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{
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"results": [
{
"id": "mp-1233016",
"created_at": "2022-09-04T14:45:54.194556Z",
"structure_string": "Sr2 Pr2 Mg1 Fe2 Ru2 O12\n1.0\n0.046885 -5.654546 0.307623\n-5.534458 0.048148 0.014774\n0.002511 0.411913 -8.939256\nSr Pr Mg Fe Ru O\n2 2 1 2 2 12\ndirect\n0.424761 0.516970 0.788418 Sr\n0.994129 0.019809 0.235059 Sr\n0.893951 0.030277 0.831823 Pr\n0.474212 0.478939 0.248258 Pr\n0.215237 0.021991 0.593283 Mg\n0.967756 0.520204 0.044669 Fe\n0.611997 0.970987 0.460625 Fe\n0.048987 0.502697 0.483540 Ru\n0.459439 0.996128 0.008785 Ru\n0.046275 0.335301 0.682886 O\n0.464482 0.048587 0.773836 O\n0.037609 0.586204 0.254731 O\n0.500949 0.908723 0.236912 O\n0.261288 0.233202 0.421138 O\n0.729107 0.252892 0.039564 O\n0.700975 0.734530 0.984642 O\n0.355438 0.706565 0.518314 O\n0.902205 0.825810 0.580729 O\n0.178033 0.761230 0.959892 O\n0.219331 0.264361 0.034811 O\n0.763836 0.296498 0.418090 O\n",
"nsites": 21,
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"elements": [
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"Pr",
"Mg",
"Fe",
"Ru",
"O"
],
"chemical_system": "Fe-Mg-O-Pr-Ru-Sr",
"density": 5.87482457640654,
"density_atomic": 0.07526055010308925,
"volume": 279.03064714827275,
"volume_molar": 8.001723016575196,
"formula_full": "Sr2 Pr2 Mg1 Fe2 Ru2 O12",
"formula_reduced": "Sr2Pr2MgFe2(RuO6)2",
"formula_anonymous": "AB2C2D2E2F12",
"energy": -158.91079529,
"energy_per_atom": -7.567180728095239,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -146.15479529,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 11.9866818,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:15.673000Z",
"spacegroup": 1
},
{
"id": "mp-1202524",
"created_at": "2022-09-04T14:45:54.767297Z",
"structure_string": "K4 Cu2 H28 C8 N12 O16\n1.0\n13.443172 0.000000 0.000000\n0.000000 4.003855 0.000000\n0.000000 2.666610 14.024235\nK Cu H C N O\n4 2 28 8 12 16\ndirect\n0.903142 0.690261 0.360929 K\n0.596858 0.690261 0.860929 K\n0.096858 0.309739 0.639071 K\n0.403142 0.309739 0.139071 K\n0.500000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.487885 0.171811 0.667461 H\n0.012115 0.171811 0.167461 H\n0.512115 0.828189 0.332539 H\n0.987885 0.828189 0.832539 H\n0.776517 0.279101 0.614450 H\n0.723483 0.279101 0.114450 H\n0.223483 0.720899 0.385550 H\n0.276517 0.720899 0.885550 H\n0.658985 0.889051 0.405392 H\n0.841015 0.889051 0.905392 H\n0.341015 0.110949 0.594608 H\n0.158985 0.110949 0.094608 H\n0.897520 0.915324 0.565715 H\n0.602480 0.915324 0.065715 H\n0.102480 0.084676 0.434285 H\n0.397520 0.084676 0.934285 H\n0.904572 0.736585 0.673686 H\n0.595428 0.736585 0.173686 H\n0.095428 0.263415 0.326314 H\n0.404572 0.263415 0.826314 