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=-volume&page=335",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=333",
"results": [
{
"id": "jvasp-59852",
"created_at": "2022-09-04T14:38:34.109971Z",
"updated_at": "2022-09-04T14:38:34.110001Z",
"structure_string": "Y2 Ni6 Se4 Cl2 O16\n1.0\n0.000000 6.842299 -0.000185\n6.289698 0.000000 0.000000\n0.000000 -0.000511 -9.436107\nY Ni Se Cl O\n2 6 4 2 16\ndirect\n0.261962 0.750000 0.750000 Y\n0.738038 0.250000 0.250000 Y\n0.000000 0.500000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.208590 0.250000 0.250000 Ni\n0.791410 0.750000 0.750000 Ni\n0.000000 0.000000 0.500000 Ni\n0.592412 0.750000 0.437450 Se\n0.407588 0.250000 0.562550 Se\n0.407585 0.250000 0.937451 Se\n0.592415 0.750000 0.062549 Se\n0.173116 0.750000 0.250002 Cl\n0.826885 0.250000 0.749998 Cl\n0.250551 0.034687 0.588106 O\n0.250551 0.465313 0.588106 O\n0.749450 0.534687 0.088105 O\n0.015270 0.250000 0.389916 O\n0.984730 0.750000 0.610084 O\n0.749450 0.965314 0.088105 O\n0.250550 0.034687 0.911895 O\n0.984730 0.750000 0.889915 O\n0.749449 0.965313 0.411894 O\n0.749449 0.534687 0.411894 O\n0.250550 0.465314 0.911895 O\n0.425976 0.250000 0.378875 O\n0.574024 0.750000 0.878876 O\n0.425976 0.250000 0.121123 O\n0.015271 0.250000 0.110085 O\n0.574024 0.750000 0.621125 O\n",
"nsites": 30,
"nelements": 5,
"elements": [
"Y",
"Ni",
"Se",
"Cl",
"O"
],
"chemical_system": "Cl-Ni-O-Se-Y",
"density": 4.795285523389348,
"density_atomic": 0.07387484037905544,
"volume": 406.0922479976745,
"volume_molar": 8.151815596622747,
"formula_full": "Y2 Ni6 Se4 Cl2 O16",
"formula_reduced": "YNi3Se2ClO8",
"formula_anonymous": "ABC2D3E8",
"energy_above_hull": 2.243018763388889,
"spacegroup": 59
},
{
"id": "jvasp-23187",
"created_at": "2022-09-04T14:37:51.988793Z",
"updated_at": "2022-09-04T14:37:51.988826Z",
"structure_string": "Co4 Se8 O20\n1.0\n5.862316 -0.000000 0.000000\n-0.000000 6.838903 0.000000\n0.000000 0.000000 10.128728\nCo Se O\n4 8 20\ndirect\n0.250000 0.000000 0.937116 Co\n0.750001 0.500000 0.562884 Co\n0.750001 0.000000 0.062884 Co\n0.250000 0.500000 0.437116 Co\n0.514922 0.366723 0.844817 Se\n0.485079 0.866723 0.655184 Se\n0.985079 0.633277 0.844817 Se\n0.014922 0.133277 0.655184 Se\n0.514922 0.133277 0.344816 Se\n0.985079 0.866723 0.344816 Se\n0.485079 0.633277 0.155184 Se\n0.014922 0.366723 0.155184 Se\n0.250000 0.000000 0.566731 O\n0.853576 0.689832 0.698167 O\n0.353576 0.810167 0.801833 O\n0.853576 0.810167 0.198167 O\n0.353576 0.689832 0.301833 O\n0.146425 0.310168 0.301833 O\n0.646425 0.189832 0.198167 O\n0.750001 0.500000 0.933269 O\n0.250000 0.500000 0.066731 O\n0.451747 0.857333 0.071478 O\n0.548254 0.142667 0.928522 O\n0.048253 0.357333 0.571479 O\n0.451747 0.642666 0.571479 O\n0.951747 0.857333 0.928522 O\n0.646425 0.310168 0.698167 O\n0.951747 0.642666 0.428522 O\n0.548254 0.357333 0.428522 O\n0.048253 0.142667 0.071478 O\n0.750001 0.000000 0.433269 O\n0.146425 0.189832 0.801833 O\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Co",
