GET /third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=687
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=formula_reduced&page=688",
    "previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=686",
    "results": [
        {
            "id": "jvasp-97856",
            "created_at": "2022-09-04T14:35:53.439235Z",
            "updated_at": "2022-09-04T14:35:53.439262Z",
            "structure_string": "B2 H22 C8 Br2 N2 F8\n1.0\n5.634249 0.000000 -1.476690\n0.000000 7.609273 0.000000\n-0.041421 0.000000 9.329095\nB H C Br N F\n2 22 8 2 2 8\ndirect\n0.053402 0.750000 0.759320 B\n0.946598 0.250000 0.240680 B\n0.762249 0.415157 0.757792 H\n0.288888 0.596156 0.060371 H\n0.249655 0.369210 0.586170 H\n0.750345 0.630790 0.413831 H\n0.174411 0.368342 0.823641 H\n0.711112 0.096156 0.939630 H\n0.825589 0.868341 0.176360 H\n0.825589 0.631658 0.176360 H\n0.514180 0.527780 0.794146 H\n0.711112 0.403844 0.939630 H\n0.514180 0.972219 0.794146 H\n0.237751 0.915156 0.242208 H\n0.237751 0.584843 0.242208 H\n0.249655 0.130790 0.586170 H\n0.485820 0.472219 0.205855 H\n0.288888 0.903844 0.060371 H\n0.635878 0.750000 0.024314 H\n0.762249 0.084843 0.757792 H\n0.174411 0.131658 0.823641 H\n0.485820 0.027780 0.205855 H\n0.364122 0.250000 0.975686 H\n0.750345 0.869210 0.413831 H\n0.643426 0.750000 0.387025 C\n0.628222 0.412174 0.820608 C\n0.371778 0.912174 0.179393 C\n0.718607 0.750000 0.143350 C\n0.356575 0.250000 0.612975 C\n0.281394 0.250000 0.856651 C\n0.371778 0.587825 0.179393 C\n0.628222 0.087826 0.820608 C\n0.583912 0.250000 0.491361 Br\n0.416088 0.750000 0.508640 Br\n0.522504 0.750000 0.222910 N\n0.477496 0.250000 0.777090 N\n0.989539 0.097721 0.331042 F\n0.910583 0.750000 0.860731 F\n0.010461 0.597721 0.668959 F\n0.297444 0.750000 0.841447 F\n0.702556 0.250000 0.158554 F\n0.089418 0.250000 0.139270 F\n0.989539 0.402278 0.331042 F\n0.010461 0.902278 0.668959 F\n",
            "nsites": 44,
            "nelements": 6,
            "elements": [
                "B",
                "H",
                "C",
                "Br",
                "N",
                "F"
            ],
            "chemical_system": "B-Br-C-F-H-N",
            "density": 1.9938732171204279,
            "density_atomic": 0.11013862083748482,
            "volume": 399.4965586587856,
            "volume_molar": 5.467782975860918,
            "formula_full": "B2 H22 C8 Br2 N2 F8",
            "formula_reduced": "BH11C4BrNF4",
            "formula_anonymous": "ABCD4E4F11",
            "energy_above_hull": 3.5077095940151506,
            "spacegroup": 11
        },
        {
            "id": "jvasp-32584",
            "created_at": "2022-09-04T14:38:03.809070Z",
            "updated_at": "2022-09-04T14:38:03.809090Z",
