{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=55","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=53","results":[{"id":"jvasp-12682","created_at":"2022-09-04T14:37:11.005611Z","updated_at":"2022-09-04T14:37:11.005642Z","structure_string":"Li2 Ti2 P2 O8 F2\n1.0\n5.195155 -0.010697 -0.004141\n-0.740733 5.348901 -0.008787\n-2.371341 -2.427678 6.554340\nLi Ti P O F\n2 2 2 8 2\ndirect\n0.261350 0.613264 0.182736 Li\n0.738649 0.386735 0.817264 Li\n0.000000 0.000000 0.000000 Ti\n0.000000 -0.000000 0.500000 Ti\n0.319811 0.633668 0.765733 P\n0.680189 0.366331 0.234266 P\n0.370767 0.237941 0.082398 O\n0.681503 0.660515 0.335349 O\n0.318497 0.339484 0.664650 O\n0.763140 0.225592 0.389510 O\n0.629232 0.762057 0.917601 O\n0.236860 0.774406 0.610489 O\n0.874010 0.348287 0.109586 O\n0.125989 0.651712 0.890414 O\n0.139500 0.928516 0.267785 F\n0.860499 0.071483 0.732215 F\n","nsites":16,"nelements":5,"elements":["Li","Ti","P","O","F"],"chemical_system":"F-Li-O-P-Ti","density":3.0813017935140974,"density_atomic":0.08795487063835074,"volume":181.91147214334666,"volume_molar":6.846853069412828,"formula_full":"Li2 Ti2 P2 O8 F2","formula_reduced":"LiTiPO4F","formula_anonymous":"ABCDE4","energy_above_hull":2.128503514479166,"spacegroup":2},{"id":"jvasp-28782","created_at":"2022-09-04T14:37:30.857175Z","updated_at":"2022-09-04T14:37:30.857201Z","structure_string":"Te2 Mo3 W1 Se4 S2\n1.0\n3.345811 0.000000 0.000000\n-1.672906 2.897315 0.000599\n0.000000 0.007388 34.477785\nTe Mo W Se S\n2 3 1 4 2\ndirect\n0.333486 0.666974 0.717126 Te\n0.333506 0.667015 0.606820 Te\n0.333126 0.666254 0.091660 Mo\n0.666627 0.333256 0.282653 Mo\n0.666829 0.333659 0.662062 Mo\n0.333417 0.666836 0.466597 W\n0.333096 0.666197 0.330982 Se\n0.666448 0.332898 0.043347 Se\n0.666425 0.332851 0.140036 Se\n0.333529 0.667059 0.234280 Se\n0.666831 0.333663 0.422354 S\n0.666666 0.333332 0.510831 S\n","nsites":12,"nelements":5,"elements":["Te","Mo","W","Se","S"],"chemical_system":"Mo-S-Se-Te-W","density":5.499124624162093,"density_atomic":0.03590416149355971,"volume":334.2230956195006,"volume_molar":16.772821058863098,"formula_full":"Te2 Mo3 W1 Se4 S2","formula_reduced":"Te2Mo3W(Se2S)2","formula_anonymous":"AB2C2D3E4","energy_above_hull":3.722818058333334,"spacegroup":156},{"id":"jvasp-23953","created_at":"2022-09-04T14:37:36.333329Z","updated_at":"2022-09-04T14:37:36.333339Z","structure_string":"Na8 Ga6 Si6 Cl2 O24\n1.0\n9.002544 0.000000 0.000000\n-0.000000 9.002544 -0.000000\n-0.000000 0.000000 9.002544\nNa Ga Si Cl O\n8 6 6 2 24\ndirect\n0.671511 0.328489 0.328489 Na\n0.328489 0.328489 0.671511 Na\n0.328489 0.671511 0.328489 Na\n0.171511 0.171511 0.171511 Na\n0.671511 0.671511 0.671511 Na\n0.828489 0.171511 0.828489 Na\n0.828489 0.828489 0.171511 Na\n0.171511 0.828489 0.828489 Na\n0.250000 0.000000 0.500000 Ga\n0.000000 0.500000 0.750000 