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{
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"structure_string": "Na2 Al1 Hg1 Br6\n1.0\n6.654774 -0.000000 3.842136\n2.218258 6.274181 3.842136\n-0.000000 -0.000000 7.684271\nNa Al Hg Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500001 Hg\n0.767789 0.232211 0.232212 Br\n0.232211 0.232211 0.767789 Br\n0.232211 0.767789 0.767789 Br\n0.232211 0.767789 0.232212 Br\n0.767789 0.232211 0.767790 Br\n0.767789 0.767789 0.232212 Br\n",
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{
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"structure_string": "K6 Pd4 O8\n1.0\n5.510877 -0.004765 0.000000\n-2.080308 5.103147 -0.000000\n0.000000 -0.000000 11.411202\nK Pd O\n6 4 8\ndirect\n0.353077 0.646924 0.568424 K\n0.646924 0.353077 0.068425 K\n0.283624 0.716377 0.250000 K\n0.646924 0.353077 0.431575 K\n0.716377 0.283625 0.750000 K\n0.353077 0.646924 0.931575 K\n0.000000 0.000000 0.500000 Pd\n0.922304 0.077698 0.250000 Pd\n0.077697 0.922304 0.750000 Pd\n0.000000 0.000000 0.000000 Pd\n0.130296 0.296853 0.115191 O\n0.130296 0.296853 0.384809 O\n0.703148 0.869706 0.384809 O\n0.296853 0.130296 0.615191 O\n0.703148 0.869706 0.115191 O\n0.869705 0.703149 0.615191 O\n0.296853 0.130296 0.884809 O\n0.869705 0.703149 0.884809 O\n",
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{
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"created_at": "2022-09-04T14:38:35.516422Z",
"updated_at": "2022-09-04T14:38:35.516439Z",
"structure_string": "Na4 Fe2 As2 C2 O14\n1.0\n0.000000 5.252936 -0.032520\n6.770586 0.000000 0.000000\n0.000000 -0.074676 -9.018140\nNa Fe As C O\n4 2 2 2 14\ndirect\n0.771793 0.497818 0.216392 Na\n0.771793 0.002182 0.216392 Na\n0.228207 0.502182 0.783608 Na\n0.228207 0.997819 0.783608 Na\n0.215107 0.250000 0.352721 Fe\n0.784893 0.750000 0.647279 Fe\n0.290868 0.750000 0.422891 As\n0.709132 0.250000 0.577109 As\n0.282627 0.250000 0.072599 C\n0.717373 0.750000 0.927401 C\n0.536981 0.750000 0.825070 O\n0.798323 0.045343 0.674837 O\n0.798323 0.454658 0.674837 O\n0.157138 0.750000 0.597168 O\n0.379580 0.250000 0.551559 O\n0.620420 0.750000 0.448441 O\n0.053030 0.250000 0.127167 O\n0.201677 0.545343 0.325163 O\n0.201677 0.954658 0.325163 O\n0.463019 0.250000 0.174930 O\n0.946970 0.750000 0.872833 O\n0.667832 0.750000 0.063853 O\n0.842862 0.250000 0.402832 O\n0.332168 0.250000 0.936147 O\n",
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{
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"updated_at": "2022-09-04T14:37:06.819330Z",
"structure_string": "Nd4 Cu4 S8\n1.0\n0.000000 6.498737 0.009086\n7.218368 0.000000 0.000000\n0.000000 -0.912183 -6.838782\nNd Cu S\n4 4 8\ndirect\n0.809360 0.950051 0.199456 Nd\n0.190641 0.450051 0.300543 Nd\n0.190641 0.049949 0.800543 Nd\n0.809360 0.549949 0.699456 Nd\n0.426105 0.663260 0.950927 Cu\n0.573896 0.336740 0.049072 Cu\n0.573896 0.163260 0.549072 Cu\n0.426105 0.836740 0.450927 Cu\n0.084161 0.725838 0.999774 S\n0.915840 0.225838 0.500225 S\n0.915839 0.274162 0.000226 S\n0.084161 0.774163 0.499774 S\n0.407426 0.113341 0.220346 S\n0.407426 0.386659 0.720346 S\n0.592575 0.886659 0.779653 S\n0.592575 0.613342 0.279653 S\n",