H\n0.760806 0.483265 0.754987 H\n0.739194 0.483265 0.254987 H\n0.239194 0.516735 0.245013 H\n0.260806 0.516735 0.745013 H\n0.843378 0.399517 0.833730 H\n0.656622 0.399517 0.333730 H\n0.156622 0.600483 0.166270 H\n0.343378 0.600483 0.666270 H\n0.628772 0.233176 0.646140 C\n0.871228 0.233176 0.146140 C\n0.371228 0.766824 0.353860 C\n0.128772 0.766824 0.853860 C\n0.720547 0.093250 0.502864 C\n0.779453 0.093250 0.002864 C\n0.279453 0.906750 0.497136 C\n0.220547 0.906750 0.997136 C\n0.540568 0.147394 0.617771 N\n0.959432 0.147394 0.117771 N\n0.459432 0.852606 0.382229 N\n0.040568 0.852606 0.882229 N\n0.710907 0.221295 0.586602 N\n0.789093 0.221295 0.086602 N\n0.289093 0.778705 0.413398 N\n0.210907 0.778705 0.913398 N\n0.639321 0.020888 0.457426 N\n0.860679 0.020888 0.957426 N\n0.360679 0.979112 0.542574 N\n0.139321 0.979112 0.042574 N\n0.647344 0.325044 0.726016 O\n0.852656 0.325044 0.226016 O\n0.352656 0.674956 0.273984 O\n0.147344 0.674956 0.773984 O\n0.810078 0.061288 0.474344 O\n0.689922 0.061288 0.974344 O\n0.189922 0.938712 0.525656 O\n0.310078 0.938712 0.025656 O\n0.945844 0.822112 0.616923 O\n0.554156 0.822112 0.116923 O\n0.054156 0.177888 0.383077 O\n0.445844 0.177888 0.883077 O\n0.822504 0.577607 0.779985 O\n0.677496 0.577607 0.279985 O\n0.177496 0.422393 0.220015 O\n0.322504 0.422393 0.720015 O\n",
"nsites": 70,
"nelements": 6,
"elements": [
"K",
"Cu",
"H",
"C",
"N",
"O"
],
"chemical_system": "C-Cu-H-K-N-O",
"density": 1.8299621575202032,
"density_atomic": 0.09273395090038083,
"volume": 754.847597027299,
"volume_molar": 6.493997830923074,
"formula_full": "K4 Cu2 H28 C8 N12 O16",
"formula_reduced": "K2CuH14C4(N3O4)2",
"formula_anonymous": "AB2C4D6E8F14",
"energy": -430.31175177,
"energy_per_atom": -6.147310739571428,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -414.98775177,
"band_gap": 1.0941999999999998,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9595154,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:11.614000Z",
"spacegroup": 14
},
{
"id": "mp-759379",
"created_at": "2022-09-04T14:45:57.880007Z",
"structure_string": "Li2 Mn2 V2 P4 H4 O20\n1.0\n-6.785674 0.000000 0.000000\n0.144185 7.430715 0.000000\n-0.002192 -3.560382 -7.153200\nLi Mn V P H O\n2 2 2 4 4 20\ndirect\n0.173339 0.616828 0.761668 Li\n0.826661 0.383172 0.238332 Li\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.254899 0.749560 0.249998 V\n0.745101 0.250440 0.750002 V\n0.600351 0.725206 0.951078 P\n0.099663 0.223163 0.454418 P\n0.900337 0.776837 0.545582 P\n0.399649 0.274794 0.048922 P\n0.035241 0.319415 0.974891 H\n0.516072 0.833930 0.497434 H\n0.483928 0.166070 0.502566 H\n0.964759 0.680585 0.025109 H\n0.044465 0.820562 0.704708 O\n0.008098 0.708716 0.353308 O\n0.453285 0.665943 0.790979 O\n0.731047 0.905723 0.972249 O\n0.087794 