GET /third-parties/JarvisStructure/?format=api&ordering=nsites&page=4623
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 55712,
    "next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=4624",
    "previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=4622",
    "results": [
        {
            "id": "jvasp-102004",
            "created_at": "2022-09-04T14:36:59.751770Z",
            "updated_at": "2022-09-04T14:36:59.751786Z",
            "structure_string": "H28 C16 O10\n1.0\n6.239957 -0.000003 -0.239309\n-0.000003 6.151003 -0.000003\n-0.025027 -0.000006 10.765488\nH C O\n28 16 10\ndirect\n0.041979 0.749665 0.792703 H\n0.677868 0.864068 0.198492 H\n0.496000 0.221182 0.450485 H\n0.504003 0.721181 0.549515 H\n0.646699 0.332770 0.326652 H\n0.353303 0.832767 0.673348 H\n0.501669 0.508465 0.423029 H\n0.498333 0.008464 0.576972 H\n0.395297 0.295375 -0.002775 H\n0.604706 0.795374 0.002775 H\n0.560326 0.427821 0.116058 H\n0.439677 0.927819 0.883943 H\n0.668499 0.216541 0.022854 H\n0.331504 0.716540 0.977146 H\n0.322133 0.364067 0.801509 H\n0.121796 0.355323 0.506843 H\n0.958023 0.249667 0.207298 H\n0.878206 0.855324 0.493158 H\n0.090279 0.264795 0.063451 H\n0.591204 0.351384 0.680767 H\n0.408799 0.851385 0.319233 H\n0.909722 0.764795 0.936549 H\n0.169760 0.665202 0.169672 H\n0.046438 0.079423 0.659226 H\n0.953563 0.579423 0.340774 H\n0.164278 0.558138 0.625536 H\n0.835723 0.058139 0.374464 H\n0.830243 0.165202 0.830329 H\n0.501090 0.348632 0.379404 C\n0.498912 0.848631 0.620596 C\n0.525052 0.274055 0.067783 C\n0.474951 0.774054 0.932218 C\n0.930357 0.913748 0.403093 C\n0.069644 0.413748 0.596907 C\n0.916943 0.740124 0.300823 C\n0.083059 0.240124 0.699177 C\n0.901413 0.305775 0.785119 C\n0.255846 0.934149 0.300202 C\n0.744157 0.434148 0.699799 C\n0.288030 0.150150 0.227487 C\n0.711972 0.650148 0.772513 C\n0.078546 0.171646 0.149627 C\n0.921456 0.671646 0.850374 C\n0.098590 0.805775 0.214881 C\n0.018277 0.952391 0.117487 O\n0.981725 0.452391 0.882513 O\n0.312125 0.341361 0.298501 O\n0.687877 0.841360 0.701500 O\n0.712806 0.723509 0.238222 O\n0.528906 0.605595 0.844569 O\n0.287197 0.223508 0.761778 O\n0.844646 0.467009 0.582632 O\n0.471097 0.105596 0.155431 O\n0.155355 0.967009 0.417368 O\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "H",
                "C",
                "O"
            ],
            "chemical_system": "C-H-O",
            "density": 1.5288075620605592,
            "density_atomic": 0.13069868701018084,
            "volume": 413.16405876207193,
            "volume_molar": 4.607652071922423,
            "formula_full": "H28 C16 O10",
            "formula_reduced": "H14C8O5",
            "formula_anonymous": "A5B8C14",
            "energy_above_hull": 4.559087314814815,
            "spacegroup": 4
        },
        {
            "id": "jvasp-32540",
            "created_at": "2022-09-04T14:37:58.969195Z",
            "updated_at": "2022-09-04T14:37:58.969217Z",
            "structure_string": "Al6 Pb10 F38\n1.0\n6.900122 0.000000 2.468583\n3.450061 10.189365 1.234292\n0.017761 0.000000 10.828168\nAl Pb F\n6 10 38\ndirect\n0.666256 0.500000 0.167487 Al\n0.833743 0.832512 0.500000 Al\n0.333743 0.500000 0.832513 Al\n0.750000 0.000000 -0.000000 Al\n0.250000 0.000000 -0.000000 Al\n0.166256 0.167487 0.500000 Al\n0.250000 0.500000 0.500000 Pb\n0.929881 0.298456 0.841781 Pb\n0.750000 0.500000 0.500000 Pb\n0.728337 0.701544 0.841781 Pb\n0.228337 0.841781 0.701544 Pb\n0.070118 0.701544 0.158219 Pb\n0.271663 0.298456 0.158219 Pb\n0.570118 0.158219 0.701544 Pb\n0.429881 0.841781 0.298456 Pb\n0.771662 0.158219 0.298456 Pb\n0.661101 0.000000 0.177798 F\n0.076123 0.821599 0.370412 F\n0.893957 0.500000 0.712085 F\n0.731864 0.821599 0.370412 F\n0.268135 0.178400 0.629588 F\n0.338899 0.000000 0.822202 F\n0.231864 0.370412 0.821600 F\n0.500000 0.000000 -0.000000 F\n0.606042 0.287915 0.500000 F\n0.076656 0.346686 0.500000 F\n0.102277 0.629587 0.821600 F\n0.423343 0.500000 0.653314 F\n0.423877 0.629587 0.178400 F\n0.897723 0.370412 0.178400 F\n0.393957 0.712085 0.500000 F\n0.838899 0.000000 0.822202 F\n0.923876 0.178400 0.629587 F\n0.553464 0.370412 0.178400 F\n0.576123 0.370412 0.821600 F\n0.602277 0.821599 0.629587 F\n0.838899 0.822201 -0.000000 F\n0.161101 0.000000 0.177798 F\n0.946535 0.821599 0.629587 F\n0.755357 0.500000 0.989286 F\n0.397723 0.178400 0.370412 F\n0.923343 0.653314 0.500000 F\n0.338899 0.822201 -0.000000 F\n0.244643 0.500000 0.010714 F\n0.000000 0.000000 0.000000 F\n0.768135 0.629587 0.178400 F\n0.106043 0.500000 0.287915 F\n0.161101 0.177798 -0.000000 F\n0.446536 0.629587 0.821600 F\n0.661101 0.177798 -0.000000 F\n0.255357 0.989285 0.500000 F\n0.576656 0.500000 0.346686 F\n0.053464 0.178400 0.370413 F\n0.744643 0.010714 0.500000 F\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "Al",
                "Pb",
                "F"
            ],
            "chemical_system": "Al-F-Pb",
            "density": 6.450960604792528,
            "density_atomic": 0.07097245236415059,
            "volume": 760.8585895120673,
            "volume_molar": 8.48518060091987,
            "formula_full": "Al6 Pb10 F38",
            "formula_reduced": "Al3Pb5F19",
            "formula_anonymous": "A3B5C19",
            "energy_above_hull": 0.062482988611111,
            "spacegroup": 140
        },
        {
            "id": "jvasp-96541",
            "created_at": "2022-09-04T14:35:42.093591Z",
            "updated_at": "2022-09-04T14:35:42.093614Z",
            "structure_string": "Mg4 B48 C2\n1.0\n5.085742 0.000000 0.000000\n-0.000000 8.967342 0.000000\n0.000000 0.000000 8.967342\nMg B C\n4 48 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.750000 0.000000 0.500000 Mg\n0.250000 0.500000 0.000000 Mg\n0.412788 0.407359 0.730867 B\n0.914839 0.248375 0.735490 B\n0.375407 0.883945 0.128257 B\n0.901676 0.579525 0.825137 B\n0.901676 0.420475 0.174863 B\n0.417158 0.694055 0.098506 B\n0.584688 0.577587 0.740946 B\n0.624592 0.871742 0.883945 B\n0.417158 0.305944 0.901493 B\n0.412788 0.592640 0.269132 B\n0.401676 0.079525 0.674862 B\n0.401676 0.920475 0.325137 B\n0.415312 0.259054 0.577587 B\n0.587212 0.269132 0.407359 B\n0.582842 0.098506 0.305944 B\n0.917158 0.194056 0.401493 B\n0.585161 0.764510 0.251625 B\n0.087212 0.230868 0.907359 B\n0.098324 0.174863 0.579525 B\n0.624592 0.128257 0.116054 B\n0.098324 0.825137 0.420475 B\n0.598323 0.674862 0.920475 B\n0.124592 0.371743 0.616054 B\n0.912788 0.092641 0.230868 B\n0.414839 0.748375 0.764510 B\n0.915312 0.240946 0.077587 B\n0.875407 0.616054 0.628257 B\n0.914839 0.751625 0.264510 B\n0.414839 0.251625 0.235490 B\n0.082842 0.401493 0.805944 B\n0.085161 0.264510 0.248375 B\n0.587212 0.730867 0.592640 B\n0.084688 0.922413 0.240946 B\n0.598323 0.325137 0.079525 B\n0.415312 0.740946 0.422413 B\n0.915312 0.759054 0.922413 B\n0.912788 0.907359 0.769132 B\n0.875407 0.383945 0.371743 B\n0.084688 0.077587 0.759054 B\n0.584688 0.422413 0.259054 B\n0.582842 0.901493 0.694055 B\n0.585161 0.235490 0.748375 B\n0.375407 0.116054 0.871742 B\n0.917158 0.805944 0.598506 B\n0.124592 0.628257 0.383945 B\n0.087212 0.769132 0.092641 B\n0.085161 0.735490 0.751625 B\n0.082842 0.598506 0.194056 B\n0.500000 0.000000 0.000000 C\n0.000000 0.500000 0.500000 C\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "Mg",
                "B",
                "C"
            ],
            "chemical_system": "B-C-Mg",
            "density": 2.5993347762295675,
            "density_atomic": 0.13204196188575448,
            "volume": 408.9609032522703,
            "volume_molar": 4.560778008744284,
            "formula_full": "Mg4 B48 C2",
            "formula_reduced": "Mg2B24C",
            "formula_anonymous": "AB2C24",
