O\n0.369894 0.616444 0.486603 O\n0.369553 0.616405 0.989315 O\n0.870304 0.115760 0.485042 O\n0.869619 0.114750 0.990386 O\n0.870985 0.616622 0.487220 O\n0.867783 0.613424 0.985400 O\n0.385175 0.390585 0.017472 O\n0.385012 0.384909 0.512816 O\n0.382174 0.884212 0.012423 O\n0.383326 0.882121 0.511218 O\n0.879555 0.383349 0.009485 O\n0.885532 0.385772 0.513894 O\n0.886699 0.886920 0.020474 O\n0.882345 0.882637 0.514560 O\n0.100921 0.117525 0.147846 O\n0.088813 0.107535 0.640103 O\n0.104325 0.616267 0.145145 O\n0.097874 0.614589 0.646613 O\n0.607519 0.114122 0.147772 O\n0.595517 0.114769 0.645372 O\n0.603302 0.615769 0.145039 O\n0.597910 0.612850 0.646772 O\n0.449527 0.386003 0.351017 O\n0.459324 0.386490 0.852806 O\n0.446940 0.885087 0.353153 O\n0.453597 0.885311 0.855006 O\n0.951405 0.385382 0.353855 O\n0.954269 0.386230 0.853763 O\n0.950363 0.893732 0.360824 O\n0.951204 0.885415 0.855686 O\n0.338629 0.279813 0.136488 O\n0.335686 0.282628 0.636935 O\n0.346855 0.780212 0.143444 O\n0.348008 0.783169 0.645428 O\n0.843295 0.280093 0.143202 O\n0.833880 0.284229 0.637571 O\n0.858870 0.781654 0.146956 O\n0.845464 0.782635 0.645757 O\n0.197915 0.214538 0.361074 O\n0.201580 0.218374 0.862153 O\n0.200256 0.718023 0.354670 O\n0.200808 0.716109 0.856844 O\n0.697462 0.217823 0.362119 O\n0.700206 0.220089 0.856879 O\n0.699320 0.715388 0.354072 O\n0.702574 0.719319 0.857203 O\n0.420810 0.070896 0.249512 O\n0.418142 0.073698 0.749656 O\n0.413546 0.570374 0.242920 O\n0.419347 0.570653 0.749995 O\n0.914178 0.071787 0.245242 O\n0.920268 0.073816 0.750090 O\n0.920899 0.571185 0.249725 O\n0.919865 0.569475 0.750441 O\n0.169354 0.427848 0.250031 O\n0.170425 0.424975 0.750215 O\n0.164061 0.924476 0.244497 O\n0.170710 0.931834 0.751133 O\n0.668625 0.427693 0.249818 O\n0.669930 0.427668 0.755920 O\n0.671892 0.928548 0.250644 O\n0.670130 0.930675 0.750674 O\n",
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"elements": [
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"Co",
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"O"
],
"chemical_system": "Co-Cu-La-O-Sm",
"density": 6.4638339803917715,
"density_atomic": 0.07268398999593106,
"volume": 1981.1790740720382,
"volume_molar": 8.285374482519641,
"formula_full": "La28 Sm4 Co20 Cu12 O80",
"formula_reduced": "La7SmCo5Cu3O20",
"formula_anonymous": "AB3C5D7E20",
"energy": -1081.23776468,
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"updated_at": "2021-11-28T01:36:41.279000Z",
"spacegroup": 1
},
{
"id": "mp-707973",
"created_at": "2022-09-04T14:47:14.203938Z",
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{
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{
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"elements": [
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],
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"formula_full": "Li4 Zr12 H72 N16 F76",
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"updated_at": "2021-11-28T01:34:33.578000Z",
"spacegroup": 14
},
{
"id": "mp-707792",
"created_at": "2022-09-04T14:39:35.815663Z",
"structure_string": "H12 Ru18 C48 S6 O48\n1.0\n11.528510 0.000000 0.000000\n-5.665530 -11.495247 0.000000\n-5.727850 1.742754 -18.210939\nH Ru C S O\n12 18 48 6 48\ndirect\n0.396747 0.185710 0.360380 H\n0.603253 0.814290 0.639620 H\n0.755455 0.525600 0.190989 H\n0.244545 0.474400 0.809011 H\n0.879669 0.155788 0.239739 H\n0.120331 0.844212 0.760261 H\n0.643224 0.226006 0.412505 H\n0.356776 0.773994 0.587495 H\n0.676585 0.955161 0.190327 H\n0.323415 0.044839 0.809673 H\n0.616375 0.443317 0.076511 H\n0.383625 0.556683 0.923489 H\n0.703944 0.098772 0.182679 Ru\n0.296056 0.901228 0.817321 Ru\n0.654417 0.914003 0.282451 Ru\n0.345583 0.085997 0.717549 Ru\n0.886969 0.126035 0.334712 Ru\n0.113031 