GET /third-parties/MatprojStructure/?format=api&ordering=-chemical_system&page=48
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=-chemical_system&page=49",
    "previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-chemical_system&page=47",
    "results": [
        {
            "id": "mp-554889",
            "created_at": "2022-09-04T14:42:38.052574Z",
            "structure_string": "Zn24 S24\n1.0\n1.925182 -3.334514 0.000000\n1.925182 3.334514 0.000000\n0.000000 0.000000 75.566505\nZn S\n24 24\ndirect\n0.000000 0.000000 0.833321 Zn\n0.666667 0.333333 0.791694 Zn\n0.000000 0.000000 0.333338 Zn\n0.666667 0.333333 0.291696 Zn\n0.333333 0.666667 0.374986 Zn\n0.666667 0.333333 0.208321 Zn\n0.666667 0.333333 0.708320 Zn\n0.000000 0.000000 0.083321 Zn\n0.333333 0.666667 0.541677 Zn\n0.000000 0.000000 0.916694 Zn\n0.333333 0.666667 0.125005 Zn\n0.000000 0.000000 0.166694 Zn\n0.666667 0.333333 0.041694 Zn\n0.333333 0.666667 0.875005 Zn\n0.666667 0.333333 0.416671 Zn\n0.333333 0.666667 0.625028 Zn\n0.666667 0.333333 0.958321 Zn\n0.333333 0.666667 0.458343 Zn\n0.666667 0.333333 0.583340 Zn\n0.333333 0.666667 0.250005 Zn\n0.000000 0.000000 0.666672 Zn\n0.000000 0.000000 0.500005 Zn\n0.333333 0.666667 0.000005 Zn\n0.333333 0.666667 0.750005 Zn\n0.000000 0.000000 0.947910 S\n0.333333 0.666667 0.489546 S\n0.333333 0.666667 0.406205 S\n0.333333 0.666667 0.656249 S\n0.000000 0.000000 0.697904 S\n0.666667 0.333333 0.447942 S\n0.333333 0.666667 0.031280 S\n0.000000 0.000000 0.531275 S\n0.666667 0.333333 0.989539 S\n0.333333 0.666667 0.781280 S\n0.333333 0.666667 0.572880 S\n0.333333 0.666667 0.906280 S\n0.666667 0.333333 0.739539 S\n0.333333 0.666667 0.281281 S\n0.000000 0.000000 0.364568 S\n0.666667 0.333333 0.072910 S\n0.000000 0.000000 0.114539 S\n0.000000 0.000000 0.864539 S\n0.666667 0.333333 0.822910 S\n0.333333 0.666667 0.156280 S\n0.666667 0.333333 0.239539 S\n0.666667 0.333333 0.614614 S\n0.666667 0.333333 0.322916 S\n0.000000 0.000000 0.197910 S\n",
            "nsites": 48,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 4.003920613035493,
            "density_atomic": 0.049474061866544676,
            "volume": 970.2053599213073,
            "volume_molar": 12.172319257401199,
            "formula_full": "Zn24 S24",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -180.4771699,
            "energy_per_atom": -3.7599410395833335,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -168.4051699,
            "band_gap": 2.0385,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 4.85e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:48.998000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-560588",
            "created_at": "2022-09-04T14:39:14.886141Z",
            "structure_string": "Zn2 S2\n1.0\n1.924139 -3.332706 0.000000\n1.924139 3.332706 0.000000\n0.000000 0.000000 6.317452\nZn S\n2 2\ndirect\n0.333333 0.666667 0.500051 Zn\n0.666667 0.333333 0.000051 Zn\n0.333333 0.666667 0.125949 S\n0.666667 0.333333 0.625949 S\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.995420460900116,
            "density_atomic": 0.04936903055017653,
            "volume": 81.02245386274244,
            "volume_molar": 12.198215547051015,
            "formula_full": "Zn2 S2",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -15.0317524,
            "energy_per_atom": -3.7579381,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -14.0257524,
            "band_gap": 2.0791000000000004,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:39.866000Z",
            "spacegroup": 186
        },
        {
            "id": "mp-556543",
            "created_at": "2022-09-04T14:40:54.689740Z",
