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"structure_string": "Th4 Te8 O24\n1.0\n7.230619 0.044980 0.000000\n-2.274013 6.988747 0.000000\n0.000000 0.000000 11.325364\nTh Te O\n4 8 24\ndirect\n0.740636 0.992171 0.908227 Th\n0.759365 0.507829 0.408227 Th\n0.259365 0.007829 0.091773 Th\n0.240635 0.492171 0.591772 Th\n0.264754 0.527902 0.925081 Te\n0.764754 0.027902 0.574919 Te\n0.735247 0.472098 0.074919 Te\n0.235247 0.972098 0.425081 Te\n0.245446 0.451936 0.273741 Te\n0.745446 0.951936 0.226259 Te\n0.754555 0.548065 0.726258 Te\n0.254554 0.048065 0.773741 Te\n0.821884 0.307737 0.970829 O\n0.686165 0.117689 0.718939 O\n0.813835 0.382312 0.218939 O\n0.963378 0.832077 0.408332 O\n0.536623 0.667923 0.908332 O\n0.036622 0.167923 0.591668 O\n0.463378 0.332077 0.091668 O\n0.321884 0.807737 0.529170 O\n0.178116 0.692263 0.029171 O\n0.678116 0.192263 0.470829 O\n0.426845 0.030447 0.899393 O\n0.910194 0.919686 0.098829 O\n0.573156 0.969554 0.100607 O\n0.926845 0.530447 0.600607 O\n0.089806 0.080314 0.901170 O\n0.410194 0.419686 0.401170 O\n0.186165 0.617689 0.781060 O\n0.589807 0.580315 0.598829 O\n0.356785 0.315413 0.745703 O\n0.143215 0.184588 0.245704 O\n0.643215 0.684588 0.254296 O\n0.856786 0.815413 0.754296 O\n0.073156 0.469553 0.399393 O\n0.313835 0.882312 0.281061 O\n",
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{
"id": "jvasp-97706",
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"updated_at": "2022-09-04T14:35:51.241929Z",
"structure_string": "Tl8 Sn4 O12\n1.0\n3.291550 -0.000000 0.000000\n-0.000000 10.321840 0.000000\n0.000000 0.000000 12.539662\nTl Sn O\n8 4 12\ndirect\n0.750000 0.132687 0.893625 Tl\n0.250000 0.867313 0.106375 Tl\n0.750000 0.632687 0.606375 Tl\n0.250000 0.367313 0.393625 Tl\n0.750000 0.291261 0.649922 Tl\n0.250000 0.708739 0.350078 Tl\n0.750000 0.791261 0.850078 Tl\n0.250000 0.208739 0.149922 Tl\n0.250000 0.959505 0.610903 Sn\n0.750000 0.040495 0.389097 Sn\n0.250000 0.459505 0.889097 Sn\n0.750000 0.540495 0.110903 Sn\n0.250000 0.787402 0.691531 O\n0.750000 0.392501 0.991224 O\n0.250000 0.607499 0.008776 O\n0.750000 0.892501 0.508776 O\n0.250000 0.107499 0.491224 O\n0.750000 0.042254 0.692138 O\n0.250000 0.957746 0.307862 O\n0.750000 0.542254 0.807862 O\n0.250000 0.457746 0.192138 O\n0.250000 0.287402 0.808469 O\n0.750000 0.712598 0.191531 O\n0.750000 0.212598 0.308469 O\n",
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{
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"structure_string": "Ba12 Mn10 O32\n1.0\n5.738801 0.000000 0.000000\n-2.869401 6.638510 -0.000000\n0.000000 -0.000000 20.099536\nBa Mn O\n12 10 32\ndirect\n0.121408 0.242815 0.839358 Ba\n0.645685 0.291370 0.981266 Ba\n0.354315 0.708630 0.018734 Ba\n0.854315 0.708630 0.481266 Ba\n0.145685 0.291370 0.518734 Ba\n0.914174 0.828347 0.678509 Ba\n0.878592 0.757185 0.160642 Ba\n0.585826 0.171653 0.178509 Ba\n0.414174 0.828347 0.821491 Ba\n0.621408 0.242815 0.660642 Ba\n0.378592 0.757185 0.339358 Ba\n0.085826 0.171653 0.321491 Ba\n0.877200 0.754401 0.906291 Mn\n0.122800 0.245599 0.093709 Mn\n0.622800 0.245599 0.406291 Mn\n0.377200 0.754401 0.593709 Mn\n0.000000 0.000000 0.000000 Mn\n0.749881 0.499762 0.811126 Mn\n0.750119 0.500238 0.311126 Mn\n0.249881 0.499762 0.688874 Mn\n0.500000 0.000000 0.500000 Mn\n0.250119 0.500238 0.188874 Mn\n0.884975 0.769950 0.314149 O\n0.588092 0.176185 0.316016 O\n0.411908 0.823815 0.683984 O\n0.615025 0.230050 0.814149 O\n0.384975 0.769950 0.185851 O\n0.943005 0.450996 0.385331 O\n0.987689 0.475379 0.250000 O\n0.492009 0.549004 0.614669 O\n0.556995 0.549004 0.885331 