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{
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"created_at": "2022-09-04T14:36:08.237509Z",
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"structure_string": "Ba4 Sc1 Tl1\n1.0\n-0.000000 5.101728 5.101728\n5.101728 -0.000000 5.101728\n5.101728 5.101728 -0.000000\nBa Sc Tl\n4 1 1\ndirect\n0.123944 0.625353 0.625353 Ba\n0.625353 0.625353 0.625353 Ba\n0.625353 0.123944 0.625353 Ba\n0.625353 0.625353 0.123944 Ba\n0.250000 0.250000 0.250000 Sc\n0.000000 0.000000 0.000000 Tl\n",
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{
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{
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"structure_string": "Fe12 B4 O24\n1.0\n4.289029 0.000000 0.000000\n-0.000000 8.157042 0.000000\n0.000000 0.000000 9.610709\nFe B O\n12 4 24\ndirect\n0.003469 0.931353 0.872994 Fe\n0.996532 0.431353 0.127006 Fe\n0.496532 0.568647 0.372994 Fe\n0.996532 0.068647 0.127006 Fe\n0.496532 0.931353 0.372994 Fe\n0.003469 0.568647 0.872994 Fe\n0.503469 0.431353 0.627006 Fe\n0.034374 0.750000 0.596373 Fe\n0.534375 0.250000 0.903627 Fe\n0.965626 0.250000 0.403627 Fe\n0.465626 0.750000 0.096373 Fe\n0.503469 0.068647 0.627006 Fe\n0.080753 0.250000 0.720796 B\n0.919247 0.750000 0.279204 B\n0.419247 0.250000 0.220796 B\n0.580753 0.750000 0.779204 B\n0.252808 0.750000 0.278028 O\n0.780000 0.750000 0.423063 O\n0.280000 0.250000 0.076937 O\n0.220000 0.250000 0.576937 O\n0.720000 0.750000 0.923063 O\n0.767458 0.417927 0.967623 O\n0.267458 0.582073 0.532377 O\n0.232542 0.917927 0.032377 O\n0.232542 0.582073 0.032377 O\n0.247192 0.750000 0.778028 O\n0.732542 0.417927 0.467623 O\n0.267458 0.917927 0.532377 O\n0.235131 0.394070 0.790460 O\n0.735131 0.605930 0.709540 O\n0.764869 0.894070 0.209540 O\n0.264869 0.105930 0.290460 O\n0.732542 0.082073 0.467623 O\n0.264869 0.394070 0.290460 O\n0.235131 0.105930 0.790460 O\n0.735131 0.894070 0.709540 O\n0.752808 0.250000 0.221972 O\n0.747192 0.250000 0.721972 O\n0.767458 0.082073 0.967623 O\n0.764869 0.605930 0.209540 O\n",
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"structure_string": "Ca2 Mg1 Pd2\n1.0\n-4.319684 -0.000000 0.000000\n-2.159842 -2.968798 4.412140\n-2.159842 2.968798 4.412140\nCa Mg Pd\n2 1 2\ndirect\n0.800406 0.699593 0.699593 Ca\n0.199593 0.300407 0.300407 Ca\n0.000000 0.000000 0.000000 Mg\n0.499999 0.265214 0.734786 Pd\n0.499999 0.734786 0.265214 Pd\n",
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{
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"structure_string": "Nb1\n1.0\n2.710000 -0.000000 -0.958129\n-1.355000 2.346929 -0.958129\n-0.000000 -0.000000 2.874389\nNb\n1\ndirect\n0.000000 0.000000 0.000000 Nb\n",
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}