GET /third-parties/JarvisStructure/?format=api&ordering=-nsites&page=2
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=3",
    "previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites",
    "results": [
        {
            "id": "jvasp-97928",
            "created_at": "2022-09-04T14:35:51.443436Z",
            "updated_at": "2022-09-04T14:35:51.443461Z",
            "structure_string": "Sr12 Pr8 B16 O48\n1.0\n7.325294 0.000000 0.000000\n0.000000 8.852617 0.000000\n0.000000 0.000000 16.712575\nSr Pr B O\n12 8 16 48\ndirect\n0.695510 0.648779 0.675389 Sr\n0.680419 0.651649 0.427481 Sr\n0.180419 0.848351 0.427481 Sr\n0.819580 0.151649 0.927481 Sr\n0.038400 0.327491 0.721831 Sr\n0.961600 0.672509 0.221831 Sr\n0.461600 0.827491 0.221831 Sr\n0.195510 0.851221 0.675389 Sr\n0.804490 0.148779 0.175390 Sr\n0.319580 0.348351 0.927481 Sr\n0.304490 0.351221 0.175390 Sr\n0.538400 0.172509 0.721831 Sr\n0.819118 0.035142 0.554723 Pr\n0.968264 0.671483 0.883862 Pr\n0.468265 0.828517 0.883862 Pr\n0.531735 0.171483 0.383862 Pr\n0.319118 0.464858 0.554723 Pr\n0.680881 0.535142 0.054723 Pr\n0.031735 0.328517 0.383862 Pr\n0.180882 0.964858 0.054723 Pr\n0.159631 0.061276 0.261257 B\n0.840369 0.938725 0.761257 B\n0.340369 0.561276 0.761257 B\n0.659630 0.438725 0.261257 B\n0.171614 0.049279 0.845396 B\n0.828386 0.950721 0.345396 B\n0.671613 0.450721 0.845396 B\n0.227143 0.141870 0.552387 B\n0.328386 0.549279 0.345396 B\n0.272857 0.641870 0.052387 B\n0.727142 0.358130 0.552387 B\n0.513558 0.129603 0.049324 B\n0.486442 0.870397 0.549323 B\n0.986442 0.629604 0.549323 B\n0.013558 0.370397 0.049324 B\n0.772857 0.858130 0.052387 B\n0.209857 0.529125 0.819133 O\n0.419777 0.704405 0.760110 O\n0.580222 0.295595 0.260110 O\n0.709857 0.970875 0.819133 O\n0.290142 0.029125 0.319134 O\n0.790142 0.470875 0.319134 O\n0.858112 0.995594 0.052236 O\n0.271825 0.216840 0.621606 O\n0.641887 0.495594 0.552236 O\n0.358113 0.504407 0.052236 O\n0.741950 0.781914 0.980536 O\n0.241951 0.718086 0.980536 O\n0.808570 0.490844 0.792495 O\n0.919777 0.795595 0.760110 O\n0.141887 0.004406 0.552236 O\n0.614302 0.261651 0.046244 O\n0.080222 0.204405 0.260110 O\n0.611036 0.540925 0.202746 O\n0.728175 0.783160 0.121606 O\n0.228175 0.716840 0.121606 O\n0.771824 0.283160 0.621606 O\n0.459282 0.055945 0.978678 O\n0.540717 0.944056 0.478679 O\n0.040717 0.555945 0.478679 O\n0.959282 0.444056 0.978678 O\n0.451899 0.072371 0.121920 O\n0.548100 0.927629 0.621920 O\n0.048101 0.572371 0.621920 O\n0.951899 0.427629 0.121920 O\n0.114302 0.238349 0.046244 O\n0.885697 0.761652 0.546244 O\n0.388964 0.459076 0.702746 O\n0.385697 0.738349 0.546244 O\n0.113576 0.939839 0.900618 O\n0.613576 0.560162 0.900618 O\n0.386423 0.439839 0.400618 O\n0.102020 0.193218 0.848025 O\n0.258049 0.218086 0.480536 O\n0.397980 0.693219 0.348025 O\n0.602020 0.306782 0.848025 O\n0.691430 0.990844 0.292495 O\n0.308570 0.009156 0.792495 O\n0.758049 0.281914 0.480536 O\n0.191430 0.509156 0.292495 O\n0.888964 0.040925 0.702746 O\n0.111036 0.959076 0.202746 O\n0.886423 0.060162 0.400618 O\n0.897979 0.806782 0.348025 O\n",
            "nsites": 84,
            "nelements": 4,
            "elements": [
                "Sr",
                "Pr",
                "B",
                "O"
            ],
            "chemical_system": "B-O-Pr-Sr",
            "density": 4.779854126160161,
            "density_atomic": 0.0775066884805308,
            "volume": 1083.7774345255414,
            "volume_molar": 7.769833646695827,
            "formula_full": "Sr12 Pr8 B16 O48",
            "formula_reduced": "Sr3Pr2(BO3)4",
            "formula_anonymous": "A2B3C4D12",
            "energy_above_hull": 2.777697664920635,
            "spacegroup": 33
        },
        {
            "id": "jvasp-98636",
            "created_at": "2022-09-04T14:36:17.952139Z",
            "updated_at": "2022-09-04T14:36:17.952152Z",
            "structure_string": "Na8 Te4 H40 O32\n1.0\n6.677936 3.678778 -0.847417\n-6.677936 3.678778 0.847417\n0.104157 0.000000 17.021862\nNa Te H O\n8 4 40 32\ndirect\n0.469051 0.564037 0.575156 Na\n0.564037 0.469051 0.924844 Na\n0.530950 0.435963 0.424844 Na\n0.435963 0.530949 0.075156 Na\n0.516372 0.516371 0.750000 Na\n0.483629 0.483629 0.250000 Na\n0.000000 0.500000 0.500000 Na\n0.500000 -0.000000 -0.000000 Na\n0.147325 0.825570 0.183255 Te\n0.825570 0.147325 0.316745 Te\n0.852676 0.174430 0.816745 Te\n0.174431 0.852675 0.683255 Te\n0.875270 0.768186 0.342713 H\n0.768186 0.875270 0.157287 H\n0.832045 0.843293 0.455188 H\n0.843293 0.832045 0.044812 H\n0.167956 0.156707 0.544812 H\n0.156707 0.167955 0.955188 H\n0.874138 0.805236 0.545536 H\n0.125863 0.194764 0.454464 H\n0.588076 0.911045 0.655866 H\n0.795906 0.901209 0.655619 H\n0.901209 0.795906 0.844381 H\n0.204095 0.098791 0.344381 H\n0.098791 0.204095 0.155619 H\n0.231814 0.124730 0.842713 H\n0.911045 0.588076 0.844134 H\n0.411924 0.088956 0.344134 H\n0.088956 0.411924 0.155866 H\n0.194764 0.125862 0.045536 H\n0.124730 0.231814 0.657287 H\n0.805236 0.874138 0.954463 H\n0.877771 0.556792 0.340050 H\n0.556792 0.877770 0.159950 H\n0.774418 0.469308 0.646701 H\n0.469309 0.774418 0.853299 H\n0.530692 0.225583 0.146701 H\n0.554886 0.253250 0.647318 