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{
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"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=nelements&page=12175",
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"results": [
{
"id": "mp-1404407",
"created_at": "2022-09-04T14:48:24.348410Z",
"structure_string": "Li1 V1 Fe1 P2 H2 O10\n1.0\n5.216535 0.000000 0.000000\n-0.729339 5.250479 0.000000\n-1.945631 -2.851309 6.569425\nLi V Fe P H O\n1 1 1 2 2 10\ndirect\n0.774183 0.409363 0.154859 Li\n0.998737 0.997259 0.504243 V\n0.004344 0.005657 0.995766 Fe\n0.317695 0.643923 0.229434 P\n0.676499 0.355676 0.774099 P\n0.645739 0.939584 0.348631 H\n0.351657 0.035550 0.657197 H\n0.143615 0.971621 0.714589 O\n0.272025 0.808283 0.378560 O\n0.721092 0.658239 0.650243 O\n0.627717 0.749592 0.074748 O\n0.102852 0.664500 0.130208 O\n0.870358 0.331142 0.891369 O\n0.369080 0.239997 0.926220 O\n0.291976 0.341351 0.343425 O\n0.735836 0.197852 0.619927 O\n0.844824 0.048543 0.283943 O\n",
"nsites": 17,
"nelements": 6,
"elements": [
"Li",
"V",
"Fe",
"P",
"H",
"O"
],
"chemical_system": "Fe-H-Li-O-P-V",
"density": 3.1163938124770465,
"density_atomic": 0.09448013629589498,
"volume": 179.93200122784566,
"volume_molar": 6.373975521309291,
"formula_full": "Li1 V1 Fe1 P2 H2 O10",
"formula_reduced": "LiVFeP2(HO5)2",
"formula_anonymous": "ABCD2E2F10",
"energy": -73.32382398,
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"energy_uncorrected": -62.13982398,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.0445788,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:36.292000Z",
"spacegroup": 1
},
{
"id": "mp-1221464",
"created_at": "2022-09-04T14:39:05.342729Z",
"structure_string": "Na2 Ca5 Ti1 Si4 O16 F2\n1.0\n-5.809622 0.000000 0.000000\n-0.005923 -7.440916 0.000000\n1.939382 1.875309 9.406853\nNa Ca Ti Si O F\n2 5 1 4 16 2\ndirect\n0.998457 0.499684 0.000865 Na\n0.778504 0.593326 0.366081 Na\n0.509030 0.763871 0.012528 Ca\n0.497338 0.235523 0.990636 Ca\n0.792899 0.088560 0.360701 Ca\n0.208325 0.909164 0.638770 Ca\n0.210567 0.410045 0.634895 Ca\n0.001829 0.999927 0.996769 Ti\n0.250864 0.352556 0.283059 Si\n0.749198 0.646965 0.716213 Si\n0.249967 0.786225 0.278339 Si\n0.746814 0.214474 0.721130 Si\n0.751427 0.031754 0.105632 O\n0.248437 0.967782 0.896000 O\n0.527901 0.845053 0.320753 O\n0.466823 0.163605 0.674068 O\n0.522809 0.326336 0.355906 O\n0.473622 0.664431 0.645887 O\n0.216977 0.559716 0.245008 O\n0.785605 0.441002 0.757908 O\n0.164450 0.828331 0.116234 O\n0.832326 0.168581 0.882278 O\n0.090086 0.870694 0.389450 O\n0.919609 0.139690 0.613881 O\n0.192703 0.221645 0.123101 O\n0.806312 0.780957 0.876053 O\n0.075184 0.327698 0.387763 O\n0.941606 0.665926 0.620554 O\n0.683669 0.518543 0.104912 F\n0.306661 0.477936 0.884623 F\n",
"nsites": 30,
"nelements": 6,
"elements": [
"Na",
"Ca",
"Ti",
"Si",
"O",
"F"
],
"chemical_system": "Ca-F-Na-O-Si-Ti",
"density": 2.860746400602591,
"density_atomic": 0.07377387903841645,
"volume": 406.64799507665884,
"volume_molar": 8.162971553744754,
"formula_full": "Na2 Ca5 Ti1 Si4 O16 F2",
"formula_reduced": "Na2Ca5TiSi4(O8F)2",