            "energy_above_hull": 5.300892225925925,
            "spacegroup": 118
        },
        {
            "id": "jvasp-98303",
            "created_at": "2022-09-04T14:36:04.924893Z",
            "updated_at": "2022-09-04T14:36:04.924924Z",
            "structure_string": "Sr2 H32 O20\n1.0\n6.187161 -0.016889 0.193262\n-0.015290 6.194082 0.167158\n0.337617 0.296977 11.087047\nSr H O\n2 32 20\ndirect\n-0.017523 -0.023593 0.496769 Sr\n0.039684 0.025512 0.011867 Sr\n-0.010859 0.413968 0.623839 H\n0.228952 0.333006 0.632494 H\n0.345608 0.682633 0.619171 H\n0.234902 0.811511 0.725383 H\n0.509708 -0.019159 0.633941 H\n0.584600 0.224132 0.628128 H\n0.304739 0.626383 0.104196 H\n0.747137 0.403487 0.104539 H\n0.805272 0.267250 0.223806 H\n0.581024 0.965646 0.153525 H\n0.636524 0.734088 0.102125 H\n0.277254 0.212804 0.227535 H\n0.412246 0.291624 0.106343 H\n0.675591 0.568747 0.619474 H\n0.831130 0.676390 0.713451 H\n0.065896 0.564479 0.155701 H\n0.719911 0.976997 0.777700 H\n0.670127 0.773638 0.878869 H\n0.041358 0.435937 0.354699 H\n0.269414 0.376630 0.407324 H\n0.797230 0.735328 0.283177 H\n0.604217 0.265462 0.405006 H\n0.559720 0.035863 0.353616 H\n0.270182 0.791802 0.286419 H\n0.709818 0.599913 0.402537 H\n0.380467 0.706028 0.405023 H\n0.977610 0.317742 0.795104 H\n0.785549 0.420800 0.884633 H\n0.091018 0.594677 0.877915 H\n0.336855 0.657642 0.888739 H\n0.496090 0.073983 0.885093 H\n0.432112 0.316922 0.889287 H\n0.368438 0.168454 0.883506 O\n0.170840 0.686953 0.147009 O\n0.643194 0.072424 0.637179 O\n0.279640 0.828817 0.636786 O\n0.074170 0.280909 0.642768 O\n0.828235 0.637921 0.629246 O\n0.748624 0.918179 0.860858 O\n0.871735 0.331679 0.146126 O\n0.189642 0.723743 0.873249 O\n0.558698 0.544124 0.914290 O\n0.319015 0.840338 0.364450 O\n0.678000 0.140924 0.363054 O\n0.844006 0.672214 0.361664 O\n0.141907 0.313595 0.366795 O\n0.537524 0.525612 0.050385 O\n0.469709 0.459427 0.594100 O\n0.485804 0.475733 0.458022 O\n0.701566 0.862344 0.142358 O\n0.939469 0.363765 0.878414 O\n0.342791 0.160419 0.150577 O\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "Sr",
                "H",
                "O"
            ],
            "chemical_system": "H-O-Sr",
            "density": 2.064928390090464,
            "density_atomic": 0.12730397005185198,
            "volume": 424.1815866229886,
            "volume_molar": 4.730520782303278,
            "formula_full": "Sr2 H32 O20",
            "formula_reduced": "Sr(H8O5)2",
            "formula_anonymous": "AB10C16",
            "energy_above_hull": 3.028848196666667,
            "spacegroup": 1
        },
        {
            "id": "jvasp-88239",
            "created_at": "2022-09-04T14:36:16.718149Z",
            "updated_at": "2022-09-04T14:36:16.718175Z",
            "structure_string": "Sr2 H32 O20\n1.0\n6.304823 0.003159 0.037436\n0.003159 6.304823 0.037436\n0.065888 0.065888 11.027715\nSr H O\n2 32 20\ndirect\n0.000815 -0.001361 0.251267 Sr\n-0.001361 0.000815 0.751268 Sr\n0.282500 0.390475 0.645515 H\n0.140144 0.313688 0.533060 H\n0.393010 0.724876 0.649167 H\n0.454266 0.970005 0.631834 H\n0.614368 0.277728 0.645910 H\n0.689052 0.137485 0.531670 H\n0.137485 0.689051 0.031670 H\n0.970005 0.454265 0.131834 H\n0.724876 0.393010 0.149166 H\n0.549107 0.973803 0.131837 H\n0.611493 0.729019 0.149520 H\n0.390475 0.282500 0.145515 H\n0.313688 0.140144 0.033060 H\n0.973803 0.549107 0.631838 H\n0.729019 0.611493 0.649521 H\n0.277727 0.614367 0.145910 H\n0.608923 0.717022 0.857001 H\n0.685712 0.859384 0.969455 H\n0.025725 0.450301 0.370679 H\n0.270517 0.387913 0.353010 H\n0.717021 0.608923 0.357000 H\n0.606484 0.274540 0.353363 H\n0.545207 0.029419 0.370723 H\n0.385117 0.721698 0.356650 H\n0.859384 0.685711 0.469455 H\n0.310410 0.861942 0.470882 H\n0.721698 0.385117 0.856650 H\n0.861942 0.310410 0.970882 