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{
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{
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"structure_string": "Ba36 Au8 O48\n1.0\n7.239244 0.000000 0.000000\n0.000000 14.404596 0.000000\n0.000000 0.000000 17.495476\nBa Au O\n36 8 48\ndirect\n0.182885 0.822036 0.556737 Ba\n0.682885 0.677964 0.943263 Ba\n0.317115 0.322036 0.443263 Ba\n0.817115 0.177964 0.056737 Ba\n0.817115 0.177964 0.443263 Ba\n0.317115 0.322036 0.056737 Ba\n0.682885 0.677964 0.556737 Ba\n0.182885 0.822036 0.943263 Ba\n0.156205 0.182280 0.250000 Ba\n0.656205 0.317720 0.250000 Ba\n0.343795 0.682280 0.750000 Ba\n0.843795 0.817720 0.750000 Ba\n0.172630 0.436506 0.250000 Ba\n0.672630 0.063494 0.250000 Ba\n0.327370 0.936506 0.750000 Ba\n0.827370 0.563494 0.750000 Ba\n0.331248 0.051213 0.420631 Ba\n0.831248 0.448787 0.079369 Ba\n0.168752 0.551213 0.579369 Ba\n0.668752 0.948787 0.920631 Ba\n0.668752 0.948787 0.579369 Ba\n0.168752 0.551213 0.920631 Ba\n0.831248 0.448787 0.420631 Ba\n0.331248 0.051213 0.079369 Ba\n0.892134 0.099513 0.750000 Ba\n0.392134 0.400487 0.750000 Ba\n0.607866 0.599513 0.250000 Ba\n0.107866 0.900487 0.250000 Ba\n0.467956 0.186892 0.641970 Ba\n0.967956 0.313108 0.858030 Ba\n0.032044 0.686892 0.358030 Ba\n0.532044 0.813108 0.141970 Ba\n0.532044 0.813108 0.358030 Ba\n0.032044 0.686892 0.141970 Ba\n0.967956 0.313108 0.641970 Ba\n0.467956 0.186892 0.858030 Ba\n0.080590 0.064164 0.583801 Au\n0.580590 0.435836 0.916199 Au\n0.419410 0.564164 0.416199 Au\n0.919410 0.935836 0.083801 Au\n0.919410 0.935836 0.416199 Au\n0.419410 0.564164 0.083801 Au\n0.580590 0.435836 0.583801 Au\n0.080590 0.064164 0.916199 Au\n0.996156 0.048005 0.347451 O\n0.496156 0.451995 0.152549 O\n0.503844 0.548005 0.652549 O\n0.003844 0.951995 0.847451 O\n0.003844 0.951995 0.652549 O\n0.503844 0.548005 0.847451 O\n0.496156 0.451995 0.347451 O\n0.996156 0.048005 0.152549 O\n0.295793 0.727837 0.250000 O\n0.795794 0.772163 0.250000 O\n0.204207 0.227837 0.750000 O\n0.704206 0.272163 0.750000 O\n0.336805 0.676176 0.480116 O\n0.836805 0.823824 0.019884 O\n0.163195 0.176176 0.519884 O\n0.663195 0.323824 0.980116 O\n0.663195 0.323824 0.519884 O\n0.163195 0.176176 0.980116 O\n0.836805 0.823824 0.480116 O\n0.336805 0.676176 0.019884 O\n0.177420 0.876844 0.405249 O\n0.677420 0.623156 0.094751 O\n0.322580 0.376844 0.594751 O\n0.822580 0.123156 0.905249 O\n0.822580 0.123156 0.594751 O\n0.322580 0.376844 0.905249 O\n0.677420 0.623156 0.405249 O\n0.177420 0.876844 0.094751 O\n0.988140 0.300296 0.154731 O\n0.488140 0.199704 0.345269 O\n0.511860 0.800296 0.845269 O\n0.011860 0.699704 0.654731 O\n0.011860 0.699704 0.845269 O\n0.511860 0.800296 0.654731 O\n0.488140 0.199704 0.154731 O\n0.988140 0.300296 0.345269 O\n0.662637 0.991813 0.425347 O\n0.162637 0.508187 0.074653 O\n0.837363 0.491813 0.574653 O\n0.337363 0.008187 0.925347 O\n0.337363 0.008187 0.574653 O\n0.837363 0.491813 0.925347 O\n0.162637 0.508187 0.425347 O\n0.662637 0.991813 0.074653 O\n0.443074 0.946194 0.250000 O\n0.943074 0.553806 0.250000 O\n0.056926 0.446194 0.750000 O\n0.556926 0.053806 0.750000 O\n",
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{
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"created_at": "2022-09-04T14:42:08.183777Z",
"structure_string": "Lu4 Cd2 S8\n1.0\n0.000000 5.561330 5.561330\n5.561330 0.000000 5.561330\n5.561330 5.561330 0.000000\nLu Cd S\n4 2 8\ndirect\n0.125000 0.125000 0.625000 Lu\n0.125000 0.625000 0.125000 Lu\n0.625000 0.125000 0.125000 Lu\n0.125000 0.125000 0.125000 Lu\n0.750000 0.750000 0.750000 Cd\n0.500000 0.500000 0.500000 Cd\n0.883715 0.348854 0.883715 S\n0.366285 0.366285 0.901146 S\n0.366285 0.366285 0.366285 S\n0.901146 0.366285 0.366285 S\n0.883715 0.883715 0.883715 S\n0.348854 0.883715 0.883715 S\n0.366285 0.901146 0.366285 S\n0.883715 0.883715 0.348854 S\n",
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{
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"structure_string": "La2 Nd2 Zr4 O14\n1.0\n-3.832374 3.834170 5.421253\n3.832374 -3.834170 5.421253\n3.832374 3.834170 -5.421253\nLa Nd Zr O\n2 2 4 14\ndirect\n0.500000 0.500000 0.000000 La\n0.000000 0.500000 0.500000 La\n0.500000 0.500000 0.500000 Nd\n0.500000 0.000000 0.000000 Nd\n0.000000 0.000000 0.500000 Zr\n0.000000 0.500000 0.000000 Zr\n0.000000 0.000000 0.000000 Zr\n0.500000 0.000000 0.500000 Zr\n0.377639 0.627639 0.750000 O\n0.622361 0.372361 0.250000 O\n0.335312 0.085312 0.250000 O\n0.916566 0.666566 0.250000 O\n0.334436 0.665644 0.251602 O\n0.914043 0.082835 0.248398 O\n0.334436 0.082835 0.668792 O\n0.914043 0.665644 0.831208 O\n0.664688 0.914688 0.750000 O\n0.083434 0.333434 0.750000 O\n0.665564 0.334356 0.748398 O\n0.085957 0.917165 0.751602 O\n0.665564 0.917165 0.331208 O\n0.085957 0.334356 0.168792 O\n",
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{
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