O\n0.007991 0.450996 0.114669 O\n0.056995 0.549004 0.614669 O\n0.507991 0.450996 0.385331 O\n0.443005 0.450996 0.114669 O\n0.992009 0.549004 0.885331 O\n0.794324 0.037586 0.069274 O\n0.756738 0.962414 0.930726 O\n0.705676 0.962414 0.569274 O\n0.743262 0.037586 0.430726 O\n0.205676 0.962414 0.930726 O\n0.243262 0.037586 0.069274 O\n0.294324 0.037586 0.430726 O\n0.256738 0.962414 0.569274 O\n0.855096 0.710193 0.002516 O\n0.144904 0.289807 -0.002516 O\n0.644904 0.289807 0.502516 O\n0.355096 0.710193 0.497484 O\n0.911908 0.823815 0.816017 O\n0.088092 0.176185 0.183984 O\n0.012311 0.524621 0.750000 O\n0.487689 0.475379 0.250000 O\n0.512311 0.524621 0.750000 O\n0.115025 0.230050 0.685851 O\n",
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{
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"created_at": "2022-09-04T14:35:46.934495Z",
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"structure_string": "Na8 Co2 O8\n1.0\n5.600294 -0.016238 0.919696\n1.841936 5.073847 1.824524\n0.013167 0.015189 8.648298\nNa Co O\n8 2 8\ndirect\n0.963959 0.789636 0.350718 Na\n0.976277 0.603813 0.761076 Na\n0.991131 0.363387 0.175717 Na\n0.480937 0.892402 0.144240 Na\n0.973502 0.241731 0.566920 Na\n0.468585 0.078237 0.733831 Na\n0.453780 0.318699 0.319187 Na\n0.471442 0.440237 0.928019 Na\n0.441525 0.684282 0.501573 Co\n0.003379 0.997745 0.993366 Co\n0.204096 0.672637 0.109118 O\n0.865973 0.995815 0.819732 O\n0.198061 0.210205 0.943249 O\n0.578880 0.686216 0.675226 O\n0.246815 0.471853 0.551664 O\n0.240836 0.009394 0.385807 O\n0.699120 0.547047 0.362845 O\n0.745805 0.134966 0.132115 O\n",
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{
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"created_at": "2022-09-04T14:38:13.982476Z",
"updated_at": "2022-09-04T14:38:13.982496Z",
"structure_string": "Na2 Nb2 Cu4 S8\n1.0\n5.299724 -0.000000 -1.598049\n0.000000 7.480745 0.000000\n-0.068124 0.000000 9.361028\nNa Nb Cu S\n2 2 4 8\ndirect\n0.720755 0.750000 0.656860 Na\n0.063896 0.250000 0.343140 Na\n0.882723 0.750000 0.228779 Nb\n0.653944 0.250000 0.771221 Nb\n0.748715 0.000000 -0.000000 Cu\n0.748715 0.500000 -0.000000 Cu\n0.375051 0.750000 0.215593 Cu\n0.159459 0.250000 0.784408 Cu\n0.238224 0.750000 0.430314 S\n0.807910 0.250000 0.569687 S\n0.629046 0.001070 0.217915 S\n0.411132 -0.001070 0.782085 S\n0.001898 0.250000 0.991350 S\n0.010548 0.750000 0.008650 S\n0.411132 0.501070 0.782085 S\n0.629046 0.498930 0.217915 S\n",
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"structure_string": "Zr8 Bi16\n1.0\n4.059740 0.000000 0.000000\n0.000000 10.379817 0.000000\n0.000000 0.000000 15.697895\nZr Bi\n8 16\ndirect\n0.500000 0.663075 0.994154 Zr\n0.500000 0.336925 0.005845 Zr\n0.000000 0.163075 0.505845 Zr\n0.000000 0.836925 0.494154 Zr\n0.000000 0.977423 0.751524 Zr\n0.000000 0.022577 0.248475 Zr\n0.500000 0.477423 0.748475 Zr\n0.500000 0.522577 0.251525 Zr\n0.500000 0.013051 0.393899 Bi\n0.500000 0.986949 0.606101 Bi\n0.000000 0.734557 0.299772 Bi\n0.000000 0.265443 0.700228 Bi\n0.500000 0.234557 0.200228 Bi\n0.500000 0.765444 0.799771 Bi\n0.500000 0.845893 0.150091 Bi\n0.500000 0.623141 0.443146 Bi\n0.000000 0.345893 0.349909 Bi\n0.000000 0.654107 0.650091 Bi\n0.000000 0.486949 0.893899 Bi\n0.500000 0.376860 0.556854 Bi\n0.000000 0.123141 0.056854 Bi\n0.000000 0.876860 0.943146 Bi\n0.500000 0.154107 0.849908 Bi\n0.000000 0.513052 0.106101 Bi\n",