H\n0.029419 0.545207 0.870723 H\n0.274540 0.606484 0.853363 H\n0.450301 0.025725 0.870679 H\n0.387913 0.270517 0.853011 H\n0.326775 0.125936 0.876724 O\n0.134400 0.676054 0.122557 O\n0.676054 0.134400 0.622557 O\n0.331575 0.869432 0.626389 O\n0.138897 0.329212 0.623561 O\n0.873591 0.672633 0.625795 O\n0.670186 0.860627 0.878955 O\n0.869432 0.331574 0.126388 O\n0.129988 0.667903 0.876168 O\n0.497705 0.495146 0.819110 O\n0.323418 0.865023 0.379994 O\n0.667903 0.129988 0.376168 O\n0.860627 0.670186 0.378955 O\n0.125936 0.326775 0.376724 O\n0.501725 0.504359 0.183425 O\n0.504359 0.501725 0.683425 O\n0.495146 0.497705 0.319110 O\n0.672633 0.873591 0.125794 O\n0.865023 0.323419 0.879995 O\n0.329212 0.138896 0.123560 O\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "Sr",
                "H",
                "O"
            ],
            "chemical_system": "H-O-Sr",
            "density": 1.9982801999214794,
            "density_atomic": 0.12319507250073118,
            "volume": 438.3292196989413,
            "volume_molar": 4.8882967782370175,
            "formula_full": "Sr2 H32 O20",
            "formula_reduced": "Sr(H8O5)2",
            "formula_anonymous": "AB10C16",
            "energy_above_hull": 3.0282796781481487,
            "spacegroup": 15
        },
        {
            "id": "jvasp-95595",
            "created_at": "2022-09-04T14:36:20.404025Z",
            "updated_at": "2022-09-04T14:36:20.404051Z",
            "structure_string": "P6 H22 N8 O18\n1.0\n7.945088 0.085809 -1.688498\n0.139327 7.708887 -2.070497\n0.023084 -0.013818 8.457747\nP H N O\n6 22 8 18\ndirect\n0.711991 0.164311 0.463008 P\n0.288009 0.835689 0.536991 P\n0.996140 0.689140 0.296956 P\n0.003860 0.310861 0.703044 P\n0.811751 0.965484 0.148319 P\n0.188249 0.034517 0.851680 P\n0.484857 0.248267 0.946062 H\n0.581867 0.240245 0.787247 H\n0.418133 0.759755 0.212752 H\n0.339245 0.505339 0.901416 H\n0.660755 0.494661 0.098584 H\n0.234722 0.703639 0.932500 H\n0.765278 0.296361 0.067500 H\n0.226581 0.570472 0.057532 H\n0.773419 0.429529 0.942468 H\n0.243626 0.361139 0.521856 H\n0.515143 0.751733 0.053938 H\n0.584397 0.661234 0.581942 H\n0.415603 0.338766 0.418058 H\n0.771024 0.558010 0.654202 H\n0.228977 0.441991 0.345797 H\n0.914672 0.817078 0.736619 H\n0.085328 0.182922 0.263380 H\n0.739206 0.839210 0.821658 H\n0.260794 0.160791 0.178342 H\n0.263113 0.073232 0.348501 H\n0.756375 0.638861 0.478144 H\n0.736888 0.926768 0.651498 H\n0.454829 0.678921 0.108188 N\n0.304076 0.611555 0.990806 N\n0.695925 0.388445 0.009193 N\n0.545172 0.321079 0.891812 N\n0.718727 0.657387 0.595454 N\n0.781845 0.819628 0.705569 N\n0.218155 0.180372 0.294431 N\n0.281273 0.342614 0.404546 N\n0.884172 0.129531 0.140580 O\n0.115829 0.870469 0.859420 O\n0.882412 0.442992 0.782176 O\n0.117588 0.557009 0.217824 O\n0.168936 0.367721 0.687484 O\n0.831064 0.632279 0.312516 O\n0.337017 0.902997 0.403988 O\n0.662983 0.097003 0.596012 O\n0.386988 0.686648 0.590222 O\n0.028221 0.157246 0.798884 O\n0.971779 0.842754 0.201115 O\n0.282431 -0.000338 0.694874 O\n0.717569 0.000338 0.305126 O\n0.088414 0.788671 0.483762 O\n0.911586 0.211330 0.516237 O\n0.694161 0.864294 -0.000173 O\n0.613013 0.313353 0.409778 O\n0.305840 0.135707 0.000172 O\n",
            "nsites": 54,
            "nelements": 4,
            "elements": [
                "P",
                "H",
                "N",
                "O"
            ],
            "chemical_system": "H-N-O-P",
            "density": 1.949281850765382,
            "density_atomic": 0.10424922360712384,
            "volume": 517.9894691926504,
            "volume_molar": 5.77667684384412,
            "formula_full": "P6 H22 N8 O18",
            "formula_reduced": "P3H11N4O9",
            "formula_anonymous": "A3B4C9D11",
            "energy_above_hull": 3.734524481481481,
            "spacegroup": 2
