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{
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"results": [
{
"id": "mp-1210239",
"created_at": "2022-09-04T14:40:28.650496Z",
"structure_string": "Sm4 Se6 O40\n1.0\n0.000000 -6.791475 0.000000\n-6.818482 3.395738 1.646205\n0.168030 0.000000 -20.375535\nSm Se O\n4 6 40\ndirect\n0.838587 0.713198 0.609937 Sm\n0.161413 0.286802 0.390063 Sm\n0.125389 0.286802 0.890063 Sm\n0.874611 0.713198 0.109937 Sm\n0.766273 0.578261 0.916427 Se\n0.233727 0.421739 0.083573 Se\n0.188012 0.421739 0.583573 Se\n0.811988 0.578261 0.416427 Se\n0.728341 0.000000 0.750000 Se\n0.271659 0.000000 0.250000 Se\n0.305963 0.635843 0.848096 O\n0.694037 0.364157 0.151904 O\n0.670120 0.364157 0.651904 O\n0.329880 0.635843 0.348096 O\n0.371356 0.738233 0.906684 O\n0.628644 0.261767 0.093316 O\n0.633124 0.261767 0.593316 O\n0.366876 0.738233 0.406684 O\n0.507887 0.409294 0.888507 O\n0.492113 0.590706 0.111493 O\n0.098592 0.590706 0.611493 O\n0.901408 0.409294 0.388507 O\n0.782430 0.697109 0.996785 O\n0.217570 0.302891 0.003215 O\n0.085321 0.302891 0.503215 O\n0.914679 0.697109 0.496785 O\n0.569159 0.972215 0.813911 O\n0.430841 0.027785 0.186089 O\n0.596943 0.027785 0.686089 O\n0.403057 0.972215 0.313911 O\n0.838797 0.733529 0.864100 O\n0.161203 0.266471 0.135900 O\n0.105268 0.266471 0.635900 O\n0.894732 0.733529 0.364100 O\n0.461132 0.536790 0.584383 O\n0.538868 0.463210 0.415617 O\n0.924342 0.463210 0.915617 O\n0.075658 0.536790 0.084383 O\n0.167511 0.980583 0.876509 O\n0.832489 0.019417 0.123491 O\n0.186929 0.019417 0.623491 O\n0.813071 0.980583 0.376509 O\n0.757424 0.975438 0.595283 O\n0.242576 0.024562 0.404717 O\n0.781987 0.024562 0.904717 O\n0.218013 0.975438 0.095283 O\n0.781536 0.805860 0.720618 O\n0.218464 0.194140 0.279382 O\n0.975676 0.194140 0.779382 O\n0.024324 0.805860 0.220618 O\n",
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],
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"volume": 941.6625043216262,
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"formula_full": "Sm4 Se6 O40",
"formula_reduced": "Sm2Se3O20",
"formula_anonymous": "A2B3C20",
"energy": -272.46727944,
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"updated_at": "2021-11-28T01:35:05.960000Z",
"spacegroup": 15
},
{
"id": "mp-21823",
"created_at": "2022-09-04T14:40:57.697637Z",
"structure_string": "Mn8 Pb16 O32\n1.0\n13.085379 0.000000 0.000000\n0.000000 13.085379 0.000000\n0.000000 0.000000 5.245501\nMn Pb O\n8 16 32\ndirect\n0.771036 0.193810 0.760650 Mn\n0.228964 0.806190 0.760650 Mn\n0.193810 0.228964 0.239350 Mn\n0.806190 0.771036 0.239350 Mn\n0.693810 0.271036 0.260650 Mn\n0.728964 0.693810 0.739350 Mn\n0.271036 0.306190 0.739350 Mn\n0.306190 0.728964 0.260650 Mn\n0.827385 0.494229 0.293535 Pb\n0.172615 0.505771 0.293535 Pb\n0.494229 0.172615 0.706465 Pb\n0.505771 0.827385 0.706465 Pb\n0.994229 