            "structure_string": "Zn22 S22\n1.0\n1.926613 -3.336992 0.000000\n1.926613 3.336992 0.000000\n0.000000 0.000000 69.248381\nZn S\n22 22\ndirect\n0.000000 0.000000 0.363601 Zn\n0.000000 0.000000 0.636396 Zn\n0.333333 0.666667 0.818195 Zn\n0.666667 0.333333 0.318169 Zn\n0.666667 0.333333 0.954526 Zn\n0.666667 0.333333 0.045479 Zn\n0.333333 0.666667 0.545468 Zn\n0.333333 0.666667 0.272719 Zn\n0.333333 0.666667 0.136397 Zn\n0.000000 0.000000 0.909093 Zn\n0.666667 0.333333 0.727296 Zn\n0.666667 0.333333 0.590904 Zn\n0.666667 0.333333 0.181821 Zn\n0.333333 0.666667 0.681821 Zn\n0.000000 0.000000 0.090904 Zn\n0.333333 0.666667 0.409095 Zn\n0.000000 0.000000 0.772720 Zn\n0.666667 0.333333 0.454520 Zn\n0.333333 0.666667 0.999995 Zn\n0.000000 0.000000 0.227296 Zn\n0.666667 0.333333 0.863615 Zn\n0.000000 0.000000 0.499999 Zn\n0.666667 0.333333 0.761378 S\n0.666667 0.333333 0.079536 S\n0.000000 0.000000 0.534093 S\n0.333333 0.666667 0.306799 S\n0.666667 0.333333 0.988580 S\n0.666667 0.333333 0.488606 S\n0.000000 0.000000 0.943202 S\n0.000000 0.000000 0.261378 S\n0.000000 0.000000 0.125001 S\n0.333333 0.666667 0.170475 S\n0.000000 0.000000 0.670473 S\n0.000000 0.000000 0.397699 S\n0.666667 0.333333 0.897681 S\n0.666667 0.333333 0.352238 S\n0.333333 0.666667 0.579536 S\n0.666667 0.333333 0.215907 S\n0.333333 0.666667 0.443178 S\n0.333333 0.666667 0.715908 S\n0.333333 0.666667 0.852277 S\n0.333333 0.666667 0.034117 S\n0.000000 0.000000 0.806806 S\n0.666667 0.333333 0.625001 S\n",
            "nsites": 44,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9991831591285445,
            "density_atomic": 0.04941552397073346,
            "volume": 890.4084478808556,
            "volume_molar": 12.186738652344628,
            "formula_full": "Zn22 S22",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -165.46674834,
            "energy_per_atom": -3.760607916818182,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -154.40074834,
            "band_gap": 2.0163,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 1.39e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:34:59.544000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1244922",
            "created_at": "2022-09-04T14:43:13.155226Z",
            "structure_string": "Zn50 S50\n1.0\n14.399522 -0.346912 0.648693\n-0.318847 12.690626 0.032818\n0.586799 0.005081 13.132324\nZn S\n50 50\ndirect\n0.871845 0.604946 0.005379 Zn\n0.359298 0.116877 0.138032 Zn\n0.465570 0.959630 0.817124 Zn\n0.074275 0.842904 0.994783 Zn\n0.334856 0.065330 0.684782 Zn\n0.620314 0.647135 0.959670 Zn\n0.697191 0.982684 0.187102 Zn\n0.515307 0.470923 0.331078 Zn\n0.796288 0.687203 0.704342 Zn\n0.300336 0.809732 0.004102 Zn\n0.503035 0.108841 0.370868 Zn\n0.814295 0.189287 0.991163 Zn\n0.229766 0.412810 0.674465 Zn\n0.755615 0.544331 0.300705 Zn\n0.748223 0.390937 0.816455 Zn\n0.481629 0.284546 0.859807 Zn\n0.408699 0.350053 0.147306 Zn\n0.670829 0.092676 0.752029 Zn\n0.930790 0.088723 0.070379 Zn\n0.546047 0.107033 0.062121 Zn\n0.218548 0.008050 0.464034 Zn\n0.015081 0.886673 0.518185 Zn\n0.641136 0.624114 0.142217 Zn\n0.995522 0.012972 0.283201 Zn\n0.517703 0.664244 0.468272 Zn\n0.991013 0.125910 0.524701 Zn\n0.942597 0.096773 0.874005 Zn\n0.853602 0.395860 0.540093 Zn\n0.062891 0.634057 0.660493 Zn\n0.188709 0.134535 0.727888 Zn\n0.106730 0.400719 0.483773 Zn\n0.570166 0.247940 0.612005 Zn\n0.937712 0.738165 0.201841 Zn\n0.148017 0.192302 0.196568 Zn\n0.631534 0.631516 0.648260 Zn\n0.449891 0.960906 0.174915 Zn\n0.475684 0.665405 0.110511 Zn\n0.120979 0.763867 0.287689 Zn\n0.241085 0.664344 0.443201 Zn\n0.316002 0.242950 0.408264 Zn\n0.157152 0.628244 0.891057 Zn\n0.399825 0.862430 0.561645 Zn\n0.001842 0.349103 0.840684 Zn\n0.019416 0.829751 0.756006 Zn\n0.691186 0.823732 0.655190 Zn\n0.806242 0.858484 0.963264 Zn\n0.874068 0.187429 0.736130 Zn\n0.385840 0.531850 0.854399 Zn\n0.219507 0.309374 0.921651 Zn\n0.941694 0.578969 0.311768 Zn\n0.552830 0.942545 0.956947 S\n0.377474 0.039425 0.499569 S\n0.511967 0.275273 0.025798 S\n0.551449 0.577589 0.809328 S\n0.456599 0.278849 0.314755 S\n0.918351 0.993549 0.437493 S\n0.353474 0.885677 0.734223 S\n0.098996 0.031659 0.603392 S\n0.991922 0.174214 0.206201 S\n0.418419 0.516978 0.210905 S\n0.351778 0.362028 0.806310 S\n0.145323 0.450690 0.837232 S\n0.152300 0.744573 0.756910 S\n0.598244 0.443374 0.882959 S\n0.157151 0.830002 0.442602 S\n0.854885 0.358087 0.932624 S\n0.055205 0.878432 0.187031 S\n0.511215 0.137196 0.754679 S\n0.695261 0.145128 0.112895 S\n0.975949 0.296472 0.574218 S\n0.175340 0.546103 0.565059 S\n0.091064 0.198174 0.863743 S\n0.237604 0.114887 0.310109 S\n0.218116 0.287456 0.544143 S\n0.266493 0.263225 0.085927 S\n0.961585 0.508418 0.749735 S\n0.381042 0.800975 