H\n0.253251 0.554886 0.852682 H\n0.445115 0.746750 0.352682 H\n0.746750 0.445115 0.147318 H\n0.432964 0.840471 0.458918 H\n0.225583 0.530692 0.353299 H\n0.567037 0.159529 0.541082 H\n0.159530 0.567036 0.958918 H\n0.366013 0.851294 0.543598 H\n0.851295 0.366013 0.956402 H\n0.633988 0.148706 0.456402 H\n0.148706 0.633987 0.043598 H\n0.122230 0.443208 0.659950 H\n0.840471 0.432964 0.041082 H\n0.443209 0.122230 0.840050 H\n0.755959 0.341671 0.997728 O\n0.733545 0.780757 0.000942 O\n0.219244 0.266456 0.500942 O\n0.266456 0.219244 0.999058 O\n0.651973 0.828592 0.673527 O\n0.828593 0.651973 0.826473 O\n0.348027 0.171408 0.326473 O\n0.376772 0.595943 0.345760 O\n0.623228 0.404057 0.654240 O\n0.404058 0.623228 0.845759 O\n0.595943 0.376772 0.154240 O\n0.341671 0.755959 0.502272 O\n0.780757 0.733544 0.499058 O\n0.171408 0.348027 0.173527 O\n0.622331 0.794257 0.172598 O\n0.992655 0.420561 0.874260 O\n0.377670 0.205743 0.827402 O\n0.205743 0.377669 0.672597 O\n0.402497 0.968547 0.134035 O\n0.968547 0.402497 0.365965 O\n0.597503 0.031454 0.865965 O\n0.031454 0.597503 0.634035 O\n0.007345 0.579440 0.125740 O\n0.579440 0.007345 0.374260 O\n0.420561 0.992655 0.625740 O\n0.023792 0.962446 0.125514 O\n0.962447 0.023792 0.374486 O\n0.976208 0.037554 0.874486 O\n0.037554 0.976208 0.625514 O\n0.658329 0.244042 0.497728 O\n0.794258 0.622331 0.327402 O\n0.244042 0.658329 0.002272 O\n",
            "nsites": 84,
            "nelements": 4,
            "elements": [
                "Na",
                "Te",
                "H",
                "O"
            ],
            "chemical_system": "H-Na-O-Te",
            "density": 2.4732157201082825,
            "density_atomic": 0.10035968675928437,
            "volume": 836.9894597367212,
            "volume_molar": 6.000557549012961,
            "formula_full": "Na8 Te4 H40 O32",
            "formula_reduced": "Na2Te(H5O4)2",
            "formula_anonymous": "AB2C8D10",
            "energy_above_hull": 2.6292777984126987,
            "spacegroup": 15
        },
        {
            "id": "jvasp-98428",
            "created_at": "2022-09-04T14:36:17.712939Z",
            "updated_at": "2022-09-04T14:36:17.712971Z",
            "structure_string": "Na6 B12 H30 O36\n1.0\n5.580659 3.221994 6.984681\n-5.580659 3.221994 6.984681\n0.000000 -6.443989 6.984681\nNa B H O\n6 12 30 36\ndirect\n0.500000 0.167410 0.832590 Na\n0.832589 0.500000 0.167411 Na\n0.167410 0.832590 0.500000 Na\n0.500000 0.500000 0.500000 Na\n0.917889 0.917889 0.917891 Na\n0.082110 0.082110 0.082110 Na\n0.525857 0.106659 0.230745 B\n0.230745 0.525856 0.106660 B\n0.769254 0.893340 0.474144 B\n0.893340 0.474143 0.769256 B\n0.474143 0.769255 0.893341 B\n0.106659 0.230745 0.525857 B\n0.118021 0.480580 0.550055 B\n0.550054 0.118021 0.480580 B\n0.881978 0.449945 0.519421 B\n0.449945 0.519420 0.881979 B\n0.519420 0.881978 0.449946 B\n0.480579 0.550054 0.118022 B\n0.237869 0.351192 0.941501 H\n0.830467 0.168877 0.681029 H\n0.681028 0.830467 0.168878 H\n0.168877 0.681028 0.830468 H\n0.318971 0.831122 0.169533 H\n0.831122 0.169532 0.318972 H\n0.843562 0.263382 0.981133 H\n0.263382 0.981132 0.843563 H\n0.736618 0.156437 0.018868 H\n0.156437 0.018868 0.736618 H\n0.018867 0.736618 0.156438 H\n0.941501 0.237869 0.351192 H\n0.981132 0.843562 0.263383 H\n0.351192 0.941501 0.237870 H\n0.169533 0.318971 0.831122 H\n0.648808 0.762130 0.058500 H\n0.058499 0.648808 0.762131 H\n0.431084 0.731921 0.621573 H\n0.621572 0.431084 0.731922 H\n0.731921 0.621572 0.431085 H\n0.378427 0.268079 0.568916 H\n0.568916 0.378427 0.268079 H\n0.268079 0.568916 0.378428 H\n0.714230 0.474460 0.945559 H\n0.945558 0.714230 0.474461 H\n0.285769 0.054442 0.525539 H\n0.054442 0.525539 0.285769 H\n0.525539 0.285769 0.054442 H\n0.762130 0.058499 0.648808 H\n0.474460 0.945558 0.714232 H\n0.233352 0.567156 0.488730 O\n0.174279 0.079109 0.523318 O\n0.567156 0.488729 0.233353 O\n0.476681 0.920890 0.825722 O\n0.825721 0.476681 0.920891 O\n0.920890 0.825721 0.476682 O\n0.079109 0.523318 0.174279 O\n0.222067 0.265405 0.914133 O\n0.777932 0.085867 0.734596 O\n0.734595 0.777932 0.085868 O\n0.085867 0.734595 0.777933 O\n0.265404 0.914132 0.222068 O\n0.914132 0.222067 0.265405 O\n0.488729 0.233352 0.567156 O\n-0.000000 0.844571 0.155429 O\n0.523318 0.174279 0.079110 O\n0.766647 0.511270 0.432845 O\n0.814278 0.449995 0.683944 O\n0.432844 0.766647 0.511271 O\n0.155428 -0.000000 0.844572 O\n-0.000000 0.539615 0.460386 O\n0.460385 -0.000000 0.539615 O\n0.539614 0.460385 0.000000 O\n0.711905 0.041067 0.491459 O\n0.491458 0.711905 0.041068 O\n0.041068 0.491458 0.711905 O\n0.508541 0.958932 0.288096 O\n0.958932 0.288095 0.508542 O\n0.288095 0.508541 0.958933 O\n0.449995 0.683943 0.814279 O\n0.683943 0.814278 0.449996 O\n0.185722 0.316057 0.550005 O\n0.316056 0.550004 0.185722 O\n0.550004 0.185722 0.316057 O\n0.511270 0.432844 0.766648 O\n0.844571 0.155428 0.000000 O\n",
            "nsites": 84,
            "nelements": 4,
            "elements": [
                "Na",
                "B",
                "H",
                "O"
            ],
            "chemical_system": "B-H-Na-O",
            "density": 1.9257344446415905,
            "density_atomic": 0.11147338807418554,