Ga\n0.000000 0.500000 0.250000 Ga\n0.500000 0.250000 0.000000 Ga\n0.500000 0.750000 0.000000 Ga\n0.750000 0.000000 0.500000 Ga\n0.000000 0.250000 0.500000 Si\n0.000000 0.750000 0.500000 Si\n0.750000 0.500000 0.000000 Si\n0.500000 0.000000 0.250000 Si\n0.500000 0.000000 0.750000 Si\n0.250000 0.500000 0.000000 Si\n0.000000 0.000000 0.000000 Cl\n0.500000 0.500000 0.500000 Cl\n0.849543 0.576259 0.133021 O\n0.150456 0.423740 0.133021 O\n0.576259 0.866979 0.150456 O\n0.349543 0.633021 0.076259 O\n0.650456 0.366979 0.076259 O\n0.923740 0.349543 0.366979 O\n0.076259 0.349543 0.633021 O\n0.366979 0.076259 0.650456 O\n0.366979 0.923740 0.349543 O\n0.133021 0.150456 0.423740 O\n0.576259 0.133021 0.849543 O\n0.849543 0.423740 0.866979 O\n0.133021 0.849543 0.576259 O\n0.866979 0.150456 0.576259 O\n0.866979 0.849543 0.423740 O\n0.349543 0.366979 0.923740 O\n0.650456 0.633021 0.923740 O\n0.076259 0.650456 0.366979 O\n0.923740 0.650456 0.633021 O\n0.633021 0.076259 0.349543 O\n0.633021 0.923740 0.650456 O\n0.423740 0.866979 0.849543 O\n0.150456 0.576259 0.866979 O\n0.423740 0.133021 0.150456 O\n","nsites":46,"nelements":5,"elements":["Na","Ga","Si","Cl","O"],"chemical_system":"Cl-Ga-Na-O-Si","density":2.789482361656256,"density_atomic":0.06304665849401629,"volume":729.6183667587367,"volume_molar":9.551879360222646,"formula_full":"Na8 Ga6 Si6 Cl2 O24","formula_reduced":"Na4Ga3Si3ClO12","formula_anonymous":"AB3C3D4E12","energy_above_hull":1.792597601847826,"spacegroup":218},{"id":"jvasp-32178","created_at":"2022-09-04T14:37:36.904551Z","updated_at":"2022-09-04T14:37:36.904577Z","structure_string":"H16 Pt2 N4 Cl4 O4\n1.0\n5.750514 0.000000 -1.674774\n0.000000 6.765941 0.000000\n0.027520 0.000000 8.222376\nH Pt N Cl O\n16 2 4 4 4\ndirect\n0.646873 0.258430 0.441552 H\n0.812276 0.616784 0.718650 H\n0.812276 0.883215 0.218650 H\n0.187723 0.383215 0.281351 H\n0.877332 0.347550 0.080847 H\n0.122667 0.847550 0.419153 H\n0.122667 0.652450 0.919154 H\n0.877332 0.152450 0.580848 H\n0.187723 0.116785 0.781351 H\n0.141290 0.846531 0.630135 H\n0.141290 0.653469 0.130134 H\n0.858710 0.153469 0.369866 H\n0.646873 0.241570 0.941552 H\n0.353126 0.741570 0.558449 H\n0.858710 0.346531 0.869866 H\n0.353126 0.758429 0.058449 H\n0.000000 0.000000 0.000000 Pt\n0.000000 0.500000 0.500000 Pt\n0.177099 0.733986 0.031523 N\n0.177099 0.766014 0.531523 N\n0.822900 0.233986 0.468477 N\n0.822900 0.266014 0.968478 N\n0.349749 0.334455 0.621287 Cl\n0.650250 0.834455 0.878714 Cl\n0.650250 0.665544 0.378714 Cl\n0.349749 0.165545 0.121287 Cl\n0.055368 0.473937 0.267872 O\n0.944632 0.973937 0.232129 O\n0.944632 0.526062 0.732129 O\n0.055368 0.026062 0.767872 O\n","nsites":30,"nelements":5,"elements":["H","Pt","N","Cl","O"],"chemical_system":"Cl-H-N-O-Pt","density":3.464620513129578,"density_atomic":0.0936841069053421,"volume":320.22507329137306,"volume_molar":6.428134887473218,"formula_full":"H16 