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{
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{
"id": "mp-1229266",
"created_at": "2022-09-04T14:47:59.675265Z",
"structure_string": "Ba12 Sr1 Ca3 Ru8 O36\n1.0\n2.993816 -5.185441 0.000000\n2.993816 5.185441 0.000000\n0.000000 0.000000 30.204728\nBa Sr Ca Ru O\n12 1 3 8 36\ndirect\n0.333333 0.666667 0.943531 Ba\n0.333333 0.666667 0.449981 Ba\n0.666667 0.333333 0.201674 Ba\n0.666667 0.333333 0.699506 Ba\n0.666667 0.333333 0.056469 Ba\n0.666667 0.333333 0.550019 Ba\n0.333333 0.666667 0.798326 Ba\n0.333333 0.666667 0.300494 Ba\n0.000000 0.000000 0.872321 Ba\n0.000000 0.000000 0.375383 Ba\n0.000000 0.000000 0.127679 Ba\n0.000000 0.000000 0.624617 Ba\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Ca\n0.000000 0.000000 0.251296 Ca\n0.000000 0.000000 0.748704 Ca\n0.333333 0.666667 0.081880 Ru\n0.333333 0.666667 0.578567 Ru\n0.666667 0.333333 0.826502 Ru\n0.666667 0.333333 0.329297 Ru\n0.666667 0.333333 0.918120 Ru\n0.666667 0.333333 0.421433 Ru\n0.333333 0.666667 0.173498 Ru\n0.333333 0.666667 0.670703 Ru\n0.029789 0.514894 0.127900 O\n0.032262 0.516131 0.624640 O\n0.485106 0.970211 0.127900 O\n0.483869 0.967738 0.624640 O\n0.485106 0.514894 0.127900 O\n0.483869 0.516131 0.624640 O\n0.970211 0.485106 0.872100 O\n0.967738 0.483869 0.375360 O\n0.514894 0.029789 0.872100 O\n0.516131 0.032262 0.375360 O\n0.514894 0.485106 0.872100 O\n0.516131 0.483869 0.375360 O\n0.354429 0.177214 0.950444 O\n0.351897 0.175948 0.454560 O\n0.822786 0.645571 0.950444 O\n0.824052 0.648103 0.454560 O\n0.822786 0.177214 0.950444 O\n0.824052 0.175948 0.454560 O\n0.648108 0.824054 0.206385 O\n0.647551 0.823775 0.703814 O\n0.175946 0.351892 0.206385 O\n0.176225 0.352449 0.703814 O\n0.175946 0.824054 0.206385 O\n0.176225 0.823775 0.703814 O\n0.645571 0.822786 0.049556 O\n0.648103 0.824052 0.545440 O\n0.177214 0.354429 0.049556 O\n0.175948 0.351897 0.545440 O\n0.177214 0.822786 0.049556 O\n0.175948 0.824052 0.545440 O\n0.351892 0.175946 0.793615 O\n0.352449 0.176225 0.296186 O\n0.824054 0.648108 0.793615 O\n0.823775 0.647551 0.296186 O\n0.824054 0.175946 0.793615 O\n0.823775 0.176225 0.296186 O\n",
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"spacegroup": 164
},
{
"id": "mp-1246771",
"created_at": "2022-09-04T14:42:12.073508Z",
"structure_string": "Mn12 Sn32 N36\n1.0\n6.952708 0.000000 -0.322915\n0.000000 11.030106 0.000000\n-5.676892 0.000000 17.961870\nMn Sn N\n12 32 36\ndirect\n0.584163 0.079954 0.743242 Mn\n0.415837 0.579954 0.756758 Mn\n0.415837 0.920046 0.256758 Mn\n0.584163 0.420046 0.243242 Mn\n0.837329 0.907886 0.574363 Mn\n0.162671 0.407886 0.925637 Mn\n0.162671 0.092114 0.425637 Mn\n0.837329 0.592114 0.074363 Mn\n0.703063 0.328740 0.595932 Mn\n0.296937 0.828740 0.904068 Mn\n0.296937 0.671260 0.404068 Mn\n0.703063 0.171260 0.095932 Mn\n0.506220 0.866731 0.095283 Sn\n0.493780 0.366731 0.404717 Sn\n0.493780 