            "volume": 753.5430783183696,
            "volume_molar": 5.402312483758244,
            "formula_full": "Na6 B12 H30 O36",
            "formula_reduced": "NaB2H5O6",
            "formula_anonymous": "AB2C5D6",
            "energy_above_hull": 3.0176710833333336,
            "spacegroup": 155
        },
        {
            "id": "jvasp-91424",
            "created_at": "2022-09-04T14:36:02.362516Z",
            "updated_at": "2022-09-04T14:36:02.362541Z",
            "structure_string": "Ca12 Nb16 O48 F8\n1.0\n10.562804 -0.000000 -0.000000\n0.000000 10.562804 -0.000000\n-0.000000 -0.000000 10.562804\nCa Nb O F\n12 16 48 8\ndirect\n0.875000 0.864650 0.614651 Ca\n0.385349 0.375000 0.635349 Ca\n0.135349 0.114651 0.625000 Ca\n0.114651 0.625000 0.135349 Ca\n0.625000 0.135349 0.114651 Ca\n0.364651 0.885349 0.125000 Ca\n0.614651 0.875000 0.864650 Ca\n0.375000 0.635349 0.385349 Ca\n0.864650 0.614651 0.875000 Ca\n0.635349 0.385349 0.375000 Ca\n0.885349 0.125000 0.364651 Ca\n0.125000 0.364651 0.885349 Ca\n0.125000 0.623592 0.626408 Nb\n0.125000 0.125000 0.125000 Nb\n0.625000 0.876407 0.373592 Nb\n0.376408 0.126408 0.375000 Nb\n0.623592 0.626408 0.125000 Nb\n0.625000 0.375000 0.875000 Nb\n0.123592 0.873592 0.875000 Nb\n0.876407 0.373592 0.625000 Nb\n0.375000 0.875000 0.625000 Nb\n0.375000 0.376408 0.126408 Nb\n0.626408 0.125000 0.623592 Nb\n0.875000 0.625000 0.375000 Nb\n0.373592 0.625000 0.876407 Nb\n0.873592 0.875000 0.123592 Nb\n0.875000 0.123592 0.873592 Nb\n0.126408 0.375000 0.376408 Nb\n0.489535 0.491667 0.811803 O\n0.258333 0.739535 0.561803 O\n0.561803 0.258333 0.739535 O\n0.188196 0.989535 0.008333 O\n0.244559 0.747753 0.948749 O\n0.744559 0.752246 0.051250 O\n0.752246 0.051250 0.744559 O\n0.239535 0.938196 0.741667 O\n0.997753 0.994559 0.801250 O\n0.198749 0.497753 0.505440 O\n0.448749 0.255440 0.252247 O\n0.551250 0.755440 0.247753 O\n0.755440 0.247753 0.551250 O\n0.010465 0.508333 0.311804 O\n0.948749 0.244559 0.747753 O\n0.260465 0.061804 0.241667 O\n0.747753 0.948749 0.244559 O\n0.510465 0.991667 0.688196 O\n0.508333 0.311804 0.010465 O\n0.811803 0.489535 0.491667 O\n0.008333 0.188196 0.989535 O\n0.698749 0.002247 0.494559 O\n0.760465 0.438196 0.758332 O\n0.438196 0.758332 0.760465 O\n0.688196 0.510465 0.991667 O\n0.247753 0.551250 0.755440 O\n0.002247 0.494559 0.698749 O\n0.311804 0.010465 0.508333 O\n0.491667 0.811803 0.489535 O\n0.252247 0.448749 0.255440 O\n0.061804 0.241667 0.260465 O\n0.989535 0.008333 0.188196 O\n0.051250 0.744559 0.752246 O\n0.505440 0.198749 0.497753 O\n0.991667 0.688196 0.510465 O\n0.741667 0.239535 0.938196 O\n0.494559 0.698749 0.002247 O\n0.739535 0.561803 0.258333 O\n0.502246 0.005440 0.301250 O\n0.938196 0.741667 0.239535 O\n0.005440 0.301250 0.502246 O\n0.301250 0.502246 0.005440 O\n0.758332 0.760465 0.438196 O\n0.255440 0.252247 0.448749 O\n0.801250 0.997753 0.994559 O\n0.497753 0.505440 0.198749 O\n0.994559 0.801250 0.997753 O\n0.241667 0.260465 0.061804 O\n0.239243 0.260756 0.739243 F\n0.510756 0.989243 0.010757 F\n0.010757 0.510756 0.989243 F\n0.489243 0.489243 0.489243 F\n0.260756 0.739243 0.239243 F\n0.739243 0.239243 0.260756 F\n0.989243 0.010757 0.510756 F\n0.760756 0.760756 0.760756 F\n",
            "nsites": 84,
            "nelements": 4,
            "elements": [
                "Ca",
                "Nb",
                "O",
                "F"
            ],
            "chemical_system": "Ca-F-Nb-O",
            "density": 4.06834580425725,
            "density_atomic": 0.07127572152219276,
            "volume": 1178.5219175065852,
            "volume_molar": 8.44907723329734,
            "formula_full": "Ca12 Nb16 O48 F8",
            "formula_reduced": "Ca3Nb4(O6F)2",
            "formula_anonymous": "A2B3C4D12",
            "energy_above_hull": 2.826801496428572,
            "spacegroup": 212
        },
        {
            "id": "jvasp-97956",
            "created_at": "2022-09-04T14:35:49.040641Z",
            "updated_at": "2022-09-04T14:35:49.040669Z",
            "structure_string": "B4 H40 C8 N20 O12\n1.0\n6.633291 0.000000 0.000000\n0.000000 9.531681 0.000000\n0.000000 0.000000 10.713247\nB H C N O\n4 40 8 20 12\ndirect\n0.856819 0.059718 0.938117 B\n0.643181 0.940282 0.438117 B\n0.356819 0.440282 0.061883 B\n0.143181 0.559718 0.561883 B\n0.406397 0.965786 0.119934 H\n0.093602 0.034214 0.619934 H\n0.845495 0.366488 0.269436 H\n0.654505 0.633511 0.769436 H\n0.345495 0.133512 0.730564 H\n0.154505 0.866488 0.230564 H\n0.838612 0.185360 0.303667 H\n0.661388 0.814640 0.803667 H\n0.161388 0.685360 0.196333 H\n0.593602 0.465786 0.380066 H\n0.445826 0.204640 0.424347 H\n0.054174 0.795359 0.924347 H\n0.945825 0.295359 0.575654 H\n0.554174 0.704640 0.075653 H\n0.366871 0.350898 0.481968 H\n0.866870 0.149102 0.518033 H\n0.633129 0.850898 0.018033 H\n0.338612 0.314640 0.696333 H\n0.906397 0.534214 0.880066 H\n0.133129 0.649102 0.981968 H\n0.399744 0.067516 0.252062 H\n0.100256 0.932484 0.752062 H\n0.866561 0.193721 0.768029 H\n0.366561 0.306279 0.231971 H\n0.133439 0.693721 0.731972 H\n0.839409 0.030704 0.144766 H\n0.660591 0.969296 0.644766 H\n0.339409 0.469296 0.855234 H\n0.160591 0.530704 0.355234 H\n0.160258 0.024674 0.934818 H\n0.633439 