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{
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"structure_string": "Rb8 Sb4 N8 O24 F12\n1.0\n7.823161 0.000000 0.000000\n0.000000 11.334531 0.000000\n0.000000 2.813522 11.373610\nRb Sb N O F\n8 4 8 24 12\ndirect\n0.255709 0.570980 0.866000 Rb\n0.755709 0.429020 0.134000 Rb\n0.993277 0.141362 0.513250 Rb\n0.493277 0.858638 0.486750 Rb\n0.743759 0.454279 0.645351 Rb\n0.243759 0.545721 0.354649 Rb\n0.966869 0.131501 0.927912 Rb\n0.466869 0.868499 0.072088 Rb\n0.756117 0.717020 0.828384 Sb\n0.256117 0.282980 0.171616 Sb\n0.550530 0.113002 0.705499 Sb\n0.050530 0.886998 0.294501 Sb\n0.193279 0.387046 0.658828 N\n0.693279 0.612954 0.341172 N\n0.460132 0.245865 0.937777 N\n0.960132 0.754135 0.062223 N\n0.990604 0.745376 0.567063 N\n0.490604 0.254624 0.432937 N\n0.211827 0.920094 0.771833 N\n0.711827 0.079906 0.228167 N\n0.346609 0.423706 0.645721 O\n0.846609 0.576294 0.354279 O\n0.983007 0.668196 0.665990 O\n0.483007 0.331804 0.334010 O\n0.122540 0.366538 0.759227 O\n0.622540 0.633462 0.240773 O\n0.360771 0.156895 0.961850 O\n0.860771 0.843105 0.038150 O\n0.944814 0.666893 0.009933 O\n0.444814 0.333107 0.990067 O\n0.578063 0.253437 0.862032 O\n0.078063 0.746563 0.137968 O\n0.108429 0.372254 0.570266 O\n0.608429 0.627746 0.429734 O\n0.107730 0.733079 0.494504 O\n0.607730 0.266921 0.505496 O\n0.885912 0.831322 0.540558 O\n0.385912 0.168678 0.459442 O\n0.302605 0.892936 0.691981 O\n0.802605 0.107064 0.308019 O\n0.148859 0.026547 0.755193 O\n0.648859 0.973453 0.244807 O\n0.186399 0.842649 0.867902 O\n0.686399 0.157351 0.132098 O\n0.585610 0.673560 0.717662 F\n0.085610 0.326440 0.282338 F\n0.570085 0.679090 0.946399 F\n0.070085 0.320910 0.053601 F\n0.809874 0.542084 0.867225 F\n0.309874 0.457916 0.132775 F\n0.660882 0.006075 0.617165 F\n0.160882 0.993925 0.382835 F\n0.613334 0.984985 0.848067 F\n0.113334 0.015015 0.151933 F\n0.782475 0.182964 0.708850 F\n0.282475 0.817036 0.291150 F\n",
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"spacegroup": 4
},
{
"id": "mp-17911",
"created_at": "2022-09-04T14:41:49.867437Z",
"structure_string": "Ba8 Zn4 O12\n1.0\n5.780640 2.982859 0.000000\n-5.780640 2.982859 0.000000\n0.000000 0.712097 12.696305\nBa Zn O\n8 4 12\ndirect\n0.440712 0.030088 0.152335 Ba\n0.030088 0.440712 0.652335 Ba\n0.559288 0.969912 0.847665 Ba\n0.969912 0.559288 0.347665 Ba\n0.865172 0.657969 0.924970 Ba\n0.342031 0.134828 0.575030 Ba\n0.134828 0.342031 0.075030 Ba\n0.657969 0.865172 0.424970 Ba\n0.726331 0.731041 0.663699 Zn\n0.273669 0.268959 0.336301 Zn\n0.268959 0.273669 0.836301 Zn\n0.731041 0.726331 0.163699 Zn\n0.323602 0.126435 0.964943 O\n0.873565 0.676398 0.535057 O\n0.676398 0.873565 0.035057 O\n0.126435 0.323602 0.464943 O\n0.993110 0.006890 0.750000 O\n0.006890 0.993110 0.250000 O\n0.593670 0.406330 0.750000 O\n0.491916 0.149386 0.367577 O\n0.149386 0.491916 0.867577 O\n0.508084 0.850614 0.632423 O\n0.850614 0.508084 0.132423 O\n0.406330 0.593670 0.250000 O\n",
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{
