{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=619","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=617","results":[{"id":"jvasp-24282","created_at":"2022-09-04T14:38:02.053430Z","updated_at":"2022-09-04T14:38:02.053452Z","structure_string":"Cd4 B8 Xe4 F40\n1.0\n0.000000 8.722806 -0.014290\n9.157830 0.000000 0.000000\n0.000000 -3.814853 -9.955305\nCd B Xe F\n4 8 4 40\ndirect\n0.654392 0.537310 0.362153 Cd\n0.154392 0.962689 0.362153 Cd\n0.845609 0.037310 0.637848 Cd\n0.345609 0.462689 0.637848 Cd\n0.475323 0.220887 0.423756 B\n0.524678 0.779113 0.576244 B\n0.709908 0.902663 0.288804 B\n0.975323 0.279113 0.423756 B\n0.790093 0.402663 0.711197 B\n0.290093 0.097337 0.711197 B\n0.209908 0.597337 0.288804 B\n0.024678 0.720887 0.576244 B\n0.652499 0.293097 0.048192 Xe\n0.347502 0.706903 0.951809 Xe\n0.152499 0.206903 0.048192 Xe\n0.847502 0.793097 0.951809 Xe\n0.273964 0.078447 0.574297 F\n0.409004 0.845752 0.463155 F\n0.356465 0.240900 0.750813 F\n0.112824 0.827935 0.532765 F\n0.365813 0.115354 0.343708 F\n0.369592 0.591463 0.278959 F\n0.051815 0.207449 0.344016 F\n0.865813 0.384646 0.343708 F\n0.391211 0.993733 0.793266 F\n0.643536 0.759100 0.249187 F\n0.229745 0.373427 0.957654 F\n0.551815 0.292550 0.344016 F\n0.590997 0.154248 0.536846 F\n0.270255 0.873427 0.042347 F\n0.608790 0.006267 0.206735 F\n0.887177 0.172064 0.467236 F\n0.226037 0.578447 0.425704 F\n0.909004 0.654248 0.463155 F\n0.072012 0.031520 0.143233 F\n0.948186 0.792550 0.655985 F\n0.130409 0.091463 0.721042 F\n0.108790 0.493733 0.206735 F\n0.572012 0.468480 0.143233 F\n0.869592 0.908537 0.278959 F\n0.427988 0.531520 0.856768 F\n0.612824 0.672064 0.532765 F\n0.143536 0.740900 0.249187 F\n0.448186 0.707449 0.655985 F\n0.726037 0.921553 0.425704 F\n0.927989 0.968480 0.856768 F\n0.770255 0.626573 0.042347 F\n0.891211 0.506267 0.793266 F\n0.387177 0.327935 0.467236 F\n0.773964 0.421553 0.574297 F\n0.729746 0.126573 0.957654 F\n0.134188 0.615354 0.656293 F\n0.856465 0.259100 0.750813 F\n0.630409 0.408537 0.721042 F\n0.634188 0.884646 0.656293 F\n0.090997 0.345752 0.536846 F\n","nsites":56,"nelements":4,"elements":["Cd","B","Xe","F"],"chemical_system":"B-Cd-F-Xe","density":3.8004970215957776,"density_atomic":0.07037398034288814,"volume":795.7486520891276,"volume_molar":8.55733998653749,"formula_full":"Cd4 B8 Xe4 F40","formula_reduced":"CdB2XeF10","formula_anonymous":"ABC2D10","energy_above_hull":0.1742237565476188,"spacegroup":14},{"id":"jvasp-46782","created_at":"2022-09-04T14:38:04.924838Z","updated_at":"2022-09-04T14:38:04.924864Z","structure_string":"Mn4 O4 F8\n1.0\n0.000000 5.661465 -0.296244\n4.872729 0.000000 0.000000\n0.000000 -1.912220 -7.144620\nMn O F\n4 4 8\ndirect\n0.393135 0.996410 0.689613 Mn\n0.893135 0.503590 0.689613 Mn\n0.106866 0.496410 0.310386 Mn\n0.606866 0.003590 0.310386 Mn\n-0.002548 0.396643 0.939518 O\n0.497453 0.103358 0.939518 O\n0.502548 0.896643 0.060482 O\n0.002548 0.603358 0.060482 O\n0.096109 0.835527 0.732932 F\n0.596109 0.664473 0.732932 F\n0.181846 0.337414 0.585666 F\n0.681846 0.162586 0.585666 