"formula_anonymous": "AB2C2D4E5F16",
"energy": -222.22477457,
"energy_per_atom": -7.407492485666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -210.30877457,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.0009355,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:38.639000Z",
"spacegroup": 1
},
{
"id": "mp-761124",
"created_at": "2022-09-04T14:39:05.383059Z",
"structure_string": "K2 Li2 Mn2 P2 C2 O14\n1.0\n0.141714 0.000243 5.394190\n0.000908 6.317385 0.000260\n-9.992684 -0.001432 -0.021475\nK Li Mn P C O\n2 2 2 2 2 14\ndirect\n0.234752 0.424288 0.757125 K\n0.765265 0.924329 0.242881 K\n0.230035 0.913996 0.883761 Li\n0.770071 0.413965 0.116257 Li\n0.773746 0.783020 0.637818 Mn\n0.225635 0.282796 0.362230 Mn\n0.706231 0.277602 0.558443 P\n0.293704 0.777505 0.441565 P\n0.733750 0.733915 0.902810 C\n0.266372 0.233857 0.097202 C\n0.229091 0.177191 0.976115 O\n0.927946 0.768677 0.825935 O\n0.519208 0.758443 0.845108 O\n0.767093 0.088616 0.654530 O\n0.763083 0.472375 0.650950 O\n0.148052 0.773472 0.570016 O\n0.419775 0.278542 0.526551 O\n0.580240 0.778649 0.473398 O\n0.851964 0.273373 0.430003 O\n0.236959 0.972251 0.348967 O\n0.233127 0.588456 0.345502 O\n0.480868 0.258376 0.154894 O\n0.072040 0.268409 0.174072 O\n0.770991 0.677081 0.023847 O\n",
"nsites": 24,
"nelements": 6,
"elements": [
"K",
"Li",
"Mn",
"P",
"C",
"O"
],
"chemical_system": "C-K-Li-Mn-O-P",
"density": 2.4964675565641525,
"density_atomic": 0.07048391744152246,
"volume": 340.50320798232855,
"volume_molar": 8.543992698754742,
"formula_full": "K2 Li2 Mn2 P2 C2 O14",
"formula_reduced": "KLiMnPCO7",
"formula_anonymous": "ABCDEF7",
"energy": -179.19248712,
"energy_per_atom": -7.46635363,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -166.23848712,
"band_gap": 0.4788,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 8.0006378,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:41.337000Z",
"spacegroup": 4
},
{
"id": "mp-555611",
"created_at": "2022-09-04T14:48:23.287726Z",
"structure_string": "Cs12 K4 Re24 C24 S32 N24\n1.0\n-9.037956 9.037956 9.037956\n9.037956 -9.037956 9.037956\n9.037956 9.037956 -9.037956\nCs K Re C S N\n12 4 24 24 32 24\ndirect\n0.448533 0.250000 0.698533 Cs\n0.750000 0.301467 0.551467 Cs\n0.750000 0.801467 0.051467 Cs\n0.250000 0.698533 0.448533 Cs\n0.948533 0.250000 0.198533 Cs\n0.551467 0.750000 0.301467 Cs\n0.250000 0.198533 0.948533 Cs\n0.198533 0.948533 0.250000 Cs\n0.051467 0.750000 0.801467 Cs\n0.301467 0.551467 0.750000 Cs\n0.698533 0.448533 0.250000 Cs\n0.801467 0.051467 0.750000 Cs\n0.500000 0.000000 0.500000 K\n0.000000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.000000 K\n0.893320 0.862559 0.400406 Re\n0.507086 0.900406 0.037847 Re\n0.992914 0.030761 0.393320 Re\n0.962153 0.492914 0.099594 Re\n0.106680 0.137441 0.599594 Re\n0.537847 0.637441 0.530761 Re\n0.007086 0.969239 0.606680 Re\n0.492914 0.099594 0.962153 Re\n0.637441 0.530761 0.537847 Re\n0.599594 0.106680 0.137441 Re\n0.137441 0.599594 0.106680 Re\n0.099594 0.962153 0.492914 Re\n0.393320 0.992914 0.030761 Re\n0.530761 0.537847 0.637441 Re\n0.469239 0.462153 0.362559 Re\n0.037847 0.507086 0.900406 