"Se",
"O"
],
"chemical_system": "Co-O-Se",
"density": 4.85552114811021,
"density_atomic": 0.07880239210132621,
"volume": 406.0790433728655,
"volume_molar": 7.642078621492317,
"formula_full": "Co4 Se8 O20",
"formula_reduced": "CoSe2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.5455506416666664,
"spacegroup": 60
},
{
"id": "jvasp-46000",
"created_at": "2022-09-04T14:38:08.361845Z",
"updated_at": "2022-09-04T14:38:08.361876Z",
"structure_string": "Li14 Co2 S9\n1.0\n3.471241 -6.012367 -0.000000\n3.471241 6.012367 0.000000\n-0.000000 0.000000 9.723481\nLi Co S\n14 2 9\ndirect\n0.345989 0.017772 0.910677 Li\n0.654011 0.982228 0.089323 Li\n0.324681 0.960259 0.408177 Li\n0.017772 0.671784 0.089323 Li\n0.328216 0.345989 0.089323 Li\n0.960259 0.635578 0.591823 Li\n0.039741 0.364422 0.408177 Li\n0.635578 0.675318 0.408177 Li\n0.982228 0.328216 0.910677 Li\n0.000000 0.000000 0.750131 Li\n0.000000 0.000000 0.249869 Li\n0.675319 0.039740 0.591823 Li\n0.364422 0.324681 0.591823 Li\n0.671783 0.654011 0.910677 Li\n0.666667 0.333333 0.254937 Co\n0.333333 0.666667 0.745063 Co\n0.333333 0.666667 0.982461 S\n0.966959 0.656686 0.337341 S\n0.033041 0.343313 0.662659 S\n0.343313 0.310273 0.337341 S\n0.666667 0.333333 0.017539 S\n0.689727 0.033040 0.337341 S\n0.310272 0.966959 0.662659 S\n0.000000 0.000000 0.000000 S\n0.656686 0.689727 0.662659 S\n",
"nsites": 25,
"nelements": 3,
"elements": [
"Li",
"Co",
"S"
],
"chemical_system": "Co-Li-S",
"density": 2.060509871181552,
"density_atomic": 0.061596777745423784,
"volume": 405.865386389588,
"volume_molar": 9.77671394579955,
"formula_full": "Li14 Co2 S9",
"formula_reduced": "Li14Co2S9",
"formula_anonymous": "A2B9C14",
"energy_above_hull": 1.6545080720000005,
"spacegroup": 147
},
{
"id": "jvasp-119025",
"created_at": "2022-09-04T14:38:32.716128Z",
"updated_at": "2022-09-04T14:38:32.716148Z",
"structure_string": "Tb10 Si6 B2\n1.0\n8.582402 0.000000 0.000000\n-4.291201 7.432578 0.000000\n-0.000000 -0.000000 6.360657\nTb Si B\n10 6 2\ndirect\n0.666667 0.333333 -0.000000 Tb\n0.000000 0.759720 0.250000 Tb\n0.240280 0.240280 0.250000 Tb\n0.000000 0.240280 0.750000 Tb\n0.240280 -0.000000 0.750000 Tb\n0.759720 -0.000000 0.250000 Tb\n0.666667 0.333333 0.500000 Tb\n0.333333 0.666667 0.500000 Tb\n0.333333 0.666667 -0.000000 Tb\n0.759720 0.759720 0.750000 Tb\n0.398457 0.398457 0.750000 Si\n0.601543 -0.000000 0.750000 Si\n0.000000 0.601543 0.750000 Si\n0.601543 0.601543 0.250000 Si\n0.398457 -0.000000 0.250000 Si\n0.000000 0.398457 0.250000 Si\n0.000000 0.000000 0.000000 B\n0.000000 0.000000 0.500000 B\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Tb",
"Si",
"B"
],
"chemical_system": "B-Si-Tb",
"density": 7.282316860279176,
