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{
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{
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{
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{
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"structure_string": "Ba10 As6\n1.0\n4.782864 -8.284163 0.000000\n4.782864 8.284163 0.000000\n0.000000 0.000000 7.804907\nBa As\n10 6\ndirect\n0.000000 0.257094 0.750000 Ba\n0.000000 0.742906 0.250000 Ba\n0.257094 0.257094 0.250000 Ba\n0.257094 0.000000 0.750000 Ba\n0.742906 0.742906 0.750000 Ba\n0.742906 0.000000 0.250000 Ba\n0.333333 0.666667 0.500000 Ba\n0.666667 0.333333 0.000000 Ba\n0.666667 0.333333 0.500000 Ba\n0.333333 0.666667 0.000000 Ba\n0.606990 0.000000 0.750000 As\n0.606990 0.606990 0.250000 As\n0.000000 0.393010 0.250000 As\n0.000000 0.606990 0.750000 As\n0.393010 0.393010 0.750000 As\n0.393010 0.000000 0.250000 As\n",
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{
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"created_at": "2022-09-04T14:43:08.037412Z",
"structure_string": "B1 As1\n1.0\n0.000000 2.409627 2.409627\n2.409627 0.000000 2.409627\n2.409627 2.409627 0.000000\nB As\n1 1\ndirect\n0.750000 0.750000 0.750000 B\n0.000000 0.000000 0.000000 As\n",
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{
"id": "mp-1004377",
"created_at": "2022-09-04T14:41:26.070346Z",
"structure_string": "Hf1 B6\n1.0\n4.036160 0.000000 0.000000\n0.000000 4.036160 0.000000\n0.000000 0.000000 4.036160\nHf B\n1 6\ndirect\n0.000000 0.000000 0.000000 Hf\n0.196840 0.500000 0.500000 B\n0.500000 0.500000 0.803160 B\n0.500000 0.500000 0.196840 B\n0.500000 0.196840 0.500000 B\n0.500000 0.803160 0.500000 B\n0.803160 0.500000 0.500000 B\n",
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{
"id": "mp-1004376",
"created_at": "2022-09-04T14:42:13.330981Z",
"structure_string": "Na4 Mn8 O16\n1.0\n4.240190 -4.609373 0.000000\n4.240190 4.609373 0.000000\n0.000000 0.000000 8.430262\nNa Mn O\n4 8 16\ndirect\n0.244737 0.755263 0.250000 Na\n0.727200 0.727200 0.500000 Na\n0.755263 0.244737 0.750000 Na\n0.272800 0.272800 0.000000 Na\n0.236211 0.509248 0.622560 Mn\n0.238556 0.009120 0.627507 Mn\n0.490752 0.763789 0.877440 Mn\n0.990880 0.761444 0.872493 Mn\n0.761444 0.990880 0.127507 Mn\n0.763789 0.490752 0.122560 Mn\n0.009120 0.238556 0.372493 Mn\n0.509248 0.236211 0.377440 Mn\n0.956886 0.760168 0.106590 O\n0.986357 0.224183 0.146684 O\n0.239936 0.464890 0.393230 O\n0.239832 0.043114 0.393410 O\n0.564015 0.222659 0.140181 O\n0.535110 0.760064 0.106770 O\n0.777341 0.435985 0.359819 O\n0.775817 0.013643 0.353316 O\n0.464890 0.239936 0.606770 O\n0.435985 0.777341 0.640181 O\n0.760168 0.956886 0.893410 O\n0.760064 0.535110 0.893230 O\n0.013643 0.775817 0.646684 O\n0.043114 0.239832 0.606590 O\n0.224183 0.986357 0.853316 O\n0.222659 0.564015 0.859819 O\n",
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{
"id": "mp-1004375",
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"structure_string": "Mg1 Mn4 O8\n1.0\n-2.915199 2.930689 4.413065\n2.915199 -2.930689 4.413065\n2.915199 2.930689 -4.413065\nMg Mn O\n1 4 8\ndirect\n0.613786 0.113786 0.500000 Mg\n0.248124 0.992520 0.744396 Mn\n0.248124 0.503728 0.255604 Mn\n0.754506 0.499748 0.254758 Mn\n0.244990 0.499748 0.745242 Mn\n0.037315 0.750784 0.286532 O\n0.464252 0.750784 0.713468 O\n0.030617 0.752976 0.722359 O\n0.030617 0.308259 0.277641 O\n0.025432 0.249271 0.776161 O\n0.473109 0.249271 0.223839 O\n0.476629 0.702013 0.225384 O\n0.476629 0.251245 0.774616 O\n",
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{
"id": "mp-1004373",
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"structure_string": "Li4 Mn4 O8\n1.0\n2.873243 0.000000 0.000000\n0.000000 5.301665 0.000000\n0.000000 0.000000 10.086128\nLi Mn O\n4 4 8\ndirect\n0.250000 0.102494 0.605663 Li\n0.750000 0.897506 0.394337 Li\n0.250000 0.397506 0.105663 Li\n0.750000 0.602494 0.894337 Li\n0.750000 0.606675 0.632429 Mn\n0.250000 0.393325 0.367571 Mn\n0.250000 0.106675 0.867571 Mn\n0.750000 0.893325 0.132429 Mn\n0.250000 0.453736 0.737745 O\n0.750000 0.546264 0.262255 O\n0.750000 0.953736 0.762255 O\n0.250000 0.046264 0.237745 O\n0.250000 0.745661 0.520472 O\n0.750000 0.254339 0.479528 O\n0.250000 0.754339 0.020472 O\n0.750000 0.245661 0.979528 O\n",
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"formula_full": "Li4 Mn4 O8",
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{
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"structure_string": "Tb3 Al1 C1\n1.0\n5.374107 0.000000 0.000000\n0.000000 5.374107 0.000000\n0.000000 0.000000 5.374107\nTb Al C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Tb\n0.500000 0.500000 0.000000 Tb\n0.500000 0.000000 0.500000 Tb\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 C\n",
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{
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"structure_string": "Ca4 Mn8 O16\n1.0\n5.793220 0.000000 0.000000\n0.000000 5.689166 0.000000\n0.000000 0.397326 10.945710\nCa Mn O\n4 8 16\ndirect\n0.580231 0.268389 0.094512 Ca\n0.419769 0.731611 0.905488 Ca\n0.919769 0.268389 0.594512 Ca\n0.080231 0.731611 0.405488 Ca\n0.045160 0.638662 0.124670 Mn\n0.087235 0.134462 0.150344 Mn\n0.912765 0.865538 0.849656 Mn\n0.954840 0.361338 0.875330 Mn\n0.587235 0.865538 0.349656 Mn\n0.545160 0.361338 0.375330 Mn\n0.454840 0.638662 0.624670 Mn\n0.412765 0.134462 0.650344 Mn\n0.904622 0.878819 0.225549 O\n0.893969 0.381101 0.211436 O\n0.106031 0.618899 0.788564 O\n0.095378 0.121181 0.774451 O\n0.393969 0.618899 0.288564 O\n0.404622 0.121181 0.274451 O\n0.595378 0.878819 0.725549 O\n0.606031 0.381101 0.711436 O\n0.224016 0.896604 0.053221 O\n0.216928 0.394559 0.039875 O\n0.783072 0.605441 0.960125 O\n0.775984 0.103396 0.946779 O\n0.275984 0.896604 0.553221 O\n0.283072 0.394559 0.539875 O\n0.716928 0.605441 0.460125 O\n0.724016 0.103396 0.446779 O\n",
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]
}