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{
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"created_at": "2022-09-04T14:38:54.418893Z",
"updated_at": "2022-09-04T14:38:54.418908Z",
"structure_string": "Mn8 Br4 O12\n1.0\n5.821269 -0.000000 0.000000\n0.000000 6.561633 0.000000\n-0.000000 -0.000000 8.396976\nMn Br O\n8 4 12\ndirect\n0.500000 0.000000 0.500000 Mn\n-0.000000 0.500000 -0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.684689 0.250000 0.249882 Mn\n0.184689 0.250000 0.250118 Mn\n0.315312 0.750000 0.750118 Mn\n0.815312 0.750000 0.749883 Mn\n0.149438 0.250000 0.545405 Br\n0.649438 0.250000 0.954595 Br\n0.850562 0.750000 0.454595 Br\n0.350562 0.750000 0.045405 Br\n0.937728 0.441211 0.221469 O\n0.676391 0.250000 0.479199 O\n0.176391 0.250000 0.020801 O\n0.323609 0.750000 0.520802 O\n0.823609 0.750000 0.979199 O\n0.937728 0.058789 0.221469 O\n0.437727 0.441211 0.278531 O\n0.062273 0.558789 0.778532 O\n0.562273 0.941210 0.721469 O\n0.062273 0.941210 0.778532 O\n0.562273 0.558789 0.721469 O\n0.437727 0.058789 0.278531 O\n",
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{
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"created_at": "2022-09-04T14:38:07.213347Z",
"updated_at": "2022-09-04T14:38:07.213369Z",
"structure_string": "Na6 Cu2 C2 S2 O14\n1.0\n0.000000 5.140472 -0.080951\n6.970256 0.000000 0.000000\n0.000000 0.123372 -8.953337\nNa Cu C S O\n6 2 2 2 14\ndirect\n0.268378 0.750000 0.077762 Na\n0.769933 0.009682 0.259345 Na\n0.769933 0.490319 0.259345 Na\n0.230066 0.509682 0.740655 Na\n0.230066 0.990319 0.740655 Na\n0.731621 0.250000 0.922238 Na\n0.307594 0.250000 0.366610 Cu\n0.692406 0.750000 0.633390 Cu\n0.766724 0.750000 0.939123 C\n0.233275 0.250000 0.060877 C\n0.280548 0.750000 0.403544 S\n0.719451 0.250000 0.596456 S\n0.567804 0.750000 0.850823 O\n0.789985 0.078369 0.684991 O\n0.789985 0.421631 0.684991 O\n0.426678 0.250000 0.578404 O\n0.151574 0.750000 0.553098 O\n0.848425 0.250000 0.446902 O\n0.723399 0.750000 0.083326 O\n0.210014 0.578370 0.315009 O\n0.210014 0.921631 0.315009 O\n0.432195 0.250000 0.149177 O\n-0.000645 0.250000 0.116007 O\n0.000644 0.750000 0.883993 O\n0.573321 0.750000 0.421596 O\n0.276600 0.250000 0.916674 O\n",
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"structure_string": "N16\n1.0\n6.842252 -0.016614 0.564274\n0.518291 6.822613 0.564274\n-0.017968 -0.016614 6.865456\nN\n16\ndirect\n0.064352 0.542075 0.219475 N\n0.457924 0.780526 0.935648 N\n0.219475 0.064352 0.542075 N\n0.456686 0.456687 0.456687 N\n0.042075 0.564352 0.719475 N\n0.280525 0.957925 0.435648 N\n0.780525 0.935648 0.457924 N\n0.543313 0.543314 0.543313 N\n0.957924 0.435649 0.280525 N\n0.043313 0.043313 0.043313 N\n0.935647 0.457926 0.780525 N\n0.956686 0.956688 0.956686 N\n0.542075 0.219475 0.064352 N\n0.435648 0.280526 0.957925 N\n0.719474 0.042076 0.564352 N\n0.564352 0.719475 0.042075 N\n",