"density_atomic": 0.04436313203778721,
"volume": 405.74231739698024,
"volume_molar": 13.574651931406732,
"formula_full": "Tb10 Si6 B2",
"formula_reduced": "Tb5Si3B",
"formula_anonymous": "AB3C5",
"energy_above_hull": 2.7028000425925924,
"spacegroup": 193
},
{
"id": "jvasp-95403",
"created_at": "2022-09-04T14:35:54.620317Z",
"updated_at": "2022-09-04T14:35:54.620337Z",
"structure_string": "As4 Pb6 O16\n1.0\n6.235729 0.000000 0.000000\n0.000000 6.955679 -2.871833\n0.000000 -0.020066 9.362112\nAs Pb O\n4 6 16\ndirect\n0.018233 0.196947 0.402264 As\n0.518233 0.303052 0.097736 As\n0.481767 0.696947 0.902264 As\n0.981767 0.803052 0.597736 As\n0.416626 0.092600 0.710765 Pb\n0.000000 0.000000 0.000000 Pb\n0.583374 0.907399 0.289235 Pb\n0.083374 0.592601 0.210765 Pb\n0.500000 0.500000 0.500000 Pb\n0.916626 0.407399 0.789235 Pb\n0.971262 0.958205 0.281938 O\n0.466928 0.815105 0.778745 O\n0.966928 0.684894 0.721255 O\n0.528738 0.458205 0.781938 O\n0.028738 0.041795 0.718062 O\n0.471262 0.541795 0.218062 O\n0.204382 0.736596 0.475977 O\n0.242326 0.234544 0.516676 O\n0.795618 0.263404 0.524023 O\n0.295618 0.236595 0.975977 O\n0.742326 0.265455 0.983324 O\n0.033072 0.315105 0.278745 O\n0.257674 0.734544 0.016676 O\n0.757674 0.765455 0.483324 O\n0.704382 0.763404 0.024023 O\n0.533073 0.184895 0.221255 O\n",
"nsites": 26,
"nelements": 3,
"elements": [
"As",
"Pb",
"O"
],
"chemical_system": "As-O-Pb",
"density": 7.36265430950549,
"density_atomic": 0.06408512559025814,
"volume": 405.71036977030394,
"volume_molar": 9.397095979032382,
"formula_full": "As4 Pb6 O16",
"formula_reduced": "As2Pb3O8",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.2229026123076925,
"spacegroup": 14
},
{
"id": "jvasp-112297",
"created_at": "2022-09-04T14:38:26.860665Z",
"updated_at": "2022-09-04T14:38:26.860688Z",
"structure_string": "Nd4 B4 S12\n1.0\n6.022498 -0.000000 0.000000\n0.000000 7.536234 0.000000\n-0.000000 -0.000000 8.938830\nNd B S\n4 4 12\ndirect\n0.930713 0.385902 0.257670 Nd\n0.069287 0.614098 0.757670 Nd\n0.430713 0.114098 0.757670 Nd\n0.569287 0.885901 0.257670 Nd\n0.097350 0.854992 0.428586 B\n0.902651 0.145008 0.928586 B\n0.597350 0.645008 0.928586 B\n0.402651 0.354992 0.428586 B\n0.635654 0.204108 0.460052 S\n0.364346 0.795891 0.960051 S\n0.663387 0.174736 0.051796 S\n0.336613 0.825263 0.551796 S\n0.163387 0.325264 0.551796 S\n0.400099 0.501071 0.267976 S\n0.900099 0.998928 0.767976 S\n0.099901 0.001071 0.267976 S\n0.864346 0.704108 0.460052 S\n0.599901 0.498928 0.767976 S\n0.836613 0.674736 0.051796 S\n0.135654 0.295891 0.960051 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nd",
"B",
"S"
],
"chemical_system": "B-Nd-S",
"density": 4.113390919240315,
"density_atomic": 0.04929674887985465,
"volume": 405.7062677448308,
"volume_molar": 12.216101257868095,
"formula_full": "Nd4 B4 S12",