            "structure_string": "B2 H22 C8 N2 Cl2 F8\n1.0\n5.742150 0.000000 -1.340666\n0.000000 7.579643 0.000000\n-0.042318 0.000000 9.166943\nB H C N Cl F\n2 22 8 2 2 8\ndirect\n0.058891 0.750000 0.757262 B\n0.941108 0.250000 0.242737 B\n0.248125 0.369414 0.583677 H\n0.243185 0.584929 0.257037 H\n0.756815 0.084929 0.742963 H\n0.484763 0.470839 0.212896 H\n0.515237 0.970839 0.787103 H\n0.626448 0.750000 0.022441 H\n0.183329 0.131034 0.827807 H\n0.288412 0.904549 0.069723 H\n0.243185 0.915071 0.257037 H\n0.484763 0.029161 0.212896 H\n0.756815 0.415071 0.742963 H\n0.711588 0.404549 0.930276 H\n0.816671 0.631034 0.172192 H\n0.515237 0.529161 0.787103 H\n0.248125 0.130586 0.583677 H\n0.816671 0.868966 0.172192 H\n0.751875 0.869414 0.416322 H\n0.373551 0.250000 0.977558 H\n0.288412 0.595451 0.069723 H\n0.183329 0.368966 0.827807 H\n0.751875 0.630585 0.416322 H\n0.711588 0.095451 0.930276 H\n0.373287 0.912274 0.189264 C\n0.355330 0.250000 0.606697 C\n0.626713 0.412275 0.810736 C\n0.710479 0.750000 0.142001 C\n0.373287 0.587725 0.189264 C\n0.626713 0.087725 0.810736 C\n0.644670 0.750000 0.393302 C\n0.289520 0.250000 0.857998 C\n0.521946 0.750000 0.228806 N\n0.478053 0.250000 0.771193 N\n0.444424 0.750000 0.510626 Cl\n0.555576 0.250000 0.489373 Cl\n0.704002 0.250000 0.159780 F\n0.913325 0.750000 0.859674 F\n0.086675 0.250000 0.140325 F\n0.295998 0.750000 0.840219 F\n0.019601 0.597170 0.666056 F\n0.019601 0.902829 0.666056 F\n0.980399 0.402829 0.333943 F\n0.980399 0.097171 0.333943 F\n",
            "nsites": 44,
            "nelements": 6,
            "elements": [
                "B",
                "H",
                "C",
                "N",
                "Cl",
                "F"
            ],
            "chemical_system": "B-C-Cl-F-H-N",
            "density": 1.6282153783791673,
            "density_atomic": 0.11040105043906318,
            "volume": 398.54693252476056,
            "volume_molar": 5.454785743478024,
            "formula_full": "B2 H22 C8 N2 Cl2 F8",
            "formula_reduced": "BH11C4NClF4",
            "formula_anonymous": "ABCD4E4F11",
            "energy_above_hull": 3.5175809559469693,
            "spacegroup": 11
        },
        {
            "id": "jvasp-117479",
            "created_at": "2022-09-04T14:38:51.564680Z",
            "updated_at": "2022-09-04T14:38:51.564704Z",
            "structure_string": "B1 H2\n1.0\n3.355249 -0.465831 0.507489\n0.921933 -1.767297 0.367870\n-0.562575 1.384911 -3.081324\nB H\n1 2\ndirect\n0.004702 0.889412 0.980135 B\n0.004437 0.283972 0.480164 H\n0.504644 0.494864 0.980033 H\n",
            "nsites": 3,
            "nelements": 2,
            "elements": [
                "B",
                "H"
            ],
            "chemical_system": "B-H",
            "density": 1.3760737399956187,
            "density_atomic": 0.19381743092452033,
            "volume": 15.478483982012488,
            "volume_molar": 3.1071203097028173,
            "formula_full": "B1 H2",
            "formula_reduced": "BH2",
            "formula_anonymous": "AB2",
            "energy_above_hull": 3.0457741944444443,
            "spacegroup": 115
        },
        {
            "id": "jvasp-117476",
            "created_at": "2022-09-04T14:38:51.270985Z",
            "updated_at": "2022-09-04T14:38:51.271007Z",
            "structure_string": "B1 H2\n1.0\n5.426526 0.000000 0.000000\n0.000000 2.314829 0.000000\n0.000000 0.000000 1.713042\nB H\n1 2\ndirect\n0.466602 0.000000 0.000000 B\n-0.033301 0.000000 0.784723 H\n-0.033301 0.000000 0.215275 H\n",
            "nsites": 3,