Pt2 N4 Cl4 O4","formula_reduced":"H8PtN2(ClO)2","formula_anonymous":"AB2C2D2E8","energy_above_hull":3.1506182023333333,"spacegroup":14},{"id":"jvasp-97546","created_at":"2022-09-04T14:36:04.419386Z","updated_at":"2022-09-04T14:36:04.419405Z","structure_string":"Cu2 H40 Se4 N4 O28\n1.0\n6.177943 0.000000 -1.728858\n0.000000 12.439054 0.000000\n-0.041080 0.000000 9.195583\nCu H Se N O\n2 40 4 4 28\ndirect\n0.500000 0.500000 -0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.384803 0.629953 0.730076 H\n0.615196 0.129954 0.769923 H\n0.884277 0.419092 0.682315 H\n0.115723 0.919092 0.817685 H\n0.115723 0.580908 0.317685 H\n0.884277 0.080908 0.182315 H\n0.896947 0.293091 0.755963 H\n0.103052 0.793091 0.744036 H\n0.103052 0.706909 0.244036 H\n0.896947 0.206909 0.255963 H\n0.705878 0.323803 0.592836 H\n0.294121 0.823803 0.907163 H\n0.294121 0.676197 0.407163 H\n0.705878 0.176197 0.092837 H\n0.037002 0.812453 0.908354 H\n0.037002 0.687546 0.408354 H\n0.962997 0.187547 0.091645 H\n0.384803 0.870046 0.230077 H\n0.615196 0.370046 0.269923 H\n0.962997 0.312453 0.591645 H\n0.176110 0.593806 0.778316 H\n0.181305 0.449107 0.098672 H\n0.818694 0.949107 0.401328 H\n0.818694 0.550893 0.901327 H\n0.823889 0.093806 0.721683 H\n0.181305 0.050893 0.598672 H\n0.188384 0.359809 0.979056 H\n0.811616 0.859809 0.520943 H\n0.188384 0.140191 0.479056 H\n0.509281 0.317430 0.871615 H\n0.811616 0.640191 0.020944 H\n0.490718 0.682570 0.128384 H\n0.509281 0.182570 0.371615 H\n0.442190 0.409291 0.742774 H\n0.557809 0.909291 0.757225 H\n0.557809 0.590708 0.257226 H\n0.442190 0.090709 0.242774 H\n0.823889 0.406194 0.221683 H\n0.176110 0.906194 0.278317 H\n0.490718 0.817430 0.628384 H\n0.247325 0.130978 0.925982 Se\n0.247325 0.369022 0.425982 Se\n0.752674 0.869022 0.074018 Se\n0.752674 0.630978 0.574018 Se\n0.136863 0.662522 0.342623 N\n0.863136 0.162522 0.157376 N\n0.863136 0.337477 0.657376 N\n0.136863 0.837477 0.842623 N\n0.323992 0.876907 0.317311 O\n0.676007 0.376907 0.182689 O\n0.541132 0.107561 0.345530 O\n0.458867 0.607561 0.154470 O\n0.458867 0.892439 0.654470 O\n0.541132 0.392439 0.845529 O\n0.211113 0.061474 0.498909 O\n0.788887 0.561474 0.001090 O\n0.788887 0.938526 0.501090 O\n0.211113 0.438526 -0.001091 O\n0.290611 0.050662 0.076170 O\n0.709388 0.550662 0.423830 O\n0.709388 0.949338 0.923829 O\n0.290611 0.449338 0.576170 O\n0.915256 0.733960 0.554189 O\n0.915256 0.766039 0.054189 O\n0.084743 0.266039 0.445810 O\n0.117282 0.061074 0.770887 O\n0.882717 0.561074 0.729112 O\n0.882717 0.938926 0.229112 O\n0.117282 0.438926 0.270887 O\n0.479910 0.183784 0.906529 O\n0.520090 0.683784 0.593470 O\n0.520090 0.816215 0.093471 O\n0.479910 0.316216 0.406529 O\n0.323992 0.623093 0.817310 O\n0.084743 0.233960 0.945810 O\n0.676007 0.123093 0.682689 