0.806279 0.268029 H\n0.660258 0.475326 0.065183 H\n0.839742 0.524674 0.565183 H\n0.557070 0.027752 0.912151 H\n0.942930 0.972248 0.412151 H\n0.057070 0.472248 0.087849 H\n0.442930 0.527752 0.587849 H\n0.600256 0.567516 0.247938 H\n0.899744 0.432484 0.747938 H\n0.339742 0.975326 0.434817 H\n0.146403 0.738012 0.382539 C\n0.353597 0.261988 0.882540 C\n0.646403 0.761988 0.617461 C\n0.853597 0.238012 0.117461 C\n0.362120 0.173939 0.086099 C\n0.637880 0.673939 0.413901 C\n0.862120 0.326061 0.913901 C\n0.137880 0.826061 0.586100 C\n0.156148 0.605674 0.423167 N\n0.359372 0.234514 0.759317 N\n0.140628 0.765486 0.259316 N\n0.640628 0.734514 0.740684 N\n0.859372 0.265486 0.240684 N\n0.141062 0.941867 0.659686 N\n0.358938 0.058132 0.159686 N\n0.641062 0.558132 0.340314 N\n0.858938 0.441868 0.840314 N\n0.343852 0.394326 0.923167 N\n0.636780 0.801654 0.364131 N\n0.843852 0.105674 0.076833 N\n0.139967 0.850056 0.460834 N\n0.360033 0.149944 0.960834 N\n0.639967 0.649944 0.539166 N\n0.860033 0.350056 0.039166 N\n0.136780 0.698346 0.635870 N\n0.363220 0.301654 0.135869 N\n0.863220 0.198346 0.864131 N\n0.656148 0.894326 0.576833 N\n0.073822 0.693501 0.906627 O\n0.426178 0.306499 0.406627 O\n0.316507 0.473050 0.600751 O\n0.183493 0.526950 0.100750 O\n0.816507 0.026950 0.399250 O\n0.465306 0.028678 0.416312 O\n0.965305 0.471322 0.583689 O\n0.534694 0.528678 0.083689 O\n0.034694 0.971322 0.916312 O\n0.926178 0.193501 0.593373 O\n0.683493 0.973050 0.899250 O\n0.573822 0.806498 0.093373 O\n",
            "nsites": 84,
            "nelements": 5,
            "elements": [
                "B",
                "H",
                "C",
                "N",
                "O"
            ],
            "chemical_system": "B-C-H-N-O",
            "density": 1.5978148833664698,
            "density_atomic": 0.12401083131699232,
            "volume": 677.3601878797347,
            "volume_molar": 4.856140948371199,
            "formula_full": "B4 H40 C8 N20 O12",
            "formula_reduced": "BH10C2N5O3",
            "formula_anonymous": "AB2C3D5E10",
            "energy_above_hull": 4.511779968253968,
            "spacegroup": 19
        },
        {
            "id": "jvasp-87859",
            "created_at": "2022-09-04T14:35:40.845385Z",
            "updated_at": "2022-09-04T14:35:40.845395Z",
            "structure_string": "Ba12 Al8 Si12 O48\n1.0\n10.320051 0.000000 -3.648689\n-5.160026 8.937427 -3.648689\n-0.000000 0.000000 10.946068\nBa Al Si O\n12 8 12 48\ndirect\n0.250000 0.375000 0.125000 Ba\n0.250000 0.875000 0.625000 Ba\n0.875000 0.625000 0.250000 Ba\n0.625000 0.875000 0.750000 Ba\n0.875000 0.750000 0.625000 Ba\n0.625000 0.250000 0.875000 Ba\n0.375000 0.750000 0.125000 Ba\n0.750000 0.125000 0.375000 Ba\n0.125000 0.375000 0.750000 Ba\n0.375000 0.125000 0.250000 Ba\n0.125000 0.250000 0.375000 Ba\n0.750000 0.625000 0.875000 Ba\n-0.000000 0.500000 0.500000 Al\n0.500000 -0.000000 0.500000 Al\n0.500000 0.500000 0.500000 Al\n0.500000 -0.000000 -0.000000 Al\n0.000000 0.000000 0.500000 Al\n-0.000000 0.500000 -0.000000 Al\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 -0.000000 Al\n0.625000 0.750000 0.375000 Si\n0.250000 0.125000 0.875000 Si\n0.750000 0.875000 0.125000 Si\n0.375000 0.250000 0.625000 Si\n0.625000 0.375000 0.250000 Si\n0.875000 0.250000 0.125000 Si\n0.875000 0.125000 0.750000 Si\n0.750000 0.375000 0.625000 Si\n0.125000 0.875000 0.250000 Si\n0.375000 0.625000 0.750000 Si\n0.125000 0.750000 0.875000 Si\n0.250000 0.625000 0.375000 Si\n0.195091 0.184532 0.582450 O\n0.315468 0.510560 0.397918 O\n0.989440 0.304909 0.887358 O\n0.102082 0.612642 0.917550 O\n0.184532 0.582451 0.195091 O\n0.184532 0.102082 0.989441 O\n0.582450 0.195091 0.184532 O\n0.612642 0.195091 0.510559 O\n0.684532 0.695091 0.082450 O\n0.917549 0.315468 0.304909 O\n0.804909 0.815469 0.417550 O\n0.112642 0.602083 0.417550 O\n0.695091 0.082450 0.684532 O\n0.082450 0.684532 0.695091 O\n0.010559 0.815469 0.897918 O\n0.804909 0.489441 0.387358 O\n0.417550 0.112642 0.602082 O\n0.387358 0.804909 0.489441 O\n0.897918 0.010559 0.815468 O\n0.602082 0.417550 0.112642 O\n0.112642 0.010559 0.695091 O\n0.387358 0.082450 0.897918 O\n0.082450 0.897918 0.387358 O\n0.489440 0.602083 0.684532 O\n0.602082 0.684532 0.489441 O\n0.695091 0.112642 0.010559 O\n0.489441 0.387358 0.804909 O\n0.304909 0.917550 0.315468 O\n0.417549 0.804909 0.815468 O\n0.815468 0.417550 0.804909 O\n0.989441 0.184532 0.102082 O\n0.195091 0.510560 0.612642 O\n0.582450 0.887359 0.397918 O\n0.102082 0.989441 0.184532 O\n0.510559 0.612642 0.195091 O\n0.397917 0.582451 0.887358 O\n0.887358 0.989441 0.304909 O\n0.815468 0.897918 0.010559 O\n0.612641 0.917550 0.102082 O\n0.510559 0.397918 0.315468 O\n0.397917 0.315468 0.510559 O\n0.304909 0.887359 0.989441 O\n0.315468 0.304909 0.917550 O\n0.684532 0.489441 0.602082 O\n0.010559 0.695091 0.112642 O\n0.897917 0.387358 0.082450 O\n0.917550 0.102082 0.612642 O\n0.887358 0.397918 0.582450 O\n",
            "nsites": 80,
            "nelements": 4,
            "elements": [
                "Ba",
                "Al",
                "Si",
                "O"
            ],
            "chemical_system": "Al-Ba-O-Si",
            "density": 4.8828532334835755,