"formula_reduced": "NdBS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.2333808166666667,
"spacegroup": 33
},
{
"id": "jvasp-21688",
"created_at": "2022-09-04T14:38:33.903322Z",
"updated_at": "2022-09-04T14:38:33.903338Z",
"structure_string": "Er12 Rh4\n1.0\n6.215199 -0.000000 0.000000\n0.000000 7.049075 0.000000\n0.000000 0.000000 9.260142\nEr Rh\n12 4\ndirect\n0.671264 0.179123 0.061918 Er\n0.171264 0.320877 0.938082 Er\n0.828736 0.679122 0.438082 Er\n0.328736 0.820877 0.561918 Er\n0.328736 0.820877 0.938082 Er\n0.828736 0.679122 0.061918 Er\n0.171264 0.320877 0.561918 Er\n0.671264 0.179123 0.438082 Er\n0.865570 0.966751 0.750000 Er\n0.365570 0.533248 0.250000 Er\n0.634430 0.466751 0.750000 Er\n0.134430 0.033248 0.250000 Er\n0.054045 0.615856 0.750000 Rh\n0.554045 0.884143 0.250000 Rh\n0.445955 0.115857 0.750000 Rh\n0.945955 0.384143 0.250000 Rh\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Er",
"Rh"
],
"chemical_system": "Er-Rh",
"density": 9.89991970957559,
"density_atomic": 0.03943802575689919,
"volume": 405.699821249318,
"volume_molar": 15.269883936688952,
"formula_full": "Er12 Rh4",
"formula_reduced": "Er3Rh",
"formula_anonymous": "AB3",
"energy_above_hull": 1.59982075,
"spacegroup": 62
},
{
"id": "jvasp-29494",
"created_at": "2022-09-04T14:37:57.720286Z",
"updated_at": "2022-09-04T14:37:57.720306Z",
"structure_string": "Zn4 In4 S10\n1.0\n3.906477 -0.000000 0.000000\n-1.953238 3.383108 -0.000000\n-0.000000 -0.000000 30.693903\nZn In S\n4 4 10\ndirect\n0.333333 0.666667 0.309712 Zn\n0.666667 0.333333 0.809712 Zn\n0.666667 0.333333 0.063902 Zn\n0.333333 0.666667 0.563902 Zn\n0.333333 0.666667 0.920295 In\n0.000000 0.000000 0.187491 In\n0.000000 0.000000 0.687491 In\n0.666667 0.333333 0.420295 In\n0.333333 0.666667 0.644858 S\n0.333333 0.666667 0.838139 S\n0.666667 0.333333 0.954387 S\n0.666667 0.333333 0.144858 S\n0.666667 0.333333 0.338139 S\n0.333333 0.666667 0.454387 S\n0.333333 0.666667 0.042914 S\n0.666667 0.333333 0.736299 S\n0.333333 0.666667 0.236299 S\n0.666667 0.333333 0.542914 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Zn",
"In",
"S"
],
"chemical_system": "In-S-Zn",
"density": 4.263628007014707,
"density_atomic": 0.044373047326897924,
"volume": 405.65165307203984,
"volume_molar": 13.57161863514728,
"formula_full": "Zn4 In4 S10",
"formula_reduced": "Zn2In2S5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 0.6926011111111112,
"spacegroup": 186
},
{
"id": "jvasp-120553",
"created_at": "2022-09-04T14:38:45.436278Z",
"updated_at": "2022-09-04T14:38:45.436308Z",