0.145675 S\n0.942749 0.751678 0.623378 S\n0.301416 0.629207 0.963557 S\n0.485773 0.394593 0.608084 S\n0.387238 0.742212 0.430825 S\n0.021921 0.662252 0.027398 S\n0.559995 0.956653 0.290378 S\n0.820460 0.882899 0.135857 S\n0.187133 0.598399 0.283991 S\n0.737220 0.994519 0.611463 S\n0.957360 0.914568 0.893453 S\n0.764522 0.519416 0.123137 S\n0.078041 0.484075 0.322537 S\n0.628942 0.644573 0.318692 S\n0.776926 0.689401 0.894101 S\n0.544132 0.773020 0.610561 S\n0.631956 0.158518 0.469637 S\n0.211701 0.935709 0.962952 S\n0.832445 0.506351 0.688174 S\n0.624469 0.003485 0.521407 S\n0.683075 0.952467 0.870820 S\n0.730988 0.260453 0.692458 S\n0.569667 0.487008 0.501242 S\n0.840800 0.428222 0.373956 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.3812370037428034,
            "density_atomic": 0.041779931441197814,
            "volume": 2393.493635592549,
            "volume_molar": 14.413955581702476,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -334.41368012,
            "energy_per_atom": -3.3441368012,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -309.26368012,
            "band_gap": 0.6751999999999998,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:35:59.928000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1102743",
            "created_at": "2022-09-04T14:45:06.820861Z",
            "structure_string": "Zn4 S8\n1.0\n6.000396 0.000000 0.000000\n0.000000 6.000396 0.000000\n0.000000 0.000000 6.000396\nZn S\n4 8\ndirect\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.100063 0.899937 0.399937 S\n0.899937 0.399937 0.100063 S\n0.399937 0.100063 0.899937 S\n0.600063 0.600063 0.600063 S\n0.899937 0.100063 0.600063 S\n0.100063 0.600063 0.899937 S\n0.600063 0.899937 0.100063 S\n0.399937 0.399937 0.399937 S\n",
            "nsites": 12,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.982629353051161,
            "density_atomic": 0.05554455700739584,
            "volume": 216.04277082275013,
            "volume_molar": 10.841999800625185,
            "formula_full": "Zn4 S8",
            "formula_reduced": "ZnS2",
            "formula_anonymous": "AB2",
            "energy": -46.56300696,
            "energy_per_atom": -3.8802505800000002,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -42.53900696,
            "band_gap": 1.4156000000000004,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:53.505000Z",
            "spacegroup": 205
        },
        {
            "id": "mp-1245199",
            "created_at": "2022-09-04T14:46:54.654058Z",
            "structure_string": "Zn50 S50\n1.0\n12.415737 0.140378 -0.218467\n0.147236 13.169912 0.038263\n-0.198729 0.039143 14.551491\nZn S\n50 50\ndirect\n0.077240 0.083899 0.028330 Zn\n0.645392 0.135467 0.248006 Zn\n0.378547 0.195919 0.229678 Zn\n0.865009 0.699210 0.044501 Zn\n0.266078 0.226030 0.492199 Zn\n0.750940 0.625928 0.828822 Zn\n0.915108 0.519582 0.190479 Zn\n0.231355 0.778465 0.530913 Zn\n0.912940 0.552510 0.704431 Zn\n0.189819 0.454867 0.278116 Zn\n0.438550 0.899885 0.415224 Zn\n0.164986 0.911615 0.199972 Zn\n0.347708 0.723277 0.267869 Zn\n0.809013 0.360276 0.335827 Zn\n0.013850 0.091516 0.798199 Zn\n0.377369 0.545100 0.465719 Zn\n0.818841 0.299451 0.837179 Zn\n0.436477 0.323020 0.643286 Zn\n0.779860 0.275063 0.108079 Zn\n0.782529 0.066387 0.992585 Zn\n0.096277 0.885236 0.429132 Zn\n0.842005 0.775057 0.285222 Zn\n0.446221 0.739378 0.990880 Zn\n0.536597 0.267728 0.898344 Zn\n0.714329 0.973989 0.806441 Zn\n0.723515 0.139061 0.434541 Zn\n0.930065 0.025004 0.246681 Zn\n0.830979 0.518734 0.479232 Zn\n0.182247 0.645011 0.687850 Zn\n0.804144 0.065156 0.693278 Zn\n0.157192 0.198511 0.285043 Zn\n0.663353 0.878967 0.524088 Zn\n0.683320 0.637408 0.469928 Zn\n0.220165 0.314865 0.017902 Zn\n0.069448 0.514097 0.494322 Zn\n0.194449 0.664849 0.053804 Zn\n0.578218 0.351006 0.426337 Zn\n0.981045 0.459960 0.977301 Zn\n0.151866 0.966274 0.578097 Zn\n0.472849 0.064952 0.508409 Zn\n0.208171 0.524773 0.834992 Zn\n0.182910 0.754781 0.833518 Zn\n0.257814 0.468065 0.675311 Zn\n0.013951 0.801765 0.750694 Zn\n0.414715 0.978688 0.135548 Zn\n0.739683 0.797250 0.954568 Zn\n0.317036 0.164159 0.729804 Zn\n0.472603 0.675145 0.669595 Zn\n0.432354 0.510201 0.233712 Zn\n0.613719 