        },
        {
            "id": "jvasp-97647",
            "created_at": "2022-09-04T14:36:18.831379Z",
            "updated_at": "2022-09-04T14:36:18.831407Z",
            "structure_string": "Hg2 H32 Br12 N8\n1.0\n9.042498 0.000000 0.000000\n0.000000 9.040688 0.000000\n0.000000 0.000000 8.874063\nHg H Br N\n2 32 12 8\ndirect\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Hg\n0.255193 0.858404 0.308425 H\n0.642241 0.244786 0.808272 H\n0.142241 0.255215 0.308273 H\n0.441928 0.857290 0.674071 H\n0.142595 0.441961 0.326031 H\n0.244807 0.358404 0.808425 H\n0.857406 0.558039 0.326031 H\n0.357405 0.941961 0.826031 H\n0.357759 0.755215 0.808272 H\n0.755194 0.641596 0.808425 H\n0.857759 0.744786 0.691727 H\n0.857759 0.744786 0.308273 H\n0.558073 0.142711 0.325929 H\n0.941928 0.642711 0.174071 H\n0.142595 0.441961 0.673968 H\n0.558073 0.142711 0.674071 H\n0.744807 0.141596 0.691574 H\n0.941928 0.642711 0.825929 H\n0.357759 0.755215 0.191727 H\n0.744807 0.141596 0.308425 H\n0.755194 0.641596 0.191574 H\n0.255193 0.858404 0.691574 H\n0.142241 0.255215 0.691727 H\n0.642595 0.058039 0.826031 H\n0.244807 0.358404 0.191574 H\n0.642241 0.244786 0.191727 H\n0.441928 0.857290 0.325929 H\n0.857406 0.558039 0.673968 H\n0.642595 0.058039 0.173968 H\n0.357405 0.941961 0.173968 H\n0.058073 0.357290 0.825929 H\n0.058073 0.357290 0.174071 H\n0.823631 0.368170 0.500000 Br\n0.368215 0.176350 0.500000 Br\n0.000000 0.000000 0.705191 Br\n0.000000 0.000000 0.294808 Br\n0.676370 0.868170 0.000000 Br\n0.131785 0.676350 0.000000 Br\n0.631786 0.823650 0.500000 Br\n0.500000 0.500000 0.205191 Br\n0.868215 0.323650 0.000000 Br\n0.500000 0.500000 0.794808 Br\n0.176369 0.631830 0.500000 Br\n0.323631 0.131830 0.000000 Br\n0.853868 0.646003 0.750014 N\n0.353868 0.853997 0.749985 N\n0.146132 0.353997 0.750014 N\n0.146132 0.353997 0.249985 N\n0.646132 0.146003 0.749985 N\n0.353868 0.853997 0.250015 N\n0.853868 0.646003 0.249985 N\n0.646132 0.146003 0.250015 N\n",
            "nsites": 54,
            "nelements": 4,
            "elements": [
                "Hg",
                "H",
                "Br",
                "N"
            ],
            "chemical_system": "Br-H-Hg-N",
            "density": 3.4433521736103287,
            "density_atomic": 0.07443571238545424,
            "volume": 725.4582279050283,
            "volume_molar": 8.090391785081925,
            "formula_full": "Hg2 H32 Br12 N8",
            "formula_reduced": "HgH16(Br3N2)2",
            "formula_anonymous": "AB4C6D16",
            "energy_above_hull": 2.809894527037037,
            "spacegroup": 128
        },
        {
            "id": "jvasp-95149",
            "created_at": "2022-09-04T14:36:31.858290Z",
            "updated_at": "2022-09-04T14:36:31.858314Z",
            "structure_string": "Sr2 H32 O20\n1.0\n6.414235 0.025707 -0.103182\n0.025707 6.414235 0.103182\n-0.179528 0.179528 10.966193\nSr H O\n2 32 20\ndirect\n-0.018108 -0.008890 0.257049 Sr\n0.008890 0.018109 0.757049 Sr\n0.291957 0.401436 0.650365 H\n0.042996 0.441987 0.628845 H\n0.374108 0.743136 0.640989 H\n0.309827 0.895150 0.528057 H\n0.626263 0.298449 0.652502 H\n0.701944 0.156682 0.544040 H\n0.104852 0.690174 0.028057 H\n0.701553 0.373738 0.152502 H\n0.843320 0.298057 0.044040 H\n0.558014 0.957005 0.128846 H\n0.598565 0.708044 0.150366 H\n0.314218 0.123636 0.050332 H\n0.382207 0.277475 0.157945 H\n0.722526 0.617794 0.657945 H\n0.876365 0.685783 0.550332 H\n0.256865 0.625893 0.140989 H\n0.626910 0.723657 0.858584 H\n0.703141 0.850692 0.974188 H\n0.276344 0.373091 0.358584 H\n0.149309 0.296860 0.474188 H\n0.733951 0.596382 0.361970 H\n0.564481 0.025728 0.389915 H\n0.613699 0.267500 0.361908 H\n0.380318 0.927850 0.270435 H\n0.973549 0.532741 0.376285 H\n0.408124 0.706522 0.345233 H\n0.732501 0.386302 0.861908 H\n0.974273 0.435520 0.889914 H\n0.072151 