"structure_string": "Ag4 Hg4 S4 Br1 Cl3\n1.0\n4.523090 -0.004324 0.004703\n0.006751 6.901585 0.033823\n0.002323 0.003083 12.992741\nAg Hg S Br Cl\n4 4 4 1 3\ndirect\n-0.000863 0.791415 0.460286 Ag\n0.000946 0.208780 0.541747 Ag\n0.001209 0.291823 0.042169 Ag\n0.998701 0.700468 0.951448 Ag\n0.499985 0.623132 0.244786 Hg\n0.500024 0.374834 0.756181 Hg\n0.500300 0.125474 0.262602 Hg\n0.499675 0.876512 0.740134 Hg\n0.499526 0.857760 0.385180 S\n0.500544 0.140694 0.616874 S\n0.500754 0.359808 0.121287 S\n0.499122 0.638598 0.878672 S\n0.000646 0.873328 0.133513 Br\n-0.000540 0.137982 0.863052 Cl\n0.999709 0.370315 0.365356 Cl\n0.000255 0.629081 0.636707 Cl\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ag",
"Hg",
"S",
"Br",
"Cl"
],
"chemical_system": "Ag-Br-Cl-Hg-S",
"density": 6.339210758575263,
"density_atomic": 0.03944893752057689,
"volume": 405.58760274986537,
"volume_molar": 15.265660214191577,
"formula_full": "Ag4 Hg4 S4 Br1 Cl3",
"formula_reduced": "Ag4Hg4S4BrCl3",
"formula_anonymous": "AB3C4D4E4",
"energy_above_hull": 0.0,
"spacegroup": 6
},
{
"id": "jvasp-62285",
"created_at": "2022-09-04T14:36:06.368742Z",
"updated_at": "2022-09-04T14:36:06.368759Z",
"structure_string": "Na1 H12 Au1 C4 S4 O12\n1.0\n5.363119 -0.071134 0.058998\n1.760948 8.519566 0.002232\n2.515995 2.437089 8.873260\nNa H Au C S O\n1 12 1 4 4 12\ndirect\n0.000001 0.500000 0.500000 Na\n0.698780 0.834876 0.097340 H\n0.301221 0.165125 0.902660 H\n0.781741 0.948381 0.205302 H\n0.218260 0.051620 0.794698 H\n0.480155 0.009412 0.140539 H\n0.519846 0.990589 0.859461 H\n0.335366 0.518567 0.854427 H\n0.664635 0.481434 0.145573 H\n0.349299 0.708922 0.887315 H\n0.650702 0.291079 0.112685 H\n0.444530 0.687470 0.696287 H\n0.555471 0.312531 0.303713 H\n0.000000 0.000000 0.500000 Au\n0.685498 0.349032 0.191964 C\n0.314503 0.650969 0.808036 C\n0.622073 0.907292 0.179450 C\n0.377928 0.092709 0.820550 C\n0.989251 0.711122 0.789986 S\n0.010750 0.288879 0.210014 S\n0.459718 0.777805 0.347781 S\n0.540283 0.222196 0.652219 S\n0.650492 0.652805 0.408102 O\n0.061341 0.360596 0.316244 O\n0.938660 0.639405 0.683756 O\n0.182593 0.315707 0.061366 O\n0.817408 0.684294 0.938634 O\n0.366563 0.885478 0.460977 O\n0.239401 0.726319 0.321112 O\n0.633438 0.114523 0.539023 O\n0.029208 0.099538 0.275828 O\n0.970793 0.900463 0.724172 O\n0.760600 0.273682 0.678888 O\n0.349509 0.347196 0.591898 O\n",
"nsites": 34,
"nelements": 6,
"elements": [
"Na",
"H",
"Au",
"C",
"S",
"O"
],
"chemical_system": "Au-C-H-Na-O-S",
"density": 2.458430830998227,
"density_atomic": 0.08384657183187229,
"volume": 405.50256566453567,
"volume_molar": 7.18233390874405,
"formula_full": "Na1 H12 Au1 C4 S4 O12",
"formula_reduced": "NaH12AuC4(SO3)4",
"formula_anonymous": "ABC4D4E12F12",
"energy_above_hull": 3.444439957941176,
"spacegroup": 2
},
{
"id": "jvasp-57430",
"created_at": "2022-09-04T14:37:02.534880Z",
"updated_at": "2022-09-04T14:37:02.534911Z",