0.761794 0.040246 O\n0.231222 0.411556 0.489634 O\n0.410329 0.729197 0.444958 O\n0.738683 0.546716 0.922661 O\n0.514151 0.212875 0.861650 O\n0.762976 0.955917 0.581097 O\n0.237024 0.044083 0.418903 O\n0.485849 0.787125 0.138350 O\n0.261317 0.453284 0.077339 O\n0.589671 0.270803 0.555042 O\n0.768778 0.588444 0.510366 O\n0.912206 0.238206 0.959754 O\n0.268953 0.094277 0.027751 O\n0.546715 0.334057 0.209021 O\n0.991902 0.291284 0.646692 O\n0.955535 0.179438 0.295292 O\n",
"nsites": 34,
"nelements": 6,
"elements": [
"Li",
"Mn",
"V",
"P",
"H",
"O"
],
"chemical_system": "H-Li-Mn-O-P-V",
"density": 3.100978657109271,
"density_atomic": 0.09426597272449759,
"volume": 360.68158018555266,
"volume_molar": 6.388456604166545,
"formula_full": "Li2 Mn2 V2 P4 H4 O20",
"formula_reduced": "LiMnVP2(HO5)2",
"formula_anonymous": "ABCD2E2F10",
"energy": -253.73950387,
"energy_per_atom": -7.462926584411765,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -233.26350387,
"band_gap": 0.8792,
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"is_magnetic": true,
"total_magnetization": 10.000001,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:13.540000Z",
"spacegroup": 2
},
{
"id": "mp-1199368",
"created_at": "2022-09-04T14:45:58.567090Z",
"structure_string": "Zn2 H20 C4 S4 N16 O12\n1.0\n5.733721 3.889657 -1.295240\n5.733721 -3.889657 -1.295240\n0.161959 0.000000 -14.491486\nZn H C S N O\n2 20 4 4 16 12\ndirect\n0.333687 0.666313 0.250000 Zn\n0.666313 0.333687 0.750000 Zn\n0.734107 0.527871 0.164551 H\n0.472129 0.265893 0.335449 H\n0.265893 0.472129 0.835449 H\n0.527871 0.734107 0.664551 H\n0.688484 0.733533 0.010040 H\n0.266467 0.311516 0.489960 H\n0.311516 0.266467 0.989960 H\n0.733533 0.688484 0.510040 H\n0.479125 0.813539 0.895886 H\n0.186461 0.520875 0.604114 H\n0.520875 0.186461 0.104114 H\n0.813539 0.479125 0.395886 H\n0.647099 0.777308 0.176402 H\n0.222692 0.352901 0.323598 H\n0.352901 0.222692 0.823598 H\n0.777308 0.647099 0.676402 H\n0.219975 0.819768 0.926714 H\n0.180232 0.780025 0.573286 H\n0.780025 0.180232 0.073286 H\n0.819768 0.219975 0.426714 H\n0.381190 0.748968 0.038016 C\n0.251032 0.618810 0.461984 C\n0.618810 0.251032 0.961984 C\n0.748968 0.381190 0.538016 C\n0.174352 0.727450 0.118527 S\n0.272550 0.825648 0.381473 S\n0.825648 0.272550 0.881473 S\n0.727450 0.174352 0.618527 S\n0.607193 0.666621 0.156843 N\n0.333379 0.392807 0.343157 N\n0.392807 0.333379 0.843157 N\n0.666621 0.607193 0.656843 N\n0.567087 0.720411 0.061862 N\n0.279589 0.432913 0.438138 N\n0.432913 0.279589 0.938138 N\n0.720411 0.567087 0.561862 N\n0.359083 0.797377 0.946166 N\n0.202623 0.640917 0.553834 N\n0.640917 0.202623 0.053834 N\n0.797377 0.359083 0.446166 N\n0.885329 0.745595 0.838348 N\n0.254405 0.114671 0.661652 N\n0.114671 0.254405 0.161652 N\n0.745595 0.885329 0.338348 N\n0.703266 0.830496 0.813993 O\n0.169504 0.296734 0.686007 O\n0.296734 0.169504 0.186007 O\n0.830496 0.703266 0.313993 O\n0.913872 0.732795 0.923458 O\n0.267205 0.086128 0.576542 O\n0.086128 0.267205 0.076542 O\n0.732795 0.913872 0.423458 O\n0.038100 0.673632 0.776627 O\n0.326368 0.961900 0.723373 O\n0.961900 0.326368 0.223373 O\n0.673632 0.038100 0.276627 O\n",
