GET /third-parties/MatprojStructure/?format=api&ordering=volume&page=10409
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 146323,
    "next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=volume&page=10410",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=volume&page=10408",
    "results": [
        {
            "id": "mp-753630",
            "created_at": "2022-09-04T14:45:33.584051Z",
            "structure_string": "Li9 V6 P12 H6 O48\n1.0\n8.085622 0.000000 0.000000\n-0.018862 9.976857 0.000000\n-0.006408 -0.018269 10.705716\nLi V P H O\n9 6 12 6 48\ndirect\n0.131784 0.232187 0.075687 Li\n0.866726 0.095129 0.253062 Li\n0.362166 0.736611 0.081282 Li\n0.635803 0.602726 0.258279 Li\n0.128035 0.565863 0.414949 Li\n0.363940 0.403907 0.745366 Li\n0.633315 0.267601 0.923771 Li\n0.633146 0.935859 0.584325 Li\n0.128605 0.897957 0.745861 Li\n0.495447 0.162746 0.176300 V\n0.002155 0.001324 0.498432 V\n0.998120 0.671067 0.162574 V\n0.503783 0.497431 0.501073 V\n0.996376 0.339916 0.824003 V\n0.505645 0.827188 0.835376 V\n0.843349 0.367535 0.129023 P\n0.344868 0.464475 0.202376 P\n0.650319 0.199058 0.467815 P\n0.149416 0.300761 0.532393 P\n0.845311 0.034124 0.800235 P\n0.651521 0.865605 0.131457 P\n0.345262 0.131621 0.870556 P\n0.153379 0.969031 0.197828 P\n0.846551 0.700929 0.464603 P\n0.346075 0.798004 0.537505 P\n0.651440 0.532014 0.802134 P\n0.150225 0.636442 0.866067 P\n0.490079 0.502391 0.013297 H\n0.990292 0.330571 0.320580 H\n0.491561 0.169263 0.678352 H\n0.485479 0.837199 0.353719 H\n0.988326 0.662579 0.649884 H\n0.987729 0.996191 0.986296 H\n0.058469 0.048496 0.097294 O\n0.667372 0.018547 0.162364 O\n0.326995 0.034116 0.212993 O\n0.950568 0.352470 0.008177 O\n0.677903 0.292625 0.109870 O\n0.325408 0.314322 0.165217 O\n0.942593 0.288347 0.232118 O\n0.547836 0.188816 0.338486 O\n0.814685 0.129285 0.436901 O\n0.436804 0.545473 0.096538 O\n0.820121 0.514740 0.164721 O\n0.166013 0.150579 0.507611 O\n0.560403 0.122778 0.571662 O\n0.178711 0.533305 0.223788 O\n0.950197 0.019907 0.681423 O\n0.458088 0.477547 0.316870 O\n0.545623 0.857932 0.005886 O\n0.060091 0.376503 0.428592 O\n0.821640 0.805349 0.114696 O\n0.667315 0.348784 0.494041 O\n0.177074 0.819547 0.165103 O\n0.314777 0.370130 0.562716 O\n0.548271 0.787462 0.226969 O\n0.046936 0.311353 0.661967 O\n0.956313 0.688943 0.346606 O\n0.443253 0.211230 0.767214 O\n0.678306 0.634362 0.440710 O\n0.823328 0.185306 0.833325 O\n0.326366 0.649631 0.501031 O\n0.178630 0.204045 0.888594 O\n0.942612 0.620844 0.566450 O\n0.451670 0.147078 0.991326 O\n0.546984 0.515887 0.682617 O\n0.048579 0.981517 0.317808 O\n0.826057 0.470763 0.789429 O\n0.450243 0.877270 0.438507 O\n0.825775 0.850381 0.500977 O\n0.171434 0.482524 0.833713 O\n0.558525 0.454096 0.905235 O\n0.182304 0.868515 0.560217 O\n0.455193 0.810327 0.659381 O\n0.068157 0.712089 0.760074 O\n0.666124 0.685123 0.829428 O\n0.327073 0.699924 0.888123 O\n0.054750 0.641374 0.988826 O\n0.674302 0.966055 0.781005 O\n0.327171 0.982153 0.835611 O\n0.942677 0.955983 0.901626 O\n",
            "nsites": 81,
            "nelements": 5,
            "elements": [
                "Li",
                "V",
                "P",
                "H",
                "O"
            ],
            "chemical_system": "H-Li-O-P-V",
            "density": 2.910723855278238,
            "density_atomic": 0.09379120569428012,
            "volume": 863.6204151594545,
            "volume_molar": 6.420794695431942,
            "formula_full": "Li9 V6 P12 H6 O48",
            "formula_reduced": "Li3V2P4(HO8)2",
            "formula_anonymous": "A2B2C3D4E16",
            "energy": -599.79508646,
            "energy_per_atom": -7.404877610617284,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -556.61908646,
            "band_gap": 0.833,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 9.0065995,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:01.631000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-555829",
            "created_at": "2022-09-04T14:45:07.491605Z",
            "structure_string": "Na4 Pr8 Cl18 O4\n1.0\n11.570299 0.000000 0.000000\n0.000000 8.307395 0.000000\n0.000000 2.729500 8.985188\nNa Pr Cl O\n4 8 18 4\ndirect\n0.984728 0.770978 0.433018 Na\n0.484728 0.229022 0.566982 Na\n0.015272 0.229022 0.566982 Na\n0.515272 0.770978 0.433018 Na\n0.750000 0.610720 0.164617 Pr\n0.046334 0.721314 0.952289 Pr\n0.453666 0.721314 0.952289 Pr\n0.546334 0.278686 0.047711 Pr\n0.250000 0.389280 0.835383 Pr\n0.953666 0.278686 0.047711 Pr\n0.750000 0.628675 0.780955 Pr\n0.250000 0.371325 0.219045 Pr\n0.080957 0.099875 0.315309 Cl\n0.906503 0.892748 0.123354 Cl\n0.750000 0.260827 0.862835 Cl\n0.997035 0.499290 0.298873 Cl\n0.093497 0.107252 0.876646 Cl\n0.919043 0.900125 0.684691 Cl\n0.497035 0.500710 0.701127 Cl\n0.750000 0.669031 0.461147 Cl\n0.406503 0.107252 0.876646 Cl\n0.250000 0.759200 0.753191 Cl\n0.002965 0.500710 0.701127 Cl\n0.250000 0.739173 0.137165 Cl\n0.580957 0.900125 0.684691 Cl\n0.750000 0.240800 0.246809 Cl\n0.250000 0.330969 0.538853 Cl\n0.502965 0.499290 0.298873 Cl\n0.593497 0.892748 0.123354 Cl\n0.419043 0.099875 0.315309 Cl\n0.619480 0.552058 0.986355 O\n0.380520 0.447942 0.013645 O\n0.880520 0.552058 0.986355 O\n0.119480 0.447942 0.013645 O\n",