            "density_atomic": 0.07923872779235858,
            "volume": 1009.6073249640795,
            "volume_molar": 7.599996779075935,
            "formula_full": "Ba12 Al8 Si12 O48",
            "formula_reduced": "Ba3Al2(SiO4)3",
            "formula_anonymous": "A2B3C3D12",
            "energy_above_hull": 2.4411030655,
            "spacegroup": 230
        },
        {
            "id": "jvasp-87161",
            "created_at": "2022-09-04T14:35:54.061830Z",
            "updated_at": "2022-09-04T14:35:54.061862Z",
            "structure_string": "Y12 Sc8 Al12 O48\n1.0\n10.124282 -0.000000 -3.579474\n-5.062141 8.767885 -3.579474\n0.000000 0.000000 10.738422\nY Sc Al O\n12 8 12 48\ndirect\n0.875000 0.625000 0.250000 Y\n0.250000 0.375000 0.125000 Y\n0.750000 0.125000 0.375000 Y\n0.125000 0.375000 0.750000 Y\n0.375000 0.125000 0.250000 Y\n0.125000 0.250000 0.375000 Y\n0.625000 0.250000 0.875000 Y\n0.625000 0.875000 0.750000 Y\n0.250000 0.875000 0.625000 Y\n0.750000 0.625000 0.875000 Y\n0.875000 0.750000 0.625000 Y\n0.375000 0.750000 0.125000 Y\n-0.000000 0.500000 0.000000 Sc\n-0.000000 -0.000000 0.500000 Sc\n0.500000 0.000000 0.000000 Sc\n-0.000000 0.500000 0.500000 Sc\n0.500000 -0.000000 0.500000 Sc\n0.500000 0.500000 0.000000 Sc\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Sc\n0.875000 0.125000 0.750000 Al\n0.125000 0.875000 0.250000 Al\n0.250000 0.625000 0.375000 Al\n0.125000 0.750000 0.875000 Al\n0.750000 0.875000 0.125000 Al\n0.875000 0.250000 0.125000 Al\n0.625000 0.750000 0.375000 Al\n0.250000 0.125000 0.875000 Al\n0.625000 0.375000 0.250000 Al\n0.375000 0.625000 0.750000 Al\n0.375000 0.250000 0.625000 Al\n0.750000 0.375000 0.625000 Al\n0.525985 0.400554 0.812068 O\n0.474015 0.374569 0.286082 O\n0.687932 0.088486 0.713918 O\n0.088486 0.713917 0.687932 O\n0.974015 0.786082 0.874569 O\n0.812068 0.525985 0.400554 O\n0.411514 0.099446 0.625431 O\n0.874569 0.974015 0.786083 O\n0.286082 0.474015 0.374569 O\n0.400554 0.088486 0.874569 O\n0.374569 0.588485 0.900554 O\n0.474015 0.599446 0.187932 O\n0.125431 0.025985 0.213918 O\n0.588485 0.900553 0.374569 O\n0.187932 0.474015 0.599446 O\n0.025985 0.213918 0.125431 O\n0.911514 0.286082 0.312068 O\n0.900554 0.025985 0.312068 O\n0.312068 0.911514 0.286082 O\n0.187932 0.213918 0.588486 O\n0.599446 0.187932 0.474015 O\n0.588486 0.187932 0.213918 O\n0.213918 0.125431 0.025985 O\n0.213918 0.588485 0.187932 O\n0.125431 0.599446 0.911514 O\n0.025985 0.312068 0.900554 O\n0.900554 0.374569 0.588486 O\n0.099446 0.974015 0.687932 O\n0.599446 0.911514 0.125431 O\n0.911514 0.125431 0.599446 O\n0.088486 0.874569 0.400554 O\n0.525985 0.625431 0.713918 O\n0.625431 0.713917 0.525985 O\n0.687932 0.099446 0.974015 O\n0.713918 0.687932 0.088486 O\n0.812068 0.786082 0.411515 O\n0.400554 0.812068 0.525985 O\n0.099446 0.625431 0.411514 O\n0.411514 0.812068 0.786082 O\n0.786082 0.411514 0.812068 O\n0.874569 0.400554 0.088486 O\n0.974015 0.687932 0.099447 O\n0.713918 0.525985 0.625431 O\n0.286082 0.312068 0.911514 O\n0.312068 0.900553 0.025985 O\n0.374569 0.286082 0.474015 O\n0.786082 0.874569 0.974015 O\n0.625431 0.411514 0.099446 O\n",
            "nsites": 80,
            "nelements": 4,
            "elements": [
                "Y",
                "Sc",
                "Al",
                "O"
            ],
            "chemical_system": "Al-O-Sc-Y",
            "density": 4.386835547913751,
            "density_atomic": 0.08392482449091816,
            "volume": 953.2340458889743,
            "volume_molar": 7.175637001959628,
            "formula_full": "Y12 Sc8 Al12 O48",
            "formula_reduced": "Y3Sc2Al3O12",
            "formula_anonymous": "A2B3C3D12",
            "energy_above_hull": 2.8454633625,
            "spacegroup": 230
        },
        {
            "id": "jvasp-21042",
            "created_at": "2022-09-04T14:38:12.743802Z",
            "updated_at": "2022-09-04T14:38:12.743826Z",
            "structure_string": "Ca12 Co8 Ge12 O48\n1.0\n9.978903 -0.000000 -3.528075\n-4.989451 8.641983 -3.528075\n0.000000 0.000000 10.584225\nCa Co Ge O\n12 8 12 48\ndirect\n0.625000 0.250000 0.874999 Ca\n0.875000 0.750000 0.624999 Ca\n0.750000 0.625000 0.874999 Ca\n0.250000 0.875000 0.624999 Ca\n0.875000 0.625000 0.249999 Ca\n0.625000 0.875000 0.749999 Ca\n0.375000 0.750000 0.124999 Ca\n0.125000 0.250000 0.375000 Ca\n0.250000 0.375000 0.125000 Ca\n0.750000 0.125000 0.374999 Ca\n0.125000 0.375000 0.749999 Ca\n0.375000 0.125000 0.250000 Ca\n0.000000 0.000000 0.000000 Co\n-0.000000 0.500000 -0.000000 Co\n-0.000000 -0.000000 0.500000 Co\n0.500000 0.000000 -0.000000 Co\n0.500000 0.500000 0.499999 Co\n0.500000 0.000000 0.499999 Co\n0.500000 0.500000 -0.000001 Co\n-0.000000 0.500000 0.499999 Co\n0.250000 0.125000 0.874999 Ge\n0.625000 0.375000 0.249999 Ge\n0.375000 0.625000 0.749999 Ge\n0.750000 0.375000 0.624999 Ge\n0.625000 0.750000 0.374999 Ge\n0.875000 0.250000 0.124999 Ge\n0.750000 0.875000 0.124999 Ge\n0.125000 0.750000 0.874999 Ge\n0.250000 0.625000 0.374999 Ge\n0.125000 0.875000 0.249999 Ge\n0.875000 0.125000 0.749999 Ge\n0.375000 0.250000 0.624999 Ge\n0.917868 0.116000 0.597761 O\n0.320106 0.902238 0.018239 O\n0.301869 0.481761 0.383999 O\n0.301869 0.320106 