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{
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{
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"structure_string": "Pt2 S2 Cl2\n1.0\n3.478941 0.000000 0.000000\n0.000000 5.266268 0.000000\n0.000000 0.000000 6.857771\nPt S Cl\n2 2 2\ndirect\n0.499999 0.000000 0.374952 Pt\n0.000000 0.500000 0.625047 Pt\n0.000000 0.000000 0.602999 S\n0.499999 0.500000 0.397000 S\n0.000000 0.000000 0.126691 Cl\n0.499999 0.500000 0.873308 Cl\n",
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{
"id": "jvasp-111874",
"created_at": "2022-09-04T14:38:41.683198Z",
"updated_at": "2022-09-04T14:38:41.683223Z",
"structure_string": "Ba2 Fe4 S4 O2\n1.0\n3.932208 -0.000040 -0.000041\n-0.000006 6.561687 0.008183\n0.000042 -0.011587 9.566866\nBa Fe S O\n2 4 4 2\ndirect\n0.499988 0.005220 0.499997 Ba\n-0.000008 0.994780 0.000003 Ba\n0.500007 0.386676 0.818565 Fe\n0.500008 0.386693 0.181401 Fe\n-0.000013 0.613307 0.318599 Fe\n-0.000015 0.613324 0.681435 Fe\n0.500002 0.741527 0.792815 S\n0.500000 0.741528 0.207212 S\n0.000016 0.258472 0.292788 S\n0.000019 0.258473 0.707185 S\n0.500007 0.267361 0.999991 O\n-0.000018 0.732639 0.500010 O\n",
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{
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"created_at": "2022-09-04T14:35:40.982895Z",
"updated_at": "2022-09-04T14:35:40.982921Z",
"structure_string": "Mg6 B4 O12\n1.0\n4.530278 0.000000 0.000000\n0.000000 5.418218 0.000000\n0.000000 0.000000 8.457302\nMg B O\n6 4 12\ndirect\n0.000000 0.500000 0.813214 Mg\n0.500000 0.000000 0.686786 Mg\n0.000000 0.500000 0.186786 Mg\n0.500000 0.000000 0.313214 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.045632 0.243948 0.500000 B\n0.454368 0.743948 0.000000 B\n0.954368 0.756052 0.500000 B\n0.545632 0.256052 0.000000 B\n0.749438 0.679044 0.000000 O\n0.249438 0.820956 0.500000 O\n0.750562 0.179044 0.500000 O\n0.250562 0.320956 0.000000 O\n0.201547 0.295542 0.639072 O\n0.298453 0.795542 0.139072 O\n0.701547 0.204458 0.860928 O\n0.298453 0.795542 0.860928 O\n0.798453 0.704458 0.360928 O\n0.701547 0.204458 0.139072 O\n0.798453 0.704458 0.639072 O\n0.201547 0.295542 0.360928 O\n",
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{
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"created_at": "2022-09-04T14:35:41.735100Z",
"updated_at": "2022-09-04T14:35:41.735124Z",
"structure_string": "Th6 Fe24 P12\n1.0\n3.711848 0.000000 0.000000\n0.000000 10.707980 -0.000000\n0.000000 -0.000000 14.277972\nTh Fe P\n6 24 12\ndirect\n0.000000 0.000000 0.000000 Th\n0.500000 0.375956 0.225808 Th\n0.500000 0.624044 0.774192 Th\n0.500000 0.500000 0.500000 Th\n0.000000 0.124044 0.725808 Th\n0.000000 0.875957 0.274192 Th\n0.000000 0.432875 0.674982 Fe\n0.000000 0.567125 0.325018 Fe\n0.500000 0.932875 0.825018 Fe\n0.500000 0.067125 0.174982 Fe\n0.000000 0.822350 0.710192 Fe\n0.000000 0.177651 0.289808 Fe\n0.500000 0.322350 0.789808 Fe\n0.500000 0.240378 0.037384 Fe\n0.500000 0.766052 0.578139 Fe\n0.000000 0.733948 0.078139 Fe\n0.000000 0.266052 0.921861 Fe\n0.500000 0.908799 0.448411 Fe\n0.000000 0.922151 0.553531 Fe\n0.500000 0.677651 0.210192 Fe\n0.500000 0.233948 0.421861 Fe\n0.500000 0.759622 0.962616 Fe\n0.000000 0.259622 0.537384 Fe\n0.500000 0.422151 0.946469 Fe\n0.500000 0.091201 0.551589 Fe\n0.000000 0.408799 0.051589 Fe\n0.000000 0.591201 0.948411 Fe\n0.500000 0.577849 0.053531 Fe\n0.000000 0.077849 0.446469 Fe\n0.000000 0.740378 0.462616 Fe\n0.500000 0.149989 0.886312 P\n0.000000 0.350011 0.386312 P\n0.000000 0.649989 0.613688 P\n0.500000 0.701107 0.367120 P\n0.500000 0.298893 0.632880 P\n0.000000 0.429268 0.834015 P\n0.500000 0.929268 0.665985 P\n0.000000 0.570732 0.165985 P\n0.000000 0.201107 0.132880 P\n0.000000 0.798893 0.867120 P\n0.500000 0.070732 0.334015 P\n0.500000 0.850011 0.113688 P\n",
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}