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{
"id": "jvasp-24628",
"created_at": "2022-09-04T14:37:18.173195Z",
"updated_at": "2022-09-04T14:37:18.173205Z",
"structure_string": "Hg6 Se4 Cl4\n1.0\n7.499708 -0.000000 -2.651548\n-3.749854 6.494937 -2.651548\n0.000000 0.000000 7.954642\nHg Se Cl\n6 4 4\ndirect\n0.750001 0.940205 0.190205 Hg\n0.309795 0.250000 0.559795 Hg\n0.559795 0.309795 0.250000 Hg\n0.190206 0.750000 0.940205 Hg\n0.940205 0.190205 0.750000 Hg\n0.250000 0.559795 0.309795 Hg\n0.947195 0.500000 -0.000000 Se\n0.500000 -0.000000 0.947194 Se\n0.552806 0.552806 0.552806 Se\n0.000001 0.947195 0.500000 Se\n0.468501 0.500000 -0.000000 Cl\n0.500000 -0.000000 0.468500 Cl\n0.000000 0.468500 0.500000 Cl\n0.031500 0.031500 0.031500 Cl\n",
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"structure_string": "Zn2 Cr4 O8\n1.0\n2.906133 0.000000 0.000000\n-1.453066 4.770809 -0.000000\n0.000000 0.000000 9.816549\nZn Cr O\n2 4 8\ndirect\n0.389836 0.779675 0.750000 Zn\n0.610162 0.220325 0.250000 Zn\n0.866906 0.733815 0.071443 Cr\n0.133092 0.266185 0.928557 Cr\n0.866906 0.733815 0.428557 Cr\n0.133092 0.266185 0.571443 Cr\n0.232333 0.464670 0.389249 O\n0.767664 0.535331 0.610751 O\n0.767664 0.535331 0.889249 O\n0.232333 0.464670 0.110751 O\n0.961890 0.923784 0.250000 O\n0.038108 0.076216 0.750000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n",
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{
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"structure_string": "Y4 Mg2 Se8\n1.0\n7.119376 -0.000000 4.110374\n2.373125 6.712213 4.110374\n-0.000000 -0.000000 8.220748\nY Mg Se\n4 2 8\ndirect\n0.500001 0.500000 0.499999 Y\n0.500000 0.000000 0.500000 Y\n0.000000 0.500000 0.500000 Y\n0.500001 0.500000 -0.000001 Y\n0.875001 0.875000 0.874999 Mg\n0.125000 0.125000 0.125000 Mg\n0.254209 0.254208 0.737374 Se\n0.745793 0.745791 0.745791 Se\n0.745793 0.745791 0.262625 Se\n0.254209 0.737374 0.254208 Se\n0.254209 0.254208 0.254208 Se\n0.262627 0.745791 0.745791 Se\n0.745792 0.262626 0.745791 Se\n0.737374 0.254208 0.254208 Se\n",
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{
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"created_at": "2022-09-04T14:37:10.471453Z",
"updated_at": "2022-09-04T14:37:10.471479Z",
"structure_string": "Mg4 V2 O8\n1.0\n5.135516 -0.000000 2.964991\n1.711839 4.841810 2.964991\n-0.000000 0.000000 5.929982\nMg V O\n4 2 8\ndirect\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500001 0.500000 -0.000000 Mg\n0.500001 0.500000 0.499999 Mg\n0.125000 0.125000 0.125000 V\n0.875001 0.875000 0.874999 V\n0.748845 0.748844 0.748843 O\n0.251156 0.251156 0.746530 O\n0.251157 0.746531 0.251156 O\n0.746531 0.251156 0.251156 O\n0.748845 0.253469 0.748843 O\n0.253470 0.748844 0.748843 O\n0.251156 0.251156 0.251156 O\n0.748845 0.748844 0.253469 O\n",
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{
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"created_at": "2022-09-04T14:37:08.150394Z",
"updated_at": "2022-09-04T14:37:08.150413Z",
"structure_string": "Na4 Se2 O8\n1.0\n5.778122 0.016029 -1.337954\n-3.155787 4.840245 -1.337954\n-0.000749 -0.001388 7.026233\nNa Se O\n4 2 8\ndirect\n0.191243 0.808757 0.250001 Na\n0.441243 0.558757 0.750000 Na\n0.558756 0.441244 0.250000 Na\n0.808756 0.191244 0.750000 Na\n0.125000 0.875001 0.750000 Se\n0.875000 0.125000 0.250000 Se\n0.795730 0.745842 0.603882 O\n0.254158 0.204270 0.896118 O\n0.858039 0.308152 0.103882 O\n0.204270 0.254158 0.396119 O\n0.691848 0.141960 0.396119 O\n0.308151 0.858040 0.603882 O\n0.141960 0.691849 0.896119 O\n0.745842 0.795731 0.103882 O\n",