0.994115 0.361360 Zn\n0.344514 0.894797 0.007611 S\n0.497561 0.206851 0.756659 S\n0.854730 0.474509 0.848098 S\n0.564230 0.612227 0.808185 S\n0.566984 0.541643 0.128442 S\n0.673835 0.315453 0.232862 S\n0.567458 0.754589 0.874049 S\n0.021806 0.109636 0.473507 S\n0.932675 0.368502 0.106094 S\n0.543471 0.495112 0.992108 S\n0.310397 0.125438 0.354401 S\n0.427795 0.505926 0.618827 S\n0.205117 0.094548 0.837129 S\n0.713285 0.238585 0.953598 S\n0.014068 0.852288 0.286749 S\n0.239361 0.138961 0.973288 S\n0.024222 0.606500 0.065594 S\n0.497633 0.128122 0.133069 S\n0.127494 0.391071 0.900359 S\n0.748188 0.306351 0.475888 S\n0.225202 0.448417 0.430695 S\n0.233163 0.302954 0.644118 S\n0.303515 0.064803 0.592181 S\n0.070236 0.247085 0.420371 S\n0.244132 0.320280 0.179472 S\n0.900111 0.212626 0.723996 S\n0.426051 0.389990 0.962314 S\n0.696565 0.826522 0.369932 S\n0.297239 0.647695 0.925852 S\n0.265945 0.587732 0.196867 S\n0.316081 0.773545 0.681889 S\n0.791243 0.654092 0.186196 S\n0.364370 0.726842 0.429290 S\n0.889461 0.056155 0.400793 S\n0.952868 0.469419 0.342220 S\n0.462566 0.248810 0.500969 S\n0.190946 0.849106 0.048487 S\n0.507357 0.694441 0.141552 S\n0.081083 0.677719 0.554626 S\n0.667706 0.045327 0.563832 S\n0.792060 0.085581 0.152991 S\n0.852412 0.715971 0.727535 S\n0.089841 0.077049 0.184542 S\n0.341778 0.897552 0.259383 S\n0.947016 0.443261 0.591377 S\n0.008571 0.962654 0.679058 S\n0.650001 0.952968 0.950654 S\n0.951063 0.022356 0.935551 S\n0.521712 0.507678 0.371682 S\n0.611262 0.733877 0.584588 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.402578295457802,
            "density_atomic": 0.04204363306984208,
            "volume": 2378.4814179564814,
            "volume_molar": 14.323549893978324,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -334.46731198,
            "energy_per_atom": -3.3446731198,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -309.31731198,
            "band_gap": 1.2531,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:50.912000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-554503",
            "created_at": "2022-09-04T14:43:36.274684Z",
            "structure_string": "Zn28 S28\n1.0\n1.926527 -3.336842 0.000000\n1.926527 3.336842 0.000000\n0.000000 0.000000 88.154727\nZn S\n28 28\ndirect\n0.000000 0.000000 0.071430 Zn\n0.333333 0.666667 0.928578 Zn\n0.333333 0.666667 0.321430 Zn\n0.333333 0.666667 0.678570 Zn\n0.666667 0.333333 0.142860 Zn\n0.666667 0.333333 0.357144 Zn\n0.000000 0.000000 0.392860 Zn\n0.666667 0.333333 0.464290 Zn\n0.666667 0.333333 0.571426 Zn\n0.333333 0.666667 0.214290 Zn\n0.000000 0.000000 0.964287 Zn\n0.666667 0.333333 0.642868 Zn\n0.666667 0.333333 0.785718 Zn\n0.000000 0.000000 0.285716 Zn\n0.000000 0.000000 0.607141 Zn\n0.333333 0.666667 0.535716 Zn\n0.000000 0.000000 0.714288 Zn\n0.000000 0.000000 0.821457 Zn\n0.333333 0.666667 0.107143 Zn\n0.666667 0.333333 0.035716 Zn\n0.666667 0.333333 0.892858 Zn\n0.000000 0.000000 0.178574 Zn\n0.333333 0.666667 0.750011 Zn\n0.000000 0.000000 0.500004 Zn\n0.333333 0.666667 0.857142 Zn\n0.333333 0.666667 0.428574 Zn\n0.666667 0.333333 0.250004 Zn\n0.333333 0.666667 0.000011 Zn\n0.000000 0.000000 0.205355 S\n0.333333 0.666667 0.348210 S\n0.666667 0.333333 0.812508 S\n0.333333 0.666667 0.776783 S\n0.333333 0.666667 0.455355 S\n0.333333 0.666667 0.026783 S\n0.000000 0.000000 0.633947 S\n0.000000 0.000000 0.848227 S\n0.000000 0.000000 0.419640 S\n0.000000 0.000000 0.526786 S\n0.000000 0.000000 0.098208 S\n0.333333 0.666667 0.133925 S\n0.000000 0.000000 0.312496 S\n0.666667 0.333333 0.169640 S\n0.666667 0.333333 0.598190 S\n0.333333 0.666667 0.883906 S\n0.333333 0.666667 0.241070 S\n0.333333 0.666667 0.705335 S\n0.000000 0.000000 0.991090 S\n0.666667 0.333333 0.919661 S\n0.666667 0.333333 0.669639 S\n0.000000 0.000000 0.741091 S\n0.333333 0.666667 0.955334 S\n0.666667 0.333333 0.276786 S\n0.666667 0.333333 0.062496 S\n0.666667 0.333333 0.383926 S\n0.666667 0.333333 0.491070 S\n0.333333 0.666667 0.562496 S\n",
            "nsites": 56,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9986148405230404,
            "density_atomic": 0.049408501596274516,
            "volume": 1133.4081826157321,