0.619684 0.770435 H\n0.293479 0.591878 0.845233 H\n0.467260 0.026453 0.876284 H\n0.403619 0.266050 0.861969 H\n0.346892 0.124333 0.886249 O\n0.135744 0.718829 0.113942 O\n0.713644 0.173578 0.633709 O\n0.281172 0.864258 0.613942 O\n0.152182 0.331459 0.629697 O\n0.868765 0.673250 0.641111 O\n0.693421 0.859765 0.882807 O\n0.826423 0.286357 0.133710 O\n0.140584 0.646808 0.850347 O\n0.509611 0.500690 0.824624 O\n0.353194 0.859417 0.350347 O\n0.680257 0.127699 0.388771 O\n0.875668 0.653109 0.386249 O\n0.140237 0.306580 0.382808 O\n0.482411 0.498618 0.187679 O\n0.501383 0.517590 0.687679 O\n0.499311 0.490390 0.324624 O\n0.668542 0.847819 0.129697 O\n0.872302 0.319744 0.888771 O\n0.326751 0.131236 0.141111 O\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "Sr",
                "H",
                "O"
            ],
            "chemical_system": "H-O-Sr",
            "density": 1.942441236077329,
            "density_atomic": 0.11975256969285865,
            "volume": 450.9297807846561,
            "volume_molar": 5.028819653261374,
            "formula_full": "Sr2 H32 O20",
            "formula_reduced": "Sr(H8O5)2",
            "formula_anonymous": "AB10C16",
            "energy_above_hull": 3.029282641111112,
            "spacegroup": 9
        },
        {
            "id": "jvasp-97436",
            "created_at": "2022-09-04T14:38:17.716312Z",
            "updated_at": "2022-09-04T14:38:17.716338Z",
            "structure_string": "Al6 Pb10 F38\n1.0\n6.851581 0.000671 2.403264\n3.342883 10.074375 1.141066\n-0.019958 -0.000714 10.709258\nAl Pb F\n6 10 38\ndirect\n0.246454 0.997958 0.003637 Al\n0.672967 0.483588 0.168223 Al\n0.837981 0.833513 0.481716 Al\n0.327032 0.516412 0.831778 Al\n0.753545 0.002042 0.996364 Al\n0.162018 0.166487 0.518285 Al\n0.240723 0.536646 0.476414 Pb\n0.558716 0.153356 0.726088 Pb\n0.922402 0.327012 0.844068 Pb\n0.283398 0.275635 0.157121 Pb\n0.441283 0.846644 0.273913 Pb\n0.253025 0.843775 0.672528 Pb\n0.077597 0.672988 0.155932 Pb\n0.716601 0.724365 0.842879 Pb\n0.759277 0.463354 0.523587 Pb\n0.746974 0.156225 0.327472 Pb\n0.858066 0.938747 0.827738 F\n0.217754 0.995161 0.474149 F\n0.621464 0.811727 0.617399 F\n0.876034 0.540160 0.705114 F\n0.000000 0.000000 0.000000 F\n0.418508 0.653403 0.843269 F\n0.930888 0.367616 0.125209 F\n0.928928 0.167846 0.654548 F\n0.141933 0.061253 0.172263 F\n0.309065 0.106750 0.632511 F\n0.690934 0.893250 0.367489 F\n0.591986 0.399165 0.778348 F\n0.378535 0.188272 0.382601 F\n0.500000 -0.000000 -0.000000 F\n0.581491 0.346597 0.156732 F\n0.994876 0.768773 0.594168 F\n0.408013 0.600835 0.221653 F\n0.368210 0.562917 0.656787 F\n0.203997 0.164946 0.939392 F\n0.631789 0.437083 0.343213 F\n0.426178 0.709962 0.458223 F\n0.071072 0.832154 0.345453 F\n0.754896 0.618489 0.196862 F\n0.894899 0.662060 0.431790 F\n0.294213 0.474692 0.005359 F\n0.691573 0.170467 0.933825 F\n0.796002 0.835054 0.060608 F\n0.069111 0.632384 0.874792 F\n0.632188 0.066565 0.162549 F\n0.705787 0.525307 0.994641 F\n0.308426 0.829533 0.066175 F\n0.782245 0.004839 0.525852 F\n0.105100 0.337940 0.568210 F\n0.573821 0.290037 0.541777 F\n0.367811 0.933435 0.837452 F\n0.123965 0.459840 0.294886 F\n0.245104 0.381511 0.803139 F\n0.005123 0.231227 0.405833 F\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "Al",
                "Pb",
                "F"
            ],
            "chemical_system": "Al-F-Pb",
            "density": 6.6357566603735,
            "density_atomic": 0.07300554945701761,
            "volume": 739.6697977294558,
            "volume_molar": 8.248880810828725,
            "formula_full": "Al6 Pb10 F38",
            "formula_reduced": "Al3Pb5F19",
            "formula_anonymous": "A3B5C19",
            "energy_above_hull": 0.0612807663888888,
            "spacegroup": 2
        },
        {
            "id": "jvasp-24337",