            "nsites": 34,
            "nelements": 4,
            "elements": [
                "Na",
                "Pr",
                "Cl",
                "O"
            ],
            "chemical_system": "Cl-Na-O-Pr",
            "density": 3.6942298724581812,
            "density_atomic": 0.03936790515089422,
            "volume": 863.647681269312,
            "volume_molar": 15.297082069562977,
            "formula_full": "Na4 Pr8 Cl18 O4",
            "formula_reduced": "Na2Pr4Cl9O2",
            "formula_anonymous": "A2B2C4D9",
            "energy": -190.87711568,
            "energy_per_atom": -5.614032814117647,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -177.07711568,
            "band_gap": 0.5886000000000005,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 2.000538,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:48.744000Z",
            "spacegroup": 11
        },
        {
            "id": "mp-1203869",
            "created_at": "2022-09-04T14:39:42.276004Z",
            "structure_string": "La16 Co12 O40\n1.0\n5.581371 0.000000 0.000000\n0.000000 5.478092 0.000000\n0.000000 0.315674 28.246684\nLa Co O\n16 12 40\ndirect\n0.484852 0.492197 0.300853 La\n0.984852 0.007803 0.699147 La\n0.515148 0.507803 0.699147 La\n0.015148 0.992197 0.300853 La\n0.487430 0.003801 0.800380 La\n0.987430 0.496199 0.199620 La\n0.512570 0.996199 0.199620 La\n0.012570 0.503801 0.800380 La\n0.498031 0.477884 0.432101 La\n0.998031 0.022116 0.567899 La\n0.501969 0.522116 0.567899 La\n0.001969 0.977884 0.432101 La\n0.501700 0.980475 0.932352 La\n0.001700 0.519525 0.067648 La\n0.498300 0.019525 0.067648 La\n0.998300 0.480475 0.932352 La\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n0.000000 0.000000 0.000000 Co\n0.496887 0.497536 0.139452 Co\n0.996887 0.002464 0.860548 Co\n0.503113 0.502464 0.860548 Co\n0.003113 0.997536 0.139452 Co\n0.497381 0.007788 0.639226 Co\n0.997381 0.492212 0.360774 Co\n0.502619 0.992212 0.360774 Co\n0.002619 0.507788 0.639226 Co\n0.218888 0.219823 0.488930 O\n0.718888 0.280177 0.511070 O\n0.781112 0.780177 0.511070 O\n0.281112 0.719823 0.488930 O\n0.292674 0.193806 0.992342 O\n0.792674 0.306194 0.007658 O\n0.707326 0.806194 0.007658 O\n0.207326 0.693806 0.992342 O\n0.440012 0.493534 0.068144 O\n0.940012 0.006466 0.931856 O\n0.559988 0.506466 0.931856 O\n0.059988 0.993534 0.068144 O\n0.428767 0.995502 0.567229 O\n0.928767 0.504498 0.432771 O\n0.571233 0.004498 0.432771 O\n0.071233 0.495502 0.567229 O\n0.247632 0.247240 0.147898 O\n0.747632 0.252760 0.852102 O\n0.752368 0.752760 0.852102 O\n0.252368 0.747240 0.147898 O\n0.245764 0.761201 0.648323 O\n0.745764 0.738799 0.351677 O\n0.754236 0.238799 0.351677 O\n0.254236 0.261201 0.648323 O\n0.550768 0.491499 0.218093 O\n0.050768 0.008501 0.781907 O\n0.449232 0.508501 0.781907 O\n0.949232 0.991499 0.218093 O\n0.554595 0.007706 0.717765 O\n0.054595 0.492294 0.282235 O\n0.445405 0.992294 0.282235 O\n0.945405 0.507706 0.717765 O\n0.252355 0.752896 0.865917 O\n0.752355 0.747104 0.134083 O\n0.747645 0.247104 0.134083 O\n0.247645 0.252896 0.865917 O\n0.254348 0.246448 0.367915 O\n0.754348 0.253552 0.632085 O\n0.745652 0.753552 0.632085 O\n0.245652 0.746448 0.367915 O\n",
            "nsites": 68,
            "nelements": 3,
            "elements": [
                "La",
                "Co",
                "O"
            ],
            "chemical_system": "Co-La-O",
            "density": 6.863387066141176,
            "density_atomic": 0.0787356157356748,
            "volume": 863.6498154568882,
            "volume_molar": 7.648559935337361,
            "formula_full": "La16 Co12 O40",
            "formula_reduced": "La4Co3O10",
            "formula_anonymous": "A3B4C10",
            "energy": -552.4086982699998,
            "energy_per_atom": -8.123657327499998,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -505.27269827,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 32.0094947,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:28.079000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-778556",
            "created_at": "2022-09-04T14:39:24.489344Z",