0.327385 0.793535 Pb\n0.672615 0.994229 0.206465 Pb\n0.327385 0.005771 0.206465 Pb\n0.005771 0.672615 0.793535 Pb\n0.623382 0.420428 0.743338 Pb\n0.376618 0.579572 0.743338 Pb\n0.420428 0.376618 0.256662 Pb\n0.579572 0.623382 0.256662 Pb\n0.920428 0.123382 0.243338 Pb\n0.876618 0.920428 0.756662 Pb\n0.123382 0.079572 0.756662 Pb\n0.079572 0.876618 0.243338 Pb\n0.057937 0.226487 0.099919 O\n0.942063 0.773513 0.099919 O\n0.226487 0.942063 0.900081 O\n0.773513 0.057937 0.900081 O\n0.726487 0.557937 0.599919 O\n0.442063 0.726487 0.400081 O\n0.557937 0.273513 0.400081 O\n0.273513 0.442063 0.599919 O\n0.256513 0.176052 0.926904 O\n0.743487 0.823948 0.926904 O\n0.176052 0.743487 0.073096 O\n0.823948 0.256513 0.073096 O\n0.676052 0.756513 0.426904 O\n0.243487 0.676052 0.573096 O\n0.756513 0.323948 0.573096 O\n0.323948 0.243487 0.426904 O\n0.641267 0.220339 0.933299 O\n0.358733 0.779661 0.933299 O\n0.220339 0.358733 0.066701 O\n0.779661 0.641267 0.066701 O\n0.720339 0.141267 0.433299 O\n0.858733 0.720339 0.566701 O\n0.141267 0.279661 0.566701 O\n0.279661 0.858733 0.433299 O\n0.314855 0.587456 0.154887 O\n0.412544 0.314855 0.845113 O\n0.587456 0.685145 0.845113 O\n0.685145 0.412544 0.154887 O\n0.814855 0.912544 0.345113 O\n0.185145 0.087456 0.345113 O\n0.087456 0.814855 0.654887 O\n0.912544 0.185145 0.654887 O\n",
"nsites": 56,
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"elements": [
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],
"chemical_system": "Mn-O-Pb",
"density": 7.888239877665714,
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"volume": 898.1721528426774,
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"formula_full": "Mn8 Pb16 O32",
"formula_reduced": "Mn(PbO2)2",
"formula_anonymous": "AB2C4",
"energy": -383.54174337,
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"updated_at": "2021-11-28T01:35:11.627000Z",
"spacegroup": 114
},
{
"id": "mp-753410",
"created_at": "2022-09-04T14:45:17.670299Z",
"structure_string": "Li2 Fe6 O2 F10\n1.0\n3.531305 4.778948 0.000000\n-3.531305 4.778948 0.000000\n0.000000 2.956285 7.005921\nLi Fe O F\n2 6 2 10\ndirect\n0.115571 0.636395 0.876524 Li\n0.636395 0.115571 0.876524 Li\n0.326336 0.326336 0.176684 Fe\n0.000720 0.000720 0.512833 Fe\n0.663342 0.663342 0.335823 Fe\n0.648135 0.648135 0.827382 Fe\n0.288302 0.288302 0.662432 Fe\n0.042881 0.042881 0.013313 Fe\n0.064611 0.064611 0.731834 O\n0.268995 0.268995 0.953705 O\n0.704637 0.299980 0.010992 F\n0.299980 0.704637 0.010992 F\n0.762021 0.762021 0.021073 F\n0.427723 0.427723 0.368424 F\n0.376571 0.952657 0.336951 F\n0.952657 0.376571 0.336951 F\n0.902829 0.902829 0.308271 F\n0.012870 0.621751 0.670654 F\n0.621751 0.012870 0.670654 F\n0.548542 0.548542 0.638125 F\n",
"nsites": 20,
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"elements": [
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],