F\n0.318155 0.837414 0.414333 F\n0.818155 0.662586 0.414333 F\n0.403892 0.335527 0.267068 F\n0.903892 0.164473 0.267068 F\n","nsites":16,"nelements":3,"elements":["Mn","O","F"],"chemical_system":"F-Mn-O","density":3.620372653750341,"density_atomic":0.08005707461840139,"volume":199.85741517867487,"volume_molar":7.522309288348379,"formula_full":"Mn4 O4 F8","formula_reduced":"MnOF2","formula_anonymous":"ABC2","energy_above_hull":1.1150103265948277,"spacegroup":14},{"id":"jvasp-45782","created_at":"2022-09-04T14:38:02.838421Z","updated_at":"2022-09-04T14:38:02.838442Z","structure_string":"Mn6 O4 F12\n1.0\n0.000000 5.388142 -0.012666\n4.674014 0.000000 0.000000\n0.000000 -0.912617 -9.932786\nMn O F\n6 4 12\ndirect\n0.500000 0.500000 0.000000 Mn\n0.261863 0.973312 0.756609 Mn\n0.738136 0.473312 0.743392 Mn\n0.500000 0.000000 0.500000 Mn\n0.261863 0.526687 0.256609 Mn\n0.738136 0.026687 0.243392 Mn\n0.477705 0.674783 0.823364 O\n0.522294 0.174784 0.676637 O\n0.477706 0.825215 0.323364 O\n0.522294 0.325216 0.176637 O\n0.021446 0.232731 0.190839 F\n0.978554 0.732730 0.309161 F\n0.778971 0.182979 0.425108 F\n0.302370 0.325104 0.420978 F\n0.697629 0.674895 0.579022 F\n0.302370 0.174896 0.920979 F\n0.021446 0.267269 0.690840 F\n0.978553 0.767268 0.809161 F\n0.778971 0.317020 0.925108 F\n0.221028 0.682979 0.074893 F\n0.221028 0.817020 0.574893 F\n0.697629 0.825103 0.079022 F\n","nsites":22,"nelements":3,"elements":["Mn","O","F"],"chemical_system":"F-Mn-O","density":4.125445746586722,"density_atomic":0.08792831905512782,"volume":250.20380505860473,"volume_molar":6.848920603411444,"formula_full":"Mn6 O4 F12","formula_reduced":"Mn3(OF3)2","formula_anonymous":"A2B3C6","energy_above_hull":1.6237618562852665,"spacegroup":14},{"id":"jvasp-29390","created_at":"2022-09-04T14:38:03.870427Z","updated_at":"2022-09-04T14:38:03.870454Z","structure_string":"Mg8 Si8 O24\n1.0\n4.979775 0.000000 -1.673245\n0.000000 8.924212 0.000000\n-0.571764 0.000000 9.845198\nMg Si O\n8 8 24\ndirect\n0.691859 0.843202 0.278647 Mg\n0.191858 0.656797 0.278647 Mg\n0.349599 0.510955 0.767143 Mg\n0.308143 0.156797 0.721353 Mg\n0.808143 0.343203 0.721353 Mg\n0.650403 0.489045 0.232857 Mg\n0.150403 0.010955 0.232857 Mg\n0.849599 0.989045 0.767143 Mg\n0.242723 0.834332 0.569455 Si\n0.757278 0.165667 0.430545 Si\n0.292302 0.211430 0.985917 Si\n0.207699 0.711430 0.014083 Si\n0.742724 0.665667 0.569455 Si\n0.792302 0.288569 0.985917 Si\n0.257278 0.334332 0.430545 Si\n0.707700 0.788569 0.014083 Si\n0.463789 0.685293 0.618716 O\n0.889705 0.769733 0.906916 O\n0.110297 0.230267 0.093084 O\n0.289379 0.830459 0.150530 O\n0.765825 0.947093 0.100213 O\n0.111780 0.842579 0.390886 O\n0.388221 0.342579 0.609114 O\n0.568947 0.027457 0.348364 O\n0.610297 0.269733 0.093084 O\n0.036213 0.185293 0.381285 O\n0.710622 0.169541 0.849470 O\n0.963789 0.814706 0.618715 O\n0.536213 0.314706 0.381284 O\n0.931055 0.527457 0.651635 O\n0.234177 0.052907 0.899787 O\n0.431054 0.972542 0.651636 O\n0.888221 0.157421 0.609114 O\n0.789380 0.669541 0.150530 O\n0.068947 0.472543 0.348365 