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{
"id": "mp-560083",
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"structure_string": "Ca8 Mn24 O48\n1.0\n11.422695 0.000000 0.000000\n0.000000 8.720042 0.000000\n0.000000 5.870172 9.166328\nCa Mn O\n8 24 48\ndirect\n0.166516 0.554137 0.251298 Ca\n0.666516 0.445863 0.248702 Ca\n0.833484 0.445863 0.748702 Ca\n0.333484 0.554137 0.751298 Ca\n0.165603 0.942109 0.257267 Ca\n0.665603 0.057891 0.242733 Ca\n0.834397 0.057891 0.742733 Ca\n0.334397 0.942109 0.757267 Ca\n0.381786 0.455985 0.443860 Mn\n0.881786 0.544015 0.056140 Mn\n0.618214 0.544015 0.556140 Mn\n0.118214 0.455985 0.943860 Mn\n0.881981 0.869814 0.072500 Mn\n0.381981 0.130186 0.427500 Mn\n0.118019 0.130186 0.927500 Mn\n0.618019 0.869814 0.572500 Mn\n0.904971 0.470577 0.418398 Mn\n0.404971 0.529423 0.081602 Mn\n0.095029 0.529423 0.581602 Mn\n0.595029 0.470577 0.918398 Mn\n0.403056 0.859806 0.090675 Mn\n0.903056 0.140194 0.409325 Mn\n0.596944 0.140194 0.909325 Mn\n0.096944 0.859806 0.590675 Mn\n0.395896 0.795590 0.431072 Mn\n0.895896 0.204410 0.068928 Mn\n0.604104 0.204410 0.568928 Mn\n0.104104 0.795590 0.931072 Mn\n0.903851 0.805933 0.416994 Mn\n0.403851 0.194067 0.083006 Mn\n0.096149 0.194067 0.583006 Mn\n0.596149 0.805933 0.916994 Mn\n0.850888 0.605239 0.210106 O\n0.350888 0.394761 0.289894 O\n0.149112 0.394761 0.789894 O\n0.649112 0.605239 0.710106 O\n0.334998 0.710957 0.306853 O\n0.834998 0.289043 0.193147 O\n0.665002 0.289043 0.693147 O\n0.165002 0.710957 0.806853 O\n0.521854 0.670609 0.112564 O\n0.021854 0.329391 0.387436 O\n0.478146 0.329391 0.887436 O\n0.978146 0.670609 0.612564 O\n0.023382 0.662406 0.382133 O\n0.523382 0.337594 0.117867 O\n0.976618 0.337594 0.617867 O\n0.476618 0.662406 0.882133 O\n0.301243 0.728077 0.032385 O\n0.801243 0.271923 0.467615 O\n0.698757 0.271923 0.967615 O\n0.198757 0.728077 0.532385 O\n0.804338 0.597156 0.477348 O\n0.304338 0.402844 0.022652 O\n0.195662 0.402844 0.522652 O\n0.695662 0.597156 0.977348 O\n0.578187 0.459459 0.428641 O\n0.078187 0.540541 0.071359 O\n0.421813 0.540541 0.571359 O\n0.921813 0.459459 0.928641 O\n0.088934 0.868515 0.076117 O\n0.588934 0.131485 0.423883 O\n0.911066 0.131485 0.923883 O\n0.411066 0.868515 0.576117 O\n0.849384 0.947547 0.208314 O\n0.349384 0.052453 0.291686 O\n0.150616 0.052453 0.791686 O\n0.650616 0.947547 0.708314 O\n0.511520 0.002583 0.126503 O\n0.011520 0.997417 0.373497 O\n0.488480 0.997417 0.873497 O\n0.988480 0.002583 0.626503 O\n0.296230 0.064581 0.039150 O\n0.796230 0.935419 0.460850 O\n0.703770 0.935419 0.960850 O\n0.203770 0.064581 0.539150 O\n0.583313 0.802629 0.433220 O\n0.083313 0.197371 0.066780 O\n0.416687 0.197371 0.566780 O\n0.916687 0.802629 0.933220 O\n",
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"formula_full": "Ca8 Mn24 O48",
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{
"id": "mp-1195295",
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{
"id": "mp-555755",
"created_at": "2022-09-04T14:39:32.282471Z",