"chemical_system": "F-Fe-Li-O",
"density": 4.009339855805069,
"density_atomic": 0.08457991217701766,
"volume": 236.46276621973686,
"volume_molar": 7.120060313371143,
"formula_full": "Li2 Fe6 O2 F10",
"formula_reduced": "LiFe3OF5",
"formula_anonymous": "ABC3D5",
"energy": -131.32481876,
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"updated_at": "2021-11-28T01:36:54.497000Z",
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},
{
"id": "mp-1247712",
"created_at": "2022-09-04T14:43:05.965506Z",
"structure_string": "Sr1 Ca7 Mn6 Al2 O20\n1.0\n7.761373 0.020585 -0.013821\n0.019857 7.751196 0.001551\n-0.018103 0.000733 7.648040\nSr Ca Mn Al O\n1 7 6 2 20\ndirect\n0.269856 0.259579 0.238609 Sr\n0.205225 0.240248 0.741430 Ca\n0.305779 0.740568 0.223104 Ca\n0.211548 0.749057 0.736741 Ca\n0.753101 0.265039 0.246095 Ca\n0.744589 0.263423 0.736553 Ca\n0.758690 0.744147 0.240904 Ca\n0.735711 0.736693 0.740678 Ca\n0.989638 0.502984 0.977359 Mn\n0.983561 0.506629 0.485436 Mn\n0.507417 0.999473 0.990284 Mn\n0.487137 0.998286 0.524388 Mn\n0.505944 0.498456 0.994809 Mn\n0.486499 0.504144 0.494335 Mn\n0.020644 0.995324 0.014422 Al\n0.004943 0.997482 0.464259 Al\n0.943848 0.495188 0.230682 O\n0.044045 0.497683 0.729007 O\n0.531502 0.981444 0.264340 O\n0.599984 0.006649 0.753985 O\n0.535284 0.513997 0.246545 O\n0.246350 0.992170 0.989824 O\n0.218658 0.995717 0.547095 O\n0.251875 0.505406 0.003421 O\n0.235664 0.523210 0.440667 O\n0.966001 0.000740 0.237063 O\n0.738759 0.495903 0.927267 O\n0.727692 0.495906 0.535094 O\n0.962847 0.200916 0.936219 O\n0.933806 0.207238 0.514461 O\n0.954310 0.792105 0.941921 O\n0.920213 0.795168 0.516660 O\n0.514841 0.247828 0.008844 O\n0.463874 0.256506 0.534542 O\n0.513968 0.749591 0.987224 O\n0.476195 0.745105 0.555733 O\n",
"nsites": 36,
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"elements": [
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],
"chemical_system": "Al-Ca-Mn-O-Sr",
"density": 3.8680142890532307,
"density_atomic": 0.07824378774808168,
"volume": 460.10042504470425,
"volume_molar": 7.696637564875107,
"formula_full": "Sr1 Ca7 Mn6 Al2 O20",
"formula_reduced": "SrCa7Mn6Al2O20",
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"energy": -275.80968509,
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"updated_at": "2021-11-28T01:36:02.926000Z",
"spacegroup": 1
},
{
"id": "mp-850984",
"created_at": "2022-09-04T14:42:19.295550Z",
"structure_string": "Mn6 O6 F6\n1.0\n4.621420 0.000000 0.000000\n0.000000 4.633280 0.000000\n0.000000 0.000000 9.562060\nMn O F\n6 6 6\ndirect\n0.777895 0.017778 0.667313 Mn\n0.777895 0.017778 0.332687 Mn\n0.724229 0.953549 0.000000 Mn\n0.222105 0.517778 0.832687 Mn\n0.275771 0.453549 0.500000 Mn\n0.222105 0.517778 0.167313 Mn\n0.926591 0.811511 0.170776 O\n0.926591 0.811511 0.829224 O\n0.409459 0.690928 0.000000 O\n0.073409 0.311511 0.670776 O\n0.073409 0.311511 0.329224 O\n0.590541 0.190928 0.500000 O\n0.998160 0.781194 0.500000 F\n0.477215 0.707875 0.659568 F\n0.477215 0.707875 0.340432 F\n0.001840 0.281194 0.000000 F\n0.522785 0.207875 0.159568 F\n0.522785 0.207875 0.840432 F\n",