0.917868 O\n0.481761 0.384000 0.301868 O\n0.902238 0.384000 0.582130 O\n0.384000 0.301869 0.481760 O\n0.198131 0.116000 0.018239 O\n0.116000 0.597762 0.917868 O\n0.179894 0.198131 0.582131 O\n0.902238 0.018239 0.320105 O\n0.018239 0.320106 0.902238 O\n0.597762 0.917868 0.115999 O\n0.179894 0.481761 0.597761 O\n0.582131 0.902238 0.383999 O\n0.320106 0.917868 0.301868 O\n0.481760 0.597762 0.179893 O\n0.384000 0.582131 0.902237 O\n0.917868 0.301869 0.320105 O\n0.018239 0.198131 0.116000 O\n0.198131 0.582131 0.179893 O\n0.582131 0.179894 0.198131 O\n0.801868 0.884000 0.981759 O\n0.616000 0.698131 0.518238 O\n0.820106 0.801868 0.417868 O\n0.801868 0.417869 0.820105 O\n0.082131 0.884000 0.402237 O\n0.679894 0.097762 0.981760 O\n0.698131 0.518239 0.615999 O\n0.698131 0.679894 0.082130 O\n0.518239 0.616000 0.698130 O\n0.097762 0.616000 0.417868 O\n0.116000 0.018239 0.198131 O\n0.402238 0.820106 0.518238 O\n0.884000 0.981760 0.801867 O\n0.981760 0.801868 0.883998 O\n0.082131 0.698131 0.679893 O\n0.616000 0.417869 0.097761 O\n0.518239 0.402238 0.820105 O\n0.679894 0.082131 0.698131 O\n0.417869 0.097762 0.616000 O\n0.820106 0.518239 0.402237 O\n0.402238 0.082131 0.883999 O\n0.097762 0.981760 0.679893 O\n0.597762 0.179894 0.481760 O\n0.981760 0.679894 0.097761 O\n0.884000 0.402238 0.082130 O\n0.417869 0.820106 0.801868 O\n",
            "nsites": 80,
            "nelements": 4,
            "elements": [
                "Ca",
                "Co",
                "Ge",
                "O"
            ],
            "chemical_system": "Ca-Co-Ge-O",
            "density": 4.715607636602344,
            "density_atomic": 0.08764652758492154,
            "volume": 912.7572101756941,
            "volume_molar": 6.870940499228668,
            "formula_full": "Ca12 Co8 Ge12 O48",
            "formula_reduced": "Ca3Co2(GeO4)3",
            "formula_anonymous": "A2B3C3D12",
            "energy_above_hull": 2.2053161455,
            "spacegroup": 230
        },
        {
            "id": "jvasp-61588",
            "created_at": "2022-09-04T14:35:52.176355Z",
            "updated_at": "2022-09-04T14:35:52.176373Z",
            "structure_string": "Y12 Sc8 Al12 O48\n1.0\n-6.200181 6.200181 6.200181\n6.200181 -6.200181 6.200181\n6.200181 6.200181 -6.200181\nY Sc Al O\n12 8 12 48\ndirect\n0.875000 0.625000 0.250000 Y\n0.250000 0.375000 0.125000 Y\n0.125000 0.250000 0.375000 Y\n0.375000 0.750000 0.125000 Y\n0.375000 0.125000 0.250000 Y\n0.750000 0.125000 0.375000 Y\n0.750000 0.625000 0.875000 Y\n0.250000 0.875000 0.625000 Y\n0.875000 0.750000 0.625000 Y\n0.625000 0.250000 0.875000 Y\n0.125000 0.375000 0.750000 Y\n0.625000 0.875000 0.750000 Y\n0.000000 0.000000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.500000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Sc\n0.000000 0.500000 0.000000 Sc\n0.000000 0.500000 0.500000 Sc\n0.500000 0.000000 0.500000 Sc\n0.500000 0.500000 0.000000 Sc\n0.250000 0.625000 0.375000 Al\n0.125000 0.875000 0.250000 Al\n0.750000 0.875000 0.125000 Al\n0.375000 0.250000 0.625000 Al\n0.125000 0.750000 0.875000 Al\n0.625000 0.375000 0.250000 Al\n0.875000 0.125000 0.750000 Al\n0.250000 0.125000 0.875000 Al\n0.750000 0.375000 0.625000 Al\n0.375000 0.625000 0.750000 Al\n0.625000 0.750000 0.375000 Al\n0.875000 0.250000 0.125000 Al\n0.286079 0.474017 0.374567 O\n0.125433 0.599450 0.911514 O\n0.187938 0.213921 0.588486 O\n0.099450 0.625433 0.411514 O\n0.312062 0.900550 0.025983 O\n0.900550 0.025983 0.312062 O\n0.374567 0.286079 0.474017 O\n0.599450 0.911514 0.125433 O\n0.525983 0.400550 0.812062 O\n0.812062 0.525983 0.400550 O\n0.625433 0.411514 0.099450 O\n0.687938 0.088486 0.713921 O\n0.974017 0.786079 0.874567 O\n0.025983 0.312062 0.900550 O\n0.411514 0.099450 0.625433 O\n0.088486 0.713921 0.687938 O\n0.213921 0.588486 0.187938 O\n0.713921 0.687938 0.088486 O\n0.474017 0.374567 0.286079 O\n0.911514 0.125433 0.599450 O\n0.400550 0.812062 0.525983 O\n0.786079 0.874567 0.974017 O\n0.088486 0.874567 0.400550 O\n0.411514 0.812062 0.786079 O\n0.525983 0.625433 0.713921 O\n0.974017 0.687938 0.099450 O\n0.687938 0.099450 0.974017 O\n0.625433 0.713921 0.525983 O\n0.812062 0.786079 0.411514 O\n0.874567 0.400550 0.088486 O\n0.713921 0.525983 0.625433 O\n0.099450 0.974017 0.687938 O\n0.588486 0.187938 0.213921 O\n0.400550 0.088486 0.874567 O\n0.911514 0.286079 0.312062 O\n0.588486 0.900550 0.374567 O\n0.474017 0.599450 0.187938 O\n0.874567 0.974017 0.786079 O\n0.312062 0.911514 0.286079 O\n0.374567 0.588486 0.900550 O\n0.187938 0.474017 0.599450 O\n0.125433 0.025983 0.213921 O\n0.286079 0.312062 0.911514 O\n0.900550 0.374567 0.588486 O\n0.599450 0.187938 0.474017 O\n0.213921 0.125433 0.025983 O\n0.786079 0.411514 0.812062 O\n0.025983 0.213921 0.125433 O\n",
            "nsites": 80,
            "nelements": 4,
            "elements": [
                "Y",
                "Sc",
                "Al",
                "O"
            ],
            "chemical_system": "Al-O-Sc-Y",
            "density": 4.386092680098496,
            "density_atomic": 0.083910612640409,
            "volume": 953.3954941174419,
            "volume_molar": 7.176852331906233,
            "formula_full": "Y12 Sc8 Al12 O48",