            "volume_molar": 12.188470739728077,
            "formula_full": "Zn28 S28",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -210.58598288,
            "energy_per_atom": -3.76046398,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -196.50198288,
            "band_gap": 2.0191,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 1.28e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:15.534000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1245216",
            "created_at": "2022-09-04T14:39:19.392071Z",
            "structure_string": "Zn50 S50\n1.0\n11.860548 -0.095675 -0.412960\n-0.038202 13.708630 -0.121844\n-0.506687 -0.144852 14.083961\nZn S\n50 50\ndirect\n0.306597 0.801444 0.142419 Zn\n0.054352 0.942677 0.949441 Zn\n0.537823 0.011766 0.812780 Zn\n0.180484 0.255398 0.274662 Zn\n0.022213 0.729323 0.254308 Zn\n0.381251 0.413528 0.428707 Zn\n0.136049 0.213698 0.707860 Zn\n0.874934 0.835460 0.938900 Zn\n0.910963 0.560649 0.783587 Zn\n0.111863 0.296679 0.536352 Zn\n0.581675 0.141212 0.584067 Zn\n0.978899 0.977594 0.593198 Zn\n0.258770 0.333469 0.811148 Zn\n0.199428 0.538906 0.554123 Zn\n0.893364 0.503263 0.479494 Zn\n0.599819 0.223413 0.410538 Zn\n0.223162 0.150985 0.084383 Zn\n0.847732 0.090847 0.677985 Zn\n0.343257 0.906529 0.896744 Zn\n0.186017 0.364713 0.122089 Zn\n0.124283 0.715192 0.869517 Zn\n0.612241 0.903958 0.401031 Zn\n0.858899 0.334106 0.646692 Zn\n0.766156 0.028301 0.358926 Zn\n0.166726 0.123914 0.554269 Zn\n0.729974 0.023002 0.533240 Zn\n0.749564 0.845316 0.204453 Zn\n0.601765 0.742692 0.823154 Zn\n0.316903 0.963929 0.636187 Zn\n0.514155 0.086685 0.179755 Zn\n0.661417 0.478824 0.953539 Zn\n0.734340 0.580398 0.648426 Zn\n0.387215 0.210061 0.982409 Zn\n0.864742 0.019591 0.962191 Zn\n0.390196 0.057498 0.413962 Zn\n0.177360 0.207785 0.912239 Zn\n0.902739 0.427056 0.187208 Zn\n0.360926 0.602877 0.945067 Zn\n0.116354 0.508995 0.709029 Zn\n0.757440 0.734413 0.428972 Zn\n0.015447 0.394440 0.822192 Zn\n0.609878 0.457542 0.390478 Zn\n0.377552 0.307874 0.196592 Zn\n0.853593 0.652360 0.057909 Zn\n0.988389 0.126993 0.215888 Zn\n0.599717 0.397139 0.171121 Zn\n0.520910 0.785181 0.608511 Zn\n0.525496 0.860711 0.042200 Zn\n0.264227 0.621034 0.322066 Zn\n0.939596 0.661825 0.642140 Zn\n0.370239 0.109957 0.564421 S\n0.356804 0.837682 0.523552 S\n0.713875 0.015839 0.187245 S\n0.951832 0.750290 0.408382 S\n0.251941 0.607295 0.811224 S\n0.199537 0.354870 0.405014 S\n0.829046 0.091027 0.109603 S\n0.431125 0.705669 0.060295 S\n0.681381 0.789879 0.962575 S\n0.944695 0.231141 0.753888 S\n0.780722 0.439464 0.839571 S\n0.753057 0.380762 0.289799 S\n0.473647 0.017813 0.961810 S\n0.188177 0.530001 0.182115 S\n0.090115 0.768618 0.710552 S\n0.745145 0.231714 0.309173 S\n0.548599 0.351866 0.505152 S\n0.010822 0.295511 0.165549 S\n0.685882 0.848398 0.554034 S\n0.059445 0.016421 0.446902 S\n0.940796 0.113815 0.378250 S\n0.677717 0.193065 0.833056 S\n0.208804 0.773768 0.274388 S\n0.047785 0.106575 0.973254 S\n0.703162 0.412813 0.701383 S\n0.410328 0.894433 0.396072 S\n0.446032 0.168452 0.311936 S\n0.923044 0.345812 0.502746 S\n0.565360 0.647189 0.697934 S\n0.464078 0.463493 0.265933 S\n0.530576 0.243341 0.102519 S\n0.932077 0.833125 0.674874 S\n0.746979 0.052419 0.823835 S\n0.639407 0.768389 0.299251 S\n0.348064 0.578855 0.465734 S\n0.446748 0.341765 0.868922 S\n0.750083 0.515032 0.098001 S\n0.149379 0.378706 0.950729 S\n0.179329 0.090448 0.227540 S\n0.905155 0.800361 0.134474 S\n0.020187 0.633141 0.492691 S\n0.200097 0.840446 0.973716 S\n0.435193 0.875367 0.756477 S\n0.451957 0.925159 0.178536 S\n0.718969 0.576113 0.478087 S\n0.148300 0.026087 0.697954 S\n0.018054 0.567099 0.184257 S\n0.941025 0.672500 0.913741 S\n0.472356 0.457587 0.968655 S\n0.533061 0.168259 0.743300 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.538992931536629,
            "density_atomic": 0.04372922746521883,
            "volume": 2286.800060200871,
            "volume_molar": 13.77143185250612,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -329.37440096999995,
            "energy_per_atom": -3.2937440096999997,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -304.22440097,