"structure_string": "Fe20 Si12 O48\n1.0\n-5.937716 5.937716 5.937716\n5.937716 -5.937716 5.937716\n5.937716 5.937716 -5.937716\nFe Si O\n20 12 48\ndirect\n0.000000 0.500000 0.500000 Fe\n0.500000 0.000000 0.500000 Fe\n0.125000 0.375000 0.750000 Fe\n0.500000 0.000000 0.000000 Fe\n0.500000 0.500000 0.000000 Fe\n0.875000 0.750000 0.625000 Fe\n0.000000 0.000000 0.000000 Fe\n0.250000 0.875000 0.625000 Fe\n0.625000 0.250000 0.875000 Fe\n0.500000 0.500000 0.500000 Fe\n0.000000 0.500000 0.000000 Fe\n0.875000 0.625000 0.250000 Fe\n0.750000 0.625000 0.875000 Fe\n0.375000 0.750000 0.125000 Fe\n0.625000 0.875000 0.750000 Fe\n0.125000 0.250000 0.375000 Fe\n0.000000 0.000000 0.500000 Fe\n0.250000 0.375000 0.125000 Fe\n0.375000 0.125000 0.250000 Fe\n0.750000 0.125000 0.375000 Fe\n0.250000 0.125000 0.875000 Si\n0.375000 0.625000 0.750000 Si\n0.250000 0.625000 0.375000 Si\n0.375000 0.250000 0.625000 Si\n0.625000 0.750000 0.375000 Si\n0.875000 0.125000 0.750000 Si\n0.750000 0.375000 0.625000 Si\n0.875000 0.250000 0.125000 Si\n0.750000 0.875000 0.125000 Si\n0.125000 0.750000 0.875000 Si\n0.625000 0.375000 0.250000 Si\n0.125000 0.875000 0.250000 Si\n0.411517 0.104278 0.622016 O\n0.588483 0.895722 0.377984 O\n0.088483 0.877984 0.395722 O\n0.104278 0.622016 0.411517 O\n0.482262 0.604278 0.192761 O\n0.289501 0.482262 0.377984 O\n0.210499 0.122016 0.017738 O\n0.895722 0.377984 0.588483 O\n0.192761 0.210499 0.588483 O\n0.307239 0.911517 0.289501 O\n0.807239 0.517738 0.395722 O\n0.604278 0.911517 0.122016 O\n0.307239 0.895722 0.017738 O\n0.104278 0.982262 0.692761 O\n0.377984 0.588483 0.895722 O\n0.122016 0.017738 0.210499 O\n0.789501 0.411517 0.807239 O\n0.395722 0.807239 0.517738 O\n0.411517 0.807239 0.789501 O\n0.192761 0.482262 0.604278 O\n0.017738 0.210499 0.122016 O\n0.982262 0.692761 0.104278 O\n0.692761 0.104278 0.982262 O\n0.877984 0.982262 0.789501 O\n0.604278 0.192761 0.482262 O\n0.982262 0.789501 0.877984 O\n0.622016 0.411517 0.104278 O\n0.122016 0.604278 0.911517 O\n0.210499 0.588483 0.192761 O\n0.911517 0.122016 0.604278 O\n0.088483 0.710499 0.692761 O\n0.517738 0.622016 0.710499 O\n0.911517 0.289501 0.307239 O\n0.895722 0.017738 0.307239 O\n0.807239 0.789501 0.411517 O\n0.710499 0.517738 0.622016 O\n0.517738 0.395722 0.807239 O\n0.017738 0.307239 0.895722 O\n0.877984 0.395722 0.088483 O\n0.710499 0.692761 0.088483 O\n0.622016 0.710499 0.517738 O\n0.289501 0.307239 0.911517 O\n0.482262 0.377984 0.289501 O\n0.789501 0.877984 0.982262 O\n0.395722 0.088483 0.877984 O\n0.377984 0.289501 0.482262 O\n0.588483 0.192761 0.210499 O\n0.692761 0.088483 0.710499 O\n",
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{
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{
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{
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{
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{
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{
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{
"id": "mp-510248",