O\n0.734177 0.447093 0.899786 O\n0.611781 0.657421 0.390886 O\n0.210622 0.330459 0.849470 O\n0.389704 0.730267 0.906916 O\n0.265824 0.552907 0.100214 O\n","nsites":40,"nelements":3,"elements":["Mg","Si","O"],"chemical_system":"Mg-O-Si","density":3.108696910331877,"density_atomic":0.093242617847752,"volume":428.98838453155213,"volume_molar":6.458571090135035,"formula_full":"Mg8 Si8 O24","formula_reduced":"MgSiO3","formula_anonymous":"ABC3","energy_above_hull":1.44345163,"spacegroup":14},{"id":"jvasp-33530","created_at":"2022-09-04T14:38:02.953098Z","updated_at":"2022-09-04T14:38:02.953130Z","structure_string":"Si2 H20 O8 F12\n1.0\n5.804642 0.000000 -1.557941\n0.000000 9.946337 0.000000\n0.058102 0.000000 6.447332\nSi H O F\n2 20 8 12\ndirect\n-0.000000 0.500000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.610313 0.356008 0.631815 H\n0.389686 0.643992 0.368185 H\n0.610313 0.143992 0.131815 H\n0.744874 0.224495 0.736173 H\n0.255125 0.724495 0.763827 H\n0.255125 0.775505 0.263827 H\n0.744874 0.275505 0.236173 H\n0.432658 0.191860 0.628377 H\n0.567341 0.691860 0.871622 H\n0.389686 0.856009 0.868185 H\n0.432658 0.308140 0.128377 H\n0.173724 0.114862 0.649750 H\n0.826275 0.614862 0.850250 H\n0.826276 0.885139 0.350250 H\n0.173724 0.385138 0.149750 H\n0.216291 0.122302 0.410481 H\n0.783709 0.622302 0.089519 H\n0.783708 0.877699 0.589518 H\n0.216291 0.377698 0.910481 H\n0.567342 0.808140 0.371623 H\n0.597824 0.273915 0.715705 O\n0.402175 0.773915 0.784295 O\n0.402176 0.726086 0.284295 O\n0.597824 0.226085 0.215705 O\n0.706420 0.612982 0.933156 O\n0.706420 0.887018 0.433156 O\n0.293580 0.387018 0.066844 O\n0.293579 0.112982 0.566844 O\n0.969179 0.394473 0.279528 F\n0.066040 0.363987 0.668493 F\n0.933959 0.863987 0.831507 F\n0.933959 0.636013 0.331507 F\n0.066040 0.136013 0.168493 F\n0.282679 0.519838 0.509479 F\n0.717320 0.019838 0.990520 F\n0.717320 0.480162 0.490520 F\n0.282680 0.980162 0.009480 F\n0.030820 0.605527 0.720472 F\n0.969179 0.105527 0.779528 F\n0.030820 0.894473 0.220472 F\n","nsites":42,"nelements":4,"elements":["Si","H","O","F"],"chemical_system":"F-H-O-Si","density":1.9238552076980504,"density_atomic":0.11255932378776312,"volume":373.1365700027955,"volume_molar":5.350192731572449,"formula_full":"Si2 H20 O8 F12","formula_reduced":"SiH10(O2F3)2","formula_anonymous":"AB4C6D10","energy_above_hull":2.1897530616666665,"spacegroup":14},{"id":"jvasp-35267","created_at":"2022-09-04T14:38:03.020727Z","updated_at":"2022-09-04T14:38:03.020751Z","structure_string":"Na8 Zn4 S8\n1.0\n0.000000 6.853022 0.031372\n7.055452 0.000000 0.000000\n0.000000 -0.529329 -8.799031\nNa Zn S\n8 4 8\ndirect\n0.546607 0.674967 0.678225 Na\n0.953392 0.174967 0.321775 Na\n0.453392 0.325033 0.321775 Na\n0.046607 0.825033 0.678225 Na\n0.512219 0.764262 0.052873 Na\n0.987781 0.264263 0.947127 Na\n0.487781 0.235737 0.947127 Na\n0.012219 0.735737 0.052873 Na\n0.344237 0.903463 0.370420 Zn\n0.155762 0.403463 0.629580 Zn\n0.655762 0.096536 0.629580 Zn\n0.844237 0.596536 0.370420 Zn\n0.302624 0.106654 0.591571 S\n0.197375 0.606654 