0.133269 0.904717 Sn\n0.506220 0.633269 0.595283 Sn\n0.464562 0.134452 0.590943 Sn\n0.535438 0.634452 0.909057 Sn\n0.535438 0.865548 0.409057 Sn\n0.464562 0.365548 0.090943 Sn\n0.793156 0.855071 0.737660 Sn\n0.206844 0.355071 0.762340 Sn\n0.206844 0.144929 0.262340 Sn\n0.793156 0.644929 0.237660 Sn\n0.691426 0.341484 0.755254 Sn\n0.308574 0.841484 0.744746 Sn\n0.308574 0.658516 0.244746 Sn\n0.691426 0.158516 0.255254 Sn\n0.810420 0.388117 0.974844 Sn\n0.189580 0.888117 0.525156 Sn\n0.189580 0.611883 0.025156 Sn\n0.810420 0.111883 0.474844 Sn\n0.003633 0.127140 0.863710 Sn\n0.996367 0.627140 0.636290 Sn\n0.996367 0.872860 0.136290 Sn\n0.003633 0.372860 0.363710 Sn\n0.012339 0.089908 0.664356 Sn\n0.987661 0.589908 0.835644 Sn\n0.987661 0.910092 0.335644 Sn\n0.012339 0.410092 0.164356 Sn\n0.081624 0.361015 0.552904 Sn\n0.918376 0.861015 0.947096 Sn\n0.918376 0.638985 0.447096 Sn\n0.081624 0.138985 0.052904 Sn\n0.522267 0.433246 0.584645 N\n0.477733 0.933246 0.915355 N\n0.477733 0.566754 0.415355 N\n0.522267 0.066754 0.084645 N\n0.669448 0.171046 0.830706 N\n0.330552 0.671046 0.669294 N\n0.330552 0.828954 0.169294 N\n0.669448 0.328954 0.330706 N\n0.746471 0.199798 0.004829 N\n0.253529 0.699798 0.495171 N\n0.253529 0.800202 0.995171 N\n0.746471 0.300202 0.504829 N\n0.605353 0.945022 0.572298 N\n0.394647 0.445022 0.927702 N\n0.394647 0.054978 0.427702 N\n0.605353 0.554978 0.072298 N\n0.871574 0.051479 0.748121 N\n0.128426 0.551479 0.751879 N\n0.128426 0.948521 0.251879 N\n0.871574 0.448521 0.248121 N\n0.993377 0.286715 0.653521 N\n0.006623 0.786715 0.846479 N\n0.006623 0.713285 0.346479 N\n0.993377 0.213285 0.153521 N\n0.019586 0.321748 0.832829 N\n0.980414 0.821748 0.667171 N\n0.980414 0.678252 0.167171 N\n0.019586 0.178252 0.332829 N\n0.154762 0.176684 0.512870 N\n0.845238 0.676684 0.987130 N\n0.845238 0.823316 0.487130 N\n0.154762 0.323316 0.012870 N\n0.317856 0.032980 0.719539 N\n0.682144 0.532980 0.780461 N\n0.682144 0.967020 0.280461 N\n0.317856 0.467020 0.219539 N\n",
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"formula_full": "Mn12 Sn32 N36",
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"spacegroup": 14
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{
"id": "mp-1213643",
"created_at": "2022-09-04T14:45:27.099580Z",
"structure_string": "Er4 V8 O8\n1.0\n-4.422695 4.422695 -4.607848\n4.422695 -4.422695 -4.607848\n-4.422695 -4.422695 4.607848\nEr V O\n4 8 8\ndirect\n0.875000 0.125000 0.250000 Er\n0.875000 0.625000 0.750000 Er\n0.375000 0.125000 0.250000 Er\n0.875000 0.125000 0.750000 Er\n0.510196 0.192819 0.682623 V\n0.510196 0.827573 0.317377 V\n0.577573 0.760196 0.817377 V\n0.239804 0.422427 0.182623 V\n0.239804 0.057181 0.817377 V\n0.942819 0.760196 0.182623 V\n0.172427 0.489804 0.682623 V\n0.807181 0.489804 0.317377 V\n0.662884 0.512938 0.850054 O\n0.662884 0.812830 0.149946 O\n0.562830 0.912884 0.649946 O\n0.087116 0.437170 0.350054 O\n0.087116 0.737062 0.649946 O\n0.262938 0.912884 0.350054 O\n0.187170 0.337116 0.850054 O\n0.487062 0.337116 0.149946 O\n",