            "structure_string": "Li12 Mn4 V4 P12 O48\n1.0\n8.652734 0.000000 0.000000\n-0.805894 8.619329 0.000000\n-3.423986 -3.783705 11.580218\nLi Mn V P O\n12 4 4 12 48\ndirect\n0.999400 0.003829 0.123799 Li\n0.995620 0.003312 0.625964 Li\n0.711788 0.289726 0.374044 Li\n0.499717 0.498847 0.250228 Li\n0.712904 0.289041 0.875903 Li\n0.499465 0.499804 0.499559 Li\n0.288352 0.711715 0.123675 Li\n0.500525 0.502639 0.751164 Li\n0.498648 0.499979 0.999295 Li\n0.289084 0.711461 0.625570 Li\n0.006716 0.996331 0.373489 Li\n0.002792 0.996759 0.875689 Li\n0.371324 0.057648 0.065373 Mn\n0.630280 0.941283 0.935086 Mn\n0.056990 0.373232 0.315090 Mn\n0.057207 0.375562 0.815295 Mn\n0.942219 0.621917 0.179913 V\n0.942952 0.623188 0.679759 V\n0.621456 0.942635 0.429966 V\n0.380347 0.055626 0.570552 V\n0.711256 0.284691 0.124816 P\n0.860196 0.665835 0.431660 P\n0.665654 0.859118 0.180924 P\n0.714305 0.287917 0.625056 P\n0.865420 0.664900 0.932122 P\n0.660827 0.861236 0.682952 P\n0.339765 0.133687 0.316549 P\n0.133470 0.339846 0.067139 P\n0.284467 0.711832 0.374548 P\n0.334485 0.135752 0.818616 P\n0.139100 0.338761 0.567760 P\n0.287789 0.715445 0.875052 P\n0.989141 0.656213 0.044993 O\n0.945662 0.615009 0.336420 O\n0.737215 0.173557 0.013760 O\n0.986925 0.661561 0.544430 O\n0.827559 0.261807 0.236058 O\n0.849247 0.840083 0.199281 O\n0.734515 0.460129 0.115794 O\n0.840161 0.849605 0.451473 O\n0.947961 0.609706 0.835476 O\n0.740867 0.173008 0.516485 O\n0.827021 0.264609 0.736907 O\n0.843271 0.842627 0.695993 O\n0.702299 0.545562 0.397741 O\n0.613906 0.946455 0.086252 O\n0.661818 0.985112 0.294369 O\n0.537368 0.258223 0.136594 O\n0.736735 0.462618 0.614714 O\n0.546025 0.701156 0.147382 O\n0.855885 0.850065 0.952608 O\n0.704296 0.548996 0.898578 O\n0.601466 0.951565 0.589690 O\n0.453782 0.295983 0.352095 O\n0.662891 0.984984 0.799479 O\n0.538458 0.262063 0.634049 O\n0.461591 0.735559 0.367636 O\n0.342299 0.012311 0.200409 O\n0.542972 0.701862 0.647426 O\n0.402782 0.046493 0.411236 O\n0.295763 0.453329 0.102372 O\n0.143247 0.157101 0.055054 O\n0.450311 0.296802 0.852259 O\n0.258500 0.536044 0.384562 O\n0.463005 0.738965 0.864993 O\n0.344383 0.011724 0.706095 O\n0.391212 0.052425 0.915387 O\n0.298307 0.456465 0.602906 O\n0.156117 0.143681 0.302527 O\n0.174347 0.739487 0.265038 O\n0.259481 0.827121 0.484033 O\n0.045499 0.404850 0.162637 O\n0.158488 0.156751 0.555667 O\n0.260913 0.539399 0.884698 O\n0.149603 0.145763 0.798845 O\n0.173990 0.743273 0.766528 O\n0.014215 0.336581 0.451997 O\n0.263833 0.827551 0.987201 O\n0.048537 0.401141 0.661817 O\n0.011611 0.341074 0.951445 O\n",
            "nsites": 80,
            "nelements": 5,
            "elements": [
                "Li",
                "Mn",
                "V",
                "P",
                "O"
            ],
            "chemical_system": "Li-Mn-O-P-V",
            "density": 3.1656176329479555,
            "density_atomic": 0.0926288859525632,
            "volume": 863.6614720916468,
            "volume_molar": 6.501363692405886,
            "formula_full": "Li12 Mn4 V4 P12 O48",
            "formula_reduced": "Li3MnV(PO4)3",
            "formula_anonymous": "ABC3D3E12",
            "energy": -607.35824788,
            "energy_per_atom": -7.5919780985,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -560.91024788,
            "band_gap": 0.3859999999999997,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 23.9999749,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:25.856000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1176474",
            "created_at": "2022-09-04T14:47:45.831484Z",
            "structure_string": "Mn4 Fe4 Co4 P12 O48\n1.0\n5.976168 0.000000 0.000000\n0.000000 9.871456 0.000000\n0.000000 0.066140 14.640723\nMn Fe Co P O\n4 4 4 12 48\ndirect\n0.000000 0.215076 0.144938 Mn\n0.000000 0.217257 0.478677 Mn\n0.000000 0.213298 0.810277 Mn\n0.500000 0.286298 0.645547 Mn\n0.500000 0.277505 0.319096 Fe\n0.500000 0.276629 0.985586 Fe\n0.000000 0.726742 0.011979 Fe\n0.000000 0.727913 0.343979 Fe\n0.000000 0.725704 0.679228 Co\n0.500000 0.770890 0.842720 Co\n0.500000 0.771919 0.178732 Co\n0.500000 0.779221 0.518019 Co\n0.500000 0.095285 0.804270 P\n0.500000 0.097926 0.471706 P\n0.500000 0.094365 0.137995 P\n0.000000 0.399356 0.305008 P\n0.000000 0.398661 0.971849 P\n0.000000 0.402653 0.639066 P\n0.500000 0.602113 0.030459 P\n0.500000 0.602330 0.365698 P\n0.500000 0.598548 0.696213 P\n0.000000 0.902793 0.527131 P\n0.000000 0.898705 0.861676 P\n0.000000 0.902360 0.194987 P\n0.000000 0.054515 0.551520 O\n0.000000 0.055062 0.217708 O\n0.000000 0.051641 0.880786 O\n0.500000 0.122133 0.575192 O\n0.500000 0.118053 0.907186 O\n0.500000 0.118688 0.240577 O\n0.298457 0.166316 0.754742 O\n0.701543 