"nsites": 18,
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"elements": [
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],
"chemical_system": "F-Mn-O",
"density": 4.376407285652597,
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"volume": 204.74601152434266,
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"formula_full": "Mn6 O6 F6",
"formula_reduced": "MnOF",
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"energy": -138.24164444000002,
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"spacegroup": 31
},
{
"id": "mp-1238822",
"created_at": "2022-09-04T14:39:44.328141Z",
"structure_string": "Ti8 Cr8 Cu8 S32\n1.0\n11.414013 0.003188 -0.017681\n0.001743 6.899164 -0.050228\n-0.018439 -0.087169 11.935791\nTi Cr Cu S\n8 8 8 32\ndirect\n0.090102 0.897806 0.681028 Ti\n0.911146 0.107131 0.182013 Ti\n0.409044 0.883503 0.184576 Ti\n0.587176 0.102199 0.684957 Ti\n0.866290 0.616881 0.833027 Ti\n0.369639 0.383901 0.831475 Ti\n0.630789 0.599524 0.330155 Ti\n0.871339 0.393587 0.487046 Ti\n0.123627 0.363490 0.330498 Cr\n0.158401 0.623439 0.951670 Cr\n0.342828 0.631554 0.455117 Cr\n0.657816 0.383350 0.953768 Cr\n0.141205 0.130344 0.973028 Cr\n0.853670 0.868088 0.471484 Cr\n0.356910 0.135990 0.469249 Cr\n0.645280 0.877284 0.970347 Cr\n0.117377 0.371638 0.684954 Cu\n0.887924 0.626499 0.186069 Cu\n0.393006 0.381528 0.185959 Cu\n0.607560 0.621264 0.685605 Cu\n0.122711 0.883475 0.324978 Cu\n0.879266 0.122845 0.817104 Cu\n0.377060 0.886398 0.820546 Cu\n0.622972 0.128045 0.321037 Cu\n0.024068 0.860875 0.878950 S\n0.974831 0.129633 0.380567 S\n0.474921 0.867145 0.382323 S\n0.526318 0.138239 0.884263 S\n0.035184 0.361743 0.143034 S\n0.958864 0.634985 0.636680 S\n0.458694 0.348425 0.640945 S\n0.537882 0.630637 0.142542 S\n0.021934 0.388240 0.877699 S\n0.978672 0.613250 0.371074 S\n0.473894 0.389188 0.382613 S\n0.522813 0.614241 0.878587 S\n0.034615 0.862170 0.141076 S\n0.965175 0.146533 0.636722 S\n0.467214 0.851957 0.643628 S\n0.529741 0.129794 0.144028 S\n0.214196 0.885808 0.520753 S\n0.784537 0.126641 0.019796 S\n0.285077 0.879802 0.017033 S\n0.716810 0.125056 0.520710 S\n0.215864 0.377081 0.509941 S\n0.784648 0.633274 0.017193 S\n0.282970 0.371299 0.015172 S\n0.714005 0.627940 0.517667 S\n0.230576 0.118925 0.789764 S\n0.763272 0.877813 0.290103 S\n0.264944 0.120383 0.289470 S\n0.736438 0.884161 0.789986 S\n0.238209 0.629000 0.771809 S\n0.767938 0.367318 0.286762 S\n0.256854 0.616010 0.279009 S\n0.735707 0.372672 0.772416 S\n",
"nsites": 56,
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"elements": [
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"S"
],