0.408429 S\n0.697375 0.893346 0.408430 S\n0.802624 0.393346 0.591571 S\n0.246252 0.044452 0.143656 S\n0.253748 0.544452 0.856344 S\n0.753748 0.955547 0.856344 S\n0.746252 0.455547 0.143657 S\n","nsites":20,"nelements":3,"elements":["Na","Zn","S"],"chemical_system":"Na-S-Zn","density":2.74100536206762,"density_atomic":0.047022725506421684,"volume":425.3262605390385,"volume_molar":12.806873049452618,"formula_full":"Na8 Zn4 S8","formula_reduced":"Na2ZnS2","formula_anonymous":"AB2C2","energy_above_hull":0.0,"spacegroup":14},{"id":"jvasp-9154","created_at":"2022-09-04T14:38:03.149166Z","updated_at":"2022-09-04T14:38:03.149199Z","structure_string":"Ti4 O8\n1.0\n0.000000 4.830002 -0.014882\n4.902779 0.000000 0.000000\n0.000000 -0.874713 -4.985349\nTi O\n4 8\ndirect\n0.721794 0.553392 0.286272 Ti\n0.278206 0.053392 0.213728 Ti\n0.278206 0.446608 0.713728 Ti\n0.721794 0.946608 0.786272 Ti\n0.556043 0.258300 0.031485 O\n0.443957 0.758300 0.468514 O\n0.443957 0.741700 0.968514 O\n0.556043 0.241700 0.531485 O\n0.934597 0.673713 0.652128 O\n0.065403 0.173713 0.847872 O\n0.065403 0.326287 0.347872 O\n0.934597 0.826287 0.152128 O\n","nsites":12,"nelements":2,"elements":["Ti","O"],"chemical_system":"O-Ti","density":4.491072026772867,"density_atomic":0.10159242598660942,"volume":118.11904168507289,"volume_molar":5.927745795531804,"formula_full":"Ti4 O8","formula_reduced":"TiO2","formula_anonymous":"AB2","energy_above_hull":1.4849317777777782,"spacegroup":14},{"id":"jvasp-31840","created_at":"2022-09-04T14:38:03.341229Z","updated_at":"2022-09-04T14:38:03.341239Z","structure_string":"Cu2 Sb4 H24 O12 F16\n1.0\n4.860533 -0.014871 0.000000\n-1.253237 6.736587 0.000000\n0.000000 0.000000 18.108916\nCu Sb H O F\n2 4 24 12 16\ndirect\n-0.000000 0.500000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.129307 0.972199 0.781556 Sb\n0.870692 0.027802 0.218444 Sb\n0.370692 0.527802 0.281556 Sb\n0.629307 0.472199 0.718444 Sb\n0.435245 0.682689 0.939217 H\n0.276498 0.156898 0.980131 H\n0.634818 0.646864 0.440518 H\n0.828962 0.158537 0.389534 H\n0.211454 0.978156 0.379609 H\n0.288545 0.521845 0.879609 H\n0.110896 0.797111 0.086993 H\n0.328962 0.658537 0.110466 H\n0.171037 0.841464 0.610466 H\n0.134819 0.146864 0.059483 H\n0.711454 0.478156 0.120391 H\n0.610896 0.297111 0.413007 H\n0.064754 0.817312 0.439217 H\n0.788545 0.021845 0.620391 H\n0.365180 0.353137 0.559483 H\n0.865180 0.853137 0.940518 H\n0.223502 0.343102 0.480131 H\n0.389103 0.702890 0.586993 H\n0.935245 0.182689 0.560783 H\n0.889103 0.202890 0.913007 H\n0.723501 0.843103 0.019869 H\n0.776497 0.656898 0.519869 H\n0.564754 0.317312 0.060783 H\n0.671037 0.341464 0.889534 H\n0.746832 0.114820 0.581662 O\n0.246832 0.614821 0.918339 O\n0.775336 0.298860 0.932175 O\n0.253167 0.885180 0.418339 O\n0.224662 0.701141 0.067825 O\n0.767753 0.732510 0.473837 O\n0.753167 0.385180 0.081662 O\n0.232246 0.267490 0.526164 O\n0.724662 0.201141 0.432175 O\n0.732246 0.767490 0.973837 O\n0.275336 0.798860 0.567825 O\n0.267753 0.232510 0.026163 O\n0.447263 0.376853 0.822776 F\n0.552735 0.623147 