"nsites": 58,
"nelements": 6,
"elements": [
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"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S-Zn",
"density": 1.91455036923741,
"density_atomic": 0.0899570186670767,
"volume": 644.7523590644225,
"volume_molar": 6.694464589013818,
"formula_full": "Zn2 H20 C4 S4 N16 O12",
"formula_reduced": "ZnH10C2S2(N4O3)2",
"formula_anonymous": "AB2C2D6E8F10",
"energy": -350.12089858,
"energy_per_atom": -6.036567216896552,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:37:09.408000Z",
"spacegroup": 15
},
{
"id": "mp-1233039",
"created_at": "2022-09-04T14:45:59.084694Z",
"structure_string": "K2 Ba1 Mg1 Co1 N6 O12\n1.0\n6.867137 0.710541 -4.491733\n-1.568674 6.723221 -4.491733\n-0.449974 -0.631315 8.342144\nK Ba Mg Co N O\n2 1 1 1 6 12\ndirect\n0.295818 0.795818 0.500000 K\n0.795819 0.295819 0.500000 K\n0.602021 0.602021 0.000000 Ba\n0.350270 0.350270 0.000000 Mg\n0.993764 0.993764 0.000000 Co\n0.196558 0.785612 0.000000 N\n0.785613 0.196559 0.000001 N\n0.195053 0.195054 0.441423 N\n0.753631 0.753631 0.558577 N\n0.157611 0.157612 0.999999 N\n0.841558 0.841558 0.000000 N\n0.614524 0.157244 0.802043 O\n0.812481 0.355202 0.197958 O\n0.157244 0.614524 0.802043 O\n0.355201 0.812481 0.197957 O\n0.325886 0.111794 0.000001 O\n0.596013 0.596014 0.396520 O\n0.891940 0.678206 0.000000 O\n0.678207 0.891940 0.000000 O\n0.801159 0.801159 0.473531 O\n0.327627 0.327627 0.526469 O\n0.199493 0.199494 0.603480 O\n0.111793 0.325885 0.000000 O\n",
"nsites": 23,
"nelements": 6,
"elements": [
"K",
"Ba",
"Mg",
"Co",
"N",
"O"
],
"chemical_system": "Ba-Co-K-Mg-N-O",
"density": 2.663325540869617,
"density_atomic": 0.06417858915273257,
"volume": 358.3749705881578,
"volume_molar": 9.383410946707592,
"formula_full": "K2 Ba1 Mg1 Co1 N6 O12",
"formula_reduced": "K2BaMgCo(NO2)6",
"formula_anonymous": "ABCD2E6F12",
"energy": -146.95028806,
"energy_per_atom": -6.389142959130434,
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"band_gap": 0.1091999999999999,
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"updated_at": "2021-11-28T01:37:10.003000Z",
"spacegroup": 42
},
{
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{
