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"structure_string": "Pa1 Hg1 O3\n1.0\n4.365834 -0.000000 0.000000\n0.000000 4.365834 0.000000\n-0.000000 -0.000000 4.365834\nPa Hg O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Pa\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n",
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{
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{
"id": "jvasp-20499",
"created_at": "2022-09-04T14:38:15.880518Z",
"updated_at": "2022-09-04T14:38:15.880529Z",
"structure_string": "Ba1 Al4\n1.0\n4.306735 0.000000 -1.622567\n-0.611303 4.263130 -1.622567\n0.006186 0.007136 6.543327\nBa Al\n1 4\ndirect\n0.000000 0.000000 0.000000 Ba\n0.750002 0.250000 0.500000 Al\n0.250001 0.750000 0.500000 Al\n0.380854 0.380853 0.761707 Al\n0.619149 0.619147 0.238293 Al\n",
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{
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"structure_string": "Ti1 Cu3 O4\n1.0\n2.979705 0.000000 0.000000\n-0.000000 5.214219 1.608828\n-0.000000 0.101144 6.027432\nTi Cu O\n1 3 4\ndirect\n0.500001 -0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Cu\n0.500001 0.500000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500001 0.615799 0.673758 O\n0.000000 0.054661 0.689773 O\n0.500001 0.384201 0.326242 O\n0.000000 0.945339 0.310227 O\n",
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"structure_string": "Ca8 B8 O20\n1.0\n0.000000 7.193193 0.066067\n5.204576 0.000000 0.000000\n0.000000 -0.604763 -11.527511\nCa B O\n8 8 20\ndirect\n0.381178 0.563307 0.632637 Ca\n0.618822 0.063306 0.867363 Ca\n0.618822 0.436694 0.367363 Ca\n0.381178 0.936695 0.132637 Ca\n0.875645 0.600851 0.665290 Ca\n0.124355 0.100851 0.834710 Ca\n0.124355 0.399149 0.334710 Ca\n0.875645 0.899150 0.165290 Ca\n0.845031 0.923028 0.404644 B\n0.154968 0.423028 0.095356 B\n0.154968 0.076973 0.595356 B\n0.845032 0.576973 0.904644 B\n0.337914 0.561900 0.910984 B\n0.337914 0.938101 0.410984 B\n0.662086 0.438101 0.089016 B\n0.662086 0.061900 0.589015 B\n0.409341 0.418745 0.825008 O\n0.145436 0.645379 0.156370 O\n0.854563 0.145378 0.343629 O\n0.106147 0.306192 0.641841 O\n0.893853 0.806192 0.858159 O\n0.893853 0.693809 0.358159 O\n0.106147 0.193809 0.141841 O\n0.590659 0.918746 0.674991 O\n0.409341 0.081255 0.325008 O\n0.230322 0.406081 0.985026 O\n0.643591 0.320514 0.571605 O\n0.356409 0.820515 0.928394 O\n0.356409 0.679486 0.428394 O\n0.643591 0.179486 0.071605 O\n0.769678 0.593920 0.014973 O\n0.230321 0.093919 0.485027 O\n0.145437 0.854622 0.656370 O\n0.769678 0.906081 0.514973 O\n0.590659 0.581255 0.174991 O\n0.854563 0.354622 0.843629 O\n",
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"structure_string": "Tl2 Sb2 Se4\n1.0\n4.410185 0.000000 0.000000\n0.000000 14.800399 0.000000\n0.000000 0.000000 4.108151\nTl Sb Se\n2 2 4\ndirect\n0.500001 0.000000 0.500000 Tl\n0.000000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Sb\n0.500001 0.500000 0.000000 Sb\n0.500001 0.213137 0.500000 Se\n0.000000 0.286863 0.500000 Se\n0.000000 0.713137 0.500000 Se\n0.500001 0.786863 0.500000 Se\n",
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{
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"updated_at": "2022-09-04T14:38:15.891482Z",
"structure_string": "Te1 F6\n1.0\n4.542288 0.094992 3.040332\n1.672715 4.224149 3.040331\n0.136688 0.094992 5.464185\nTe F\n1 6\ndirect\n0.000000 0.000000 0.000000 Te\n0.082438 0.377967 0.772463 F\n0.772463 0.082437 0.377968 F\n0.622033 0.227537 0.917563 F\n0.227537 0.917562 0.622033 F\n0.917562 0.622032 0.227538 F\n0.377967 0.772462 0.082438 F\n",
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{
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"structure_string": "Li4 V2 Cr3 Fe3 O16\n1.0\n5.693578 -0.012893 0.000850\n-2.857894 4.950010 0.000064\n0.001146 0.000523 9.311598\nLi V Cr Fe O\n4 2 3 3 16\ndirect\n0.343996 0.672007 0.891123 Li\n0.990189 0.995108 0.995884 Li\n0.987206 0.993618 0.494398 Li\n0.675571 0.337795 0.396464 Li\n0.335948 0.667986 0.497635 V\n0.673219 0.336622 0.993200 V\n0.179411 0.833294 0.214562 Cr\n0.179414 0.346137 0.214565 Cr\n0.336730 0.168375 0.714441 Cr\n0.829950 0.177968 0.714836 Fe\n0.647821 0.823919 0.212842 Fe\n0.829948 0.651999 0.714834 Fe\n0.339166 0.169600 0.095463 O\n0.826352 0.661442 0.099901 O\n0.668663 0.334342 0.603855 O\n0.520969 0.042426 0.840061 O\n0.520967 0.478563 0.840056 O\n0.659600 0.829809 0.601535 O\n0.486823 0.523127 0.344276 O\n0.045706 0.522861 0.341194 O\n0.165230 0.336705 0.595829 O\n0.986883 0.993448 0.807217 O\n0.992419 0.996219 0.304348 O\n0.332906 0.666466 0.097193 O\n0.966532 0.483275 0.842115 O\n0.165233 0.828543 0.595831 O\n0.486822 0.963712 0.344272 O\n0.826355 0.164937 0.099904 O\n",
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