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{
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"created_at": "2022-09-04T14:38:52.306786Z",
"updated_at": "2022-09-04T14:38:52.306804Z",
"structure_string": "Tm4 Mg2 Se8\n1.0\n6.999232 0.012446 -2.609468\n-3.371316 6.133811 -2.609468\n-0.007346 -0.012446 7.469841\nTm Mg Se\n4 2 8\ndirect\n0.874999 0.756514 0.381513 Tm\n0.506513 0.125000 0.881513 Tm\n0.374999 0.493486 0.618486 Tm\n0.243486 0.625000 0.118486 Tm\n0.000000 0.000000 0.000000 Mg\n0.749999 0.250000 0.500000 Mg\n0.512797 0.380197 0.261577 Se\n0.748779 0.487203 0.867398 Se\n0.118618 0.251219 0.738422 Se\n0.619803 0.881381 0.132600 Se\n0.237203 -0.001220 0.367399 Se\n0.001219 0.368619 0.238422 Se\n0.631380 0.869803 0.632600 Se\n0.130195 0.762797 0.761576 Se\n",
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"structure_string": "Fe4 Te4 O12 F4\n1.0\n0.000000 5.093194 0.016154\n5.051628 0.000000 0.000000\n0.000000 -3.508440 -12.469576\nFe Te O F\n4 4 12 4\ndirect\n0.110588 0.759797 0.073096 Fe\n0.889412 0.240203 0.926904 Fe\n0.889412 0.259797 0.426904 Fe\n0.110588 0.740203 0.573096 Fe\n0.319283 0.787173 0.830972 Te\n0.319283 0.712828 0.330972 Te\n0.680717 0.287173 0.669029 Te\n0.680717 0.212827 0.169029 Te\n0.063877 0.584066 0.201823 O\n0.936123 0.084066 0.298177 O\n0.867271 0.431296 0.569174 O\n0.132728 0.568705 0.430827 O\n0.550214 0.096876 0.837910 O\n0.936123 0.415935 0.798177 O\n0.449786 0.596876 0.662090 O\n0.867271 0.068704 0.069174 O\n0.063877 0.915935 0.701823 O\n0.132728 0.931296 0.930827 O\n0.550214 0.403124 0.337910 O\n0.449785 0.903124 0.162090 O\n0.247981 0.067542 0.515446 F\n0.247981 0.432458 0.015446 F\n0.752019 0.567542 0.984555 F\n0.752019 0.932459 0.484554 F\n",
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{
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"structure_string": "Rb2 Na1 La1 Cl6\n1.0\n6.652633 0.000000 3.840900\n2.217544 6.272163 3.840900\n-0.000000 -0.000000 7.681799\nRb Na La Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 La\n0.746724 0.253275 0.253276 Cl\n0.253275 0.253275 0.746725 Cl\n0.253275 0.746724 0.746725 Cl\n0.253275 0.746724 0.253276 Cl\n0.746724 0.253275 0.746725 Cl\n0.746724 0.746724 0.253276 Cl\n",
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{
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"created_at": "2022-09-04T14:37:03.643669Z",
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"structure_string": "Lu4 Mn2 S8\n1.0\n6.652515 -0.000000 3.840831\n2.217505 6.272051 3.840831\n0.000000 0.000000 7.681662\nLu Mn S\n4 2 8\ndirect\n0.499999 0.500000 0.000000 Lu\n0.499999 0.500000 0.500000 Lu\n-0.000000 0.500000 0.500000 Lu\n0.500000 0.000000 0.500000 Lu\n0.874999 0.875000 0.875000 Mn\n0.125000 0.125000 0.125000 Mn\n0.745930 0.745931 0.745932 S\n0.254068 0.254069 0.737795 S\n0.254068 0.737795 0.254069 S\n0.737794 0.254069 0.254069 S\n0.745931 0.262205 0.745931 S\n0.262204 0.745931 0.745931 S\n0.254068 0.254069 0.254069 S\n0.745930 0.745931 0.262205 S\n",
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]
}