            "band_gap": 0.8600999999999999,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:31.990000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-1244890",
            "created_at": "2022-09-04T14:44:59.687000Z",
            "structure_string": "Zn50 S50\n1.0\n12.311392 0.849521 0.332694\n0.828394 15.298600 0.796408\n0.285984 0.781466 13.385105\nZn S\n50 50\ndirect\n0.446879 0.902803 0.836750 Zn\n0.448883 0.252349 0.101036 Zn\n0.669199 0.046606 0.937017 Zn\n0.668535 0.325693 0.935201 Zn\n0.059395 0.329773 0.300818 Zn\n0.759559 0.261263 0.569030 Zn\n0.631699 0.840544 0.601994 Zn\n0.902928 0.968620 0.101374 Zn\n0.315676 0.100303 0.598469 Zn\n0.594245 0.783132 0.883048 Zn\n0.616493 0.458160 0.549231 Zn\n0.655246 0.072163 0.190800 Zn\n0.608356 0.577344 0.022063 Zn\n0.976235 0.027931 0.904226 Zn\n0.235063 0.627238 0.934338 Zn\n0.599123 0.405567 0.289506 Zn\n0.118505 0.975702 0.419459 Zn\n0.102161 0.694875 0.211010 Zn\n0.936259 0.058581 0.378882 Zn\n0.190756 0.007736 0.706929 Zn\n0.895006 0.405089 0.898062 Zn\n0.749771 0.232065 0.756931 Zn\n0.798846 0.366402 0.321335 Zn\n0.628655 0.059694 0.474348 Zn\n0.285868 0.111800 0.937773 Zn\n0.241421 0.762950 0.640637 Zn\n0.916534 0.769334 0.725904 Zn\n0.534197 0.746104 0.146722 Zn\n0.842237 0.979269 0.617666 Zn\n0.495808 0.255034 0.802686 Zn\n0.303391 0.821243 0.306402 Zn\n0.974759 0.437092 0.520744 Zn\n0.083760 0.641071 0.506816 Zn\n0.314951 0.261332 0.334053 Zn\n0.194234 0.228104 0.161339 Zn\n0.446813 0.904712 0.430099 Zn\n0.668045 0.249649 0.324017 Zn\n0.538024 0.531029 0.797123 Zn\n0.178587 0.191731 0.699821 Zn\n0.356545 0.508541 0.560234 Zn\n0.485840 0.585409 0.281264 Zn\n0.413194 0.741182 0.819522 Zn\n0.238900 0.389580 0.562735 Zn\n0.978572 0.554167 0.334386 Zn\n0.932351 0.226065 0.668927 Zn\n0.165533 0.860488 0.947610 Zn\n0.995872 0.632022 0.028241 Zn\n0.783932 0.627872 0.828481 Zn\n0.168187 0.306255 0.907496 Zn\n0.994758 0.842657 0.578370 Zn\n0.625414 0.129651 0.795576 S\n0.079179 0.970713 0.039275 S\n0.407720 0.272426 0.475551 S\n0.837521 0.267641 0.906375 S\n0.065069 0.326846 0.648243 S\n0.133280 0.189799 0.018646 S\n0.306249 0.337351 0.174525 S\n0.668156 0.715000 0.029481 S\n0.826514 0.028642 0.234567 S\n0.714967 0.500466 0.886481 S\n0.514194 0.567047 0.634267 S\n0.450338 0.764115 0.640943 S\n0.543798 0.184356 0.247459 S\n0.439233 0.605358 0.917860 S\n0.220751 0.623667 0.608993 S\n0.761945 0.155902 0.448907 S\n0.404732 0.909468 0.624439 S\n0.315822 0.643064 0.207315 S\n0.221782 0.760280 0.818564 S\n0.716586 0.762842 0.739309 S\n0.131839 0.504052 0.989565 S\n0.604478 0.330249 0.671073 S\n0.032011 0.098736 0.756556 S\n0.156225 0.191180 0.330702 S\n0.345457 0.771632 0.147788 S\n0.279180 0.978410 0.864777 S\n0.491045 0.476048 0.416850 S\n0.922339 0.593440 0.496517 S\n0.492034 0.336120 0.945888 S\n0.798052 0.399941 0.488150 S\n0.073593 0.445216 0.869625 S\n0.947312 0.660320 0.860369 S\n0.581473 0.706859 0.311018 S\n0.921222 0.367218 0.196694 S\n0.138340 0.747167 0.360943 S\n0.109660 0.437744 0.388481 S\n0.550826 0.016826 0.072848 S\n0.825161 0.954650 0.949525 S\n0.305336 0.233579 0.806472 S\n0.448654 0.748035 0.405883 S\n0.539724 0.493033 0.152106 S\n0.530014 0.967542 0.683411 S\n0.295452 0.965530 0.340120 S\n0.405383 0.105458 0.070679 S\n0.632977 0.915275 0.442290 S\n0.133380 0.726222 0.040894 S\n0.159000 0.909437 0.593721 S\n0.016759 0.851505 0.396279 S\n0.473327 0.146818 0.538771 S\n0.933873 0.644471 0.195899 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.2334153750489234,
            "density_atomic": 0.039953387633260035,
            "volume": 2502.9166717455746,
            "volume_molar": 15.072916507802566,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -331.23095126,
            "energy_per_atom": -3.3123095125999997,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -306.08095126,
            "band_gap": 0.8751000000000002,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:47.116000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-557175",
            "created_at": "2022-09-04T14:41:37.284140Z",