            "nelements": 2,
            "elements": [
                "B",
                "H"
            ],
            "chemical_system": "B-H",
            "density": 0.9898316025380568,
            "density_atomic": 0.13941594311104136,
            "volume": 21.518342400844173,
            "volume_molar": 4.319549561991999,
            "formula_full": "B1 H2",
            "formula_reduced": "BH2",
            "formula_anonymous": "AB2",
            "energy_above_hull": 3.122870861111111,
            "spacegroup": 47
        },
        {
            "id": "jvasp-33311",
            "created_at": "2022-09-04T14:38:34.134149Z",
            "updated_at": "2022-09-04T14:38:34.134182Z",
            "structure_string": "B4 H8 C4 O4\n1.0\n5.220288 2.218037 -0.864115\n-5.220288 2.218037 0.864115\n-0.243375 0.000000 10.033490\nB H C O\n4 8 4 4\ndirect\n0.642958 0.485924 0.485251 B\n0.485923 0.642958 0.014749 B\n0.357044 0.514078 0.514749 B\n0.514078 0.357044 -0.014749 B\n0.515908 0.205536 0.485850 H\n0.205536 0.515908 0.014150 H\n0.794465 0.484094 0.985850 H\n0.484093 0.794466 0.514150 H\n0.806374 0.662098 0.389514 H\n0.337904 0.193627 0.889514 H\n0.193627 0.337904 0.610485 H\n0.662097 0.806375 0.110486 H\n0.861094 0.618367 0.612633 C\n0.618366 0.861095 0.887367 C\n0.138907 0.381635 0.387367 C\n0.381635 0.138907 0.112633 C\n-0.015668 0.281064 0.286353 O\n0.015668 0.718937 0.713647 O\n0.718937 0.015669 0.786352 O\n0.281064 -0.015667 0.213647 O\n",
            "nsites": 20,
            "nelements": 4,
            "elements": [
                "B",
                "H",
                "C",
                "O"
            ],
            "chemical_system": "B-C-H-O",
            "density": 1.1721001000498514,
            "density_atomic": 0.08642352825490002,
            "volume": 231.41846212308562,
            "volume_molar": 6.96817276683975,
            "formula_full": "B4 H8 C4 O4",
            "formula_reduced": "BH2CO",
            "formula_anonymous": "ABCD2",
            "energy_above_hull": 3.793093216666666,
            "spacegroup": 15
        },
        {
            "id": "jvasp-62936",
            "created_at": "2022-09-04T14:35:45.313647Z",
            "updated_at": "2022-09-04T14:35:45.313675Z",
            "structure_string": "B12 H24 N12\n1.0\n5.270454 -0.000000 -0.000000\n-0.000000 5.270454 0.000000\n0.000000 -0.000000 16.105061\nB H N\n12 24 12\ndirect\n0.339813 0.560493 0.059086 B\n0.342598 0.657401 0.750000 B\n0.842598 0.842598 0.500000 B\n0.157401 0.157401 0.000000 B\n0.439506 0.660186 0.440914 B\n0.560493 0.339813 0.940914 B\n0.657401 0.342598 0.250000 B\n0.160186 0.060494 0.690914 B\n0.060494 0.160186 0.309086 B\n0.939505 0.839813 0.809086 B\n0.660186 0.439506 0.559086 B\n0.839813 0.939505 0.190914 B\n0.126772 0.504190 0.848951 H\n0.873227 0.495809 0.348951 H\n0.495809 0.873227 0.651049 H\n0.504190 0.126772 0.151049 H\n0.373228 0.004190 0.901049 H\n-0.003849 -0.003849 0.000000 H\n0.003849 0.003849 0.500000 H\n0.503849 0.496150 0.750000 H\n0.496150 0.503849 0.250000 H\n0.995809 0.626771 0.598951 H\n0.626771 0.995809 0.401049 H\n0.004190 0.373228 0.098951 H\n0.267526 0.671511 0.392330 H\n0.732474 0.328488 