Re\n0.030761 0.393320 0.992914 Re\n0.606680 0.007086 0.969239 Re\n0.362559 0.469239 0.462153 Re\n0.462153 0.362559 0.469239 Re\n0.400406 0.893320 0.862559 Re\n0.862559 0.400406 0.893320 Re\n0.900406 0.037847 0.507086 Re\n0.969239 0.606680 0.007086 Re\n0.490103 0.220444 0.932567 C\n0.287877 0.720444 0.230340 C\n0.769660 0.712123 0.279556 C\n0.557537 0.567433 0.787877 C\n0.779556 0.067433 0.509897 C\n0.787877 0.557537 0.567433 C\n0.442463 0.432567 0.212123 C\n0.269660 0.990103 0.057537 C\n0.220444 0.932567 0.490103 C\n0.057537 0.269660 0.990103 C\n0.212123 0.442463 0.432567 C\n0.730340 0.009897 0.942463 C\n0.712123 0.279556 0.769660 C\n0.567433 0.787877 0.557537 C\n0.230340 0.287877 0.720444 C\n0.067433 0.509897 0.779556 C\n0.279556 0.769660 0.712123 C\n0.990103 0.057537 0.269660 C\n0.432567 0.212123 0.442463 C\n0.009897 0.942463 0.730340 C\n0.942463 0.730340 0.009897 C\n0.932567 0.490103 0.220444 C\n0.720444 0.230340 0.287877 C\n0.509897 0.779556 0.067433 C\n0.310204 0.310204 0.310204 S\n0.438126 0.633716 0.619904 S\n0.866284 0.304410 0.986188 S\n0.880096 0.513812 0.818223 S\n0.681777 0.195590 0.061874 S\n0.695590 0.013812 0.133716 S\n0.061874 0.681777 0.195590 S\n0.938126 0.318223 0.804410 S\n0.119904 0.486188 0.181777 S\n0.986188 0.866284 0.304410 S\n0.689796 0.689796 0.689796 S\n0.810204 0.500000 0.000000 S\n0.500000 0.000000 0.189796 S\n0.633716 0.619904 0.438126 S\n0.818223 0.880096 0.513812 S\n0.195590 0.061874 0.681777 S\n0.513812 0.818223 0.880096 S\n0.181777 0.119904 0.486188 S\n0.304410 0.986188 0.866284 S\n0.189796 0.500000 0.000000 S\n0.013812 0.133716 0.695590 S\n0.486188 0.181777 0.119904 S\n0.000000 0.189796 0.500000 S\n0.366284 0.380096 0.561874 S\n0.133716 0.695590 0.013812 S\n0.000000 0.810204 0.500000 S\n0.380096 0.561874 0.366284 S\n0.318223 0.804410 0.938126 S\n0.804410 0.938126 0.318223 S\n0.619904 0.438126 0.633716 S\n0.500000 0.000000 0.810204 S\n0.561874 0.366284 0.380096 S\n0.490451 0.292839 0.924711 N\n0.792839 0.302387 0.368128 N\n0.697613 0.631872 0.207161 N\n0.065741 0.197613 0.990451 N\n0.302387 0.368128 0.792839 N\n0.207161 0.697613 0.631872 N\n0.990451 0.065741 0.197613 N\n0.368128 0.792839 0.302387 N\n0.292839 0.924711 0.490451 N\n0.509549 0.707161 0.075289 N\n0.009549 0.934259 0.802387 N\n0.565741 0.575289 0.868128 N\n0.631872 0.207161 0.697613 N\n0.802387 0.009549 0.934259 N\n0.924711 0.490451 0.292839 N\n0.575289 0.868128 0.565741 N\n0.707161 0.075289 0.509549 N\n0.934259 0.802387 0.009549 N\n0.197613 0.990451 0.065741 N\n0.131872 0.434259 0.424711 N\n0.434259 0.424711 0.131872 N\n0.075289 0.509549 0.707161 N\n0.424711 0.131872 0.434259 N\n0.868128 0.565741 0.575289 N\n",
"nsites": 120,
"nelements": 6,
"elements": [
"Cs",
"K",
"Re",
"C",
"S",
"N"
],
"chemical_system": "C-Cs-K-N-Re-S",
"density": 4.425813750285946,
"density_atomic": 0.04063596584482194,
"volume": 2953.049041783538,
"volume_molar": 14.81973083400299,
"formula_full": "Cs12 K4 Re24 C24 S32 N24",
"formula_reduced": "Cs3KRe6C6(S4N3)2",
"formula_anonymous": "AB3C6D6E6F8",
"energy": -947.28764446,
"energy_per_atom": -7.894063703833334,
"energy_above_hull": null,
