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{
"id": "jvasp-44421",
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"structure_string": "Li2 Fe1 Si3 O8\n1.0\n5.061715 0.059029 -0.100887\n1.790591 5.890627 0.023285\n1.638704 1.074214 5.787475\nLi Fe Si O\n2 1 3 8\ndirect\n0.248312 0.645917 0.147467 Li\n0.777112 0.327868 0.862999 Li\n0.658556 0.301662 0.361755 Fe\n0.297578 0.120327 0.179373 Si\n0.331231 0.746430 0.609761 Si\n0.728469 0.880263 0.811393 Si\n0.983616 0.186776 0.123369 O\n0.063168 0.752083 0.840368 O\n0.438421 0.337736 0.107763 O\n0.340146 0.561985 0.462451 O\n0.712412 0.139198 0.668382 O\n0.286515 0.010294 0.457604 O\n0.506269 0.892892 0.059450 O\n0.628181 0.695171 0.709261 O\n",
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"structure_string": "Ba2 Y1 Bi3 O8\n1.0\n4.382865 -0.000000 -0.000000\n-0.000000 4.382865 -0.000000\n0.000000 0.000000 13.638099\nBa Y Bi O\n2 1 3 8\ndirect\n0.499999 0.499999 0.856083 Ba\n0.499999 0.499999 0.143917 Ba\n0.499999 0.499999 0.500000 Y\n0.000000 0.000000 0.654530 Bi\n0.000000 0.000000 0.000000 Bi\n0.000000 0.000000 0.345470 Bi\n0.499999 0.000000 0.598173 O\n0.000000 0.499999 0.598173 O\n0.000000 0.499999 0.000000 O\n0.000000 0.000000 0.821725 O\n0.499999 0.000000 0.401827 O\n0.000000 0.499999 0.401827 O\n0.000000 0.000000 0.178275 O\n0.499999 0.000000 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:38:15.345323Z",
"updated_at": "2022-09-04T14:38:15.345355Z",
"structure_string": "Na2 V4 O8\n1.0\n-3.036124 3.036124 4.304411\n3.036124 -3.036124 4.304411\n3.036124 3.036124 -4.304411\nNa V O\n2 4 8\ndirect\n0.874999 0.125000 0.749999 Na\n0.125000 0.874999 0.250000 Na\n0.500000 0.000000 0.000000 V\n0.500000 0.500000 0.000000 V\n0.500000 0.500000 0.499999 V\n0.000000 0.499999 0.499999 V\n0.730601 0.268678 0.038078 O\n0.307476 0.269398 0.038078 O\n0.731321 0.269398 0.461922 O\n0.730601 0.692523 0.461922 O\n0.269398 0.307476 0.538077 O\n0.268678 0.730601 0.538077 O\n0.692523 0.730601 0.961921 O\n0.269398 0.731321 0.961921 O\n",
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{
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"structure_string": "Li2 V3 Fe1 O8\n1.0\n5.863935 0.101697 0.071910\n3.020038 5.027468 0.071910\n3.020038 1.743620 4.715972\nLi V Fe O\n2 3 1 8\ndirect\n0.126411 0.126411 0.126411 Li\n0.495080 0.495080 0.495080 Li\n-0.002893 0.504069 0.504068 V\n0.504069 -0.002892 0.504068 V\n0.504069 0.504069 -0.002893 V\n0.878061 0.878061 0.878060 Fe\n0.261360 0.261360 0.261359 O\n0.246894 0.246893 0.718686 O\n0.246893 0.718687 0.246893 O\n0.718687 0.246894 0.246893 O\n0.269239 0.750833 0.750832 O\n0.750834 0.269240 0.750832 O\n0.750833 0.750834 0.269239 O\n0.750470 0.750470 0.750469 O\n",
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"created_at": "2022-09-04T14:38:10.268760Z",
"updated_at": "2022-09-04T14:38:10.268791Z",
