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{
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{
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{
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{
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"structure_string": "Na6 P2 S2 O6\n1.0\n6.221332 0.005986 0.555110\n0.508316 6.200534 0.555110\n0.006490 0.005986 6.246044\nNa P S O\n6 2 2 6\ndirect\n0.494318 0.118006 0.811058 Na\n0.811059 0.494319 0.118005 Na\n0.118006 0.811058 0.494318 Na\n0.618006 0.994318 0.311058 Na\n0.311059 0.618006 0.994318 Na\n0.994318 0.311059 0.618005 Na\n0.093010 0.093010 0.093010 P\n0.593010 0.593010 0.593009 P\n0.414264 0.414264 0.414263 S\n0.914264 0.914264 0.914263 S\n0.136868 0.305890 0.955719 O\n0.955719 0.136869 0.305889 O\n0.305890 0.955719 0.136868 O\n0.805889 0.636868 0.455719 O\n0.455720 0.805889 0.636867 O\n0.636868 0.455720 0.805888 O\n",
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{
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"created_at": "2022-09-04T14:38:37.767471Z",
"updated_at": "2022-09-04T14:38:37.767500Z",
"structure_string": "K1 Sr1 Bi2 O6\n1.0\n5.199672 0.013239 -3.128916\n-1.655404 4.929138 -3.128916\n-0.009494 -0.013239 6.068494\nK Sr Bi O\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 -0.000000 Sr\n0.750000 0.250000 0.499999 Bi\n0.250001 0.750000 0.500000 Bi\n0.452123 0.078700 -0.000000 O\n0.078700 0.452124 -0.000000 O\n0.547877 0.547877 0.626576 O\n0.921301 0.921301 0.373423 O\n0.500000 -0.000000 0.499999 O\n0.000001 0.500000 0.500000 O\n",
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{
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"structure_string": "Sm4 Ni2 Pt2 O12\n1.0\n5.820576 0.000000 0.000000\n-0.000000 4.388425 3.068900\n0.000000 -0.014711 9.397878\nSm Ni Pt O\n4 2 2 12\ndirect\n0.422323 0.226813 0.749531 Sm\n0.577678 0.773186 0.250470 Sm\n0.922323 0.773187 0.750470 Sm\n0.077678 0.226813 0.249531 Sm\n0.000000 0.500000 0.500000 Ni\n0.500000 0.499999 0.000000 Ni\n0.000000 0.000000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.805142 0.260122 0.054307 O\n0.194859 0.739877 0.945693 O\n0.804107 0.870021 0.445477 O\n0.195894 0.129978 0.554524 O\n0.304107 0.129978 0.054523 O\n0.962719 0.634862 0.252592 O\n0.462719 0.365137 0.247409 O\n0.537282 0.634862 0.752592 O\n0.694859 0.260122 0.554308 O\n0.037282 0.365137 0.747409 O\n0.695894 0.870021 0.945477 O\n0.305141 0.739877 0.445693 O\n",
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"structure_string": "Li2 Mn1 Fe1 O4\n1.0\n3.680559 -0.025487 -3.429283\n-0.713737 3.610781 -3.429283\n0.021090 0.025487 5.030511\nLi Mn Fe O\n2 1 1 4\ndirect\n0.249999 0.750000 0.500000 Li\n0.500000 0.499999 -0.000000 Li\n0.000000 0.000000 0.000000 Mn\n0.750000 0.250000 0.500000 Fe\n0.509703 0.009703 0.500000 O\n0.236508 0.236508 -0.000000 O\n0.990297 0.490297 0.500000 O\n0.763491 0.763491 -0.000000 O\n",
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{
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"structure_string": "Cd1 H14 C9 O4\n1.0\n4.225863 0.138091 0.360918\n0.881066 4.121010 0.202062\n0.203288 0.216112 12.927102\nCd H C O\n1 14 9 4\ndirect\n0.063111 0.991661 0.829569 Cd\n0.266786 0.029633 0.429324 H\n0.810611 0.390157 0.162751 H\n0.823044 0.050575 0.089160 H\n0.793041 0.130000 0.337473 H\n0.865514 0.749733 0.279835 H\n0.359928 0.639621 0.377248 H\n0.776427 0.880980 0.521675 H\n0.581152 0.659203 0.018593 H\n0.220552 0.624549 0.093527 H\n0.269626 0.322700 0.255315 H\n0.331496 0.947583 0.195816 H\n0.239483 0.769304 0.604027 H\n0.376843 0.360501 0.563806 H\n0.876216 0.486516 0.471080 H\n0.355047 0.333717 0.961977 C\n0.446757 0.481686 0.053908 C\n0.655887 0.252296 0.131181 C\n0.461011 0.118294 0.222826 C\n0.670390 0.690469 0.495042 C\n0.471900 0.827729 0.402749 C\n0.457289 0.573460 0.585896 C\n0.634629 0.477779 0.683463 C\n0.669443 0.953515 0.310334 C\n0.533343 0.072176 0.924087 O\n0.549563 0.650058 0.763121 O\n0.872955 0.222033 0.680740 O\n0.087271 0.474970 0.921898 O\n",
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{
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"structure_string": "Li3 Fe5 Co2 O12\n1.0\n4.932034 0.014927 0.447827\n-2.605264 4.187813 0.447827\n-0.012315 -0.022245 9.514218\nLi Fe Co O\n3 5 2 12\ndirect\n0.673024 0.841862 0.744135 Li\n0.158139 0.326977 0.255866 Li\n0.076750 0.923250 0.500000 Li\n0.923478 0.076522 0.000000 Fe\n-0.005582 0.518292 0.736367 Fe\n0.481708 0.005583 0.263633 Fe\n0.582504 0.417496 0.000000 Fe\n0.423013 0.576988 0.500000 Fe\n0.746754 0.253246 0.500000 Co\n0.249440 0.750560 0.000000 Co\n0.035611 0.229886 0.614744 O\n0.394430 0.860254 0.613098 O\n0.222403 0.046717 0.113192 O\n0.537423 0.714630 0.107919 O\n0.770114 0.964389 0.385256 O\n0.874850 0.362313 0.107207 O\n0.953283 0.777598 0.886809 O\n0.705571 0.536125 0.614880 O\n0.637687 0.125151 0.892794 O\n0.285370 0.462578 0.892082 O\n0.463876 0.294429 0.385121 O\n0.139746 0.605570 0.386902 O\n",
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}