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"energy_uncorrected": -922.52764446,
"band_gap": 2.0687,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.3423842,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:14.573000Z",
"spacegroup": 206
},
{
"id": "mp-776560",
"created_at": "2022-09-04T14:39:07.399780Z",
"structure_string": "Li6 Mn3 V3 P6 O24 F6\n1.0\n12.852420 2.453147 6.718852\n-0.732225 5.298493 0.055697\n-2.034457 -2.804792 6.564727\nLi Mn V P O F\n6 3 3 6 24 6\ndirect\n0.026830 0.401315 0.785978 Li\n0.307560 0.266696 0.880242 Li\n0.360154 0.067993 0.451485 Li\n0.638513 0.932561 0.549463 Li\n0.693607 0.733355 0.117589 Li\n0.972749 0.597959 0.215346 Li\n0.334478 0.667991 0.668083 Mn\n0.497930 0.998936 0.999979 Mn\n0.833656 0.666806 0.666895 Mn\n0.000898 0.999491 0.002571 V\n0.166795 0.331286 0.332520 V\n0.665833 0.333541 0.333485 V\n0.148106 0.972074 0.613587 P\n0.186002 0.692748 0.049758 P\n0.518784 0.361747 0.721218 P\n0.480526 0.637470 0.280333 P\n0.813990 0.304147 0.947714 P\n0.852853 0.029619 0.387817 P\n0.093078 0.064364 0.819464 O\n0.120670 0.702727 0.489636 O\n0.116916 0.199023 0.536774 O\n0.080024 0.699581 0.035337 O\n0.237744 0.596289 0.843952 O\n0.252478 0.972349 0.629972 O\n0.212260 0.962619 0.174159 O\n0.215190 0.467789 0.129054 O\n0.414276 0.361329 0.699871 O\n0.427183 0.734560 0.486078 O\n0.451631 0.869133 0.208051 O\n0.545902 0.632154 0.843434 O\n0.453438 0.368195 0.157852 O\n0.550205 0.132249 0.792498 O\n0.574248 0.274004 0.514489 O\n0.586385 0.630688 0.297442 O\n0.784145 0.534582 0.876699 O\n0.786989 0.036076 0.823947 O\n0.747836 0.034566 0.368157 O\n0.759379 0.394731 0.154621 O\n0.919452 0.299195 0.968203 O\n0.883563 0.797942 0.457076 O\n0.880900 0.297841 0.509537 O\n0.907642 0.938028 0.180518 O\n0.047474 0.286665 0.216961 F\n0.373164 0.968638 0.892151 F\n0.283302 0.363091 0.434308 F\n0.705302 0.614224 0.542920 F\n0.628305 0.053070 0.123126 F\n0.961655 0.718563 0.789649 F\n",
"nsites": 48,
"nelements": 6,
"elements": [
"Li",
"Mn",
"V",
"P",
"O",
"F"
],
"chemical_system": "F-Li-Mn-O-P-V",
"density": 3.1677596596193,
"density_atomic": 0.08778434544085789,
"volume": 546.7945310629283,
"volume_molar": 6.860153401789889,
"formula_full": "Li6 Mn3 V3 P6 O24 F6",
"formula_reduced": "Li2MnVP2(O4F)2",
"formula_anonymous": "ABC2D2E2F8",
"energy": -359.78671047,
"energy_per_atom": -7.495556468125,
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"energy_uncorrected": -330.42271047,
"band_gap": 0.0947,
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"is_magnetic": true,
"total_magnetization": 17.9999998,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:24.085000Z",
"spacegroup": 1
},
{
"id": "mp-1265479",
"created_at": "2022-09-04T14:39:05.280379Z",