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{
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"created_at": "2022-09-04T14:37:16.987688Z",
"updated_at": "2022-09-04T14:37:16.987731Z",
"structure_string": "Li2 Mn4 S8\n1.0\n6.873765 -0.010862 -0.009338\n-3.427665 5.927331 -0.002016\n-3.432447 -1.943318 5.596811\nLi Mn S\n2 4 8\ndirect\n0.000003 0.999997 0.000004 Li\n0.500005 0.500007 0.500013 Li\n0.000001 0.999999 0.500004 Mn\n0.500003 0.000002 0.000007 Mn\n0.500003 0.000000 0.500005 Mn\n0.000001 0.499998 0.500004 Mn\n0.014772 0.757179 0.272374 S\n0.016613 0.756564 0.743432 S\n0.485230 0.227634 0.742821 S\n0.516612 0.243426 0.256570 S\n0.514773 0.772365 0.257187 S\n0.983391 0.243435 0.256576 S\n0.483393 0.756577 0.743443 S\n0.985231 0.242819 0.727635 S\n",
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{
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"created_at": "2022-09-04T14:37:16.987516Z",
"updated_at": "2022-09-04T14:37:16.987537Z",
"structure_string": "Fe2 Rh4 S8\n1.0\n6.019812 -0.000000 3.475540\n2.006604 5.675533 3.475540\n-0.000000 -0.000000 6.951080\nFe Rh S\n2 4 8\ndirect\n0.874999 0.875000 0.875001 Fe\n0.125000 0.125000 0.125000 Fe\n0.500000 0.500000 0.000000 Rh\n0.500000 0.500000 0.500000 Rh\n-0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n0.743059 0.743059 0.743060 S\n0.256940 0.256940 0.729180 S\n0.256940 0.729180 0.256941 S\n0.729180 0.256940 0.256940 S\n0.743059 0.270820 0.743060 S\n0.270819 0.743059 0.743060 S\n0.256940 0.256940 0.256940 S\n0.743059 0.743059 0.270820 S\n",
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"structure_string": "B12 As2\n1.0\n5.021419 -0.013676 1.787049\n1.256418 4.861713 1.787049\n-0.017709 -0.013676 5.329904\nB As\n12 2\ndirect\n0.015219 0.015219 0.325120 B\n0.015219 0.325120 0.015219 B\n0.822219 0.271714 0.822218 B\n0.822219 0.822217 0.271716 B\n0.271716 0.822217 0.822218 B\n0.728285 0.177781 0.177782 B\n0.177782 0.728283 0.177782 B\n0.177782 0.177781 0.728284 B\n0.984782 0.674878 0.984781 B\n0.984782 0.984779 0.674880 B\n0.674881 0.984779 0.984781 B\n0.325120 0.015219 0.015219 B\n0.601226 0.601224 0.601226 As\n0.398775 0.398774 0.398775 As\n",
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"created_at": "2022-09-04T14:37:18.078036Z",
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"structure_string": "Zn2 Co4 O8\n1.0\n2.836784 0.000000 0.000000\n-1.418392 4.637975 -0.000000\n0.000000 -0.000000 9.473232\nZn Co O\n2 4 8\ndirect\n0.393477 0.786956 0.750000 Zn\n0.606522 0.213045 0.250000 Zn\n0.864378 0.728758 0.069831 Co\n0.135622 0.271243 0.930168 Co\n0.864378 0.728758 0.430169 Co\n0.135622 0.271243 0.569831 Co\n0.232083 0.464167 0.391485 O\n0.767916 0.535834 0.608515 O\n0.767916 0.535834 0.891485 O\n0.232083 0.464167 0.108515 O\n0.955223 0.910449 0.250000 O\n0.044776 0.089552 0.750000 O\n0.499999 0.000000 0.000000 O\n0.499999 0.000000 0.500000 O\n",
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"structure_string": "Zn2 Sb4 O8\n1.0\n6.623730 0.249562 0.205658\n3.527992 5.611538 0.205658\n3.551826 2.050648 5.800108\nZn Sb O\n2 4 8\ndirect\n0.125000 0.625000 0.625001 Zn\n0.625000 0.125000 0.625001 Zn\n0.970587 0.970588 0.029413 Sb\n0.279412 0.279412 0.220588 Sb\n0.625000 0.625000 0.125000 Sb\n0.625000 0.625000 0.625001 Sb\n0.383494 0.383494 0.418677 O\n0.380784 0.885969 0.366624 O\n0.383494 0.383494 0.814336 O\n0.885968 0.380785 0.366624 O\n0.364031 0.869215 0.883377 O\n0.869215 0.364031 0.883377 O\n0.866505 0.866506 0.435666 O\n0.866506 0.866506 0.831324 O\n",
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}