0.177224 F\n0.052736 0.123147 0.322776 F\n0.174923 0.254736 0.187619 F\n0.903242 0.960743 0.101453 F\n0.674922 0.754736 0.312381 F\n0.839428 0.140156 0.777936 F\n0.660571 0.359844 0.277936 F\n0.160571 0.859845 0.222064 F\n0.947263 0.876854 0.677224 F\n0.825076 0.745265 0.812381 F\n0.596756 0.539258 0.601453 F\n0.403243 0.460743 0.398547 F\n0.325077 0.245264 0.687619 F\n0.339428 0.640156 0.722065 F\n0.096756 0.039257 0.898547 F\n","nsites":58,"nelements":5,"elements":["Cu","Sb","H","O","F"],"chemical_system":"Cu-F-H-O-Sb","density":3.178367545117737,"density_atomic":0.09787211703370854,"volume":592.6100482737487,"volume_molar":6.153070907749845,"formula_full":"Cu2 Sb4 H24 O12 F16","formula_reduced":"CuSb2H12(O3F4)2","formula_anonymous":"AB2C6D8E12","energy_above_hull":2.02878503137931,"spacegroup":14},{"id":"jvasp-37764","created_at":"2022-09-04T14:38:03.390395Z","updated_at":"2022-09-04T14:38:03.390413Z","structure_string":"Na6 Dy2 Cl12\n1.0\n0.000000 6.750266 -0.002178\n7.261327 0.000000 0.000000\n0.000000 -6.560373 -10.091726\nNa Dy Cl\n6 2 12\ndirect\n0.710387 0.913343 0.242904 Na\n0.289614 0.413343 0.257097 Na\n0.289615 0.086657 0.757097 Na\n0.710387 0.586657 0.742904 Na\n0.500001 0.000000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.000000 0.000000 0.000000 Dy\n0.000000 0.500000 0.500000 Dy\n0.246995 0.808446 0.578990 Cl\n0.753007 0.308446 0.921011 Cl\n0.388303 0.320360 0.569034 Cl\n0.611699 0.820360 0.930967 Cl\n0.611698 0.679640 0.430966 Cl\n0.094901 0.062581 0.241680 Cl\n0.094901 0.437419 0.741680 Cl\n0.905101 0.937419 0.758321 Cl\n0.246995 0.691554 0.078990 Cl\n0.905101 0.562581 0.258321 Cl\n0.388303 0.179640 0.069034 Cl\n0.753006 0.191554 0.421010 Cl\n","nsites":20,"nelements":3,"elements":["Na","Dy","Cl"],"chemical_system":"Cl-Dy-Na","density":2.9816167704211827,"density_atomic":0.04042374820967617,"volume":494.75867245810304,"volume_molar":14.897531838867158,"formula_full":"Na6 Dy2 Cl12","formula_reduced":"Na3DyCl6","formula_anonymous":"AB3C6","energy_above_hull":0.0,"spacegroup":14},{"id":"jvasp-45919","created_at":"2022-09-04T14:38:03.410213Z","updated_at":"2022-09-04T14:38:03.410245Z","structure_string":"Fe4 O4 F4\n1.0\n0.000000 5.006404 -0.034574\n4.547129 0.000000 0.000000\n0.000000 -0.100599 -5.532766\nFe O F\n4 4 4\ndirect\n0.215501 0.512214 0.633610 Fe\n0.215501 0.987786 0.133609 Fe\n0.784498 0.012214 0.866391 Fe\n0.784498 0.487786 0.366390 Fe\n0.088802 0.760190 0.868136 O\n0.088802 0.739810 0.368136 O\n0.911197 0.260190 0.631864 O\n0.911197 0.239810 0.131864 O\n0.415933 0.233758 0.881989 F\n0.415933 0.266242 0.381989 F\n0.584066 0.733758 0.618011 F\n0.584066 0.766242 0.118011 F\n","nsites":12,"nelements":3,"elements":["Fe","O","F"],"chemical_system":"F-Fe-O","density":4.790045244936837,"density_atomic":0.09526234012695126,"volume":125.9679321755923,"volume_molar":6.321638490062917,"formula_full":"Fe4 O4 F4","formula_reduced":"FeOF","formula_anonymous":"ABC","energy_above_hull":1.1214364275,"spacegroup":14},{"id":"jvasp-36686","created_at":"2022-09-04T14:38:03.568698Z","updated_at":"2022-09-04T14:38:03.568708Z","structure_string":"Ba4 