"structure_string": "Ba4 Mn4 Bi4 O2\n1.0\n2.410161 -4.174522 0.000000\n2.410161 4.174522 -0.000000\n-0.000000 0.000000 20.151322\nBa Mn Bi O\n4 4 4 2\ndirect\n0.000000 0.000000 0.250000 Ba\n0.000000 0.000000 0.750000 Ba\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.848644 Mn\n0.333333 0.666667 0.151356 Mn\n0.666667 0.333333 0.651356 Mn\n0.333333 0.666667 0.348644 Mn\n0.666667 0.333333 0.113102 Bi\n0.666667 0.333333 0.386898 Bi\n0.333333 0.666667 0.613102 Bi\n0.333333 0.666667 0.886898 Bi\n0.666667 0.333333 0.750000 O\n0.333333 0.666667 0.250000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Mn",
"Bi",
"O"
],
"chemical_system": "Ba-Bi-Mn-O",
"density": 6.703571988757607,
"density_atomic": 0.0345256360799707,
"volume": 405.4957877552847,
"volume_molar": 17.44251936749578,
"formula_full": "Ba4 Mn4 Bi4 O2",
"formula_reduced": "Ba2Mn2Bi2O",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 1.861658360394088,
"spacegroup": 194
},
{
"id": "jvasp-112047",
"created_at": "2022-09-04T14:38:42.089327Z",
"updated_at": "2022-09-04T14:38:42.089356Z",
"structure_string": "Ca2 H24 C16 O8\n1.0\n4.194802 -0.012818 0.104684\n0.368520 7.945648 0.937100\n0.059072 0.097604 12.175074\nCa H C O\n2 24 16 8\ndirect\n0.924373 0.495091 0.840984 Ca\n0.924373 -0.004908 0.840983 Ca\n0.816470 0.349115 0.463225 H\n0.818057 0.136285 0.521200 H\n0.818046 0.636285 0.521198 H\n0.267464 0.181780 0.602611 H\n0.267457 0.681780 0.602612 H\n0.265156 0.895617 0.549311 H\n0.265165 0.395617 0.549310 H\n0.322287 0.301055 0.355760 H\n0.322273 0.801055 0.355759 H\n0.348597 0.087948 0.411348 H\n0.348577 0.587949 0.411348 H\n0.816457 0.849114 0.463222 H\n0.861189 0.769662 0.262148 H\n0.861198 0.269667 0.262147 H\n0.447891 0.836988 0.115430 H\n0.149336 0.689661 0.110256 H\n0.149343 0.189646 0.110259 H\n0.416828 0.487772 0.231345 H\n0.447883 0.336983 0.115432 H\n0.776977 0.015423 0.155904 H\n0.776956 0.515423 0.155904 H\n0.905644 0.563645 0.330062 H\n0.905667 0.063652 0.330061 H\n0.416854 0.987769 0.231349 H\n0.493150 0.198265 0.386061 C\n0.406343 0.206271 0.106277 C\n0.406337 0.706277 0.106275 C\n0.582402 0.083768 0.196514 C\n0.582382 0.583769 0.196512 C\n0.727160 0.157803 0.293243 C\n0.727142 0.657800 0.293243 C\n0.493134 0.698265 0.386062 C\n0.423702 0.287378 0.578782 C\n0.660375 0.743300 0.487920 C\n0.423694 0.787378 0.578781 C\n0.534295 0.174901 0.992748 C\n0.534289 0.674903 0.992748 C\n0.567620 0.322590 0.685758 C\n0.567614 0.822590 0.685757 C\n0.660388 0.243299 0.487920 C\n0.426854 0.930350 0.741913 O\n0.828427 0.745655 0.717938 O\n0.828432 0.245655 0.717939 O\n0.403694 0.570725 0.938606 O\n0.403698 0.070727 0.938605 O\n0.793597 0.744098 0.957268 O\n0.793603 0.244098 0.957270 O\n0.426854 0.430350 0.741914 O\n",
"nsites": 50,
"nelements": 4,
"elements": [
"Ca",
"H",
"C",
"O"
],
"chemical_system": "C-Ca-H-O",
"density": 1.7387062631140675,
"density_atomic": 0.12332643343073638,
"volume": 405.42808714306506,
"volume_molar": 4.883090017666168,
"formula_full": "Ca2 H24 C16 O8",
"formula_reduced": "CaH12(C2O)4",
"formula_anonymous": "AB4C8D12",
"energy_above_hull": 4.4895313768,
"spacegroup": 1
}
]
}