            "created_at": "2022-09-04T14:38:10.299391Z",
            "updated_at": "2022-09-04T14:38:10.299421Z",
            "structure_string": "Na9 Li9 C9 O27\n1.0\n7.203083 -12.476105 0.000000\n7.203083 12.476104 -0.000000\n-0.000000 -0.000000 3.274060\nNa Li C O\n9 9 9 27\ndirect\n0.094324 0.870216 0.500000 Na\n0.426815 0.547445 0.500000 Na\n0.805775 0.549042 0.500000 Na\n0.775891 0.905676 0.500000 Na\n0.129783 0.224108 0.500000 Na\n0.452554 0.879369 0.500000 Na\n0.450957 0.256732 0.500000 Na\n0.743267 0.194224 0.500000 Na\n0.120631 0.573185 0.500000 Na\n0.579535 0.475287 0.000000 Li\n0.179606 0.430922 0.000000 Li\n0.875678 0.772589 0.000000 Li\n0.569077 0.748683 0.000000 Li\n0.524713 0.104248 0.000000 Li\n0.895751 0.420464 0.000000 Li\n0.896911 0.124321 0.000000 Li\n0.251316 0.820394 0.000000 Li\n0.227411 0.103088 0.000000 Li\n0.654759 0.991311 0.000000 C\n0.666667 0.333333 0.000000 C\n0.336551 0.345240 0.000000 C\n0.681828 0.668232 0.500000 C\n0.333333 0.666667 0.000000 C\n0.986403 0.318172 0.500000 C\n0.008689 0.663448 0.000000 C\n0.331768 0.013596 0.500000 C\n0.000000 0.000000 0.000000 C\n0.088453 0.091732 0.000000 O\n0.087954 0.389020 0.500000 O\n0.433376 0.084385 0.500000 O\n0.419562 0.659860 0.000000 O\n0.651008 0.566624 0.500000 O\n0.249580 0.351233 0.000000 O\n0.747502 0.077909 0.000000 O\n0.908267 0.996719 0.000000 O\n0.956619 0.216789 0.500000 O\n0.761845 0.417093 0.000000 O\n0.003280 0.911547 0.000000 O\n0.330407 0.252498 0.000000 O\n0.655248 0.238154 0.000000 O\n0.648767 0.898347 0.000000 O\n0.610980 0.698933 0.500000 O\n0.301066 0.912046 0.500000 O\n0.915615 0.348991 0.500000 O\n0.783211 0.739831 0.500000 O\n0.260169 0.043380 0.500000 O\n0.922091 0.669593 0.000000 O\n0.002864 0.570471 0.000000 O\n0.340139 0.759702 0.000000 O\n0.582906 0.344752 0.000000 O\n0.101652 0.750419 0.000000 O\n0.567608 0.997136 0.000000 O\n0.240298 0.580437 0.000000 O\n0.429528 0.432392 0.000000 O\n",
            "nsites": 54,
            "nelements": 4,
            "elements": [
                "Na",
                "Li",
                "C",
                "O"
            ],
            "chemical_system": "C-Li-Na-O",
            "density": 2.2841721953565197,
            "density_atomic": 0.0917655574812816,
            "volume": 588.4560774451238,
            "volume_molar": 6.562528387874068,
            "formula_full": "Na9 Li9 C9 O27",
            "formula_reduced": "NaLiCO3",
            "formula_anonymous": "ABCD3",
            "energy_above_hull": 2.1252899166666666,
            "spacegroup": 174
        },
        {
            "id": "jvasp-97704",
            "created_at": "2022-09-04T14:35:49.196797Z",
            "updated_at": "2022-09-04T14:35:49.196822Z",
            "structure_string": "Ba12 Mn10 O32\n1.0\n5.738801 0.000000 0.000000\n-2.869401 6.638510 -0.000000\n0.000000 -0.000000 20.099536\nBa Mn O\n12 10 32\ndirect\n0.121408 0.242815 0.839358 Ba\n0.645685 0.291370 0.981266 Ba\n0.354315 0.708630 0.018734 Ba\n0.854315 0.708630 0.481266 Ba\n0.145685 0.291370 0.518734 Ba\n0.914174 0.828347 0.678509 Ba\n0.878592 0.757185 0.160642 Ba\n0.585826 0.171653 0.178509 Ba\n0.414174 0.828347 0.821491 Ba\n0.621408 0.242815 0.660642 Ba\n0.378592 0.757185 0.339358 Ba\n0.085826 0.171653 0.321491 Ba\n0.877200 0.754401 0.906291 Mn\n0.122800 0.245599 0.093709 Mn\n0.622800 0.245599 0.406291 Mn\n0.377200 0.754401 0.593709 Mn\n0.000000 0.000000 0.000000 Mn\n0.749881 0.499762 0.811126 Mn\n0.750119 0.500238 0.311126 Mn\n0.249881 0.499762 0.688874 Mn\n0.500000 0.000000 0.500000 Mn\n0.250119 0.500238 0.188874 Mn\n0.884975 0.769950 0.314149 O\n0.588092 0.176185 0.316016 O\n0.411908 0.823815 0.683984 O\n0.615025 0.230050 0.814149 O\n0.384975 0.769950 0.185851 O\n0.943005 0.450996 0.385331 O\n0.987689 0.475379 0.250000 O\n0.492009 0.549004 0.614669 O\n0.556995 0.549004 0.885331 O\n0.007991 