            "structure_string": "Zn18 S18\n1.0\n1.927007 -3.337674 0.000000\n1.927007 3.337674 0.000000\n0.000000 0.000000 56.689884\nZn S\n18 18\ndirect\n0.000000 0.000000 0.166668 Zn\n0.333333 0.666667 0.722218 Zn\n0.666667 0.333333 0.277777 Zn\n0.000000 0.000000 0.444461 Zn\n0.333333 0.666667 0.555556 Zn\n0.000000 0.000000 0.666667 Zn\n0.333333 0.666667 0.055561 Zn\n0.666667 0.333333 0.611123 Zn\n0.666667 0.333333 0.111113 Zn\n0.333333 0.666667 0.222223 Zn\n0.666667 0.333333 0.777776 Zn\n0.666667 0.333333 0.944439 Zn\n0.333333 0.666667 0.388896 Zn\n0.000000 0.000000 0.333326 Zn\n0.333333 0.666667 0.833345 Zn\n0.000000 0.000000 0.000013 Zn\n0.666667 0.333333 0.499996 Zn\n0.000000 0.000000 0.888886 Zn\n0.666667 0.333333 0.986143 S\n0.333333 0.666667 0.430602 S\n0.000000 0.000000 0.041669 S\n0.666667 0.333333 0.652776 S\n0.666667 0.333333 0.152779 S\n0.333333 0.666667 0.097228 S\n0.333333 0.666667 0.763855 S\n0.000000 0.000000 0.708330 S\n0.666667 0.333333 0.819480 S\n0.000000 0.000000 0.374967 S\n0.666667 0.333333 0.319440 S\n0.000000 0.000000 0.930522 S\n0.000000 0.000000 0.486108 S\n0.333333 0.666667 0.263890 S\n0.666667 0.333333 0.541634 S\n0.000000 0.000000 0.208331 S\n0.333333 0.666667 0.874996 S\n0.333333 0.666667 0.597257 S\n",
            "nsites": 36,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.995283659581207,
            "density_atomic": 0.04936734017777177,
            "volume": 729.2270531562773,
            "volume_molar": 12.198633222519732,
            "formula_full": "Zn18 S18",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -135.36832887,
            "energy_per_atom": -3.7602313575,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -126.31432887,
            "band_gap": 2.0281,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 1.71e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:35:29.699000Z",
            "spacegroup": 156
        },
        {
            "id": "mp-1245136",
            "created_at": "2022-09-04T14:40:14.725989Z",
            "structure_string": "Zn50 S50\n1.0\n13.923851 -0.358363 0.471870\n-0.437071 13.015052 0.539493\n0.493992 0.556074 13.178226\nZn S\n50 50\ndirect\n0.350620 0.392414 0.115478 Zn\n0.514781 0.342783 0.524600 Zn\n0.636280 0.315243 0.368056 Zn\n0.931539 0.967667 0.966483 Zn\n0.546715 0.162985 0.492606 Zn\n0.575353 0.552766 0.174849 Zn\n0.742735 0.896423 0.078680 Zn\n0.861406 0.325558 0.426491 Zn\n0.883005 0.926541 0.729605 Zn\n0.156555 0.801904 0.079412 Zn\n0.364558 0.076512 0.152944 Zn\n0.035718 0.314507 0.946473 Zn\n0.228260 0.540526 0.626841 Zn\n0.903450 0.756355 0.137867 Zn\n0.689625 0.509773 0.624524 Zn\n0.597065 0.379691 0.016070 Zn\n0.489264 0.804026 0.158422 Zn\n0.007758 0.071084 0.764016 Zn\n0.030160 0.320769 0.230927 Zn\n0.340216 0.650346 0.845807 Zn\n0.154239 0.986794 0.294331 Zn\n0.210664 0.770982 0.819750 Zn\n0.749732 0.477052 0.849578 Zn\n0.026305 0.108528 0.465440 Zn\n0.728353 0.553978 0.390823 Zn\n0.028669 0.663701 0.214548 Zn\n0.818158 0.089572 0.780778 Zn\n0.148653 0.431350 0.291483 Zn\n0.438793 0.499475 0.562115 Zn\n0.452206 0.212086 0.915918 Zn\n0.857961 0.881320 0.360851 Zn\n0.374477 0.302236 0.687258 Zn\n0.781688 0.119308 0.359641 Zn\n0.190109 0.078407 0.983639 Zn\n0.637756 0.764044 0.849732 Zn\n0.494413 0.943254 0.907786 Zn\n0.764947 0.736977 0.578455 Zn\n0.171445 0.695184 0.438867 Zn\n0.235317 0.412283 0.896733 Zn\n0.276658 0.190948 0.257809 Zn\n0.980699 0.680152 0.688533 Zn\n0.360487 0.902571 0.387011 Zn\n0.978951 0.292500 0.666051 Zn\n0.146947 0.929683 0.603838 Zn\n0.419992 0.894607 0.693111 Zn\n0.817235 0.375103 0.122741 Zn\n0.940312 0.503899 0.538629 Zn\n0.198401 0.652835 0.998742 Zn\n0.294913 0.138116 0.641207 Zn\n0.334386 0.560471 0.324641 Zn\n0.370758 0.053385 0.970250 S\n0.628348 0.144283 0.333612 S\n0.690239 0.460503 0.247293 S\n0.259912 0.926704 0.725150 S\n0.316866 0.382034 0.289110 S\n0.809110 0.066760 0.039699 S\n0.395755 0.069642 0.498861 S\n0.196959 0.877027 0.432364 S\n0.715900 0.084295 0.921751 S\n0.729070 0.390279 0.499252 S\n0.088697 0.472705 0.836290 S\n0.849141 0.543968 0.692785 S\n0.043548 0.719309 0.839713 S\n0.327075 0.471024 0.739215 S\n0.087128 0.598169 0.576515 S\n0.980137 0.402471 0.080257 S\n0.130624 0.957526 0.132886 S\n0.465244 0.279367 0.072191 S\n0.590668 0.851072 0.014864 S\n0.730504 0.171038 0.654612 S\n0.644380 0.642088 0.511273 S\n0.948764 0.231676 0.822650 S\n0.110985 0.153399 0.313521 S\n0.111519 0.109219 