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"density": 4.122566102922051,
"density_atomic": 0.059583518997886886,
"volume": 939.8572112195325,
"volume_molar": 10.107057893330492,
"formula_full": "Ti8 Cr8 Cu8 S32",
"formula_reduced": "TiCrCuS4",
"formula_anonymous": "ABCD4",
"energy": -358.3268591,
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"updated_at": "2021-11-28T01:34:34.845000Z",
"spacegroup": 1
},
{
"id": "mp-759619",
"created_at": "2022-09-04T14:46:20.353786Z",
"structure_string": "Mn6 O4 F10\n1.0\n-3.214148 3.570157 6.946181\n3.214148 -3.570157 6.946181\n3.214148 3.570157 -6.946181\nMn O F\n6 4 10\ndirect\n0.108826 0.108826 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.891174 0.891174 0.000000 Mn\n0.798653 0.019951 0.221299 O\n0.798653 0.577354 0.778701 O\n0.201347 0.980049 0.778701 O\n0.201347 0.422646 0.221299 O\n0.000000 0.191718 0.191718 F\n0.000000 0.808282 0.808282 F\n0.444148 0.146399 0.297748 F\n0.151349 0.853601 0.297748 F\n0.110661 0.330679 0.779982 F\n0.449303 0.669321 0.779982 F\n0.889339 0.669321 0.220018 F\n0.550697 0.330679 0.220018 F\n0.555852 0.853601 0.702252 F\n0.848651 0.146399 0.702252 F\n",
"nsites": 20,
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"formula_full": "Mn6 O4 F10",
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"spacegroup": 71
},
{
"id": "mp-767065",
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{
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"structure_string": "Yb4 Mn8 O20\n1.0\n5.846178 0.000000 0.000000\n0.000000 7.060213 0.000000\n0.000000 0.000000 8.462259\nYb Mn O\n4 8 20\ndirect\n0.000000 0.372765 0.670051 Yb\n0.000000 0.627235 0.329949 Yb\n0.000000 0.127235 0.170051 Yb\n0.000000 0.872765 0.829949 Yb\n0.754291 0.000000 0.500000 Mn\n0.754291 0.500000 0.000000 Mn\n0.500000 0.591093 0.652673 Mn\n0.245709 0.000000 0.500000 Mn\n0.500000 0.908907 0.152673 Mn\n0.245709 0.500000 0.000000 Mn\n0.500000 0.091093 0.847327 Mn\n0.500000 0.408907 0.347327 Mn\n0.247530 0.388940 0.206371 O\n0.287382 0.500000 0.500000 O\n0.500000 0.653366 0.087265 O\n0.000000 0.165030 0.444575 O\n0.000000 0.334970 0.944575 O\n0.752470 0.388940 0.206371 O\n0.712618 0.000000 0.000000 O\n0.247530 0.611060 0.793629 O\n0.000000 0.834970 0.555425 O\n0.712618 0.500000 0.500000 O\n0.752470 0.611060 0.793629 O\n0.287382 0.000000 0.000000 O\n0.752470 0.888940 0.293629 O\n0.247530 0.888940 0.293629 O\n0.500000 0.346634 0.912735 O\n0.752470 0.111060 0.706371 O\n0.000000 0.665030 0.055425 O\n0.247530 0.111060 0.706371 O\n0.500000 0.846634 0.587265 O\n0.500000 0.153366 0.412735 O\n",
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"elements": [
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],
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"spacegroup": 55
},
{
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"created_at": "2022-09-04T14:46:54.802444Z",