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{
"id": "mp-1208032",
"created_at": "2022-09-04T14:47:02.278379Z",
"structure_string": "Y4 V8 O8\n1.0\n-4.556758 4.556758 4.385802\n4.556758 -4.556758 4.385802\n4.556758 4.556758 -4.385802\nY V O\n4 8 8\ndirect\n0.125000 0.875000 0.750000 Y\n0.125000 0.375000 0.250000 Y\n0.625000 0.875000 0.750000 Y\n0.125000 0.875000 0.250000 Y\n0.498052 0.829497 0.331445 V\n0.498052 0.166607 0.668555 V\n0.416607 0.248052 0.168555 V\n0.751948 0.583393 0.831445 V\n0.751948 0.920503 0.168555 V\n0.079497 0.248052 0.831445 V\n0.833393 0.501948 0.331445 V\n0.170503 0.501948 0.668555 V\n0.350766 0.504232 0.153467 O\n0.350766 0.197299 0.846533 O\n0.447299 0.100766 0.346533 O\n0.899234 0.552701 0.653467 O\n0.899234 0.245768 0.346533 O\n0.754232 0.100766 0.653467 O\n0.802701 0.649234 0.153467 O\n0.495768 0.649234 0.846533 O\n",
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{
"id": "mp-1221552",
"created_at": "2022-09-04T14:43:40.881200Z",
"structure_string": "Mn10 Si4 Ge2\n1.0\n3.486440 -6.036170 0.000000\n3.486440 6.036170 0.000000\n0.000000 0.000000 4.854115\nMn Si Ge\n10 4 2\ndirect\n0.663007 0.333990 0.246344 Mn\n0.333990 0.663007 0.246344 Mn\n0.333990 0.663007 0.753656 Mn\n0.663007 0.333990 0.753656 Mn\n0.246724 0.007559 0.500000 Mn\n0.007559 0.246724 0.500000 Mn\n0.748866 0.748866 0.500000 Mn\n0.754733 0.998921 0.000000 Mn\n0.998921 0.754733 0.000000 Mn\n0.248692 0.248692 0.000000 Mn\n0.399043 0.399043 0.500000 Si\n0.393631 0.999078 0.000000 Si\n0.999078 0.393631 0.000000 Si\n0.603818 0.603818 0.000000 Si\n0.605130 0.001077 0.500000 Ge\n0.001077 0.605130 0.500000 Ge\n",
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{
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"created_at": "2022-09-04T14:42:14.976956Z",
"structure_string": "Na3 Li6 Mn5 O9\n1.0\n5.881800 0.000000 0.000000\n-2.928659 5.115320 0.000000\n-0.992963 -1.692892 9.065986\nNa Li Mn O\n3 6 5 9\ndirect\n0.162716 0.840479 0.495316 Na\n0.837123 0.161645 0.495795 Na\n0.481424 0.484160 0.487027 Na\n0.014336 0.338797 0.064865 Li\n0.334689 0.017765 0.064824 Li\n0.068224 0.071252 0.247053 Li\n0.648227 0.930046 0.973757 Li\n0.360815 0.364257 0.963953 Li\n0.920005 0.654706 0.981205 Li\n0.263630 0.583532 0.755357 Mn\n0.584667 0.271674 0.755717 Mn\n0.424960 0.747480 0.241357 Mn\n0.745048 0.425387 0.243747 Mn\n0.890064 0.888907 0.757539 Mn\n0.285725 0.661203 0.002646 O\n0.657233 0.290253 0.004318 O\n0.097616 0.425985 0.295090 O\n0.778357 0.779825 0.324281 O\n0.422486 0.097128 0.295130 O\n0.548829 0.902010 0.671223 O\n0.896168 0.548651 0.663445 O\n0.204340 0.206768 0.674467 O\n0.025584 0.030087 0.995644 O\n",
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{
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