0.609653 S\n0.186397 0.256425 0.992478 S\n0.003329 0.343949 0.503856 S\n0.475171 0.651583 0.255574 S\n0.739627 0.833953 0.710798 S\n0.309511 0.524425 0.001985 S\n0.334156 0.618112 0.491297 S\n0.895651 0.603417 0.390338 S\n0.854705 0.805705 0.980223 S\n0.472983 0.774591 0.813414 S\n0.084403 0.987001 0.891989 S\n0.911933 0.741459 0.465990 S\n0.874569 0.020134 0.454479 S\n0.992684 0.851725 0.625579 S\n0.775174 0.814722 0.240761 S\n0.174092 0.620532 0.285765 S\n0.588917 0.448600 0.772534 S\n0.562751 0.553178 0.000041 S\n0.459810 0.926433 0.518310 S\n0.624291 0.063923 0.632369 S\n0.044353 0.582727 0.933059 S\n0.696873 0.619575 0.938145 S\n0.442051 0.943286 0.235077 S\n0.506466 0.055496 0.749154 S\n0.746805 0.340861 0.974354 S\n0.533538 0.294270 0.762429 S\n0.865404 0.263682 0.271801 S\n",
            "nsites": 100,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.4023111105436876,
            "density_atomic": 0.042040331625021306,
            "volume": 2378.6682010967443,
            "volume_molar": 14.32467472834058,
            "formula_full": "Zn50 S50",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -331.72396258,
            "energy_per_atom": -3.3172396257999996,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -306.57396258,
            "band_gap": 1.0427,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:34:53.361000Z",
            "spacegroup": 1
        },
        {
            "id": "mp-554681",
            "created_at": "2022-09-04T14:48:20.698496Z",
            "structure_string": "Zn28 S28\n1.0\n1.926569 -3.336915 0.000000\n1.926569 3.336915 0.000000\n0.000000 0.000000 88.144620\nZn S\n28 28\ndirect\n0.000000 0.000000 0.071430 Zn\n0.333333 0.666667 0.321430 Zn\n0.333333 0.666667 0.214291 Zn\n0.666667 0.333333 0.142861 Zn\n0.666667 0.333333 0.357143 Zn\n0.000000 0.000000 0.392860 Zn\n0.666667 0.333333 0.464291 Zn\n0.333333 0.666667 0.642860 Zn\n0.000000 0.000000 0.785719 Zn\n0.666667 0.333333 0.571431 Zn\n0.333333 0.666667 0.535714 Zn\n0.666667 0.333333 0.892865 Zn\n0.666667 0.333333 0.821430 Zn\n0.666667 0.333333 0.964295 Zn\n0.000000 0.000000 0.285714 Zn\n0.000000 0.000000 0.607143 Zn\n0.666667 0.333333 0.678573 Zn\n0.000000 0.000000 0.714291 Zn\n0.333333 0.666667 0.107143 Zn\n0.000000 0.000000 0.928570 Zn\n0.666667 0.333333 0.035718 Zn\n0.000000 0.000000 0.178573 Zn\n0.333333 0.666667 0.000000 Zn\n0.000000 0.000000 0.500003 Zn\n0.333333 0.666667 0.857140 Zn\n0.333333 0.666667 0.428573 Zn\n0.666667 0.333333 0.250003 Zn\n0.333333 0.666667 0.750000 Zn\n0.000000 0.000000 0.205357 S\n0.666667 0.333333 0.848194 S\n0.333333 0.666667 0.776800 S\n0.666667 0.333333 0.991054 S\n0.666667 0.333333 0.705357 S\n0.333333 0.666667 0.455357 S\n0.000000 0.000000 0.633927 S\n0.333333 0.666667 0.026800 S\n0.333333 0.666667 0.348210 S\n0.333333 0.666667 0.883941 S\n0.000000 0.000000 0.419640 S\n0.000000 0.000000 0.098208 S\n0.333333 0.666667 0.133927 S\n0.000000 0.000000 0.312497 S\n0.000000 0.000000 0.526787 S\n0.666667 0.333333 0.169640 S\n0.333333 0.666667 0.669640 S\n0.666667 0.333333 0.598208 S\n0.333333 0.666667 0.241070 S\n0.000000 0.000000 0.741056 S\n0.000000 0.000000 0.812496 S\n0.666667 0.333333 0.919625 S\n0.000000 0.000000 0.955371 S\n0.666667 0.333333 0.383927 S\n0.666667 0.333333 0.276787 S\n0.666667 0.333333 0.062496 S\n0.666667 0.333333 0.491070 S\n0.333333 0.666667 0.562497 S\n",
            "nsites": 56,
            "nelements": 2,
            "elements": [
                "Zn",
                "S"
            ],
            "chemical_system": "S-Zn",
            "density": 3.9988986717818142,
            "density_atomic": 0.04941200873005997,
            "volume": 1133.3277362984882,
            "volume_molar": 12.187605634288673,
            "formula_full": "Zn28 S28",
            "formula_reduced": "ZnS",
            "formula_anonymous": "AB",
            "energy": -210.58586554,
            "energy_per_atom": -3.760461884642857,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -196.50186554,
            "band_gap": 2.0164,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 1.44e-05,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:39:32.107000Z",
            "spacegroup": 156
        }
    ]
}