O\n","nsites":78,"nelements":5,"elements":["Cu","H","Se","N","O"],"chemical_system":"Cu-H-N-O-Se","density":2.3228075153812164,"density_atomic":0.1105165609963131,"volume":705.7765758979971,"volume_molar":5.4490844681648225,"formula_full":"Cu2 H40 Se4 N4 O28","formula_reduced":"CuH20Se2(NO7)2","formula_anonymous":"AB2C2D14E20","energy_above_hull":3.2332808380341884,"spacegroup":14},{"id":"jvasp-97846","created_at":"2022-09-04T14:36:04.651692Z","updated_at":"2022-09-04T14:36:04.651734Z","structure_string":"Ca2 Cr4 Cu6 Sb4 O24\n1.0\n7.505579 -0.000000 -0.000000\n0.000000 7.505579 -0.000000\n0.000000 -0.000000 7.505579\nCa Cr Cu Sb O\n2 4 6 4 24\ndirect\n0.250000 0.250000 0.250000 Ca\n0.750000 0.750000 0.750000 Ca\n0.000000 0.500000 0.000000 Cr\n0.500000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.500000 0.500000 0.500000 Cr\n0.750000 0.250000 0.750000 Cu\n0.750000 0.250000 0.250000 Cu\n0.250000 0.750000 0.250000 Cu\n0.750000 0.750000 0.250000 Cu\n0.250000 0.750000 0.750000 Cu\n0.250000 0.250000 0.750000 Cu\n0.500000 0.500000 0.000000 Sb\n0.000000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.000000 0.500000 Sb\n0.948394 0.253278 0.073044 O\n0.948394 0.246722 0.426956 O\n0.073044 0.551606 0.246722 O\n0.551606 0.246722 0.073044 O\n0.753278 0.926956 0.448394 O\n0.551606 0.253278 0.426956 O\n0.753278 0.573044 0.051606 O\n0.746722 0.926956 0.051606 O\n0.573044 0.051606 0.753278 O\n0.051606 0.746722 0.926956 O\n0.051606 0.753278 0.573044 O\n0.926956 0.448394 0.753278 O\n0.448394 0.753278 0.926956 O\n0.426956 0.551606 0.253278 O\n0.926956 0.051606 0.746722 O\n0.448394 0.746722 0.573044 O\n0.746722 0.573044 0.448394 O\n0.246722 0.073044 0.551606 O\n0.246722 0.426956 0.948394 O\n0.253278 0.073044 0.948394 O\n0.426956 0.948394 0.246722 O\n0.253278 0.426956 0.551606 O\n0.573044 0.448394 0.746722 O\n0.073044 0.948394 0.253278 O\n","nsites":40,"nelements":5,"elements":["Ca","Cr","Cu","Sb","O"],"chemical_system":"Ca-Cr-Cu-O-Sb","density":6.049811555766381,"density_atomic":0.09460354047186494,"volume":422.8171567415702,"volume_molar":6.365661084101797,"formula_full":"Ca2 Cr4 Cu6 Sb4 O24","formula_reduced":"CaCr2Cu3(SbO6)2","formula_anonymous":"AB2C2D3E12","energy_above_hull":2.4474020385,"spacegroup":201},{"id":"jvasp-97867","created_at":"2022-09-04T14:36:04.289974Z","updated_at":"2022-09-04T14:36:04.290011Z","structure_string":"K4 Nb11 Al2 O20 F1\n1.0\n7.715780 0.000000 -4.404432\n-2.514201 7.294660 -4.404432\n-0.000582 -0.000815 8.959534\nK Nb Al O F\n4 11 2 20 1\ndirect\n0.500000 0.808217 0.000000 K\n0.191783 0.500000 0.000000 K\n0.808217 0.500000 0.000000 K\n0.500000 0.191783 0.000000 K\n0.324236 0.000728 0.324965 Nb\n0.316447 0.316446 0.632893 Nb\n0.000000 0.000000 0.000000 Nb\n0.000728 0.324236 0.324965 Nb\n0.324236 0.324236 0.324965 Nb\n0.683553 0.683553 0.367107 Nb\n0.000728 0.000728 0.324965 Nb\n0.675764 0.675763 0.675035 Nb\n0.999272 