0.166316 0.754742 O\n0.301302 0.168933 0.087596 O\n0.698698 0.168933 0.087596 O\n0.300921 0.172696 0.421832 O\n0.699079 0.172696 0.421832 O\n0.795742 0.327614 0.258979 O\n0.204258 0.327614 0.258979 O\n0.204095 0.326972 0.925666 O\n0.795905 0.326972 0.925666 O\n0.798510 0.333258 0.589868 O\n0.201490 0.333258 0.589868 O\n0.000000 0.379434 0.742956 O\n0.000000 0.378429 0.077092 O\n0.000000 0.379682 0.410262 O\n0.500000 0.450311 0.050240 O\n0.500000 0.449965 0.384612 O\n0.500000 0.445440 0.719115 O\n0.000000 0.551823 0.286403 O\n0.000000 0.551334 0.953388 O\n0.000000 0.557368 0.621121 O\n0.500000 0.617222 0.592150 O\n0.500000 0.627487 0.926311 O\n0.500000 0.627314 0.260932 O\n0.297418 0.675234 0.078171 O\n0.702582 0.675234 0.078171 O\n0.297363 0.675253 0.412451 O\n0.702637 0.675253 0.412451 O\n0.298316 0.670222 0.745404 O\n0.701684 0.670222 0.745404 O\n0.796488 0.828701 0.575671 O\n0.203512 0.828701 0.575671 O\n0.800284 0.829521 0.244984 O\n0.199716 0.829521 0.244984 O\n0.799403 0.828329 0.911024 O\n0.200597 0.828329 0.911024 O\n0.000000 0.874777 0.756991 O\n0.000000 0.883860 0.091638 O\n0.000000 0.884261 0.424321 O\n0.500000 0.941035 0.784062 O\n0.500000 0.947356 0.449632 O\n0.500000 0.941846 0.116931 O\n",
            "nsites": 72,
            "nelements": 5,
            "elements": [
                "Mn",
                "Fe",
                "Co",
                "P",
                "O"
            ],
            "chemical_system": "Co-Fe-Mn-O-P",
            "density": 3.4962377274884364,
            "density_atomic": 0.08336158445959273,
            "volume": 863.7071915889512,
            "volume_molar": 7.224119837740212,
            "formula_full": "Mn4 Fe4 Co4 P12 O48",
            "formula_reduced": "MnFeCo(PO4)3",
            "formula_anonymous": "ABCD3E12",
            "energy": -563.56960455,
            "energy_per_atom": -7.82735561875,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -508.34560455,
            "band_gap": 0.0298,
            "is_gap_direct": true,
            "is_magnetic": true,
            "total_magnetization": 45.9998277,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:38:24.179000Z",
            "spacegroup": 6
        },
        {
            "id": "mp-1211130",
            "created_at": "2022-09-04T14:43:04.583165Z",
            "structure_string": "Lu10 In20 Pd10\n1.0\n-6.880724 6.880724 4.560905\n6.880724 -6.880724 4.560905\n6.880724 6.880724 -4.560905\nLu In Pd\n10 20 10\ndirect\n0.669876 0.389243 0.280633 Lu\n0.108610 0.389243 0.719367 Lu\n0.389243 0.669876 0.280633 Lu\n0.389243 0.108610 0.719367 Lu\n0.676677 0.676677 0.597109 Lu\n0.079567 0.079567 0.402891 Lu\n0.079567 0.676677 0.000000 Lu\n0.676677 0.079567 0.000000 Lu\n0.456649 0.456649 0.000000 Lu\n0.995058 0.995058 0.000000 Lu\n0.268680 0.476885 0.492834 In\n0.984051 0.775846 0.507166 In\n0.775846 0.268680 0.791795 In\n0.268680 0.775846 0.791795 In\n0.476885 0.984051 0.208205 In\n0.984051 0.476885 0.208205 In\n0.775846 0.984051 0.507166 In\n0.476885 0.268680 0.492834 In\n0.248261 0.865517 0.382744 In\n0.482773 0.865517 0.617256 In\n0.865517 0.248261 0.382744 In\n0.865517 0.482773 0.617256 In\n0.357797 0.357797 0.263480 In\n0.094318 0.094318 0.736520 In\n0.094318 0.357797 0.000000 In\n0.357797 0.094318 0.000000 In\n0.879934 0.719400 0.160534 In\n0.558865 0.719400 0.839466 In\n0.719400 0.879934 0.160534 In\n0.719400 0.558865 0.839466 In\n0.114934 0.614934 0.500000 Pd\n0.614934 0.114934 0.500000 Pd\n0.370661 0.370661 0.677637 Pd\n0.693023 0.693023 0.322363 Pd\n0.693023 0.370661 0.000000 Pd\n0.370661 0.693023 0.000000 Pd\n0.236586 0.024969 0.211617 Pd\n0.813352 0.024969 0.788383 Pd\n0.024969 0.236586 0.211617 Pd\n0.024969 0.813352 0.788383 Pd\n",
            "nsites": 40,
            "nelements": 3,
            "elements": [
                "Lu",
                "In",
                "Pd"
            ],
            "chemical_system": "In-Lu-Pd",
            "density": 9.824495351654146,
            "density_atomic": 0.0463106309689176,
            "volume": 863.7325634117765,
            "volume_molar": 13.003797689653359,
            "formula_full": "Lu10 In20 Pd10",
            "formula_reduced": "LuIn2Pd",
            "formula_anonymous": "ABC2",
            "energy": -176.7760493,
            "energy_per_atom": -4.4194012325,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -176.7760493,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.005204,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:00.873000Z",
            "spacegroup": 107
        },
        {
            "id": "mp-723282",
            "created_at": "2022-09-04T14:46:34.947497Z",