"structure_string": "Ba6 Yb6 Al13 Si11 N29 O13\n1.0\n6.351894 0.043373 0.022577\n-3.139148 5.365526 0.018799\n-0.027209 -0.157667 30.639498\nBa Yb Al Si N O\n6 6 13 11 29 13\ndirect\n0.343045 0.644552 0.039196 Ba\n0.310288 0.659286 0.708799 Ba\n0.327699 0.652907 0.393785 Ba\n0.673210 0.347880 0.553634 Ba\n0.674084 0.372915 0.877730 Ba\n0.690643 0.322101 0.217528 Ba\n0.388371 0.638157 0.272377 Yb\n0.395007 0.761420 0.922827 Yb\n0.336815 0.672676 0.568551 Yb\n0.688137 0.326244 0.104821 Yb\n0.667750 0.331410 0.445247 Yb\n0.661044 0.334646 0.766581 Yb\n0.138154 0.814056 0.809381 Al\n0.129782 0.802779 0.484879 Al\n0.003562 0.993230 0.067642 Al\n0.185323 0.325597 0.483383 Al\n0.314290 0.200694 0.642135 Al\n0.334944 0.170837 0.317637 Al\n0.339811 0.184123 0.975812 Al\n0.848551 0.668542 0.318077 Al\n0.877880 0.694661 0.642342 Al\n0.854881 0.686010 0.974957 Al\n0.824965 0.135115 0.315739 Al\n0.783924 0.125867 0.645107 Al\n0.829055 0.159532 0.978518 Al\n0.160421 0.797201 0.147459 Si\n0.037977 0.022727 0.231780 Si\n0.986034 0.986284 0.404867 Si\n0.980241 0.002327 0.565745 Si\n0.975536 0.996814 0.731711 Si\n0.991920 0.013038 0.892499 Si\n0.183074 0.347631 0.808545 Si\n0.219125 0.337387 0.147705 Si\n0.632097 0.867801 0.805642 Si\n0.657522 0.865459 0.480375 Si\n0.625478 0.832517 0.140844 Si\n0.053059 0.012402 0.174025 N\n0.252675 0.056113 0.918887 N\n0.284501 0.219964 0.259885 N\n0.237181 0.257239 0.584777 N\n0.550757 0.524894 0.653965 N\n0.521010 0.523332 0.971141 N\n0.528425 0.535090 0.157710 N\n0.495399 0.549898 0.816247 N\n0.516221 0.550629 0.487966 N\n0.741388 0.988105 0.425024 N\n0.729024 0.960648 0.091938 N\n0.723163 0.979338 0.753022 N\n0.462858 0.969746 0.158286 N\n0.462634 0.977472 0.493746 N\n0.463290 0.997844 0.820960 N\n0.025151 0.776028 0.918790 N\n0.823043 0.753952 0.259564 N\n0.040255 0.781633 0.587017 N\n0.047759 0.479796 0.157904 N\n0.006704 0.475069 0.814529 N\n0.006687 0.473665 0.491677 N\n0.808012 0.085588 0.919648 N\n0.772727 0.984817 0.258242 N\n0.725173 0.976383 0.589720 N\n0.994266 0.017274 0.834217 N\n0.017771 0.014944 0.006384 N\n0.006491 0.997149 0.345080 N\n0.969851 0.986896 0.505794 N\n0.002191 0.018021 0.674497 N\n0.052470 0.763233 0.095936 O\n0.994920 0.738186 0.421234 O\n0.009327 0.769197 0.752485 O\n0.981774 0.471564 0.313528 O\n0.948089 0.453296 0.654714 O\n0.950232 0.475046 0.995349 O\n0.247238 0.260015 0.095740 O\n0.240309 0.222491 0.424450 O\n0.216271 0.245949 0.756573 O\n0.503476 0.012077 0.325243 O\n0.477540 0.047202 0.658887 O\n0.507176 0.028822 0.990633 O\n0.532871 0.494574 0.331924 O\n",
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],
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"density": 4.967009106633248,
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"updated_at": "2021-11-28T01:34:33.960000Z",
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},
{
"id": "mp-1198815",
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H\n0.750777 0.064607 0.382017 H\n0.750777 0.435393 0.882017 H\n0.249223 0.935393 0.617983 H\n0.318733 0.646884 0.084129 H\n0.681267 0.146884 0.415871 H\n0.681267 0.353116 0.915871 H\n0.318733 0.853116 0.584129 H\n0.950955 0.624377 0.024350 H\n0.049045 0.124377 0.475650 H\n0.049045 0.375623 0.975650 H\n0.950955 0.875623 0.524350 H\n0.122220 0.630212 0.010017 H\n0.877780 0.130212 0.489983 H\n0.877780 0.369788 0.989983 H\n0.122220 0.869788 0.510017 H\n0.060298 0.548430 0.046289 H\n0.939702 0.048430 0.453711 H\n0.939702 0.451570 0.953711 H\n0.060298 0.951570 0.546289 H\n0.883361 0.620305 0.144810 