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"structure_string": "Si8 O16\n1.0\n8.225999 0.000000 0.000000\n-0.000000 8.225999 0.000000\n0.000000 0.000000 5.563821\nSi O\n8 16\ndirect\n0.313431 0.931221 0.500000 Si\n0.686569 0.931221 0.000000 Si\n0.686569 0.068780 0.500000 Si\n0.931221 0.686569 0.000000 Si\n0.931221 0.313431 0.500000 Si\n0.313431 0.068780 0.000000 Si\n0.068780 0.313431 0.000000 Si\n0.068780 0.686569 0.500000 Si\n0.764162 0.000000 0.250000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.235838 0.250000 O\n0.764162 0.000000 0.750000 O\n0.000000 0.500000 0.500000 O\n0.000000 0.764162 0.250000 O\n0.000000 0.764162 0.750000 O\n0.733716 0.266284 0.500000 O\n0.235838 0.000000 0.750000 O\n0.266284 0.266284 0.000000 O\n0.500000 0.000000 0.500000 O\n0.235838 0.000000 0.250000 O\n0.733716 0.733716 0.000000 O\n0.266284 0.733716 0.500000 O\n0.000000 0.235838 0.750000 O\n0.000000 0.500000 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:37:18.584066Z",
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"structure_string": "Pa1 Au3\n1.0\n0.000000 3.458012 3.458012\n3.458012 0.000000 3.458012\n3.458012 3.458012 0.000000\nPa Au\n1 3\ndirect\n0.750000 0.750000 0.750000 Pa\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 Au\n0.250000 0.250000 0.250000 Au\n",
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{
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"structure_string": "Mg2 Sn1\n1.0\n4.147653 0.000000 2.394649\n1.382551 3.910445 2.394649\n0.000000 0.000000 4.789297\nMg Sn\n2 1\ndirect\n0.250000 0.250000 0.250001 Mg\n0.749999 0.749999 0.750002 Mg\n0.000000 0.000000 0.000000 Sn\n",
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"structure_string": "Mo3 O8\n1.0\n4.459067 -0.424794 -2.181276\n-0.889866 5.288795 -2.849075\n-0.791787 -0.061977 6.604609\nMo O\n3 8\ndirect\n0.499999 0.999998 -0.000000 Mo\n0.999999 0.708949 -0.000000 Mo\n0.999999 0.291052 -0.000000 Mo\n-0.027497 0.370867 0.741736 O\n0.027495 0.629131 0.258264 O\n0.020789 0.890897 0.781797 O\n0.979209 0.109101 0.218201 O\n0.465288 0.334127 0.211462 O\n0.465287 0.877334 0.211462 O\n0.534712 0.122664 0.788538 O\n0.534712 0.665872 0.788538 O\n",
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{
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"structure_string": "Ge4 Te4\n1.0\n6.032159 0.000000 0.000000\n0.000000 6.032159 0.000000\n0.000000 0.000000 6.032159\nGe Te\n4 4\ndirect\n0.500000 0.000000 0.500000 Ge\n0.500000 0.500000 0.000000 Ge\n0.000000 0.000000 0.000000 Ge\n0.000000 0.500000 0.500000 Ge\n0.000000 0.000000 0.500000 Te\n0.000000 0.500000 0.000000 Te\n0.500000 0.000000 0.000000 Te\n0.500000 0.500000 0.500000 Te\n",
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{
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"structure_string": "As1 Pd4\n1.0\n2.997552 -0.148642 -7.398324\n-0.251776 2.990656 -7.398324\n0.143609 0.148642 7.981221\nAs Pd\n1 4\ndirect\n0.000000 0.000000 0.000000 As\n0.405131 0.405132 0.000000 Pd\n0.798586 0.798589 0.000001 Pd\n0.201412 0.201413 0.000000 Pd\n0.594867 0.594870 0.000001 Pd\n",
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{
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"structure_string": "Bi2 Se3\n1.0\n4.113792 0.008072 9.142179\n1.968617 3.612187 9.142179\n0.013562 0.008072 10.025095\nBi Se\n2 3\ndirect\n0.399996 0.399995 0.399996 Bi\n0.600005 0.600004 0.600005 Bi\n0.000000 0.000000 0.000000 Se\n0.212773 0.212772 0.212773 Se\n0.787228 0.787227 0.787228 Se\n",
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{
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"structure_string": "Ti4 Br16\n1.0\n0.000000 10.151187 0.036283\n6.792156 0.000000 0.000000\n0.000000 -2.042903 -9.941585\nTi Br\n4 16\ndirect\n0.630655 0.421047 0.750186 Ti\n0.869346 0.921047 0.249815 Ti\n0.369345 0.578954 0.249814 Ti\n0.130655 0.078953 0.750186 Ti\n0.051274 0.082546 0.190445 Br\n0.448727 0.582546 0.809556 Br\n0.196193 0.914325 0.572329 Br\n0.303808 0.414325 0.427672 Br\n0.803808 0.085675 0.427672 Br\n0.696193 0.585676 0.572329 Br\n0.072416 0.403150 0.687857 Br\n0.927584 0.596851 0.312144 Br\n0.551274 0.417454 0.190445 Br\n0.572416 0.096851 0.687857 Br\n0.310481 0.077662 0.934567 Br\n0.189520 0.577662 0.065433 Br\n0.689520 0.922339 0.065434 Br\n0.810481 0.422338 0.934567 Br\n0.427584 0.903150 0.312144 Br\n0.948727 0.917454 0.809556 Br\n",
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