            "structure_string": "Cs2 C8 S8 N16 O4 F2\n1.0\n-4.553930 5.134087 9.235787\n4.553930 -5.134087 9.235787\n4.553930 5.134087 -9.235787\nCs C S N O F\n2 8 8 16 4 2\ndirect\n0.250000 0.000000 0.250000 Cs\n0.750000 0.000000 0.750000 Cs\n0.447325 0.301097 0.853772 C\n0.552675 0.698903 0.146228 C\n0.052675 0.406446 0.353772 C\n0.947325 0.593554 0.646228 C\n0.784230 0.884948 0.100718 C\n0.215770 0.115052 0.899282 C\n0.715770 0.316489 0.600718 C\n0.284230 0.683511 0.399282 C\n0.380850 0.066060 0.685210 S\n0.619150 0.933940 0.314790 S\n0.119150 0.304360 0.185210 S\n0.880850 0.695640 0.814790 S\n0.857065 0.101682 0.244617 S\n0.142935 0.898318 0.755383 S\n0.642935 0.387551 0.744617 S\n0.357065 0.612449 0.255383 S\n0.314658 0.230193 0.689130 N\n0.458937 0.769807 0.084464 N\n0.185342 0.374472 0.415536 N\n0.041063 0.625528 0.810870 N\n0.685342 0.769807 0.310870 N\n0.541063 0.230193 0.915536 N\n0.814658 0.625528 0.584464 N\n0.958937 0.374472 0.189130 N\n0.681197 0.924587 0.006087 N\n0.081500 0.075413 0.756610 N\n0.818803 0.324890 0.743390 N\n0.418500 0.675110 0.493913 N\n0.318803 0.075413 0.993913 N\n0.918500 0.924587 0.243390 N\n0.181197 0.675110 0.256610 N\n0.581500 0.324890 0.506087 N\n0.165996 0.770795 0.604800 O\n0.834004 0.229205 0.395200 O\n0.334004 0.438804 0.104800 O\n0.665996 0.561196 0.895200 O\n0.000000 0.500000 0.500000 F\n0.500000 0.500000 0.000000 F\n",
            "nsites": 40,
            "nelements": 6,
            "elements": [
                "Cs",
                "C",
                "S",
                "N",
                "O",
                "F"
            ],
            "chemical_system": "C-Cs-F-N-O-S",
            "density": 1.8158330347064102,
            "density_atomic": 0.046310185129741686,
            "volume": 863.7408787707673,
            "volume_molar": 13.00392288030914,
            "formula_full": "Cs2 C8 S8 N16 O4 F2",
            "formula_reduced": "CsC4S4N8O2F",
            "formula_anonymous": "ABC2D4E4F8",
            "energy": -254.27980299,
            "energy_per_atom": -6.35699507475,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -244.83180299,
            "band_gap": 2.1873,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0017475,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:40.436000Z",
            "spacegroup": 72
        },
        {
            "id": "mp-31872",
            "created_at": "2022-09-04T14:41:03.703665Z",
            "structure_string": "Fe10 P12 O44\n1.0\n6.681168 0.000000 0.000000\n0.000000 10.549077 0.000000\n0.000000 3.178327 12.256035\nFe P O\n10 12 44\ndirect\n0.501561 0.702591 0.335305 Fe\n0.998439 0.202591 0.335305 Fe\n0.238995 0.710835 0.139430 Fe\n0.738995 0.789165 0.860570 Fe\n0.500000 0.500000 0.000000 Fe\n0.761005 0.289165 0.860570 Fe\n0.001561 0.797409 0.664695 Fe\n0.261005 0.210835 0.139430 Fe\n0.000000 0.000000 0.000000 Fe\n0.498439 0.297409 0.664695 Fe\n0.800664 0.910913 0.418672 P\n0.300664 0.589087 0.581328 P\n0.199336 0.089087 0.581328 P\n0.882479 0.072946 0.742032 P\n0.117521 0.927054 0.257968 P\n0.241891 0.275971 0.913154 P\n0.617521 0.572946 0.742032 P\n0.258109 0.775971 0.913154 P\n0.741891 0.224029 0.086846 P\n0.758109 0.724029 0.086846 P\n0.699336 0.410913 0.418672 P\n0.382479 0.427054 0.257968 P\n0.021935 0.052970 0.839792 O\n0.320918 0.648205 0.459769 O\n0.000394 0.861048 0.366635 O\n0.700238 0.441827 0.728866 O\n0.553258 0.178409 0.151689 O\n0.376169 0.145903 0.630418 O\n0.212381 0.862310 0.996379 O\n0.500394 0.638952 0.633365 O\n0.695714 0.561017 0.384954 O\n0.779996 0.673823 0.750754 O\n0.220004 0.326177 0.249246 O\n0.720004 0.173823 0.750754 O\n0.978065 0.947030 0.160208 O\n0.446742 0.821591 0.848311 O\n0.211141 0.140189 0.001264 O\n0.712381 0.637690 0.003621 O\n0.788859 0.859811 0.998736 O\n0.576868 0.729538 0.161671 O\n0.279996 0.826177 0.249246 O\n0.946742 0.678409 0.151689 O\n0.287619 0.362310 0.996379 O\n0.053258 0.321591 0.848311 O\n0.478065 0.552970 0.839792 O\n0.679082 0.351795 0.540231 O\n0.299762 0.558173 0.271134 O\n0.623831 0.854097 0.369582 O\n0.804286 0.061017 0.384954 O\n0.787619 0.137690 0.003621 O\n0.195714 0.938983 0.615046 O\n0.711141 0.359811 0.998736 O\n0.179082 0.148205 0.459769 O\n0.423132 0.270462 0.838329 O\n0.076868 0.770462 0.838329 O\n0.923132 0.229538 0.161671 O\n0.876169 0.354097 0.369582 O\n0.999606 0.138952 0.633365 O\n0.799762 0.941827 0.728866 O\n0.200238 0.058173 0.271134 O\n0.499606 0.361048 0.366635 O\n0.820918 0.851795 0.540231 O\n0.123831 0.645903 0.630418 O\n0.304286 0.438983 0.615046 O\n0.288859 0.640189 0.001264 O\n0.521935 0.447030 0.160208 O\n",
            "nsites": 66,
            "nelements": 3,
            "elements": [
                "Fe",
                "P",
                "O"
            ],
            "chemical_system": "Fe-O-P",