0.450996 0.114669 O\n0.056995 0.549004 0.614669 O\n0.507991 0.450996 0.385331 O\n0.443005 0.450996 0.114669 O\n0.992009 0.549004 0.885331 O\n0.794324 0.037586 0.069274 O\n0.756738 0.962414 0.930726 O\n0.705676 0.962414 0.569274 O\n0.743262 0.037586 0.430726 O\n0.205676 0.962414 0.930726 O\n0.243262 0.037586 0.069274 O\n0.294324 0.037586 0.430726 O\n0.256738 0.962414 0.569274 O\n0.855096 0.710193 0.002516 O\n0.144904 0.289807 -0.002516 O\n0.644904 0.289807 0.502516 O\n0.355096 0.710193 0.497484 O\n0.911908 0.823815 0.816017 O\n0.088092 0.176185 0.183984 O\n0.012311 0.524621 0.750000 O\n0.487689 0.475379 0.250000 O\n0.512311 0.524621 0.750000 O\n0.115025 0.230050 0.685851 O\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "Ba",
                "Mn",
                "O"
            ],
            "chemical_system": "Ba-Mn-O",
            "density": 5.875245508477547,
            "density_atomic": 0.07052059191800421,
            "volume": 765.7337882640995,
            "volume_molar": 8.539549365952674,
            "formula_full": "Ba12 Mn10 O32",
            "formula_reduced": "Ba6Mn5O16",
            "formula_anonymous": "A5B6C16",
            "energy_above_hull": 2.6727502972924646,
            "spacegroup": 64
        },
        {
            "id": "jvasp-34194",
            "created_at": "2022-09-04T14:38:36.318887Z",
            "updated_at": "2022-09-04T14:38:36.318910Z",
            "structure_string": "Nb1 W17 Se36\n1.0\n10.013605 0.000000 -0.000000\n-5.006802 8.672037 0.000000\n-0.000000 0.000000 13.145172\nNb W Se\n1 17 36\ndirect\n0.222222 0.444444 0.750000 Nb\n0.111130 0.222261 0.250000 W\n0.888890 0.777778 0.750000 W\n0.777763 0.888905 0.250000 W\n0.111143 0.888905 0.250000 W\n0.888589 0.109796 0.750000 W\n0.111131 0.555537 0.250000 W\n0.888589 0.445459 0.750000 W\n0.221207 0.109796 0.750000 W\n0.556872 0.445459 0.750000 W\n0.444406 0.555537 0.250000 W\n0.221207 0.778079 0.750000 W\n0.777713 0.222189 0.250000 W\n0.556872 0.778079 0.750000 W\n0.777763 0.555525 0.250000 W\n0.444477 0.222189 0.250000 W\n0.555556 0.111111 0.750000 W\n0.444477 0.888955 0.250000 W\n0.222222 0.444444 0.122432 Se\n0.778140 0.222403 0.876936 Se\n0.222243 0.777780 0.122517 Se\n0.444264 0.222403 0.876936 Se\n0.555538 0.777780 0.122517 Se\n0.222222 0.444444 0.377568 Se\n0.777917 0.555834 0.622429 Se\n0.222243 0.777780 0.377483 Se\n0.777917 0.555834 0.877571 Se\n0.108951 0.217902 0.621064 Se\n0.444264 0.222403 0.623064 Se\n0.888890 0.777778 0.377486 Se\n0.777917 0.888751 0.622429 Se\n0.222243 0.111130 0.377483 Se\n0.110834 0.888751 0.622429 Se\n0.888888 0.111130 0.377483 Se\n0.888890 0.777778 0.122514 Se\n0.108951 0.217902 0.878936 Se\n0.222243 0.111130 0.122517 Se\n0.777917 0.888751 0.877571 Se\n0.888888 0.111130 0.122517 Se\n0.110834 0.888751 0.877571 Se\n0.108951 0.557716 0.621064 Se\n0.888888 0.444424 0.377483 Se\n0.448764 0.557716 0.621064 Se\n0.555538 0.444424 0.377483 Se\n0.444264 0.888528 0.623064 Se\n0.555556 0.111111 0.377556 Se\n0.888888 0.444424 0.122517 Se\n0.108951 0.557716 0.878936 Se\n0.555538 0.444424 0.122517 Se\n0.448764 0.557716 0.878936 Se\n0.555556 0.111111 0.122444 Se\n0.444264 0.888528 0.876936 Se\n0.555538 0.777780 0.377483 Se\n0.778140 0.222403 0.623064 Se\n",
            "nsites": 54,
            "nelements": 3,
            "elements": [
                "Nb",
                "W",
                "Se"
            ],
            "chemical_system": "Nb-Se-W",
            "density": 8.816523245900925,
            "density_atomic": 0.0473059652600855,
            "volume": 1141.5050872149227,
            "volume_molar": 12.730193173082112,
            "formula_full": "Nb1 W17 Se36",
            "formula_reduced": "NbW17Se36",
            "formula_anonymous": "AB17C36",
            "energy_above_hull": 4.578397974074075,
            "spacegroup": 187
        }
    ]
}