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"structure_string": "Ta4 As4 O16\n1.0\n5.063183 0.000000 0.000000\n0.000000 5.517547 0.000000\n0.000000 0.000000 11.853580\nTa As O\n4 4 16\ndirect\n0.250000 0.120906 0.750000 Ta\n0.250000 0.379094 0.250000 Ta\n0.750000 0.620906 0.750000 Ta\n0.750000 0.879094 0.250000 Ta\n0.651378 0.250000 0.000000 As\n0.848622 0.250000 0.500000 As\n0.348622 0.750000 0.000000 As\n0.151378 0.750000 0.500000 As\n0.086805 0.084052 0.590193 O\n0.413195 0.084052 0.909807 O\n0.996053 0.145205 0.200155 O\n0.503947 0.145205 0.299845 O\n0.503947 0.354795 0.700155 O\n0.996053 0.354795 0.799845 O\n0.413195 0.415948 0.090193 O\n0.086805 0.415948 0.409807 O\n0.586805 0.584052 0.909807 O\n0.913195 0.584052 0.590193 O\n0.003947 0.645205 0.200155 O\n0.496053 0.645205 0.299845 O\n0.496053 0.854795 0.700155 O\n0.003947 0.854795 0.799845 O\n0.586805 0.915948 0.090193 O\n0.913195 0.915948 0.409807 O\n",
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{
"id": "mp-1201717",
"created_at": "2022-09-04T14:40:42.321064Z",
"structure_string": "K4 B24 H8 O4 F24\n1.0\n-7.299344 0.000000 1.808361\n0.033162 0.000000 -9.500436\n0.000000 -11.659985 0.000000\nK B H O F\n4 24 8 4 24\ndirect\n0.873808 0.060832 0.655334 K\n0.126192 0.439168 0.155334 K\n0.126192 0.939168 0.344666 K\n0.873808 0.560832 0.844666 K\n0.617186 0.137349 0.916275 B\n0.382814 0.362651 0.416275 B\n0.382814 0.862651 0.083725 B\n0.617186 0.637349 0.583725 B\n0.701736 0.980379 0.944783 B\n0.298264 0.519621 0.444783 B\n0.298264 0.019621 0.055217 B\n0.701736 0.480379 0.555217 B\n0.695625 0.108340 0.057643 B\n0.304375 0.391660 0.557643 B\n0.304375 0.891660 0.942357 B\n0.695625 0.608340 0.442357 B\n0.490480 0.171715 0.038276 B\n0.509520 0.328285 0.538276 B\n0.509520 0.828285 0.961724 B\n0.490480 0.671715 0.461724 B\n0.369685 0.083906 0.914117 B\n0.630315 0.416094 0.414117 B\n0.630315 0.916094 0.085883 B\n0.369685 0.583906 0.585883 B\n0.501747 0.966100 0.857113 B\n0.498253 0.533900 0.357113 B\n0.498253 0.033900 0.142887 B\n0.501747 0.466100 0.642887 B\n0.283657 0.006079 0.607494 H\n0.716343 0.493921 0.107494 H\n0.716343 0.993921 0.392506 H\n0.283657 0.506079 0.892506 H\n0.176456 0.845888 0.616248 H\n0.823544 0.654112 0.116248 H\n0.823544 0.154112 0.383752 H\n0.176456 0.345888 0.883752 H\n0.166165 0.939868 0.587311 O\n0.833835 0.560132 0.087311 O\n0.833835 0.060132 0.412689 O\n0.166165 0.439868 0.912689 O\n0.722226 0.245044 0.845096 F\n0.277774 0.254956 0.345096 F\n0.277774 0.754956 0.154904 F\n0.722226 0.745044 0.654904 F\n0.862722 0.966509 0.891476 F\n0.137278 0.533491 0.391476 F\n0.137278 0.033491 0.108524 F\n0.862722 0.466509 0.608524 F\n0.852986 0.200451 0.103569 F\n0.147014 0.299549 0.603569 F\n0.147014 0.799549 0.896431 F\n0.852986 0.700451 0.396431 F\n0.482214 0.311817 0.070308 F\n0.517786 0.188183 0.570308 F\n0.517786 0.688183 0.929692 F\n0.482214 0.811817 0.429692 F\n0.264749 0.151864 0.844407 F\n0.735251 0.348136 0.344407 F\n0.735251 0.848136 0.155593 F\n0.264749 0.651864 0.655593 F\n0.513106 0.943327 0.739234 F\n0.486894 0.556673 0.239234 F\n0.486894 0.056673 0.260766 F\n0.513106 0.443327 0.760766 F\n",