            "formula_reduced": "Y3Sc2Al3O12",
            "formula_anonymous": "A2B3C3D12",
            "energy_above_hull": 2.8454583625,
            "spacegroup": 230
        },
        {
            "id": "jvasp-60092",
            "created_at": "2022-09-04T14:38:36.037451Z",
            "updated_at": "2022-09-04T14:38:36.037472Z",
            "structure_string": "Zn12 Si12 Bi8 O48\n1.0\n10.177866 -0.000000 -3.598420\n-5.088933 8.814291 -3.598420\n0.000000 0.000000 10.795257\nZn Si Bi O\n12 12 8 48\ndirect\n0.375000 0.750000 0.125000 Zn\n0.250000 0.375000 0.125000 Zn\n0.625000 0.875000 0.750000 Zn\n0.875000 0.625000 0.250000 Zn\n0.625000 0.250000 0.875000 Zn\n0.750000 0.625000 0.875000 Zn\n0.250000 0.875000 0.625000 Zn\n0.875000 0.750000 0.625000 Zn\n0.125000 0.375000 0.750000 Zn\n0.375000 0.125000 0.250000 Zn\n0.125000 0.250000 0.375000 Zn\n0.750000 0.125000 0.375000 Zn\n0.375000 0.625000 0.750000 Si\n0.250000 0.625000 0.375000 Si\n0.625000 0.750000 0.375000 Si\n0.875000 0.250000 0.125000 Si\n0.125000 0.875000 0.250000 Si\n0.750000 0.375000 0.625000 Si\n0.750000 0.875000 0.125000 Si\n0.125000 0.750000 0.875000 Si\n0.625000 0.375000 0.250000 Si\n0.375000 0.250000 0.625000 Si\n0.250000 0.125000 0.875000 Si\n0.875000 0.125000 0.750000 Si\n0.500000 0.500000 0.000000 Bi\n0.500000 0.000000 0.000000 Bi\n0.500000 0.500000 0.500000 Bi\n0.500000 -0.000000 0.500000 Bi\n0.000000 0.500000 0.500000 Bi\n-0.000000 -0.000000 0.500000 Bi\n0.000000 0.500000 0.000000 Bi\n0.000000 0.000000 0.000000 Bi\n0.974902 0.708876 0.106823 O\n0.868079 0.393177 0.102053 O\n0.766026 0.397947 0.791124 O\n0.766026 0.868078 0.974902 O\n0.397947 0.791124 0.766026 O\n0.393177 0.791124 0.525099 O\n0.791124 0.766026 0.397947 O\n0.733975 0.708876 0.102053 O\n0.708876 0.106823 0.974902 O\n0.631922 0.733974 0.525099 O\n0.102053 0.868078 0.393177 O\n0.733975 0.525098 0.631922 O\n0.393177 0.102053 0.868079 O\n0.106823 0.974902 0.708876 O\n0.631922 0.397947 0.106823 O\n0.525099 0.393177 0.791124 O\n0.868079 0.974902 0.766026 O\n0.397947 0.106823 0.631922 O\n0.791124 0.525098 0.393177 O\n0.974902 0.766026 0.868079 O\n0.102053 0.733974 0.708876 O\n0.525099 0.631921 0.733975 O\n0.266026 0.291124 0.897947 O\n0.208876 0.233974 0.602053 O\n0.368079 0.266026 0.474902 O\n0.266026 0.474902 0.368079 O\n0.025098 0.291124 0.893177 O\n0.131922 0.606823 0.897947 O\n0.233975 0.602053 0.208876 O\n0.233975 0.131921 0.025098 O\n0.602053 0.208876 0.233975 O\n0.606823 0.208876 0.474902 O\n0.708876 0.102053 0.733975 O\n0.893177 0.368078 0.602053 O\n0.291124 0.897947 0.266026 O\n0.897947 0.266026 0.291124 O\n0.025098 0.233974 0.131922 O\n0.208876 0.474902 0.606823 O\n0.602053 0.893177 0.368079 O\n0.131922 0.025098 0.233975 O\n0.474902 0.606823 0.208876 O\n0.368079 0.602053 0.893177 O\n0.893177 0.025098 0.291124 O\n0.606824 0.897947 0.131922 O\n0.106823 0.631921 0.397947 O\n0.897947 0.131921 0.606823 O\n0.291124 0.893177 0.025098 O\n0.474902 0.368078 0.266026 O\n",
            "nsites": 80,
            "nelements": 4,
            "elements": [
                "Zn",
                "Si",
                "Bi",
                "O"
            ],
            "chemical_system": "Bi-O-Si-Zn",
            "density": 6.107102880883915,
            "density_atomic": 0.08260624629677735,
            "volume": 968.4497672559294,
            "volume_molar": 7.290176021755557,
            "formula_full": "Zn12 Si12 Bi8 O48",
            "formula_reduced": "Zn3Si3(BiO6)2",
            "formula_anonymous": "A2B3C3D12",
            "energy_above_hull": 2.14231438,
            "spacegroup": 230
        },
        {
            "id": "jvasp-97685",
            "created_at": "2022-09-04T14:36:00.983043Z",
            "updated_at": "2022-09-04T14:36:00.983071Z",
            "structure_string": "Ca12 Mn8 Si12 O48\n1.0\n9.882427 0.000000 -3.493966\n-4.941214 8.558433 -3.493966\n-0.000000 -0.000000 10.481897\nCa Mn Si O\n12 8 12 48\ndirect\n0.875001 0.625000 0.250000 Ca\n0.625001 0.875000 0.749999 Ca\n0.875000 0.749999 0.624999 Ca\n0.625000 0.249999 0.875000 Ca\n0.750001 0.625000 0.875000 Ca\n0.750001 0.125000 0.375000 Ca\n0.250001 0.375000 0.125000 Ca\n0.250000 0.875000 0.624999 Ca\n0.375000 0.749999 0.125000 Ca\n0.125000 0.249999 0.374999 Ca\n0.375001 0.125000 0.250000 Ca\n0.125000 0.375000 0.750000 Ca\n0.000000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 1.000000 Mn\n0.500000 -0.000000 0.500000 Mn\n0.500000 -0.000000 1.000000 Mn\n0.000000 0.000000 0.500001 Mn\n0.000000 0.500000 1.