0.892330 H\n0.828487 0.767525 0.142330 H\n0.171512 0.232474 0.642330 H\n0.232474 0.171512 0.357670 H\n0.767525 0.828487 0.857670 H\n0.671511 0.267526 0.607670 H\n0.328488 0.732474 0.107670 H\n0.178725 0.821274 0.250000 H\n0.821274 0.178725 0.750000 H\n0.321274 0.321274 0.500000 H\n0.678725 0.678725 0.000000 H\n0.652406 0.136956 0.191712 N\n0.347593 0.863043 0.691712 N\n0.863043 0.347593 0.308288 N\n0.136956 0.652406 0.808288 N\n0.847593 0.636956 0.558288 N\n0.541889 0.541889 0.000000 N\n0.041889 0.958110 0.250000 N\n0.958110 0.041889 0.750000 N\n0.458110 0.458110 0.500000 N\n0.363043 0.152406 0.941712 N\n0.152406 0.363043 0.058288 N\n0.636956 0.847593 0.441712 N\n",
            "nsites": 48,
            "nelements": 3,
            "elements": [
                "B",
                "H",
                "N"
            ],
            "chemical_system": "B-H-N",
            "density": 1.1952273788794123,
            "density_atomic": 0.10729582140445051,
            "volume": 447.36131726010547,
            "volume_molar": 5.612651714832027,
            "formula_full": "B12 H24 N12",
            "formula_reduced": "BH2N",
            "formula_anonymous": "ABC2",
            "energy_above_hull": 3.547063958333334,
            "spacegroup": 96
        },
        {
            "id": "jvasp-98154",
            "created_at": "2022-09-04T14:36:14.590521Z",
            "updated_at": "2022-09-04T14:36:14.590548Z",
            "structure_string": "B12 H24 N12 Cl24\n1.0\n10.245741 0.000000 0.000000\n0.000000 11.946005 0.000000\n0.000000 0.000000 8.105349\nB H N Cl\n12 24 12 24\ndirect\n0.537388 0.250000 0.795275 B\n0.667864 0.364700 0.036461 B\n0.832136 0.635300 0.536461 B\n0.332136 0.864700 0.963539 B\n0.832136 0.864700 0.536461 B\n0.332136 0.635300 0.963539 B\n0.167864 0.135300 0.463539 B\n0.667864 0.135300 0.036461 B\n0.962612 0.750000 0.295275 B\n0.462612 0.750000 0.204725 B\n0.037388 0.250000 0.704725 B\n0.167864 0.364700 0.463539 B\n0.809476 0.630355 0.275549 H\n0.554117 0.426404 0.836696 H\n0.945883 0.573596 0.336696 H\n0.445883 0.926404 0.163304 H\n0.945883 0.926404 0.336696 H\n0.445883 0.573596 0.163304 H\n0.054117 0.426404 0.663304 H\n0.554117 0.073596 0.836696 H\n0.190524 0.130355 0.724452 H\n0.690524 0.369646 0.775549 H\n0.309476 0.869646 0.224451 H\n0.054117 0.073596 0.663304 H\n0.309476 0.630355 0.224451 H\n0.809476 0.869646 0.275549 H\n0.828297 0.250000 0.026600 H\n0.328297 0.250000 0.473400 H\n0.671703 0.750000 0.526600 H\n0.756275 0.250000 0.206215 H\n0.171703 0.750000 0.973400 H\n0.243725 0.750000 0.793785 H\n0.743725 0.750000 0.706215 H\n0.690524 0.130355 0.775549 H\n0.190524 0.369646 0.724452 H\n0.256275 0.250000 0.293785 H\n0.887084 0.856900 0.355101 N\n0.612916 0.356900 0.855101 N\n0.887084 0.643101 0.355101 N\n0.387084 0.856900 0.144899 N\n0.387084 0.643101 0.144899 N\n0.112916 0.143101 0.644899 N\n0.612916 0.143101 0.855101 N\n0.763473 0.750000 0.581502 N\n0.263473 0.750000 0.918499 N\n0.236527 0.250000 0.418499 N\n0.736527 0.250000 0.081501 N\n0.112916 0.356900 0.644899 N\n0.707036 0.522688 0.535823 Cl\n0.792964 0.477313 0.035823 Cl\n0.292964 0.022688 0.464177 Cl\n0.368030 0.250000 0.874072 Cl\n0.631969 