0.675763 0.675035 Nb\n0.675764 0.999271 0.675035 Nb\n0.999272 0.999271 0.675035 Nb\n0.250000 0.750000 0.500000 Al\n0.750000 0.250000 0.500000 Al\n0.170332 0.170332 0.000000 O\n0.834239 0.494555 0.668478 O\n0.165761 0.826078 0.331522 O\n0.173922 0.834239 0.668478 O\n0.165761 0.505444 0.331522 O\n0.839061 0.839060 0.347115 O\n0.491945 0.491945 0.652885 O\n0.494556 0.834239 0.668478 O\n0.160940 0.491945 0.652885 O\n0.508055 0.839060 0.347115 O\n0.839061 0.508054 0.347115 O\n0.829668 0.170332 0.000000 O\n0.829668 0.829668 0.000000 O\n0.508055 0.508054 0.347115 O\n0.160940 0.160939 0.652885 O\n0.505445 0.165761 0.331522 O\n0.826078 0.165761 0.331522 O\n0.834239 0.173922 0.668477 O\n0.491945 0.160939 0.652885 O\n0.170332 0.829668 0.000000 O\n0.500000 0.500000 0.000000 F\n","nsites":38,"nelements":5,"elements":["K","Nb","Al","O","F"],"chemical_system":"Al-F-K-Nb-O","density":5.174747721269667,"density_atomic":0.07536349245921883,"volume":504.2229169589347,"volume_molar":7.990793106169727,"formula_full":"K4 Nb11 Al2 O20 F1","formula_reduced":"K4Nb11Al2O20F","formula_anonymous":"AB2C4D11E20","energy_above_hull":3.6205245074342094,"spacegroup":139},{"id":"jvasp-35164","created_at":"2022-09-04T14:37:30.115888Z","updated_at":"2022-09-04T14:37:30.115925Z","structure_string":"Li4 Ca2 Mg1 Si2 N6\n1.0\n-0.022028 0.000000 -5.621906\n-2.930408 -4.903149 0.241172\n-2.930408 4.903149 0.241172\nLi Ca Mg Si N\n4 2 1 2 6\ndirect\n0.625653 0.988358 0.332416 Li\n0.625653 0.332416 0.988358 Li\n0.374349 0.011643 0.667585 Li\n0.374349 0.667585 0.011643 Li\n0.000000 0.322235 0.677765 Ca\n0.000000 0.677765 0.322235 Ca\n0.000000 0.000000 0.000000 Mg\n0.367998 0.319813 0.319813 Si\n0.632003 0.680188 0.680188 Si\n0.311345 0.623190 0.623190 N\n0.688656 0.376811 0.376811 N\n0.253009 0.031066 0.320787 N\n0.253009 0.320787 0.031066 N\n0.746992 0.968935 0.679214 N\n0.746992 0.679214 0.968935 N\n","nsites":15,"nelements":5,"elements":["Li","Ca","Mg","Si","N"],"chemical_system":"Ca-Li-Mg-N-Si","density":2.799349534155022,"density_atomic":0.0928184852285476,"volume":161.6057400965486,"volume_molar":6.488083429902612,"formula_full":"Li4 Ca2 Mg1 Si2 N6","formula_reduced":"Li4Ca2Mg(SiN3)2","formula_anonymous":"AB2C2D4E6","energy_above_hull":3.091970439333333,"spacegroup":12},{"id":"jvasp-11411","created_at":"2022-09-04T14:37:03.906104Z","updated_at":"2022-09-04T14:37:03.906133Z","structure_string":"Sr3 Sc2 Cu2 S2 O5\n1.0\n4.044359 0.000000 -0.626703\n-0.097113 4.043193 -0.626703\n-0.010843 -0.011106 13.293283\nSr Sc Cu S O\n3 2 2 2 5\ndirect\n0.500000 0.500000 0.000000 Sr\n0.644709 0.644707 0.289416 Sr\n0.355293 0.355291 0.710584 Sr\n0.923419 0.923417 0.846836 Sc\n0.076582 0.076582 0.153164 Sc\n0.250001 0.749999 0.500000 Cu\n0.750001 0.249999 0.500000 Cu\n0.802030 0.802028 0.604058 S\n0.197971 0.197970 0.395942 S\n0.000000 0.000000 