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"structure_string": "Ba4 Gd8 Mn8 O28\n1.0\n5.544188 0.000000 0.000000\n0.000000 5.544188 0.000000\n0.000000 0.000000 20.098601\nBa Gd Mn O\n4 8 8 28\ndirect\n0.244028 0.244028 0.000000 Ba\n0.255972 0.744028 0.500000 Ba\n0.744028 0.255972 0.500000 Ba\n0.755972 0.755972 0.000000 Ba\n0.228731 0.228731 0.183660 Gd\n0.271269 0.728731 0.683660 Gd\n0.728731 0.271269 0.683660 Gd\n0.728731 0.271269 0.316340 Gd\n0.271269 0.728731 0.316340 Gd\n0.771269 0.771269 0.183660 Gd\n0.228731 0.228731 0.816340 Gd\n0.771269 0.771269 0.816340 Gd\n0.246327 0.246327 0.397841 Mn\n0.253673 0.746327 0.897841 Mn\n0.746327 0.253673 0.897841 Mn\n0.746327 0.253673 0.102159 Mn\n0.253673 0.746327 0.102159 Mn\n0.753673 0.753673 0.397841 Mn\n0.246327 0.246327 0.602159 Mn\n0.753673 0.753673 0.602159 Mn\n0.274080 0.725920 0.000000 O\n0.774080 0.774080 0.500000 O\n0.225920 0.225920 0.500000 O\n0.725920 0.274080 0.000000 O\n0.000000 0.500000 0.387650 O\n0.000000 0.500000 0.887650 O\n0.500000 0.000000 0.112350 O\n0.500000 0.000000 0.612350 O\n0.000000 0.500000 0.612350 O\n0.000000 0.500000 0.112350 O\n0.500000 0.000000 0.887650 O\n0.500000 0.000000 0.387650 O\n0.000000 0.000000 0.099557 O\n0.500000 0.500000 0.599557 O\n0.500000 0.500000 0.400443 O\n0.000000 0.000000 0.900443 O\n0.000000 0.000000 0.375397 O\n0.500000 0.500000 0.875397 O\n0.500000 0.500000 0.124603 O\n0.000000 0.000000 0.624603 O\n0.298196 0.298196 0.291650 O\n0.201804 0.798196 0.791650 O\n0.798196 0.201804 0.791650 O\n0.798196 0.201804 0.208350 O\n0.201804 0.798196 0.208350 O\n0.701804 0.701804 0.291650 O\n0.298196 0.298196 0.708350 O\n0.701804 0.701804 0.708350 O\n",
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{
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"structure_string": "Li4 Mn28 O56\n1.0\n4.157058 9.362646 0.000000\n-4.157058 9.362646 0.000000\n0.000000 1.799411 12.992107\nLi Mn O\n4 28 56\ndirect\n0.268189 0.018438 0.821077 Li\n0.731811 0.981562 0.178923 Li\n0.018438 0.268189 0.321077 Li\n0.981562 0.731811 0.678923 Li\n0.857035 0.359032 0.928868 Mn\n0.714065 0.712437 0.857297 Mn\n0.571115 0.073611 0.785490 Mn\n0.213211 0.713385 0.858659 Mn\n0.142525 0.145984 0.070226 Mn\n0.571339 0.570177 0.786206 Mn\n0.857475 0.854016 0.929774 Mn\n0.500000 0.000000 0.000000 Mn\n0.142965 0.640968 0.071132 Mn\n0.428885 0.926389 0.214510 Mn\n0.000000 0.000000 0.000000 Mn\n0.285935 0.287563 0.142703 Mn\n0.359032 0.857035 0.428868 Mn\n0.428661 0.429823 0.213794 Mn\n0.073611 0.571115 0.285490 Mn\n0.786789 0.286615 0.141341 Mn\n0.712437 0.714065 0.357297 Mn\n0.570177 0.571339 0.286206 Mn\n0.000000 0.500000 0.500000 Mn\n0.854016 0.857475 0.429774 Mn\n0.713385 0.213211 0.358659 Mn\n0.145984 0.142525 0.570226 Mn\n0.926389 0.428885 0.714510 Mn\n0.287563 0.285935 0.642703 Mn\n0.640968 0.142965 0.571132 Mn\n0.000000 0.000000 0.500000 Mn\n0.429823 0.428661 0.713794 Mn\n0.286615 0.786789 0.641341 Mn\n0.813641 0.346095 0.790450 O\n0.626150 0.597050 0.915390 O\n0.938392 0.471918 0.852405 O\n0.486387 0.957811 0.859232 O\n0.804706 0.828870 0.797765 O\n0.093564 0.130952 0.936967 O\n0.614501 0.080521 0.924576 O\n0.738606 0.768973 0.985767 O\n0.898102 0.370075 0.067992 O\n0.453759 0.484424 