0.750000 0.125929 Cl\n0.207036 0.977313 0.964178 Cl\n0.131970 0.750000 0.374071 Cl\n0.538496 0.250000 0.565008 Cl\n0.038496 0.250000 0.934992 Cl\n0.868030 0.250000 0.625929 Cl\n0.707036 0.977313 0.535823 Cl\n0.792964 0.022688 0.035823 Cl\n0.292964 0.477313 0.464177 Cl\n0.035609 0.105286 0.315159 Cl\n0.535609 0.394714 0.184841 Cl\n0.964391 0.605287 0.684841 Cl\n0.464391 0.894714 0.815159 Cl\n0.964391 0.894714 0.684841 Cl\n0.464391 0.605287 0.815159 Cl\n0.035609 0.394714 0.315159 Cl\n0.535609 0.105286 0.184841 Cl\n0.461504 0.750000 0.434992 Cl\n0.207036 0.522688 0.964178 Cl\n0.961504 0.750000 0.065008 Cl\n",
            "nsites": 72,
            "nelements": 4,
            "elements": [
                "B",
                "H",
                "N",
                "Cl"
            ],
            "chemical_system": "B-Cl-H-N",
            "density": 1.9631931368587001,
            "density_atomic": 0.07257628125667011,
            "volume": 992.059647495136,
            "volume_molar": 8.297670610460681,
            "formula_full": "B12 H24 N12 Cl24",
            "formula_reduced": "BH2NCl2",
            "formula_anonymous": "ABC2D2",
            "energy_above_hull": 2.628647328055555,
            "spacegroup": 62
        },
        {
            "id": "jvasp-88330",
            "created_at": "2022-09-04T14:36:11.777151Z",
            "updated_at": "2022-09-04T14:36:11.777175Z",
            "structure_string": "B4 H8 O4 F12\n1.0\n7.430240 0.000000 -0.666834\n0.000000 7.841339 0.000000\n-0.143333 0.000000 4.645876\nB H O F\n4 8 4 12\ndirect\n0.128911 0.797517 0.021100 B\n0.628911 0.702484 0.521101 B\n0.871090 0.202484 0.978902 B\n0.371089 0.297516 0.478901 B\n0.236764 0.541476 0.062951 H\n0.736764 0.958524 0.562952 H\n0.763236 0.458524 0.937051 H\n0.263236 0.041476 0.437050 H\n0.330791 0.658870 0.828586 H\n0.830791 0.841130 0.328586 H\n0.669209 0.341130 0.171416 H\n0.169210 0.158870 0.671416 H\n0.281812 0.137645 0.580011 O\n0.781812 0.362355 0.080011 O\n0.718188 0.862355 0.419991 O\n0.218188 0.637645 0.919991 O\n0.060966 0.889040 0.777134 F\n0.560966 0.610960 0.277134 F\n0.939034 0.110960 0.222868 F\n0.439035 0.389040 0.722868 F\n0.261070 0.894480 0.194652 F\n0.761070 0.605520 0.694653 F\n0.738931 0.105520 0.805350 F\n0.238930 0.394480 0.305349 F\n0.994440 0.740345 0.185164 F\n0.494441 0.759655 0.685164 F\n0.005560 0.259655 0.814838 F\n0.505560 0.240345 0.314838 F\n",
            "nsites": 28,
            "nelements": 4,
            "elements": [
                "B",
                "H",
                "O",
                "F"
            ],
            "chemical_system": "B-F-H-O",
            "density": 2.1117796414565486,
            "density_atomic": 0.10372931095738029,
            "volume": 269.93334614460593,
            "volume_molar": 5.80563073678793,
            "formula_full": "B4 H8 O4 F12",
            "formula_reduced": "BH2OF3",
            "formula_anonymous": "ABC2D3",
            "energy_above_hull": 1.5824881329761908,
            "spacegroup": 14
        },
        {
            "id": "jvasp-33032",
            "created_at": "2022-09-04T14:37:31.397176Z",
            "updated_at": "2022-09-04T14:37:31.397201Z",
