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"structure_string": "Mg1 Co4 S8\n1.0\n5.658070 -0.224119 3.922114\n1.933829 5.322056 3.922114\n-0.333760 -0.224119 6.876434\nMg Co S\n1 4 8\ndirect\n0.500000 0.500001 0.499998 Mg\n0.500001 1.000000 0.500000 Co\n0.999999 0.500000 0.500000 Co\n0.500000 0.500000 -0.000001 Co\n0.000000 0.000000 0.000000 Co\n0.763569 0.265143 0.763568 S\n0.236430 0.236431 0.734857 S\n0.236430 0.734859 0.236429 S\n0.734856 0.236431 0.236430 S\n0.263007 0.263010 0.263007 S\n0.736992 0.736993 0.736991 S\n0.265144 0.763570 0.763568 S\n0.763570 0.763570 0.265142 S\n",
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"structure_string": "Ba2 Y1 Ni3 O7\n1.0\n3.832488 0.000000 0.000000\n0.000000 3.855057 0.000000\n0.000000 0.000000 11.571836\nBa Y Ni O\n2 1 3 7\ndirect\n0.500000 0.500000 0.819804 Ba\n0.500000 0.500000 0.180204 Ba\n0.500000 0.500000 0.500005 Y\n0.000000 0.000000 0.653877 Ni\n0.000000 0.000000 0.346132 Ni\n0.000000 0.000000 -0.000008 Ni\n0.500000 0.000000 -0.000010 O\n0.000000 0.500000 0.623467 O\n0.000000 0.500000 0.376539 O\n0.500000 0.000000 0.621930 O\n0.500000 0.000000 0.378073 O\n0.000000 0.000000 0.834000 O\n0.000000 0.000000 0.165989 O\n",
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{
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"created_at": "2022-09-04T14:38:10.268697Z",
"updated_at": "2022-09-04T14:38:10.268718Z",
"structure_string": "Ba1 Ni2 As2 O8\n1.0\n4.739554 -0.025583 6.859734\n2.120505 4.238805 6.859735\n-0.041658 -0.025587 8.337721\nBa Ni As O\n1 2 2 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.831060 0.831059 0.831060 Ni\n0.168940 0.168940 0.168941 Ni\n0.573878 0.573877 0.573878 As\n0.426122 0.426122 0.426122 As\n0.881027 0.212476 0.560970 O\n0.212476 0.560968 0.881029 O\n0.560970 0.881027 0.212476 O\n0.118973 0.787523 0.439031 O\n0.787524 0.439031 0.118972 O\n0.354039 0.354039 0.354039 O\n0.645961 0.645960 0.645961 O\n0.439030 0.118972 0.787525 O\n",
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{
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{
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"structure_string": "Co4 Ni1 O8\n1.0\n5.641689 -0.007877 -0.063721\n-2.813496 4.918846 0.079307\n-2.769411 -1.512030 4.665766\nCo Ni O\n4 1 8\ndirect\n0.000000 0.500001 0.500001 Co\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.000000 Co\n0.000000 0.500001 0.000000 Co\n0.500000 -0.000000 0.000000 Ni\n0.535295 0.274834 0.795666 O\n0.033756 0.764271 0.787659 O\n0.518264 0.764267 0.787673 O\n0.032354 0.276862 0.787758 O\n0.967647 0.723139 0.212244 O\n0.481737 0.235734 0.212329 O\n0.966245 0.235730 0.212342 O\n0.464706 0.725167 0.204336 O\n",
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}