H\n0.116639 0.120305 0.355190 H\n0.116639 0.379695 0.855190 H\n0.883361 0.879695 0.644810 H\n0.005034 0.544452 0.140965 H\n0.994966 0.044452 0.359035 H\n0.994966 0.455548 0.859035 H\n0.005034 0.955548 0.640965 H\n0.022070 0.621640 0.188388 H\n0.977930 0.121640 0.311612 H\n0.977930 0.378360 0.811612 H\n0.022070 0.878360 0.688388 H\n0.488857 0.210574 0.653734 Ir\n0.511143 0.710574 0.846266 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C\n0.205412 0.188160 0.205863 C\n0.619084 0.404109 0.631572 C\n0.380916 0.904109 0.868428 C\n0.380916 0.595891 0.368428 C\n0.619084 0.095891 0.131572 C\n0.532041 0.385587 0.735897 C\n0.467959 0.885587 0.764103 C\n0.467959 0.614413 0.264103 C\n0.532041 0.114413 0.235897 C\n0.764295 0.310850 0.704275 C\n0.235705 0.810851 0.795725 C\n0.235705 0.689149 0.295725 C\n0.764295 0.189149 0.204275 C\n0.743411 0.731513 0.066836 C\n0.256589 0.231513 0.433164 C\n0.256589 0.268487 0.933164 C\n0.743411 0.768487 0.566836 C\n0.776723 0.894225 0.053284 C\n0.223277 0.394225 0.446716 C\n0.223277 0.105775 0.946716 C\n0.776723 0.605775 0.553284 C\n0.893256 0.790089 0.979703 C\n0.106744 0.290089 0.520297 C\n0.106744 0.209911 0.020297 C\n0.893256 0.709911 0.479703 C\n0.251816 0.629159 0.115465 C\n0.748184 0.129159 0.384535 C\n0.748184 0.370841 0.884535 C\n0.251816 0.870841 0.615465 C\n0.050610 0.612058 0.039547 C\n0.949390 0.112058 0.460453 C\n0.949390 0.387942 0.960453 C\n0.050610 0.887942 0.539547 C\n0.989201 0.607582 0.148275 C\n0.010799 0.107582 0.351725 C\n0.010799 0.392418 0.851725 C\n0.989201 0.892418 0.648275 C\n0.283852 0.089197 0.554377 Cl\n0.716148 0.589197 0.945623 Cl\n0.716148 0.910803 0.445623 Cl\n0.283852 0.410803 0.054377 Cl\n0.973828 0.012338 0.139257 Cl\n0.026172 0.512338 0.360743 Cl\n0.026172 0.987662 0.860743 Cl\n0.973828 0.487662 0.639257 Cl\n",
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"elements": [
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],
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"density": 1.485688866768228,
"density_atomic": 0.06933784193959255,
"volume": 4384.330280495984,
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"formula_full": "B64 P16 H144 Ir8 C64 Cl8",
"formula_reduced": "B8P2H18IrC8Cl",
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"energy": -1625.61263646,
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"updated_at": "2021-11-28T01:34:23.591000Z",
"spacegroup": 14
},
{
"id": "mp-1199396",
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"elements": [
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"chemical_system": "C-Cl-H-N-O-Y",
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"density_atomic": 0.08708626032173551,
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"volume_molar": 6.915144521938965,
"formula_full": "Y2 H48 C18 N12 Cl6 O6",
"formula_reduced": "YH24C9N6(ClO)3",
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"total_magnetization": 5.17e-05,
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"updated_at": "2021-11-28T01:34:27.337000Z",
"spacegroup": 148
},
{
"id": "mp-1208085",
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]
}