            "structure_string": "B4 H12\n1.0\n4.232304 -0.055793 0.000000\n-1.505002 5.413740 0.000000\n0.000000 0.000000 6.233960\nB H\n4 12\ndirect\n0.501812 0.648617 0.456539 B\n0.998188 0.851384 0.956539 B\n0.498188 0.351384 0.543461 B\n0.001812 0.148616 0.043461 B\n0.282929 0.672962 0.345247 H\n0.217071 0.827038 0.845247 H\n0.717070 0.327038 0.654753 H\n0.782929 0.172963 0.154753 H\n0.723099 0.823305 0.508650 H\n0.776901 0.676696 0.008650 H\n0.276901 0.176696 0.491350 H\n0.223099 0.323305 -0.008650 H\n0.625667 0.479007 0.370743 H\n0.874332 0.020994 0.870743 H\n0.374333 0.520994 0.629257 H\n0.125668 0.979006 0.129257 H\n",
            "nsites": 16,
            "nelements": 2,
            "elements": [
                "B",
                "H"
            ],
            "chemical_system": "B-H",
            "density": 0.645711972096186,
            "density_atomic": 0.11242844902136004,
            "volume": 142.3127343592563,
            "volume_molar": 5.3564207390745615,
            "formula_full": "B4 H12",
            "formula_reduced": "BH3",
            "formula_anonymous": "AB3",
            "energy_above_hull": 3.033585645833333,
            "spacegroup": 14
        },
        {
            "id": "jvasp-33326",
            "created_at": "2022-09-04T14:36:51.538053Z",
            "updated_at": "2022-09-04T14:36:51.538069Z",
            "structure_string": "B2 H6 N2 F8\n1.0\n5.042159 -0.061490 -1.682405\n-1.114558 4.783568 -1.472139\n0.053291 0.058584 6.510956\nB H N F\n2 6 2 8\ndirect\n0.641638 0.746927 0.320586 B\n0.358362 0.253073 0.679415 B\n0.868047 0.704556 0.875857 H\n0.131952 0.295444 0.124144 H\n0.172584 0.875047 0.886636 H\n0.827415 0.124952 0.113365 H\n0.139349 0.842448 0.132357 H\n0.860651 0.157551 0.867644 H\n0.959662 0.131266 0.023171 N\n0.040337 0.868734 0.976830 N\n0.779065 0.862808 0.557904 F\n0.220934 0.137192 0.442097 F\n0.617044 0.963420 0.221602 F\n0.382955 0.036579 0.778399 F\n0.370124 0.601973 0.273032 F\n0.629876 0.398026 0.726969 F\n0.778749 0.565163 0.217842 F\n0.221250 0.434836 0.782159 F\n",
            "nsites": 18,
            "nelements": 4,
            "elements": [
                "B",
                "H",
                "N",
                "F"
            ],
            "chemical_system": "B-F-H-N",
            "density": 2.1884714906587854,
            "density_atomic": 0.11423257922094976,
            "volume": 157.57326082241588,
            "volume_molar": 5.271824203804344,
            "formula_full": "B2 H6 N2 F8",
            "formula_reduced": "BH3NF4",
            "formula_anonymous": "ABC3D4",
            "energy_above_hull": 2.00156744037037,
            "spacegroup": 2
        },
        {
            "id": "jvasp-33313",
            "created_at": "2022-09-04T14:38:17.223584Z",
            "updated_at": "2022-09-04T14:38:17.223604Z",