"structure_string": "Li12 Mn4 V4 P12 O48\n1.0\n8.656112 0.000000 0.000000\n-4.189977 -7.603342 0.000000\n-3.995332 2.060314 -14.449974\nLi Mn V P O\n12 4 4 12 48\ndirect\n0.752993 0.697960 0.317509 Li\n0.715724 0.815403 0.549251 Li\n0.715561 0.314302 0.054159 Li\n0.256696 0.827573 0.189346 Li\n0.677753 0.786721 0.830022 Li\n0.680240 0.287718 0.331201 Li\n0.222048 0.729414 0.636249 Li\n0.225326 0.235237 0.134395 Li\n0.743177 0.183619 0.813756 Li\n0.244222 0.320819 0.688089 Li\n0.181294 0.637311 0.978141 Li\n0.179682 0.142784 0.479037 Li\n0.863089 0.718077 0.073927 Mn\n0.348272 0.965889 0.818044 Mn\n0.854435 0.218001 0.571668 Mn\n0.137457 0.276857 0.923633 Mn\n0.636983 0.526664 0.680523 V\n0.357284 0.468582 0.319673 V\n0.138562 0.784922 0.424251 V\n0.646037 0.028466 0.181034 V\n0.943053 0.988492 0.732078 P\n0.955133 0.489253 0.235168 P\n0.257379 0.977747 0.022943 P\n0.538008 0.897938 0.374596 P\n0.460825 0.599787 0.123797 P\n0.748233 0.519789 0.476769 P\n0.250964 0.479087 0.524071 P\n0.530524 0.392388 0.875607 P\n0.452074 0.096563 0.624496 P\n0.763912 0.023422 0.978635 P\n0.041237 0.516905 0.765973 P\n0.046157 0.015934 0.264919 P\n0.844935 0.976866 0.241159 O\n0.916502 0.541126 0.135333 O\n0.939724 0.601627 0.308065 O\n0.677174 0.983867 0.470193 O\n0.910012 0.700716 0.468342 O\n0.657093 0.650441 0.123722 O\n0.451133 0.767994 0.148875 O\n0.548687 0.730366 0.348869 O\n0.786045 0.793741 0.724559 O\n0.796404 0.295888 0.227616 O\n0.102265 0.793949 0.038080 O\n0.337829 0.843146 0.369657 O\n0.067931 0.903414 0.196234 O\n0.294367 0.991304 0.534395 O\n0.814863 0.874466 0.994255 O\n0.686590 0.563601 0.555088 O\n0.306280 0.500628 0.032849 O\n0.417530 0.972251 0.701409 O\n0.617688 0.957808 0.882391 O\n0.802896 0.373132 0.491436 O\n0.702046 0.069605 0.056373 O\n0.088497 0.972932 0.366145 O\n0.422065 0.474015 0.199466 O\n0.595676 0.446365 0.380771 O\n0.841527 0.482748 0.739564 O\n0.148153 0.512280 0.258722 O\n0.410786 0.555094 0.616478 O\n0.420933 0.056104 0.113680 O\n0.905202 0.041398 0.632088 O\n0.580561 0.524447 0.803715 O\n0.304562 0.924705 0.940598 O\n0.189359 0.619494 0.508780 O\n0.583277 0.029130 0.301898 O\n0.304923 0.432080 0.443130 O\n0.198596 0.119996 0.008248 O\n0.924281 0.099383 0.803655 O\n0.669169 0.474108 0.971579 O\n0.933857 0.207786 0.976162 O\n0.646534 0.148381 0.622252 O\n0.185648 0.713331 0.763712 O\n0.185482 0.211049 0.261997 O\n0.438843 0.263122 0.647165 O\n0.536182 0.221434 0.848608 O\n0.094815 0.293743 0.536637 O\n0.329612 0.343755 0.867512 O\n0.062060 0.408348 0.694213 O\n0.078912 0.468312 0.865313 O\n0.135991 0.013900 0.755048 O\n",
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],
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"volume": 951.0305287352147,
"volume_molar": 7.159049638875861,
"formula_full": "Li12 Mn4 V4 P12 O48",
"formula_reduced": "Li3MnV(PO4)3",
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{
"id": "mp-1225913",