            "density": 3.141327412186461,
            "density_atomic": 0.07640593388159968,
            "volume": 863.8072548432567,
            "volume_molar": 7.881771027538309,
            "formula_full": "Fe10 P12 O44",
            "formula_reduced": "Fe5(P3O11)2",
            "formula_anonymous": "A5B6C22",
            "energy": -522.01451236,
            "energy_per_atom": -7.909310793333334,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -469.22651236,
            "band_gap": 0.8186999999999999,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 47.9977436,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:12.325000Z",
            "spacegroup": 14
        },
        {
            "id": "mp-777936",
            "created_at": "2022-09-04T14:46:37.951408Z",
            "structure_string": "Li32 Ti11 Cr5 O48\n1.0\n5.074367 0.000000 0.000000\n-2.530248 4.404237 0.000000\n-0.708889 -1.300627 38.652756\nLi Ti Cr O\n32 11 5 48\ndirect\n0.913328 0.090678 0.249779 Li\n0.496973 0.003285 0.000116 Li\n0.558841 0.060650 0.187469 Li\n0.627175 0.123246 0.375019 Li\n0.688991 0.190622 0.562498 Li\n0.753576 0.250104 0.750195 Li\n0.812369 0.312410 0.937474 Li\n0.218398 0.038116 0.124961 Li\n0.874761 0.378069 0.124968 Li\n0.340502 0.166388 0.500193 Li\n0.457241 0.281838 0.874623 Li\n0.937536 0.437539 0.312450 Li\n0.002374 0.495147 0.500078 Li\n0.584975 0.409242 0.249840 Li\n0.709718 0.532120 0.624731 Li\n0.040473 0.220887 0.625052 Li\n0.162587 0.337462 0.000123 Li\n0.839914 0.659481 0.000170 Li\n0.964091 0.787583 0.374990 Li\n0.284050 0.463758 0.375104 Li\n0.404026 0.584298 0.750065 Li\n0.062336 0.562547 0.687523 Li\n0.531811 0.709219 0.124980 Li\n0.658164 0.837356 0.500001 Li\n0.127425 0.624173 0.874851 Li\n0.790811 0.968408 0.874974 Li\n0.185648 0.689563 0.062513 Li\n0.252356 0.749109 0.249836 Li\n0.312954 0.812475 0.437531 Li\n0.375086 0.871739 0.624911 Li\n0.434394 0.935983 0.812515 Li\n0.092836 0.915298 0.750343 Li\n0.856568 0.017623 0.062559 Ti\n0.270147 0.105161 0.312456 Ti\n0.395370 0.229700 0.687536 Ti\n0.645126 0.479675 0.437448 Ti\n0.774245 0.606925 0.812645 Ti\n0.900100 0.732417 0.187598 Ti\n0.480366 0.644861 0.937535 Ti\n0.605246 0.769896 0.312427 Ti\n0.730253 0.894394 0.687542 Ti\n0.018089 0.851041 0.562404 Ti\n0.144811 0.979574 0.937506 Ti\n0.981933 0.143682 0.437589 Cr\n0.518801 0.356782 0.062528 Cr\n0.101550 0.268308 0.812489 Cr\n0.226791 0.393367 0.187252 Cr\n0.356595 0.523357 0.562479 Cr\n0.946121 0.090741 0.340747 O\n0.917567 0.064637 0.159340 O\n0.571947 0.071605 0.283467 O\n0.696310 0.196186 0.658574 O\n0.553114 0.058408 0.090948 O\n0.680851 0.178132 0.466280 O\n0.810624 0.301669 0.841116 O\n0.817278 0.322140 0.034189 O\n0.946889 0.441942 0.408900 O\n0.213717 0.066489 0.215984 O\n0.935895 0.426231 0.216005 O\n0.340850 0.202143 0.590443 O\n0.465849 0.321037 0.965764 O\n0.174464 0.031724 0.033961 O\n0.298966 0.159868 0.409353 O\n0.423212 0.284384 0.784621 O\n0.071221 0.215628 0.715966 O\n0.039206 0.183980 0.534737 O\n0.158777 0.303339 0.909103 O\n0.590699 0.446454 0.340898 O\n0.715256 0.571523 0.716045 O\n0.548596 0.409097 0.159624 O\n0.682787 0.536368 0.533928 O\n0.803607 0.659316 0.908980 O\n0.206257 0.342776 0.090617 O\n0.319839 0.464488 0.465713 O\n0.441141 0.586126 0.840385 O\n0.284310 0.428710 0.284106 O\n0.409274 0.553471 0.659219 O\n0.842710 0.701157 0.091187 O\n0.965334 0.828021 0.465706 O\n0.928516 0.783845 0.283974 O\n0.565999 0.710624 0.215279 O\n0.686423 0.833126 0.590547 O\n0.820981 0.964987 0.965943 O\n0.532449 0.668754 0.034417 O\n0.660262 0.803920 0.409303 O\n0.070630 0.574633 0.783456 O\n0.791770 0.938624 0.784567 O\n0.050318 0.554852 0.591608 O\n0.178305 0.678274 0.966438 O\n0.195238 0.699678 0.158207 O\n0.323643 0.814250 0.533911 O\n0.446701 0.946280 0.908461 O\n0.303082 0.803489 0.341416 O\n0.428521 0.928865 0.716583 O\n0.089119 0.942678 0.841014 O\n0.053662 0.909774 0.659099 O\n",
            "nsites": 96,
            "nelements": 4,
            "elements": [
                "Li",
                "Ti",
                "Cr",
                "O"
            ],
            "chemical_system": "Cr-Li-O-Ti",
            "density": 3.415119508622315,
            "density_atomic": 0.11113176519767659,
            "volume": 863.8394236718833,
            "volume_molar": 5.418919378530581,
            "formula_full": "Li32 Ti11 Cr5 O48",
            "formula_reduced": "Li32Ti11Cr5O48",
            "formula_anonymous": "A5B11C32D48",
            "energy": -703.92518058,
            "energy_per_atom": -7.332553964374999,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -660.95418058,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 0.1468381,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:40.313000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1197854",