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.250001 0.125000 0.875001 Si\n0.625000 0.749999 0.375000 Si\n0.250000 0.625000 0.374999 Si\n0.375001 0.625000 0.750000 Si\n0.875001 0.125000 0.750000 Si\n0.750001 0.375000 0.625000 Si\n0.125000 0.749999 0.875000 Si\n0.625001 0.375000 0.250000 Si\n0.375000 0.249999 0.625000 Si\n0.750001 0.875000 0.125000 Si\n0.125000 0.875000 0.250000 Si\n0.875000 0.249999 0.125000 Si\n0.194251 0.204795 0.588431 O\n0.795205 0.411569 0.805749 O\n0.010545 0.305749 0.894181 O\n0.116364 0.605820 0.911569 O\n0.204795 0.588431 0.194251 O\n0.204796 0.116364 0.010545 O\n0.588431 0.194251 0.204795 O\n0.605820 0.194251 0.489456 O\n0.704796 0.694250 0.088431 O\n0.911570 0.295205 0.305749 O\n0.805750 0.795205 0.411569 O\n0.105820 0.616363 0.411569 O\n0.694251 0.088431 0.704795 O\n0.088432 0.704795 0.694251 O\n0.989456 0.795205 0.883635 O\n0.805750 0.510545 0.394180 O\n0.411569 0.105820 0.616364 O\n0.394181 0.805749 0.510544 O\n0.883636 0.989455 0.795204 O\n0.616364 0.411569 0.105820 O\n0.105820 0.989455 0.694251 O\n0.394180 0.088431 0.883636 O\n0.088432 0.883636 0.394180 O\n0.510544 0.616363 0.704795 O\n0.616364 0.704795 0.510544 O\n0.694251 0.105820 0.989455 O\n0.510544 0.394180 0.805749 O\n0.305749 0.911568 0.295204 O\n0.411570 0.805749 0.795205 O\n0.295205 0.489455 0.383635 O\n0.010545 0.204795 0.116364 O\n0.194251 0.489455 0.605819 O\n0.588431 0.894180 0.383635 O\n0.116364 0.010545 0.204795 O\n0.489456 0.605820 0.194251 O\n0.383636 0.588431 0.894180 O\n0.894181 0.010545 0.305749 O\n0.795205 0.883636 0.989455 O\n0.605820 0.911568 0.116363 O\n0.489456 0.383636 0.295204 O\n0.383637 0.295205 0.489455 O\n0.305750 0.894180 0.010544 O\n0.295205 0.305749 0.911569 O\n0.704796 0.510545 0.616363 O\n0.989456 0.694250 0.105819 O\n0.883636 0.394180 0.088430 O\n0.911570 0.116364 0.605820 O\n0.894180 0.383636 0.588431 O\n",
            "nsites": 80,
            "nelements": 4,
            "elements": [
                "Ca",
                "Mn",
                "Si",
                "O"
            ],
            "chemical_system": "Ca-Mn-O-Si",
            "density": 3.793763020080778,
            "density_atomic": 0.09023857511521388,
            "volume": 886.5388210957278,
            "volume_molar": 6.673576962303662,
            "formula_full": "Ca12 Mn8 Si12 O48",
            "formula_reduced": "Ca3Mn2(SiO4)3",
            "formula_anonymous": "A2B3C3D12",
            "energy_above_hull": 2.732894177137931,
            "spacegroup": 230
        },
        {
            "id": "jvasp-21043",
            "created_at": "2022-09-04T14:38:14.888837Z",
            "updated_at": "2022-09-04T14:38:14.888861Z",
            "structure_string": "Ca12 Ge12 Mo8 O48\n1.0\n10.296961 -0.000000 -3.640525\n-5.148479 8.917429 -3.640525\n0.000000 0.000000 10.921576\nCa Ge Mo O\n12 12 8 48\ndirect\n0.625000 0.250000 0.875000 Ca\n0.375000 0.125000 0.250000 Ca\n0.125000 0.375000 0.750000 Ca\n0.750000 0.125000 0.375000 Ca\n0.125000 0.250000 0.375000 Ca\n0.375000 0.750000 0.125000 Ca\n0.250000 0.375000 0.125000 Ca\n0.875000 0.625000 0.249999 Ca\n0.250000 0.875000 0.625000 Ca\n0.750000 0.625000 0.875000 Ca\n0.875000 0.750000 0.625000 Ca\n0.625000 0.875000 0.750000 Ca\n0.875000 0.250000 0.125000 Ge\n0.625000 0.375000 0.250000 Ge\n0.375000 0.625000 0.750000 Ge\n0.750000 0.375000 0.625000 Ge\n0.250000 0.125000 0.875000 Ge\n0.625000 0.750000 0.375000 Ge\n0.125000 0.875000 0.250000 Ge\n0.750000 0.875000 0.124999 Ge\n0.125000 0.750000 0.875000 Ge\n0.250000 0.625000 0.375000 Ge\n0.875000 0.125000 0.750000 Ge\n0.375000 0.250000 0.625000 Ge\n-0.000000 -0.000000 0.500000 Mo\n0.000000 0.000000 0.000000 Mo\n0.000000 0.500000 -0.000000 Mo\n0.500000 0.000000 -0.000000 Mo\n0.000000 0.500000 0.500000 Mo\n0.500000 0.000000 0.500000 Mo\n0.500000 0.500000 -0.000000 Mo\n0.500000 0.500000 0.500000 Mo\n0.911417 0.121086 0.600314 O\n0.311103 0.899686 0.020773 O\n0.290331 0.479227 0.378914 O\n0.290331 0.311103 0.911417 O\n0.479227 0.378914 0.290331 O\n0.899686 0.378914 0.588582 O\n0.378914 0.290331 0.479227 O\n0.209669 0.121086 0.020773 O\n0.121086 0.600314 0.911417 O\n0.188897 0.209669 0.588583 O\n0.020773 0.311103 0.899686 O\n0.209669 0.588583 0.188896 O\n0.899686 0.020773 0.311103 O\n0.600314 0.911417 0.121086 O\n0.188897 0.479227 0.600314 O\n0.588583 0.899686 0.378913 O\n0.311103 0.911417 0.290331 O\n0.479227 0.600314 0.188896 O\n0.378914 0.588583 0.899686 O\n0.911417 0.290331 0.311103 O\n0.020773 0.209669 0.121086 O\n0.588583 0.188897 0.209669 O\n0.790331 0.878914 0.979226 O\n0.621086 0.709669 0.520773 O\n0.811103 0.790331 0.411417 O\n0.790331 0.411417 0.811103 O\n0.088583 0.878914 0.399686 O\n0.688897 0.100314 0.979227 O\n0.709669 0.520773 0.621086 O\n0.709669 0.688897 0.088582 O\n0.520773 0.621086 0.709669 O\n0.100314 0.621086 0.411417 O\n0.121086 0.020773 0.209669 O\n0.399686 0.811103 0.520773 O\n0.878914 0.979227 0.790331 O\n0.979227 0.790331 0.878913 O\n0.088583 0.709669 0.688897 O\n0.621086 0.411417 0.100314 O\n0.520773 0.399686 0.811103 O\n0.688897 0.088583 0.709669 O\n0.411417 0.100314 0.621086 O\n0.811103 0.520773 0.399686 O\n0.399686 0.088583 0.878914 O\n0.100314 0.979227 0.688897 O\n0.600314 0.188897 0.479227 O\n0.979227 0.688897 0.100313 O\n0.878914 0.399686 0.088582 O\n0.411417 0.811103 0.790331 O\n",
            "nsites": 80,
            "nelements": 4,
            "elements": [
                "Ca",
                "Ge",
                "Mo",
                "O"
            ],
            "chemical_system": "Ca-Ge-Mo-O",
            "density": 4.782206951354795,
            "density_atomic": 0.0797730040338154,
            "volume": 1002.8455236070635,
            "volume_molar": 7.549096129622049,
            "formula_full": "Ca12 Ge12 Mo8 O48",
            "formula_reduced": "Ca3Ge3(MoO6)2",
            "formula_anonymous": "A2B3C3D12",
            "energy_above_hull": 2.5402711455,
            "spacegroup": 230
        }
    ]
}