0.873965 0.665288 Ru\n0.502730 0.151094 0.328239 Ru\n0.497270 0.848906 0.671761 Ru\n0.417370 0.334739 0.332825 Ru\n0.582630 0.665261 0.667175 Ru\n0.686331 0.381284 0.408596 Ru\n0.313669 0.618716 0.591404 Ru\n0.723985 0.390874 0.048984 Ru\n0.276015 0.609126 0.951016 Ru\n0.898712 0.500776 0.187398 Ru\n0.101288 0.499224 0.812602 Ru\n0.601239 0.390954 0.159238 Ru\n0.398761 0.609046 0.840762 Ru\n0.785785 0.086894 0.112586 C\n0.214215 0.913106 0.887414 C\n0.528730 0.036902 0.112642 C\n0.471270 0.963098 0.887358 C\n0.466192 0.811496 0.234695 C\n0.533808 0.188504 0.765305 C\n0.734865 0.816970 0.268050 C\n0.265135 0.183030 0.731950 C\n0.649723 0.870008 0.377813 C\n0.350277 0.129992 0.622187 C\n0.913945 0.109667 0.437059 C\n0.086055 0.890333 0.562941 C\n0.000234 0.056290 0.329670 C\n0.999766 0.943710 0.670330 C\n0.016692 0.286816 0.345801 C\n0.983308 0.713184 0.654199 C\n0.357763 0.055978 0.246158 C\n0.642237 0.944022 0.753842 C\n0.443960 0.025131 0.385903 C\n0.556040 0.974869 0.614097 C\n0.352651 0.325914 0.414880 C\n0.647349 0.674086 0.585120 C\n0.249518 0.274368 0.253304 C\n0.750482 0.725632 0.746696 C\n0.448754 0.492467 0.326559 C\n0.551246 0.507533 0.673441 C\n0.658714 0.373642 0.502221 C\n0.341286 0.626358 0.497779 C\n0.861029 0.383267 0.441680 C\n0.138971 0.616733 0.558320 C\n0.751435 0.546623 0.409965 C\n0.248565 0.453377 0.590035 C\n0.564398 0.278632 0.978096 C\n0.435602 0.721368 0.021904 C\n0.847508 0.362780 0.015700 C\n0.152492 0.637220 0.984300 C\n0.754449 0.530091 0.999874 C\n0.245551 0.469909 0.000126 C\n0.053013 0.492212 0.175213 C\n0.946987 0.507788 0.824787 C\n0.975673 0.548256 0.290885 C\n0.024327 0.451744 0.709115 C\n0.950423 0.655343 0.158653 C\n0.049577 0.344657 0.841347 C\n0.427388 0.265948 0.114035 C\n0.572612 0.734052 0.885965 C\n0.527947 0.497502 0.158076 C\n0.472053 0.502498 0.841924 C\n0.656605 0.095413 0.295548 S\n0.343395 0.904587 0.704452 S\n0.578062 0.336237 0.279836 S\n0.421938 0.663763 0.720164 S\n0.740485 0.299098 0.157955 S\n0.259515 0.700902 0.842045 S\n0.837727 0.077953 0.071785 O\n0.162273 0.922047 0.928215 O\n0.422198 0.994619 0.069125 O\n0.577802 0.005381 0.930875 O\n0.352266 0.751915 0.205273 O\n0.647734 0.248085 0.794727 O\n0.782300 0.758696 0.257405 O\n0.217700 0.241304 0.742595 O\n0.647092 0.846675 0.436749 O\n0.352908 0.153325 0.563251 O\n0.930379 0.100854 0.499200 O\n0.069621 0.899146 0.500800 O\n0.069493 0.014289 0.326474 O\n0.930507 0.985711 0.673526 O\n0.100528 0.380820 0.346960 O\n0.899472 0.619180 0.653040 O\n0.267399 0.995320 0.197260 O\n0.732601 0.004680 0.802740 O\n0.402560 0.945828 0.418742 O\n0.597440 0.054172 0.581258 O\n0.316048 0.322500 0.465465 O\n0.683952 0.677500 0.534535 O\n0.149473 0.239033 0.204765 O\n0.850527 0.760967 0.795235 O\n0.470042 0.589697 0.323391 O\n0.529958 0.410303 0.676609 O\n0.644302 0.369845 0.559701 O\n0.355698 0.630155 0.440299 O\n0.961874 0.376346 0.466991 O\n0.038126 0.623654 0.533009 O\n0.794706 0.647038 0.409339 O\n0.205294 0.352962 0.590661 O\n0.466661 0.211008 0.935722 O\n0.533339 0.788992 0.064278 O\n0.922884 0.346877 0.994245 O\n0.077116 0.653123 0.005755 O\n0.769427 0.614523 0.970933 O\n0.230573 0.385477 0.029067 O\n0.145403 0.486490 0.166400 O\n0.854597 0.513510 0.833600 O\n0.027188 0.587417 0.351672 O\n0.972812 0.412583 0.648328 O\n0.977549 0.749208 0.141609 O\n0.022451 0.250792 0.858391 O\n0.321382 0.189841 0.086229 O\n0.678618 0.810159 0.913771 O\n0.484029 0.562710 0.159997 O\n0.515971 0.437290 0.840003 O\n",
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],
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"volume_molar": 11.01034174102857,
"formula_full": "H12 Ru18 C48 S6 O48",
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"updated_at": "2021-11-28T01:34:31.256000Z",
"spacegroup": 2
}
]
}