            "created_at": "2022-09-04T14:43:21.082337Z",
            "structure_string": "Bi14 Mo5 O36\n1.0\n2.866601 17.448772 0.000000\n-2.866601 17.448772 0.000000\n0.000000 1.505841 8.635193\nBi Mo O\n14 5 36\ndirect\n0.265123 0.250525 0.811674 Bi\n0.749475 0.734877 0.188326 Bi\n0.276669 0.144536 0.467768 Bi\n0.855464 0.723331 0.532232 Bi\n0.688182 0.670928 0.771196 Bi\n0.329072 0.311818 0.228804 Bi\n0.610873 0.650295 0.439602 Bi\n0.349705 0.389127 0.560398 Bi\n0.083023 0.125184 0.727308 Bi\n0.874816 0.916977 0.272692 Bi\n0.055470 0.047517 0.388492 Bi\n0.952483 0.944530 0.611508 Bi\n0.527200 0.527251 0.668998 Bi\n0.472749 0.472800 0.331002 Bi\n0.994370 0.005630 0.000000 Mo\n0.412766 0.429403 0.946530 Mo\n0.570597 0.587234 0.053470 Mo\n0.866900 0.808701 0.902532 Mo\n0.191299 0.133100 0.097468 Mo\n0.953496 0.511240 0.691785 O\n0.488760 0.046504 0.308215 O\n0.471794 0.990351 0.660125 O\n0.009649 0.528206 0.339875 O\n0.872170 0.427972 0.616558 O\n0.572028 0.127830 0.383442 O\n0.386613 0.918274 0.606083 O\n0.081726 0.613387 0.393917 O\n0.847799 0.301189 0.560065 O\n0.698811 0.152201 0.439935 O\n0.339642 0.812870 0.548697 O\n0.187130 0.660358 0.451303 O\n0.736448 0.263552 0.500000 O\n0.232256 0.767744 0.500000 O\n0.295012 0.622933 0.817752 O\n0.377067 0.704988 0.182248 O\n0.564797 0.293524 0.125935 O\n0.706476 0.435203 0.874065 O\n0.170439 0.594299 0.017619 O\n0.405701 0.829561 0.982381 O\n0.583250 0.217609 0.823574 O\n0.782391 0.416750 0.176426 O\n0.986890 0.757839 0.730992 O\n0.242161 0.013110 0.269008 O\n0.719815 0.970872 0.077930 O\n0.029128 0.280185 0.922070 O\n0.067596 0.539954 0.963545 O\n0.460046 0.932404 0.036455 O\n0.636283 0.976786 0.820756 O\n0.023213 0.363717 0.179244 O\n0.202052 0.872828 0.880941 O\n0.127172 0.797948 0.119059 O\n0.831050 0.209073 0.133901 O\n0.790927 0.168950 0.866099 O\n0.217391 0.386419 0.625182 O\n0.613581 0.782609 0.374818 O\n",
            "nsites": 55,
            "nelements": 3,
            "elements": [
                "Bi",
                "Mo",
                "O"
            ],
            "chemical_system": "Bi-Mo-O",
            "density": 7.653343143671144,
            "density_atomic": 0.06366907337570576,
            "volume": 863.8416908543603,
            "volume_molar": 9.458502284875204,
            "formula_full": "Bi14 Mo5 O36",
            "formula_reduced": "Bi14Mo5O36",
            "formula_anonymous": "A5B14C36",
            "energy": -387.18075118,
            "energy_per_atom": -7.039650021454546,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -346.43875118,
            "band_gap": 2.6027,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0024654,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:03.812000Z",
            "spacegroup": 5
        },
        {
            "id": "mp-1325795",
            "created_at": "2022-09-04T14:46:56.265315Z",
            "structure_string": "Zn12 Ni8 Ge12 O48\n1.0\n-5.999643 5.999643 5.999643\n5.999643 -5.999643 5.999643\n5.999643 5.999643 -5.999643\nZn Ni Ge O\n12 8 12 48\ndirect\n0.250000 0.875000 0.625000 Zn\n0.750000 0.625000 0.875000 Zn\n0.625000 0.875000 0.750000 Zn\n0.875000 0.625000 0.250000 Zn\n0.625000 0.250000 0.875000 Zn\n0.875000 0.750000 0.625000 Zn\n0.750000 0.125000 0.375000 Zn\n0.250000 0.375000 0.125000 Zn\n0.375000 0.125000 0.250000 Zn\n0.125000 0.375000 0.750000 Zn\n0.375000 0.750000 0.125000 Zn\n0.125000 0.250000 0.375000 Zn\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.125000 0.750000 0.875000 Ge\n0.875000 0.250000 0.125000 Ge\n0.625000 0.375000 0.250000 Ge\n0.750000 0.875000 0.125000 Ge\n0.875000 0.125000 0.750000 Ge\n0.250000 0.625000 0.375000 Ge\n0.750000 0.375000 0.625000 Ge\n0.250000 0.125000 0.875000 Ge\n0.125000 0.875000 0.250000 Ge\n0.375000 0.625000 0.750000 Ge\n0.625000 0.750000 0.375000 Ge\n0.375000 0.250000 0.625000 Ge\n0.420055 0.819935 0.792249 O\n0.872194 0.399880 0.079945 O\n0.100120 0.972314 0.680065 O\n0.527686 0.627806 0.707751 O\n0.680065 0.079945 0.707751 O\n0.627806 0.707751 0.527686 O\n0.627806 0.420055 0.100120 O\n0.707751 0.527686 0.627806 O\n0.819935 0.527686 0.399880 O\n0.972314 0.792249 0.872194 O\n0.792249 0.872194 0.972314 O\n0.707751 0.680065 0.079945 O\n0.420055 0.100120 0.627806 O\n0.399880 0.819935 0.527686 O\n0.079945 0.707751 0.680065 O\n0.100120 0.627806 0.420055 O\n0.527686 0.399880 0.819935 O\n0.079945 0.872194 0.399880 O\n0.972314 0.680065 0.100120 O\n0.180065 0.472314 0.600120 O\n0.680065 0.100120 0.972314 O\n0.792249 0.420055 0.819935 O\n0.399880 0.079945 0.872194 O\n0.872194 0.972314 0.792249 O\n0.579945 0.180065 0.207751 O\n0.127806 0.600120 0.920055 O\n0.899880 0.027686 0.319935 O\n0.472314 0.372194 0.292249 O\n0.319935 0.920055 0.292249 O\n0.372194 0.292249 0.472314 O\n0.372194 0.579945 0.899880 O\n0.292249 0.472314 0.372194 O\n0.127806 0.027686 0.207751 O\n0.600120 0.920055 0.127806 O\n0.207751 0.579945 0.180065 O\n0.180065 0.207751 0.579945 O\n0.319935 0.899880 0.027686 O\n0.027686 0.319935 0.899880 O\n0.920055 0.127806 0.600120 O\n0.472314 0.600120 0.180065 O\n0.899880 0.372194 0.579945 O\n0.920055 0.292249 0.319935 O\n0.600120 0.180065 0.472314 O\n0.579945 0.899880 0.372194 O\n0.292249 0.319935 0.920055 O\n0.207751 0.127806 0.027686 O\n0.027686 0.207751 0.127806 O\n0.819935 0.792249 0.420055 O\n",