0.000000 O\n0.413487 0.913484 0.826973 O\n0.913487 0.413485 0.826973 O\n0.086515 0.586514 0.173028 O\n0.586515 0.086514 0.173028 O\n","nsites":14,"nelements":5,"elements":["Sr","Sc","Cu","S","O"],"chemical_system":"Cu-O-S-Sc-Sr","density":4.767968486418981,"density_atomic":0.0644219863145532,"volume":217.3171117643316,"volume_molar":9.34795883286755,"formula_full":"Sr3 Sc2 Cu2 S2 O5","formula_reduced":"Sr3Sc2Cu2S2O5","formula_anonymous":"A2B2C2D3E5","energy_above_hull":1.446281987857143,"spacegroup":139},{"id":"jvasp-40648","created_at":"2022-09-04T14:37:57.685347Z","updated_at":"2022-09-04T14:37:57.685375Z","structure_string":"Li4 Nb3 Fe3 Sb2 O16\n1.0\n-6.067179 0.102228 0.019513\n2.877247 5.175638 -0.004079\n-0.002767 -0.136867 -10.404070\nLi Nb Fe Sb O\n4 3 3 2 16\ndirect\n0.674211 0.332260 0.900560 Li\n-0.009502 0.009419 0.004198 Li\n0.003228 0.012425 0.486506 Li\n0.335539 0.669322 0.391821 Li\n0.816962 0.643177 0.223798 Nb\n0.173281 0.805913 0.710070 Nb\n0.681143 0.830002 0.725010 Nb\n0.817957 0.181512 0.217798 Fe\n0.170428 0.352333 0.707204 Fe\n0.334464 0.160493 0.216582 Fe\n0.639550 0.294654 0.493441 Sb\n0.320183 0.647494 0.018977 Sb\n0.127772 0.311485 0.116504 O\n0.145502 0.831167 0.103001 O\n0.373810 0.693813 0.595249 O\n0.513925 0.509879 0.809322 O\n0.025192 0.519250 0.831846 O\n0.866629 0.701537 0.602335 O\n0.976896 0.491189 0.334999 O\n0.523306 0.032584 0.332978 O\n0.845729 0.152784 0.601427 O\n0.004187 0.994646 0.820166 O\n0.982320 0.003475 0.307463 O\n0.662361 0.340150 0.100083 O\n0.495794 0.983208 0.819869 O\n0.299810 0.135624 0.596311 O\n0.515125 0.498175 0.326828 O\n0.683900 0.862033 0.113502 O\n","nsites":28,"nelements":5,"elements":["Li","Nb","Fe","Sb","O"],"chemical_system":"Fe-Li-Nb-O-Sb","density":4.902301816162953,"density_atomic":0.084910283643446,"volume":329.75982176172187,"volume_molar":7.092357370148573,"formula_full":"Li4 Nb3 Fe3 Sb2 O16","formula_reduced":"Li4Nb3Fe3(SbO8)2","formula_anonymous":"A2B3C3D4E16","energy_above_hull":3.1984333178571425,"spacegroup":1},{"id":"jvasp-103898","created_at":"2022-09-04T14:37:02.015206Z","updated_at":"2022-09-04T14:37:02.015223Z","structure_string":"Al1 H16 C10 Cl1 O4\n1.0\n4.757365 -0.013961 0.833531\n0.641731 6.436852 2.552180\n0.043223 -0.203279 9.248469\nAl H C Cl O\n1 16 10 1 4\ndirect\n0.143802 0.746251 0.902399 Al\n0.349397 0.276375 0.390406 H\n0.502815 0.512411 0.495959 H\n0.532435 0.319064 0.676522 H\n-0.008337 0.299158 0.707497 H\n0.982992 0.524957 0.542660 H\n0.824079 0.201320 0.174403 H\n0.926281 0.951417 0.163428 H\n0.301984 0.084134 0.574583 H\n0.638808 0.836929 0.456684 H\n0.872384 0.243181 0.411572 H\n0.812642 0.048030 0.593593 H\n0.241290 0.169215 0.980086 H\n0.572670 0.272219 0.955398 H\n0.421579 0.875493 0.220928 H\n0.315029 0.123813 0.234569 H\n0.001376 0.875271 0.414049 H\n0.462594 0.131299 0.000795 C\n0.478863 