W4 N12\n1.0\n0.000000 7.627640 -0.110562\n5.779235 0.000000 0.000000\n0.000000 -6.761468 -7.606365\nBa W N\n4 4 12\ndirect\n0.291081 0.736649 0.632526 Ba\n0.708918 0.263350 0.367474 Ba\n0.708917 0.236649 0.867473 Ba\n0.291082 0.763350 0.132526 Ba\n0.841395 0.761540 0.638797 W\n0.841395 0.738459 0.138797 W\n0.158603 0.261540 0.861202 W\n0.158604 0.238459 0.361202 W\n0.579976 0.934541 0.570551 N\n0.795320 0.748422 0.441990 N\n0.204679 0.248423 0.058009 N\n0.579977 0.565458 0.070551 N\n0.795320 0.751577 0.941990 N\n0.872897 0.435969 0.703935 N\n0.420022 0.434541 0.929448 N\n0.420022 0.065459 0.429448 N\n0.204679 0.251577 0.558009 N\n0.127102 0.564030 0.296064 N\n0.872897 0.064030 0.203935 N\n0.127101 0.935969 0.796064 N\n","nsites":20,"nelements":3,"elements":["Ba","W","N"],"chemical_system":"Ba-N-W","density":7.102998486112358,"density_atomic":0.058888733542873266,"volume":339.623537419755,"volume_molar":10.22630373875446,"formula_full":"Ba4 W4 N12","formula_reduced":"BaWN3","formula_anonymous":"ABC3","energy_above_hull":4.769717144,"spacegroup":14},{"id":"jvasp-33415","created_at":"2022-09-04T14:38:03.472914Z","updated_at":"2022-09-04T14:38:03.472931Z","structure_string":"P4 H24 N8 O8\n1.0\n6.895532 0.000000 -3.475957\n0.000000 8.203540 0.000000\n-0.093319 0.000000 7.046909\nP H N O\n4 24 8 8\ndirect\n0.866516 0.467925 0.852603 P\n0.133484 0.967925 0.647396 P\n0.133484 0.532075 0.147396 P\n0.866516 0.032075 0.352603 P\n0.347528 0.244154 0.229395 H\n0.652471 0.744154 0.270605 H\n0.652471 0.755846 0.770605 H\n0.347528 0.255846 0.729395 H\n0.478531 0.063978 0.291380 H\n0.521468 0.563978 0.208620 H\n0.478531 0.436022 0.791380 H\n0.240928 0.070300 0.101120 H\n0.759071 0.570300 0.398879 H\n0.759071 0.929700 0.898879 H\n0.240928 0.429700 0.601120 H\n0.521468 0.936022 0.708620 H\n0.697864 0.592759 0.130947 H\n0.697864 0.907241 0.630947 H\n0.302135 0.407241 0.869053 H\n0.795961 0.279022 0.457952 H\n0.204039 0.779022 0.042048 H\n0.204039 0.720978 0.542048 H\n0.795961 0.220978 0.957952 H\n0.930131 0.308034 0.329209 H\n0.069869 0.808034 0.170790 H\n0.069869 0.691966 0.670790 H\n0.930130 0.191966 0.829209 H\n0.302135 0.092759 0.369053 H\n0.342293 0.118035 0.249585 N\n0.657706 0.618035 0.250414 N\n0.657706 0.881964 0.750414 N\n0.342293 0.381964 0.749585 N\n0.171170 0.767072 0.656938 N\n0.171170 0.732928 0.156938 N\n0.828829 0.267072 0.843062 N\n0.828829 0.232928 0.343062 N\n0.304670 0.450568 0.129843 O\n0.902487 0.516256 0.665682 O\n0.097512 0.016256 0.834318 O\n0.097512 0.483744 0.334318 O\n0.902487 0.983744 0.165682 O\n0.695329 0.549432 0.870157 O\n0.304670 0.049432 0.629843 O\n0.695330 0.950568 0.370157 O\n","nsites":44,"nelements":4,"elements":["P","H","N","O"],"chemical_system":"H-N-O-P","density":1.6276923199702302,"density_atomic":0.11112038791511651,"volume":395.96694023072575,"volume_molar":5.419474205399857,"formula_full":"P4 H24 N8 O8","formula_reduced":"PH6(NO)2","formula_anonymous":"AB2C2D6","energy_above_hull":3.614726272727272,"spacegroup":14}]}