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"structure_string": "K12 Bi4 Se12\n1.0\n9.725069 0.000000 0.000000\n0.000000 9.725069 0.000000\n0.000000 -0.000000 9.725069\nK Bi Se\n12 4 12\ndirect\n0.325285 0.325285 0.325285 K\n0.174715 0.674715 0.825285 K\n0.825285 0.174715 0.674715 K\n0.674715 0.825285 0.174715 K\n0.571606 0.571606 0.571606 K\n0.928394 0.428394 0.071606 K\n0.071606 0.928394 0.428394 K\n0.428394 0.071606 0.928394 K\n0.815397 0.815397 0.815397 K\n0.684603 0.184603 0.315397 K\n0.315397 0.684603 0.184603 K\n0.184603 0.315397 0.684603 K\n0.461169 0.961169 0.538831 Bi\n0.961169 0.538831 0.461169 Bi\n0.538831 0.461169 0.961169 Bi\n0.038831 0.038831 0.038831 Bi\n0.116014 -0.000530 0.772549 Se\n0.227452 0.616014 0.500531 Se\n0.500531 0.227452 0.616014 Se\n0.616014 0.500531 0.227452 Se\n0.883986 0.499470 0.727452 Se\n0.000530 0.272548 0.383986 Se\n0.383986 0.000530 0.272548 Se\n-0.000530 0.772549 0.116014 Se\n0.499470 0.727452 0.883986 Se\n0.772549 0.116014 -0.000530 Se\n0.272548 0.383986 0.000530 Se\n0.727452 0.883986 0.499470 Se\n",
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"structure_string": "Na16 Ga8 S20\n1.0\n6.119590 0.000000 0.000000\n0.000000 7.973350 -0.171673\n0.000000 0.130092 19.845091\nNa Ga S\n16 8 20\ndirect\n0.743278 0.923083 0.956460 Na\n0.996037 0.114220 0.199732 Na\n0.496037 0.885780 0.300268 Na\n0.003963 0.885780 0.800268 Na\n0.503963 0.114220 0.699732 Na\n0.026223 0.656567 0.215701 Na\n0.973777 0.343432 0.784299 Na\n0.473777 0.656567 0.715701 Na\n0.526223 0.343432 0.284299 Na\n0.540068 0.404060 0.102953 Na\n0.959932 0.404060 0.602953 Na\n0.459932 0.595939 0.897047 Na\n0.756722 0.923083 0.456460 Na\n0.256722 0.076917 0.043541 Na\n0.243278 0.076917 0.543541 Na\n0.040068 0.595940 0.397047 Na\n0.913073 0.344879 0.963735 Ga\n0.933470 0.835057 0.635094 Ga\n0.566530 0.835057 0.135094 Ga\n0.066530 0.164943 0.364906 Ga\n0.413073 0.655121 0.536265 Ga\n0.086927 0.655121 0.036265 Ga\n0.586927 0.344879 0.463735 Ga\n0.433470 0.164943 0.864906 Ga\n0.488570 0.370401 0.791576 S\n0.522745 0.611834 0.424048 S\n0.977255 0.611833 0.924048 S\n0.477255 0.388166 0.575952 S\n0.011430 0.370401 0.291576 S\n0.511430 0.629599 0.208425 S\n0.975695 0.905756 0.326255 S\n0.475695 0.094243 0.173745 S\n0.022745 0.388166 0.075952 S\n0.024305 0.094243 0.673745 S\n0.940609 0.258846 0.470975 S\n0.440609 0.741154 0.029025 S\n0.059391 0.741154 0.529025 S\n0.559391 0.258846 0.970975 S\n0.931325 0.869093 0.097507 S\n0.431325 0.130907 0.402493 S\n0.068676 0.130907 0.902493 S\n0.568676 0.869093 0.597507 S\n0.524305 0.905756 0.826255 S\n0.988570 0.629599 0.708425 S\n",
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{
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"created_at": "2022-09-04T14:36:20.800988Z",
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"structure_string": "Tl6 Cd4 I14\n1.0\n4.560960 0.000000 0.000000\n0.000000 13.699295 0.000000\n0.000000 0.000000 14.992255\nTl Cd I\n6 4 14\ndirect\n0.000000 0.888434 0.857155 Tl\n0.000000 0.388434 0.642845 Tl\n0.000000 0.611566 0.357155 Tl\n0.000000 0.500000 0.000000 Tl\n0.000000 0.000000 0.500000 Tl\n0.000000 0.111566 0.142845 Tl\n0.500000 0.230288 0.892041 Cd\n0.500000 0.769712 0.107959 Cd\n0.500000 0.269712 0.392041 Cd\n0.500000 0.730288 0.607959 Cd\n0.000000 0.847744 0.200186 I\n0.000000 0.347744 0.299814 I\n0.500000 0.571115 0.181204 I\n0.500000 0.428886 0.818796 I\n0.000000 0.152256 0.799814 I\n0.500000 0.071114 0.318796 I\n0.500000 0.798782 0.431550 I\n0.500000 0.201218 0.568449 I\n0.000000 0.652257 0.700186 I\n0.500000 0.701218 0.931550 I\n0.500000 0.000000 0.000000 I\n0.500000 0.500000 0.500000 I\n0.500000 0.928886 0.681203 I\n0.500000 0.298782 0.068450 I\n",
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