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"structure_string": "Rb4 C8 S8 N4 O20 F24\n1.0\n-8.359162 8.359162 3.877797\n8.359162 -8.359162 3.877797\n8.359162 8.359162 -3.877797\nRb C S N O F\n4 8 8 4 20 24\ndirect\n0.517626 0.916464 0.942630 Rb\n0.973833 0.574996 0.057370 Rb\n0.425004 0.482374 0.398837 Rb\n0.083536 0.026167 0.601163 Rb\n0.611278 0.960386 0.570049 C\n0.390338 0.041230 0.429951 C\n0.958770 0.388722 0.349108 C\n0.039614 0.609662 0.650892 C\n0.124337 0.290426 0.935745 C\n0.354681 0.188592 0.064255 C\n0.811408 0.875663 0.166089 C\n0.709574 0.645319 0.833911 C\n0.730353 0.958882 0.672759 S\n0.286122 0.057593 0.327241 S\n0.942407 0.269647 0.228529 S\n0.041118 0.713878 0.771471 S\n0.045215 0.328239 0.830209 S\n0.498030 0.215006 0.169791 S\n0.784994 0.954785 0.283024 S\n0.671761 0.501970 0.716976 S\n0.947719 0.175000 0.715263 N\n0.459737 0.232456 0.284737 N\n0.767544 0.052281 0.227281 N\n0.825000 0.540263 0.772719 N\n0.630416 0.885515 0.757143 O\n0.128372 0.873273 0.242857 O\n0.126727 0.369584 0.255099 O\n0.114485 0.871628 0.744902 O\n0.720207 0.849424 0.602179 O\n0.247245 0.118028 0.397821 O\n0.881972 0.279793 0.129217 O\n0.150576 0.752755 0.870783 O\n0.919792 0.297053 0.873906 O\n0.423147 0.045886 0.126094 O\n0.954114 0.080208 0.377261 O\n0.702947 0.576853 0.622739 O\n0.220916 0.514535 0.822493 O\n0.692041 0.398423 0.177507 O\n0.601577 0.779084 0.293619 O\n0.485465 0.307959 0.706381 O\n0.609890 0.210230 0.858102 O\n0.352129 0.751788 0.141898 O\n0.248212 0.390110 0.600340 O\n0.789770 0.647871 0.399660 O\n0.436617 0.778674 0.510057 F\n0.268618 0.926561 0.489943 F\n0.073439 0.563383 0.342057 F\n0.221326 0.731382 0.657943 F\n0.712362 0.056683 0.498256 F\n0.558427 0.214106 0.501744 F\n0.785894 0.287638 0.344321 F\n0.943317 0.441573 0.655679 F\n0.593083 0.041488 0.626261 F\n0.415228 0.966822 0.373739 F\n0.033178 0.406917 0.448406 F\n0.958512 0.584772 0.551594 F\n0.206618 0.272810 0.891958 F\n0.380852 0.314660 0.108042 F\n0.685340 0.793382 0.066192 F\n0.727190 0.619148 0.933808 F\n0.974297 0.131072 0.963420 F\n0.167653 0.010877 0.036580 F\n0.989123 0.025703 0.156776 F\n0.868928 0.832347 0.843224 F\n0.252064 0.440422 0.030202 F\n0.410220 0.221863 0.969798 F\n0.778137 0.747936 0.188358 F\n0.559578 0.589780 0.811642 F\n",
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],
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"formula_full": "Rb4 C8 S8 N4 O20 F24",
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},
{
"id": "mp-772637",
"created_at": "2022-09-04T14:46:04.671488Z",