            "structure_string": "B2 H6 O2 F8\n1.0\n4.448566 0.098045 0.806299\n0.103369 5.855496 1.069299\n-0.069071 0.075274 6.275668\nB H O F\n2 6 2 8\ndirect\n0.568237 0.792662 0.797085 B\n0.431764 0.207338 0.202916 B\n0.861349 0.689592 0.158907 H\n0.138653 0.310407 0.841094 H\n0.757650 0.677774 0.430178 H\n0.242352 0.322225 0.569823 H\n0.049223 0.831941 0.295084 H\n0.950778 0.168058 0.704916 H\n0.069738 0.307375 0.696434 O\n0.930264 0.692624 0.303566 O\n0.740754 0.659225 0.948041 F\n0.259247 0.340774 0.051959 F\n0.739547 0.979137 0.669623 F\n0.260455 0.020863 0.330377 F\n0.515750 0.653189 0.645261 F\n0.484251 0.346810 0.354740 F\n0.299475 0.872502 0.903666 F\n0.700527 0.127497 0.096335 F\n",
            "nsites": 18,
            "nelements": 4,
            "elements": [
                "B",
                "H",
                "O",
                "F"
            ],
            "chemical_system": "B-F-H-O",
            "density": 2.151254759049661,
            "density_atomic": 0.11017558205807436,
            "volume": 163.37558344381668,
            "volume_molar": 5.465948668032165,
            "formula_full": "B2 H6 O2 F8",
            "formula_reduced": "BH3OF4",
            "formula_anonymous": "ABC3D4",
            "energy_above_hull": 1.6149374681481483,
            "spacegroup": 2
        },
        {
            "id": "jvasp-33501",
            "created_at": "2022-09-04T14:38:03.362926Z",
            "updated_at": "2022-09-04T14:38:03.362936Z",
            "structure_string": "B4 H16 N4 F16\n1.0\n7.029684 0.000000 0.000000\n0.000000 8.371927 0.000000\n-0.000000 0.000000 5.988424\nB H N F\n4 16 4 16\ndirect\n0.808433 0.585371 0.250000 B\n0.691566 0.085371 0.250000 B\n0.191566 0.414629 0.750000 B\n0.308433 0.914629 0.750000 B\n0.344268 0.609775 0.390147 H\n0.844268 0.890225 0.609853 H\n0.655732 0.390225 0.890146 H\n0.844268 0.890225 0.890146 H\n0.655732 0.390225 0.609853 H\n0.155732 0.109775 0.390147 H\n0.344268 0.609775 0.109853 H\n0.155732 0.109775 0.109853 H\n0.822239 0.285180 0.750000 H\n0.322239 0.214821 0.250000 H\n0.177760 0.714821 0.250000 H\n0.906450 0.722550 0.750000 H\n0.593550 0.222550 0.750000 H\n0.093550 0.277451 0.250000 H\n0.406450 0.777451 0.250000 H\n0.677760 0.785180 0.750000 H\n0.818633 0.821334 0.750000 N\n0.681366 0.321334 0.750000 N\n0.181367 0.178667 0.250000 N\n0.318633 0.678667 0.250000 N\n0.308806 0.419455 0.942537 F\n0.191193 0.919455 0.557462 F\n0.191193 0.919455 0.942537 F\n0.308806 0.419455 0.557462 F\n0.808806 0.080545 0.442538 F\n0.691193 0.580545 0.057462 F\n0.413996 0.770054 0.750000 F\n0.565340 0.954124 0.250000 F\n0.586003 0.229946 0.250000 F\n0.913996 0.729946 0.250000 F\n0.434660 0.045876 0.750000 F\n0.065340 0.545876 0.750000 F\n0.934659 0.454124 0.250000 F\n0.691193 0.580545 0.442538 F\n0.086003 0.270054 0.750000 F\n0.808806 0.080545 0.057462 F\n",
            "nsites": 40,
            "nelements": 4,
            "elements": [
                "B",
                "H",
                "N",
                "F"
            ],
            "chemical_system": "B-F-H-N",
            "density": 1.975945909468334,
            "density_atomic": 0.11349747853896086,
            "volume": 352.4307369195783,
            "volume_molar": 5.305968764700573,
            "formula_full": "B4 H16 N4 F16",
            "formula_reduced": "BH4NF4",
            "formula_anonymous": "ABC4D4",
            "energy_above_hull": 2.136453696333333,
            "spacegroup": 62
        }
    ]
}