"created_at": "2022-09-04T14:42:04.212364Z",
"structure_string": "Eu4 Mo2 W4 O24\n1.0\n5.874941 3.976893 0.000000\n-5.874941 3.976893 0.000000\n0.000000 3.862282 10.969228\nEu Mo W O\n4 2 4 24\ndirect\n0.193119 0.444359 0.094876 Eu\n0.555641 0.806881 0.405124 Eu\n0.806881 0.555641 0.905124 Eu\n0.444359 0.193119 0.594876 Eu\n0.620231 0.379769 0.250000 Mo\n0.379769 0.620231 0.750000 Mo\n0.006626 0.298679 0.453899 W\n0.701321 0.993374 0.046101 W\n0.993374 0.701321 0.546101 W\n0.298679 0.006626 0.953899 W\n0.514872 0.099568 0.278746 O\n0.900432 0.485128 0.221254 O\n0.485128 0.900432 0.721254 O\n0.099568 0.514872 0.778746 O\n0.895763 0.827491 0.439339 O\n0.172509 0.104237 0.060661 O\n0.104237 0.172509 0.560661 O\n0.827491 0.895763 0.939339 O\n0.724955 0.126882 0.461828 O\n0.873118 0.275045 0.038172 O\n0.275045 0.873118 0.538172 O\n0.126882 0.724955 0.961828 O\n0.400900 0.826514 0.074553 O\n0.173486 0.599100 0.425447 O\n0.599100 0.173486 0.925447 O\n0.826514 0.400900 0.574553 O\n0.555112 0.476178 0.112713 O\n0.523822 0.444888 0.387287 O\n0.444888 0.523822 0.887287 O\n0.476178 0.555112 0.612713 O\n0.140439 0.292651 0.305168 O\n0.707349 0.859561 0.194832 O\n0.859561 0.707349 0.694832 O\n0.292651 0.140439 0.805168 O\n",
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{
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"created_at": "2022-09-04T14:45:19.657678Z",
"structure_string": "Mg4 S4 O32\n1.0\n13.130645 0.000000 0.000000\n0.000000 5.297456 0.000000\n0.000000 5.146151 8.691277\nMg S O\n4 4 32\ndirect\n0.407452 0.998882 0.191428 Mg\n0.592548 0.001118 0.808572 Mg\n0.907452 0.001118 0.308572 Mg\n0.092548 0.998882 0.691428 Mg\n0.603797 0.608458 0.189886 S\n0.396203 0.391542 0.810114 S\n0.103797 0.391542 0.310114 S\n0.896203 0.608458 0.689886 S\n0.833883 0.666650 0.050150 O\n0.166117 0.333350 0.949850 O\n0.333883 0.333350 0.449850 O\n0.666117 0.666650 0.550150 O\n0.359226 0.587787 0.188540 O\n0.640774 0.412213 0.811460 O\n0.859226 0.412213 0.311460 O\n0.140774 0.587787 0.688540 O\n0.590568 0.290009 0.289970 O\n0.409432 0.709991 0.710030 O\n0.090568 0.709991 0.210030 O\n0.909432 0.290009 0.789970 O\n0.282121 0.783267 0.322279 O\n0.717879 0.216733 0.677721 O\n0.782121 0.216733 0.177721 O\n0.217879 0.783267 0.822279 O\n0.918504 0.835523 0.163467 O\n0.081496 0.164477 0.836533 O\n0.418504 0.164477 0.336533 O\n0.581496 0.835523 0.663467 O\n0.711032 0.694319 0.208654 O\n0.288968 0.305681 0.791346 O\n0.211032 0.305681 0.291346 O\n0.788968 0.694319 0.708654 O\n0.536270 0.775340 0.236802 O\n0.463730 0.224660 0.763198 O\n0.036270 0.224660 0.263198 O\n0.963730 0.775340 0.736802 O\n0.585788 0.701910 0.026312 O\n0.414212 0.298090 0.973688 O\n0.085788 0.298090 0.473688 O\n0.914212 0.701910 0.526312 O\n",
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"formula_full": "Mg4 S4 O32",
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}
]
}