0.035143 0.178758 C\n0.739033 0.117604 0.478715 C\n0.788168 0.954553 0.397500 C\n0.768229 0.040960 0.221530 C\n0.407880 0.374745 0.578615 C\n0.432626 0.208810 0.502205 C\n0.090804 0.562942 0.742392 C\n0.601587 0.983329 0.918768 C\n0.102316 0.435801 0.639897 C\n0.175300 0.561151 0.141909 Cl\n0.274941 0.695094 0.714141 O\n0.875399 0.959750 0.897593 O\n0.460534 0.882262 0.872217 O\n0.916846 0.545714 0.866384 O\n","nsites":32,"nelements":5,"elements":["Al","H","C","Cl","O"],"chemical_system":"Al-C-Cl-H-O","density":1.5281619973872167,"density_atomic":0.11211561935630324,"volume":285.41964254154504,"volume_molar":5.371366447043965,"formula_full":"Al1 H16 C10 Cl1 O4","formula_reduced":"AlH16C10ClO4","formula_anonymous":"ABC4D10E16","energy_above_hull":4.533354089609375,"spacegroup":1},{"id":"jvasp-91487","created_at":"2022-09-04T14:36:05.496143Z","updated_at":"2022-09-04T14:36:05.496162Z","structure_string":"Li8 Be6 As6 Cl2 O24\n1.0\n8.279692 -0.000000 0.000000\n-0.000000 8.279692 -0.000000\n-0.000000 -0.000000 8.279692\nLi Be As Cl O\n8 6 6 2 24\ndirect\n0.830509 0.830509 0.169491 Li\n0.330509 0.330509 0.669491 Li\n0.169491 0.169491 0.169491 Li\n0.669491 0.669491 0.669491 Li\n0.830509 0.169491 0.830509 Li\n0.330509 0.669491 0.330509 Li\n0.169491 0.830509 0.830509 Li\n0.669491 0.330509 0.330509 Li\n0.750000 0.000000 0.500000 Be\n0.000000 0.500000 0.750000 Be\n0.500000 0.250000 0.000000 Be\n0.500000 0.750000 0.000000 Be\n0.250000 0.000000 0.500000 Be\n0.000000 0.500000 0.250000 Be\n0.500000 0.000000 0.750000 As\n0.750000 0.500000 0.000000 As\n0.000000 0.750000 0.500000 As\n0.250000 0.500000 0.000000 As\n0.000000 0.250000 0.500000 As\n0.500000 0.000000 0.250000 As\n0.500000 0.500000 0.500000 Cl\n0.000000 0.000000 0.000000 Cl\n0.097607 0.634068 0.358555 O\n0.597607 0.141445 0.865932 O\n0.634068 0.641445 0.902393 O\n0.641445 0.902393 0.634068 O\n0.858555 0.134068 0.597607 O\n0.634068 0.358555 0.097607 O\n0.641445 0.097607 0.365932 O\n0.402393 0.858555 0.865932 O\n0.902393 0.634068 0.641445 O\n0.402393 0.141445 0.134068 O\n0.365932 0.358555 0.902393 O\n0.097607 0.365932 0.641445 O\n0.902393 0.365932 0.358555 O\n0.858555 0.865932 0.402393 O\n0.358555 0.097607 0.634068 O\n0.865932 0.402393 0.858555 O\n0.865932 0.597607 0.141445 O\n0.358555 0.902393 0.365932 O\n0.141445 0.134068 0.402393 O\n0.134068 0.402393 0.141445 O\n0.597607 0.858555 0.134068 O\n0.365932 0.641445 0.097607 O\n0.134068 0.597607 0.858555 O\n0.141445 0.865932 0.597607 O\n","nsites":46,"nelements":5,"elements":["Li","Be","As","Cl","O"],"chemical_system":"As-Be-Cl-Li-O","density":2.966566275520509,"density_atomic":0.08104295855030896,"volume":567.6002063947927,"volume_molar":7.430800735466291,"formula_full":"Li8 Be6 As6 Cl2 O24","formula_reduced":"Li4Be3As3ClO12","formula_anonymous":"AB3C3D4E12","energy_above_hull":2.359265200760869,"spacegroup":218}]}