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{
"id": "jvasp-27196",
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"structure_string": "Rb2 Ti6 O13\n1.0\n3.838074 0.000000 -0.000000\n-1.919038 7.882983 -1.445531\n-0.000000 0.003952 9.188888\nRb Ti O\n2 6 13\ndirect\n0.455069 0.910140 0.250922 Rb\n0.544929 0.089859 0.749078 Rb\n0.114580 0.229161 0.095107 Ti\n0.885418 0.770838 0.904893 Ti\n0.173760 0.347519 0.437422 Ti\n0.826238 0.652480 0.562579 Ti\n0.234094 0.468188 0.778951 Ti\n0.765904 0.531811 0.221049 Ti\n0.641037 0.282078 0.110569 O\n0.358960 0.717922 0.889432 O\n0.861653 0.723308 0.384257 O\n0.138345 0.276691 0.615743 O\n0.703480 0.406964 0.428006 O\n0.761516 0.523035 0.760922 O\n0.918574 0.837151 0.709988 O\n0.081424 0.162848 0.290013 O\n0.169699 0.339398 0.917709 O\n0.238482 0.476964 0.239078 O\n0.000000 0.000000 0.000000 O\n0.296517 0.593035 0.571994 O\n0.830299 0.660601 0.082291 O\n",
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"structure_string": "Sn7 P1\n1.0\n6.526841 0.000000 0.000000\n0.000000 6.526841 0.000000\n0.000000 0.000000 6.526841\nSn P\n7 1\ndirect\n0.239923 0.239923 0.739923 Sn\n0.000000 0.500000 0.000000 Sn\n0.239923 0.760077 0.260077 Sn\n0.500000 0.000000 0.000000 Sn\n0.760077 0.239923 0.260077 Sn\n0.500000 0.500000 0.500000 Sn\n0.760077 0.760077 0.739923 Sn\n0.000000 0.000000 0.500000 P\n",
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{
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"structure_string": "Ti2 V6 O16\n1.0\n3.558566 0.000564 -1.097176\n-1.108257 12.359038 2.732042\n-0.000599 -0.023494 6.318103\nTi V O\n2 6 16\ndirect\n0.696165 0.641582 0.750919 Ti\n0.696304 0.141581 0.250897 Ti\n0.399100 0.647132 0.151224 V\n0.600029 0.352292 0.847641 V\n0.303741 0.359309 0.247925 V\n0.399261 0.147132 0.651204 V\n0.599835 0.852290 0.347668 V\n0.303600 0.859309 0.747952 V\n0.764596 0.328209 0.200782 O\n0.764450 0.828210 0.700806 O\n0.634193 -0.001209 0.269702 O\n0.634262 0.498793 0.769704 O\n0.557151 0.183954 0.930168 O\n0.556940 0.683952 0.430192 O\n0.442951 0.317482 0.568217 O\n0.237321 0.174319 0.300186 O\n0.361640 0.497762 0.225447 O\n0.361652 0.997764 0.725454 O\n0.867761 0.649448 0.086216 O\n0.237186 0.674319 0.800210 O\n0.135674 0.349720 0.921507 O\n0.135520 0.849719 0.421533 O\n0.442764 0.817481 0.068240 O\n0.867903 0.149450 0.586193 O\n",
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{
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"structure_string": "Mn2 Bi2 Se4 I2\n1.0\n4.125839 -0.000000 0.000000\n-2.062919 6.708082 -0.147643\n0.000000 -0.053639 10.048345\nMn Bi Se I\n2 2 4 2\ndirect\n0.500000 0.000000 -0.000000 Mn\n0.500000 -0.000000 0.500000 Mn\n0.787098 0.574196 0.192693 Bi\n0.212902 0.425803 0.807308 Bi\n0.569474 0.138947 0.755880 Se\n0.865166 0.730331 0.941207 Se\n0.430526 0.861052 0.244120 Se\n0.134834 0.269668 0.058793 Se\n0.863324 0.726647 0.569431 I\n0.136676 0.273353 0.430570 I\n",
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{
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"structure_string": "Mn2 Bi2 Se4 I2\n1.0\n4.125840 -0.000000 0.000000\n-2.062919 6.708082 -0.147643\n0.000000 -0.053639 10.048345\nMn Bi Se I\n2 2 4 2\ndirect\n0.500000 0.000000 -0.000000 Mn\n0.500000 -0.000000 0.500000 Mn\n0.787098 0.574196 0.192693 Bi\n0.212902 0.425803 0.807308 Bi\n0.569474 0.138947 0.755880 Se\n0.865166 0.730331 0.941207 Se\n0.430526 0.861052 0.244120 Se\n0.134834 0.269668 0.058793 Se\n0.863324 0.726647 0.569431 I\n0.136676 0.273353 0.430570 I\n",
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{
"id": "jvasp-25624",
"created_at": "2022-09-04T14:37:56.628242Z",
"updated_at": "2022-09-04T14:37:56.628256Z",
"structure_string": "Nd2 Te4 Br2 O10\n1.0\n5.196015 0.012475 -1.607470\n-0.509679 5.170971 -1.607470\n0.292728 0.323776 10.146384\nNd Te Br O\n2 4 2 10\ndirect\n0.999976 0.000022 -0.000000 Nd\n0.500024 0.499975 -0.000000 Nd\n0.623075 0.123074 0.246272 Te\n0.144824 0.644823 0.289756 Te\n0.876924 0.376924 0.753727 Te\n0.355177 0.855176 0.710243 Te\n0.750000 0.750003 0.500003 Br\n0.249996 0.250000 0.499996 Br\n0.174216 0.674215 0.814866 O\n0.640693 0.674207 0.814840 O\n0.980489 0.480490 0.961068 O\n0.325785 0.825783 0.185134 O\n0.859306 0.825793 0.185159 O\n0.640674 0.140675 0.814815 O\n0.859324 0.359325 0.185185 O\n0.174208 0.140693 0.814841 O\n0.519509 0.019510 0.038931 O\n0.325792 0.359307 0.185159 O\n",