            "nsites": 80,
            "nelements": 4,
            "elements": [
                "Zn",
                "Ni",
                "Ge",
                "O"
            ],
            "chemical_system": "Ge-Ni-O-Zn",
            "density": 5.563234575621787,
            "density_atomic": 0.09260912233737098,
            "volume": 863.845785176146,
            "volume_molar": 6.502751141579341,
            "formula_full": "Zn12 Ni8 Ge12 O48",
            "formula_reduced": "Zn3Ni2(GeO4)3",
            "formula_anonymous": "A2B3C3D12",
            "energy": -483.89819908,
            "energy_per_atom": -6.0487274885,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -430.59419908,
            "band_gap": 0.0817000000000001,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 7.9912157,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:48.250000Z",
            "spacegroup": 230
        },
        {
            "id": "mp-1194885",
            "created_at": "2022-09-04T14:46:42.419299Z",
            "structure_string": "Na12 V4 S8 O32 F8\n1.0\n6.756121 0.000000 0.000000\n0.000000 9.010492 0.000000\n0.000000 0.000000 14.190450\nNa V S O F\n12 4 8 32 8\ndirect\n0.518161 0.667028 0.903354 Na\n0.018161 0.832972 0.596646 Na\n0.481839 0.167028 0.596646 Na\n0.981839 0.332972 0.903354 Na\n0.481839 0.332972 0.096646 Na\n0.981839 0.167028 0.403354 Na\n0.518161 0.832972 0.403354 Na\n0.018161 0.667028 0.096646 Na\n0.750000 0.000000 0.049173 Na\n0.250000 0.500000 0.450827 Na\n0.250000 0.000000 0.950827 Na\n0.750000 0.500000 0.549173 Na\n0.750000 0.000000 0.802073 V\n0.250000 0.500000 0.697927 V\n0.250000 0.000000 0.197927 V\n0.750000 0.500000 0.302073 V\n0.001488 0.693735 0.857313 S\n0.501488 0.806265 0.642687 S\n0.998512 0.193735 0.642687 S\n0.498512 0.306265 0.857313 S\n0.998512 0.306265 0.142687 S\n0.498512 0.193735 0.357313 S\n0.001488 0.806265 0.357313 S\n0.501488 0.693735 0.142687 S\n0.447012 0.443896 0.799722 O\n0.947012 0.056104 0.700278 O\n0.552988 0.943896 0.700278 O\n0.052988 0.556104 0.799722 O\n0.552988 0.556104 0.200278 O\n0.052988 0.943896 0.299722 O\n0.447012 0.056104 0.299722 O\n0.947012 0.443896 0.200278 O\n0.183811 0.766483 0.889424 O\n0.683811 0.733517 0.610576 O\n0.816189 0.266483 0.610576 O\n0.316189 0.233517 0.889424 O\n0.816189 0.233517 0.110576 O\n0.316189 0.266483 0.389424 O\n0.183811 0.733517 0.389424 O\n0.683811 0.766483 0.110576 O\n0.877758 0.642515 0.936435 O\n0.377758 0.857485 0.563565 O\n0.122242 0.142515 0.563565 O\n0.622242 0.357485 0.936435 O\n0.122242 0.357485 0.063565 O\n0.622242 0.142515 0.436435 O\n0.877758 0.857485 0.436435 O\n0.377758 0.642515 0.063565 O\n0.383536 0.708126 0.706872 O\n0.883536 0.791874 0.793128 O\n0.616464 0.208126 0.793128 O\n0.116464 0.291874 0.706872 O\n0.616464 0.291874 0.293128 O\n0.116464 0.208126 0.206872 O\n0.383536 0.791874 0.206872 O\n0.883536 0.708126 0.293128 O\n0.575952 0.930461 0.902042 F\n0.075952 0.569539 0.597958 F\n0.424048 0.430461 0.597958 F\n0.924048 0.069539 0.902042 F\n0.424048 0.069539 0.097958 F\n0.924048 0.430461 0.402042 F\n0.575952 0.569539 0.402042 F\n0.075952 0.930461 0.097958 F\n",
            "nsites": 64,
            "nelements": 5,
            "elements": [
                "Na",
                "V",
                "S",
                "O",
                "F"
            ],
            "chemical_system": "F-Na-O-S-V",
            "density": 2.6913845577763587,
            "density_atomic": 0.07408629587834126,
            "volume": 863.8574683919387,
            "volume_molar": 8.128548861302354,
            "formula_full": "Na12 V4 S8 O32 F8",
            "formula_reduced": "Na3VS2(O4F)2",
            "formula_anonymous": "AB2C2D3E8",
            "energy": -411.76973516,
            "energy_per_atom": -6.433902111875,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -379.28973516,
            "band_gap": 2.4277,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 7.9998409,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:37:49.474000Z",
            "spacegroup": 60
        }
    ]
}