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"structure_string": "Li8 Mn5 Fe3 B8 O24\n1.0\n5.230844 0.000000 0.000000\n0.067606 6.029863 0.000000\n0.225490 2.252535 16.049200\nLi Mn Fe B O\n8 5 3 8 24\ndirect\n0.850253 0.064488 0.388729 Li\n0.150354 0.435338 0.111148 Li\n0.650351 0.186676 0.859561 Li\n0.348702 0.313129 0.639380 Li\n0.649366 0.687191 0.357686 Li\n0.348886 0.812797 0.142446 Li\n0.848944 0.563468 0.891579 Li\n0.151502 0.936131 0.607943 Li\n0.668880 0.272216 0.041320 Mn\n0.168149 0.024784 0.789783 Mn\n0.831626 0.475717 0.710468 Mn\n0.666956 0.775269 0.539379 Mn\n0.331736 0.724162 0.960513 Mn\n0.332950 0.225848 0.460658 Fe\n0.172540 0.521498 0.292178 Fe\n0.838314 0.971222 0.209817 Fe\n0.331135 0.038778 0.297184 B\n0.827420 0.287131 0.545566 B\n0.672133 0.462360 0.204344 B\n0.169622 0.214708 0.952513 B\n0.831894 0.784359 0.049571 B\n0.330481 0.535421 0.797852 B\n0.167186 0.714842 0.451272 B\n0.668947 0.965578 0.701657 B\n0.590395 0.012839 0.308564 O\n0.185302 0.170995 0.345524 O\n0.705374 0.172388 0.488577 O\n0.286423 0.333102 0.009169 O\n0.784949 0.083793 0.758442 O\n0.816942 0.326771 0.157361 O\n0.319932 0.080269 0.906395 O\n0.088207 0.263795 0.557044 O\n0.409715 0.486063 0.192071 O\n0.910048 0.235470 0.938687 O\n0.682495 0.418324 0.593853 O\n0.215219 0.416685 0.740781 O\n0.795035 0.582192 0.259136 O\n0.314287 0.579428 0.404625 O\n0.091961 0.763917 0.062296 O\n0.589795 0.515194 0.812043 O\n0.907609 0.737426 0.438170 O\n0.683368 0.916884 0.096955 O\n0.179146 0.669338 0.843615 O\n0.206221 0.925351 0.240430 O\n0.713978 0.668837 0.992262 O\n0.285952 0.830597 0.508174 O\n0.820008 0.831416 0.655666 O\n0.409311 0.985815 0.687612 O\n",
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{
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{
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{
"id": "mp-1105094",
"created_at": "2022-09-04T14:42:16.920823Z",
"structure_string": "Tl4 Hg4 Cl12\n1.0\n4.491792 0.000000 0.000000\n0.000000 9.512382 0.000000\n0.000000 0.000000 14.158436\nTl Hg Cl\n4 4 12\ndirect\n0.250000 0.450626 0.332808 Tl\n0.250000 0.950626 0.167192 Tl\n0.750000 0.549374 0.667192 Tl\n0.750000 0.049374 0.832808 Tl\n0.250000 0.174521 0.545960 Hg\n0.250000 0.674521 0.954040 Hg\n0.750000 0.825479 0.454040 Hg\n0.750000 0.325479 0.045960 Hg\n0.250000 0.271193 0.704110 Cl\n0.250000 0.771193 0.795890 Cl\n0.750000 0.728807 0.295890 Cl\n0.750000 0.228807 0.204110 Cl\n0.250000 0.155517 0.984513 Cl\n0.250000 0.655517 0.515487 Cl\n0.750000 0.844483 0.015487 Cl\n0.750000 0.344483 0.484513 Cl\n0.250000 0.042954 0.398346 Cl\n0.250000 0.542954 0.101654 Cl\n0.750000 0.957046 0.601654 Cl\n0.750000 0.457046 0.898346 Cl\n",
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"elements": [
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],
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{
"id": "mp-1212447",
"created_at": "2022-09-04T14:42:23.883784Z",