0.843213 O\n0.261394 0.231027 0.014233 O\n0.385499 0.919479 0.075424 O\n0.974405 0.939529 0.870503 O\n0.101898 0.629925 0.932008 O\n0.906436 0.869048 0.063033 O\n0.227088 0.750575 0.996031 O\n0.195294 0.171130 0.202235 O\n0.513613 0.042189 0.140768 O\n0.373850 0.402950 0.084610 O\n0.659545 0.686352 0.228371 O\n0.061608 0.528082 0.147595 O\n0.346095 0.813641 0.290450 O\n0.772912 0.249425 0.003969 O\n0.186359 0.653905 0.209550 O\n0.471918 0.938392 0.352405 O\n0.313648 0.340455 0.271629 O\n0.597050 0.626150 0.415390 O\n0.025595 0.060471 0.129497 O\n0.828870 0.804706 0.297765 O\n0.130952 0.093564 0.436967 O\n0.546241 0.515576 0.156787 O\n0.957811 0.486387 0.359232 O\n0.673410 0.200378 0.217082 O\n0.484424 0.453759 0.343213 O\n0.768973 0.738606 0.485767 O\n0.799622 0.326590 0.282918 O\n0.370075 0.898102 0.567992 O\n0.080521 0.614501 0.424576 O\n0.231027 0.261394 0.514233 O\n0.919479 0.385499 0.575424 O\n0.629925 0.101898 0.432008 O\n0.939529 0.974405 0.370503 O\n0.042189 0.513613 0.640768 O\n0.750575 0.227088 0.496031 O\n0.171130 0.195294 0.702235 O\n0.869048 0.906436 0.563033 O\n0.686352 0.659545 0.728371 O\n0.402950 0.373850 0.584610 O\n0.528082 0.061608 0.647595 O\n0.249425 0.772912 0.503969 O\n0.340455 0.313648 0.771629 O\n0.060471 0.025595 0.629497 O\n0.653905 0.186359 0.709550 O\n0.515576 0.546241 0.656787 O\n0.200378 0.673410 0.717082 O\n0.326590 0.799622 0.782918 O\n",
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{
"id": "mp-1204194",
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"structure_string": "Gd12 Mo4 O28\n1.0\n7.570731 0.000000 0.000000\n0.000000 7.579282 0.000000\n0.000000 0.000000 10.660931\nGd Mo O\n12 4 28\ndirect\n0.027992 0.508708 0.742810 Gd\n0.472008 0.491292 0.242810 Gd\n0.527992 0.991292 0.257190 Gd\n0.972008 0.008708 0.757190 Gd\n0.276502 0.254419 0.967057 Gd\n0.223498 0.745581 0.467057 Gd\n0.776502 0.245581 0.032943 Gd\n0.723498 0.754419 0.532943 Gd\n0.300545 0.246123 0.513966 Gd\n0.199455 0.753877 0.013966 Gd\n0.800545 0.253877 0.486034 Gd\n0.699455 0.746123 0.986034 Gd\n0.502773 0.500234 0.750680 Mo\n0.997227 0.499766 0.250680 Mo\n0.002773 0.999766 0.249320 Mo\n0.497227 0.000234 0.749320 Mo\n0.410576 0.247697 0.742274 O\n0.089424 0.752303 0.242274 O\n0.910576 0.252303 0.257726 O\n0.589424 0.747697 0.757726 O\n0.220511 0.463989 0.367747 O\n0.279489 0.536011 0.867747 O\n0.720511 0.036011 0.632253 O\n0.779489 0.963989 0.132253 O\n0.872496 0.549896 0.400327 O\n0.627504 0.450104 0.900327 O\n0.372496 0.950104 0.599673 O\n0.127504 0.049896 0.099673 O\n0.169957 0.464062 0.116107 O\n0.330043 0.535938 0.616107 O\n0.669957 0.035938 0.883893 O\n0.830043 0.964062 0.383893 O\n0.788067 0.529192 0.133798 O\n0.711933 0.470808 0.633798 O\n0.288067 0.970808 0.866202 O\n0.211933 0.029192 0.366202 O\n0.040355 0.246477 0.614531 O\n0.459645 0.753523 0.114531 O\n0.540355 0.253523 0.385469 O\n0.959645 0.746477 0.885469 O\n0.994731 0.262796 0.880955 O\n0.505269 0.737204 0.380955 O\n0.494731 0.237204 0.119045 O\n0.005269 0.762796 0.619045 O\n",
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}