"structure_string": "Na6 Li6 Mn4 P4 C4 O28\n1.0\n6.769928 0.000000 0.000000\n-0.032465 8.747831 0.000000\n-0.006659 -0.207753 10.136858\nNa Li Mn P C O\n6 6 4 4 4 28\ndirect\n0.249786 0.915719 0.379012 Na\n0.999843 0.747291 0.627370 Na\n0.999213 0.743659 0.122653 Na\n0.501388 0.744090 0.122633 Na\n0.500331 0.252845 0.875384 Na\n0.501268 0.254232 0.374762 Na\n0.247984 0.920869 0.875109 Li\n0.477137 0.729941 0.619030 Li\n0.980366 0.265536 0.884236 Li\n0.978027 0.271350 0.385682 Li\n0.753252 0.086189 0.626735 Li\n0.760968 0.089582 0.123289 Li\n0.748543 0.641665 0.884942 Mn\n0.746202 0.639582 0.391056 Mn\n0.244275 0.354933 0.613433 Mn\n0.245444 0.355807 0.108648 Mn\n0.249778 0.595149 0.849103 P\n0.243828 0.585402 0.354308 P\n0.748842 0.404771 0.648371 P\n0.753645 0.401704 0.145424 P\n0.757557 0.954816 0.865254 C\n0.758861 0.954586 0.367082 C\n0.256484 0.051979 0.639310 C\n0.248658 0.052041 0.129732 C\n0.275979 0.905416 0.655115 O\n0.250645 0.906504 0.150101 O\n0.752005 0.911277 0.987495 O\n0.753377 0.910911 0.488790 O\n0.744656 0.853370 0.769329 O\n0.745326 0.852256 0.271375 O\n0.067949 0.696099 0.886584 O\n0.433811 0.684746 0.900043 O\n0.062018 0.683181 0.396701 O\n0.429750 0.674777 0.405631 O\n0.263752 0.579105 0.695149 O\n0.733874 0.570602 0.595255 O\n0.251174 0.573061 0.200694 O\n0.750701 0.564849 0.087921 O\n0.234297 0.431138 0.904908 O\n0.770143 0.419203 0.801797 O\n0.233297 0.420863 0.408050 O\n0.770747 0.419677 0.299214 O\n0.564442 0.305763 0.612638 O\n0.927462 0.314394 0.590656 O\n0.565487 0.307263 0.109700 O\n0.928803 0.304306 0.091094 O\n0.239604 0.141730 0.742552 O\n0.244446 0.147760 0.229924 O\n0.252429 0.110842 0.523005 O\n0.250575 0.102215 0.010052 O\n0.775083 0.097632 0.836236 O\n0.776485 0.097322 0.337434 O\n",
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"formula_full": "Na6 Li6 Mn4 P4 C4 O28",
"formula_reduced": "Na3Li3Mn2P2(CO7)2",
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},
{
"id": "mp-1199679",
"created_at": "2022-09-04T14:46:07.447494Z",
"structure_string": "K4 Zr4 Ni2 H24 O12 F24\n1.0\n10.097893 0.000000 0.000000\n0.000000 6.687624 0.000000\n0.000000 5.389968 11.934079\nK Zr Ni H O F\n4 4 2 24 12 24\ndirect\n0.215774 0.390221 0.584730 K\n0.284226 0.390221 0.084730 K\n0.784226 0.609779 0.415270 K\n0.715774 0.609779 0.915270 K\n0.485507 0.187452 0.850372 Zr\n0.014493 0.187452 0.350372 Zr\n0.514493 0.812548 0.149628 Zr\n0.985507 0.812548 0.649628 Zr\n0.500000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.317102 0.266656 0.381560 H\n0.182898 0.266656 0.881560 H\n0.682898 0.733344 0.618440 H\n0.817102 0.733344 0.118440 H\n0.436847 0.412181 0.390257 H\n0.063153 0.412181 0.890257 H\n0.563153 0.587819 0.609743 H\n0.936847 0.587819 0.109743 H\n0.306888 0.919184 0.394117 H\n0.193112 0.919184 0.894117 H\n0.693112 0.080816 0.605883 H\n0.806888 0.080816 0.105883 H\n0.426397 0.761133 0.396426 H\n0.073603 0.761133 0.896426 H\n0.573603 0.238867 0.603574 H\n0.926397 0.238867 0.103574 H\n0.685467 0.202674 0.336500 H\n0.814533 0.202674 0.836500 H\n0.314533 0.797326 0.663500 H\n0.185467 0.797326 0.163500 H\n0.565247 0.120179 0.283226 H\n0.934753 0.120179 0.783226 H\n0.434753 0.879821 0.716774 H\n0.065247 