"structure_string": "K6 Cr2 H6 C12 O24\n1.0\n7.213166 0.000000 -2.254749\n-0.308608 0.000000 -10.843765\n3.606583 10.247756 -1.127375\nK Cr H C O\n6 2 6 12 24\ndirect\n0.874513 0.834173 0.677814 K\n0.125487 0.165827 0.322186 K\n0.447674 0.665827 0.677814 K\n0.552326 0.334173 0.322186 K\n0.329461 0.750000 0.341078 K\n0.670539 0.250000 0.658922 K\n0.879828 0.750000 0.240344 Cr\n0.120172 0.250000 0.759656 Cr\n0.740149 0.750000 0.519701 H\n0.259851 0.250000 0.480299 H\n0.242118 0.971578 0.121827 H\n0.757882 0.028422 0.878173 H\n0.636055 0.528422 0.121827 H\n0.363945 0.471578 0.878173 H\n0.056959 0.292845 0.022105 C\n0.943041 0.707155 0.977895 C\n0.920936 0.207155 0.022105 C\n0.079064 0.792845 0.977895 C\n0.809448 0.525794 0.386984 C\n0.190552 0.474206 0.613016 C\n0.803568 0.974206 0.386984 C\n0.196432 0.025794 0.613016 C\n0.035372 0.505898 0.329795 C\n0.964628 0.494102 0.670205 C\n0.634833 0.994102 0.329795 C\n0.365167 0.005898 0.670205 C\n0.854798 0.594122 0.646723 O\n0.145202 0.405878 0.353277 O\n0.498479 0.905878 0.646723 O\n0.501521 0.094122 0.353277 O\n0.059937 0.324888 0.127141 O\n0.940063 0.675112 0.872859 O\n0.812922 0.175112 0.127141 O\n0.187078 0.824888 0.872859 O\n0.066515 0.823730 0.093583 O\n0.933485 0.176270 0.906417 O\n0.839902 0.676270 0.093583 O\n0.160098 0.323730 0.906417 O\n0.187687 0.938882 0.549870 O\n0.812313 0.061118 0.450130 O\n0.262442 0.561118 0.549870 O\n0.737558 0.438882 0.450130 O\n0.925728 0.861493 0.364730 O\n0.074272 0.138507 0.635270 O\n0.709541 0.638507 0.364730 O\n0.290459 0.361493 0.635270 O\n0.093086 0.601171 0.262139 O\n0.906914 0.398829 0.737861 O\n0.644776 0.898829 0.262139 O\n0.355224 0.101171 0.737861 O\n",
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{
"id": "mp-18779",
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"structure_string": "Na8 Cr4 O16\n1.0\n5.560350 -0.004802 -0.000067\n-2.331098 5.048130 0.000064\n-0.000173 0.000104 14.377699\nNa Cr O\n8 4 16\ndirect\n0.183020 0.816980 0.375006 Na\n0.183027 0.816972 0.874987 Na\n0.816978 0.183022 0.124991 Na\n0.816970 0.183032 0.625012 Na\n0.500000 0.500003 0.249997 Na\n0.499997 0.500002 0.749999 Na\n0.500004 0.499995 0.999981 Na\n0.499993 0.500008 0.500017 Na\n0.853680 0.146326 0.875036 Cr\n0.146328 0.853670 0.624966 Cr\n0.853714 0.146285 0.374965 Cr\n0.146287 0.853705 0.125038 Cr\n0.249287 0.750714 0.031337 O\n0.249273 0.750726 0.531301 O\n0.750723 0.249276 0.281321 O\n0.750709 0.249291 0.781309 O\n0.750699 0.249303 0.468676 O\n0.750732 0.249267 0.968690 O\n0.249290 0.750711 0.218691 O\n0.249294 0.750707 0.718691 O\n0.185646 0.269223 0.374964 O\n0.185653 0.269247 0.875004 O\n0.814362 0.730788 0.125035 O\n0.814344 0.730753 0.624992 O\n0.730778 0.814351 0.374964 O\n0.730752 0.814347 0.875004 O\n0.269213 0.185636 0.125035 O\n0.269248 0.185660 0.624992 O\n",
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{
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"structure_string": "Sb1 S2 N1 F6\n1.0\n3.466742 4.905227 0.000000\n-3.466742 4.905227 0.000000\n0.000000 0.161235 5.509987\nSb S N F\n1 2 1 6\ndirect\n0.000000 0.000000 0.000000 Sb\n0.640172 0.640172 0.386593 S\n0.359828 0.359828 0.613407 S\n0.500000 0.500000 0.500000 N\n0.113248 0.113248 0.278077 F\n0.886752 0.886752 0.721923 F\n0.918040 0.309434 0.851099 F\n0.690566 0.081960 0.148901 F\n0.081960 0.690566 0.148901 F\n0.309434 0.918040 0.851099 F\n",
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}
]
}