"structure_string": "Zn2 Cr4 Se8\n1.0\n6.468093 0.000000 3.734355\n2.156031 6.098176 3.734355\n0.000000 0.000000 7.468710\nZn Cr Se\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Zn\n0.874999 0.875001 0.874999 Zn\n0.500000 -0.000000 0.500000 Cr\n-0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 0.499999 Cr\n0.500000 0.500000 -0.000001 Cr\n0.260114 0.260114 0.260113 Se\n0.739886 0.739887 0.280341 Se\n0.280341 0.739887 0.739885 Se\n0.739886 0.280342 0.739886 Se\n0.719658 0.260114 0.260113 Se\n0.260113 0.719659 0.260113 Se\n0.260114 0.260114 0.719658 Se\n0.739886 0.739887 0.739885 Se\n",
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{
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"created_at": "2022-09-04T14:38:15.336479Z",
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"structure_string": "Ca4 Pb2 O8\n1.0\n3.416172 0.000000 0.000000\n0.000000 5.874429 0.000000\n0.000000 -0.000000 9.828445\nCa Pb O\n4 2 8\ndirect\n0.500000 0.426863 0.818333 Ca\n0.500000 0.573137 0.181666 Ca\n0.500000 0.926863 0.681666 Ca\n0.500000 0.073137 0.318334 Ca\n0.000000 0.500000 0.500000 Pb\n0.000000 0.000000 0.000000 Pb\n0.000000 0.140433 0.797347 O\n0.000000 0.859567 0.202653 O\n0.000000 0.640433 0.702652 O\n0.000000 0.359567 0.297347 O\n0.500000 0.257448 0.547761 O\n0.500000 0.742552 0.452238 O\n0.500000 0.242552 0.047762 O\n0.500000 0.757448 0.952238 O\n",
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"structure_string": "Li2 Ti3 Ni1 O8\n1.0\n5.894603 -0.027216 -0.019245\n2.923731 5.118485 -0.019245\n2.923731 1.688016 4.832169\nLi Ti Ni O\n2 3 1 8\ndirect\n0.119505 0.119505 0.119505 Li\n0.499770 0.499770 0.499769 Li\n0.007482 0.498840 0.498840 Ti\n0.498840 0.007482 0.498840 Ti\n0.498841 0.498840 0.007481 Ti\n0.882766 0.882765 0.882764 Ni\n0.258997 0.258997 0.258996 O\n0.251601 0.251602 0.711946 O\n0.251602 0.711946 0.251601 O\n0.711946 0.251601 0.251601 O\n0.281447 0.747440 0.747439 O\n0.747440 0.281447 0.747439 O\n0.747441 0.747440 0.281445 O\n0.742322 0.742321 0.742320 O\n",
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"structure_string": "Al4 Pb2 Se8\n1.0\n6.284386 -0.110308 0.000000\n-3.068368 5.485508 0.000000\n0.000000 0.000000 10.937202\nAl Pb Se\n4 2 8\ndirect\n0.238163 0.759139 0.000000 Al\n0.240862 0.761837 0.500000 Al\n0.759139 0.238163 0.500000 Al\n0.761837 0.240861 0.000000 Al\n0.500000 0.500000 0.250000 Pb\n0.500000 0.500000 0.750000 Pb\n-0.000000 0.500000 0.169121 Se\n0.183974 0.346952 0.500000 Se\n0.500000 -0.000000 0.330879 Se\n0.346952 0.183974 0.000000 Se\n0.653049 0.816026 0.000000 Se\n0.500000 -0.000000 0.669121 Se\n0.816026 0.653048 0.500000 Se\n-0.000000 0.500000 0.830879 Se\n",
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"structure_string": "Na2 V2 Si2 O8\n1.0\n5.033851 0.115652 0.000000\n2.067423 4.591165 0.000000\n0.000000 -0.000000 6.633910\nNa V Si O\n2 2 2 8\ndirect\n0.317569 0.317569 0.250000 Na\n0.682431 0.682430 0.750000 Na\n0.000000 0.000000 0.000000 V\n0.000000 0.000000 0.500000 V\n0.338468 0.338468 0.750000 Si\n0.661532 0.661531 0.250000 Si\n0.222188 0.222187 0.555651 O\n0.222188 0.222187 0.944349 O\n0.203815 0.706001 0.750000 O\n0.293998 0.796184 0.250000 O\n0.706001 0.203815 0.750000 O\n0.796185 0.293998 0.250000 O\n0.777812 0.777811 0.055651 O\n0.777812 0.777811 0.444349 O\n",
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}