0.879821 0.216774 H\n0.382377 0.280513 0.434419 O\n0.117623 0.280513 0.934419 O\n0.617623 0.719487 0.565581 O\n0.882377 0.719487 0.065581 O\n0.374145 0.817821 0.443113 O\n0.125855 0.817821 0.943113 O\n0.625855 0.182179 0.556887 O\n0.874145 0.182179 0.056887 O\n0.611035 0.097902 0.353610 O\n0.888965 0.097902 0.853610 O\n0.388965 0.902098 0.646390 O\n0.111035 0.902098 0.146390 O\n0.613696 0.042037 0.995821 F\n0.886304 0.042037 0.495821 F\n0.386304 0.957963 0.004179 F\n0.113696 0.957963 0.504179 F\n0.286065 0.159149 0.811713 F\n0.213935 0.159149 0.311713 F\n0.713935 0.840851 0.188287 F\n0.786065 0.840851 0.688287 F\n0.430040 0.425765 0.897637 F\n0.069960 0.425765 0.397637 F\n0.569960 0.574235 0.102363 F\n0.930040 0.574235 0.602363 F\n0.474706 0.360104 0.672459 F\n0.025294 0.360104 0.172459 F\n0.525294 0.639896 0.327541 F\n0.974706 0.639896 0.827541 F\n0.665627 0.345593 0.804588 F\n0.834373 0.345593 0.304588 F\n0.334373 0.654407 0.195412 F\n0.165627 0.654407 0.695412 F\n0.533498 0.921997 0.817738 F\n0.966502 0.921997 0.317738 F\n0.466502 0.078003 0.182262 F\n0.033498 0.078003 0.682262 F\n",
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},
{
"id": "mp-776752",
"created_at": "2022-09-04T14:46:09.350475Z",
"structure_string": "Li4 Mn2 Fe3 Sb1 P6 O24\n1.0\n8.457093 0.000000 0.000000\n3.649777 7.730493 0.000000\n3.620139 2.366572 7.389405\nLi Mn Fe Sb P O\n4 2 3 1 6 24\ndirect\n0.749173 0.142655 0.355944 Li\n0.283734 0.840748 0.647376 Li\n0.643167 0.280092 0.840321 Li\n0.841886 0.644380 0.287591 Li\n0.013857 0.001243 0.996634 Mn\n0.485210 0.506841 0.500187 Mn\n0.148381 0.150698 0.146337 Fe\n0.347781 0.348439 0.346538 Fe\n0.660268 0.659524 0.662638 Fe\n0.841310 0.834963 0.842510 Sb\n0.071781 0.747108 0.430715 P\n0.430681 0.072980 0.747940 P\n0.746202 0.431705 0.070086 P\n0.250454 0.542557 0.949853 P\n0.551098 0.949876 0.251708 P\n0.941223 0.247660 0.544055 P\n0.108837 0.308603 0.487752 O\n0.323673 0.499131 0.104374 O\n0.068003 0.904848 0.251892 O\n0.534259 0.102264 0.314973 O\n0.067817 0.805637 0.581564 O\n0.254036 0.590131 0.407819 O\n0.244593 0.087986 0.893394 O\n0.426173 0.249506 0.581735 O\n0.171288 0.398568 0.985213 O\n0.593910 0.409085 0.257100 O\n0.103810 0.742126 0.927643 O\n0.393766 0.997961 0.183484 O\n0.581138 0.062980 0.814419 O\n0.890673 0.241256 0.087914 O\n0.404020 0.563026 0.761771 O\n0.810746 0.580280 0.062214 O\n0.562619 0.763065 0.408326 O\n0.747905 0.917755 0.103291 O\n0.756628 0.406282 0.568081 O\n0.953845 0.175929 0.402501 O\n0.477771 0.904191 0.691698 O\n0.927916 0.100805 0.740909 O\n0.687537 0.477171 0.904389 O\n0.902829 0.686944 0.480110 O\n",
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"formula_full": "Li4 Mn2 Fe3 Sb1 P6 O24",
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}
]
}