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{
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"structure_string": "Hf8 O16\n1.0\n5.171984 -0.000000 0.000000\n0.000000 5.295556 0.000000\n0.000000 0.000000 10.153395\nHf O\n8 16\ndirect\n0.959101 0.341841 0.138155 Hf\n0.540897 0.841841 0.138155 Hf\n0.459102 0.341841 0.361845 Hf\n0.040898 0.841841 0.361845 Hf\n0.959101 0.158159 0.638155 Hf\n0.540897 0.658160 0.638155 Hf\n0.459102 0.158159 0.861845 Hf\n0.040898 0.658160 0.861845 Hf\n0.753334 0.913099 0.776599 O\n0.746665 0.413099 0.776599 O\n0.253334 0.913099 0.723402 O\n0.246666 0.413099 0.723402 O\n0.830486 0.833671 0.533456 O\n0.669512 0.333671 0.533456 O\n0.330487 0.666330 0.466544 O\n0.253334 0.586902 0.223402 O\n0.753334 0.586902 0.276598 O\n0.746665 0.086901 0.276598 O\n0.169513 0.333671 0.966545 O\n0.246666 0.086901 0.223402 O\n0.669512 0.166329 0.033456 O\n0.830486 0.666330 0.033456 O\n0.169513 0.166329 0.466544 O\n0.330487 0.833671 0.966545 O\n",
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{
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"structure_string": "Ag8 Te4\n1.0\n0.000000 8.001340 0.001150\n4.507263 0.000000 0.000000\n0.000000 -4.829759 -7.711779\nAg Te\n8 4\ndirect\n0.034015 0.117383 0.659399 Ag\n0.965985 0.617383 0.840601 Ag\n0.965985 0.882616 0.340601 Ag\n0.034015 0.382617 0.159399 Ag\n0.333235 0.854434 0.347168 Ag\n0.666765 0.354435 0.152832 Ag\n0.666765 0.145565 0.652832 Ag\n0.333235 0.645565 0.847168 Ag\n0.275814 0.141673 0.035321 Te\n0.724186 0.641673 0.464680 Te\n0.724186 0.858326 0.964680 Te\n0.275814 0.358327 0.535321 Te\n",
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{
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"created_at": "2022-09-04T14:37:28.723196Z",
"updated_at": "2022-09-04T14:37:28.723229Z",
"structure_string": "K2 Na2 Pr2 Ta2 O10\n1.0\n5.792268 0.000000 0.000000\n0.000000 5.792268 0.000000\n-0.000000 0.000000 8.289053\nK Na Pr Ta O\n2 2 2 2 10\ndirect\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.000000 0.241299 Na\n0.000000 0.500000 0.758701 Na\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.500000 Pr\n0.000000 0.500000 0.255320 Ta\n0.500000 0.000000 0.744680 Ta\n0.269905 0.230095 0.674048 O\n0.730095 0.769905 0.674048 O\n0.269905 0.769905 0.674048 O\n0.230095 0.730095 0.325951 O\n0.000000 0.500000 0.031184 O\n0.230095 0.269905 0.325951 O\n0.769905 0.269905 0.325951 O\n0.730095 0.230095 0.674048 O\n0.769905 0.730095 0.325951 O\n0.500000 0.000000 0.968816 O\n",
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{
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"structure_string": "Li4 Cr3 Co3 Sn2 O16\n1.0\n5.778047 -0.029376 0.015144\n-2.890226 5.034179 0.004075\n-0.099460 -0.065086 9.589062\nLi Cr Co Sn O\n4 3 3 2 16\ndirect\n0.664067 0.332025 0.892078 Li\n0.007946 0.003911 0.993932 Li\n0.005118 0.002610 0.495394 Li\n0.331558 0.665776 0.398044 Li\n0.830148 0.172122 0.215395 Cr\n0.830150 0.657963 0.215398 Cr\n0.657406 0.828718 0.715142 Cr\n0.171339 0.339708 0.714595 Co\n0.171341 0.831645 0.714597 Co\n0.341793 0.170864 0.214720 Co\n0.664110 0.332069 0.495730 Sn\n0.330332 0.665125 0.990886 Sn\n0.684453 0.842187 0.102284 O\n0.158205 0.315875 0.103339 O\n0.327592 0.663794 0.608883 O\n0.483491 0.969685 0.834231 O\n0.483513 0.513805 0.834212 O\n0.312790 0.156399 0.605407 O\n0.512755 0.481889 0.334634 O\n0.969943 0.484943 0.336854 O\n0.842616 0.686996 0.603114 O\n0.004809 0.002417 0.806893 O\n0.003996 0.001970 0.307471 O\n0.665324 0.332630 0.105342 O\n0.031614 0.515816 0.828132 O\n0.842597 0.155654 0.603133 O\n0.512773 0.030844 0.334643 O\n0.158213 0.842244 0.103354 O\n",
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}