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{
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{
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{
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{
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"structure_string": "Li5 Nb2 Fe5 O12\n1.0\n4.540729 2.570244 0.000000\n-4.540729 2.570244 0.000000\n0.000000 1.937214 9.905016\nLi Nb Fe O\n5 2 5 12\ndirect\n0.167018 0.316135 0.744238 Li\n0.315637 0.176081 0.258398 Li\n0.683865 0.832982 0.255762 Li\n0.823919 0.684363 0.741602 Li\n0.923670 0.076330 0.500000 Li\n0.249901 0.750099 0.500000 Nb\n0.735662 0.264338 0.000000 Nb\n0.087577 0.912423 0.000000 Fe\n0.996256 0.499525 0.264751 Fe\n0.500475 0.003744 0.735249 Fe\n0.442676 0.557324 0.000000 Fe\n0.590512 0.409488 0.500000 Fe\n0.974565 0.804386 0.377347 O\n0.195614 0.025435 0.622653 O\n0.121587 0.618192 0.878476 O\n0.381808 0.878413 0.121524 O\n0.290318 0.467006 0.378936 O\n0.532994 0.709682 0.621064 O\n0.478563 0.295805 0.861163 O\n0.704195 0.521437 0.138837 O\n0.619208 0.112132 0.378870 O\n0.887868 0.380792 0.621130 O\n0.785655 0.967738 0.882982 O\n0.032262 0.214345 0.117018 O\n",
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{
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"formula_full": "Hf3 Tl10 Mo12 Pb1 O48",
"formula_reduced": "Hf3Tl10Mo12PbO48",
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"updated_at": "2021-11-28T01:36:42.334000Z",
"spacegroup": 148
},
{
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"structure_string": "Mn6 O7 F5\n1.0\n-4.752070 0.322191 0.004685\n-0.317453 4.740423 -6.071984\n0.325486 -4.743270 -3.039192\nMn O F\n6 7 5\ndirect\n0.534432 0.011133 0.479491 Mn\n0.498790 0.665830 0.167679 Mn\n0.492314 0.331528 0.835573 Mn\n0.002078 0.668609 0.666413 Mn\n0.983767 0.322315 0.336433 Mn\n0.996341 0.002930 0.008577 Mn\n0.810350 0.101560 0.288601 O\n0.699452 0.103035 0.793222 O\n0.693142 0.768658 0.468689 O\n0.693292 0.434051 0.128867 O\n0.304529 0.567569 0.867110 O\n0.310388 0.229742 0.529857 O\n0.306557 0.900012 0.208657 O\n0.805638 0.439445 0.634737 F\n0.812678 0.767359 0.960690 F\n0.176297 0.552208 0.372849 F\n0.194583 0.231448 0.033528 F\n0.185374 0.902569 0.719026 F\n",
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"formula_full": "Mn6 O7 F5",
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{
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]
}