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{
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{
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{
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"structure_string": "Te8 Mo4 O28\n1.0\n9.194091 0.000000 0.000000\n0.000000 4.389221 0.000000\n0.000000 1.795808 15.956263\nTe Mo O\n8 4 28\ndirect\n0.028077 0.165898 0.220649 Te\n0.528077 0.834102 0.279351 Te\n0.971923 0.834102 0.779351 Te\n0.471923 0.165898 0.720649 Te\n0.288166 0.291498 0.387565 Te\n0.788166 0.708502 0.112435 Te\n0.711834 0.708502 0.612435 Te\n0.211834 0.291498 0.887565 Te\n0.368867 0.881378 0.068577 Mo\n0.868867 0.118622 0.431423 Mo\n0.631133 0.118622 0.931423 Mo\n0.131133 0.881378 0.568577 Mo\n0.159120 0.409018 0.298062 O\n0.659120 0.590982 0.201938 O\n0.840880 0.590982 0.701938 O\n0.340880 0.409018 0.798062 O\n0.467378 0.417377 0.312260 O\n0.967378 0.582623 0.187740 O\n0.532622 0.582623 0.687740 O\n0.032622 0.417377 0.812260 O\n0.347575 0.894396 0.358565 O\n0.847575 0.105604 0.141435 O\n0.652425 0.105604 0.641435 O\n0.152425 0.894396 0.858565 O\n0.316112 0.976740 0.562519 O\n0.816112 0.023260 0.937481 O\n0.683888 0.023260 0.437481 O\n0.183888 0.976740 0.062519 O\n0.125499 0.485005 0.568573 O\n0.625499 0.514995 0.931427 O\n0.874501 0.514995 0.431427 O\n0.374501 0.485005 0.068573 O\n0.399408 0.030689 0.948626 O\n0.899408 0.969311 0.551374 O\n0.600592 0.969311 0.051374 O\n0.100592 0.030689 0.448626 O\n0.101095 0.937060 0.686257 O\n0.601095 0.062940 0.813743 O\n0.898905 0.062940 0.313743 O\n0.398905 0.937060 0.186257 O\n",
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{
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"structure_string": "Fe12 O12 F12\n1.0\n3.124038 0.000000 0.000000\n0.000000 9.443020 0.000000\n0.000000 0.003522 14.201079\nFe O F\n12 12 12\ndirect\n0.000000 0.993187 0.005008 Fe\n0.000000 0.980531 0.679009 Fe\n0.000000 0.998020 0.322551 Fe\n0.500000 0.766026 0.843958 Fe\n0.500000 0.754002 0.478419 Fe\n0.500000 0.777427 0.163902 Fe\n0.000000 0.487724 0.669837 Fe\n0.000000 0.475832 0.011701 Fe\n0.000000 0.506524 0.333324 Fe\n0.500000 0.276582 0.839185 Fe\n0.500000 0.259301 0.511173 Fe\n0.500000 0.226780 0.158496 Fe\n0.500000 0.895438 0.730899 O\n0.500000 0.910045 0.399449 O\n0.500000 0.900302 0.058988 O\n0.000000 0.852295 0.897153 O\n0.000000 0.837310 0.232665 O\n0.000000 0.643587 0.429354 O\n0.500000 0.402094 0.728554 O\n0.500000 0.402790 0.074270 O\n0.000000 0.352206 0.899728 O\n0.000000 0.352621 0.561929 O\n0.000000 0.151160 0.095189 O\n0.500000 0.103241 0.268894 O\n0.000000 0.846353 0.565063 F\n0.000000 0.650597 0.768917 F\n0.000000 0.651337 0.100824 F\n0.500000 0.597923 0.936998 F\n0.500000 0.605883 0.601715 F\n0.500000 0.588269 0.263754 F\n0.500000 0.396430 0.394471 F\n0.000000 0.355041 0.239133 F\n0.000000 0.150911 0.764884 F\n0.000000 0.159893 0.442321 F\n0.500000 0.100080 0.925562 F\n0.500000 0.092254 0.602725 F\n",
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{
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"structure_string": "Mn5 Cr1 O12\n1.0\n4.389834 2.519526 0.000000\n-4.389834 2.519526 0.000000\n0.000000 0.014426 9.344478\nMn Cr O\n5 1 12\ndirect\n0.166676 0.833324 0.500000 Mn\n0.666723 0.333277 0.000000 Mn\n0.333277 0.666723 0.000000 Mn\n0.833324 0.166676 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Cr\n0.334801 0.998636 0.103188 O\n0.001364 0.665199 0.896812 O\n0.499864 0.832771 0.397121 O\n0.832771 0.499864 0.397121 O\n0.167229 0.500136 0.602879 O\n0.833176 0.833176 0.602965 O\n0.500136 0.167229 0.602879 O\n0.998636 0.334801 0.103188 O\n0.667830 0.667830 0.103464 O\n0.665199 0.001364 0.896812 O\n0.332170 0.332170 0.896536 O\n0.166824 0.166824 0.397035 O\n",
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{
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"structure_string": "La6 In2 Ni2 S14\n1.0\n5.087154 -8.811210 0.000000\n5.087154 8.811210 0.000000\n0.000000 0.000000 6.329815\nLa In Ni S\n6 2 2 14\ndirect\n0.629098 0.852949 0.307620 La\n0.147051 0.776148 0.307620 La\n0.223852 0.370902 0.307620 La\n0.370902 0.147051 0.807620 La\n0.852949 0.223852 0.807620 La\n0.776148 0.629098 0.807620 La\n0.666667 0.333333 0.379232 In\n0.333333 0.666667 0.879232 In\n0.000000 0.000000 0.495538 Ni\n0.000000 0.000000 0.995538 Ni\n0.911498 0.128730 0.228255 S\n0.871270 0.782768 0.228255 S\n0.217232 0.088502 0.228255 S\n0.088502 0.871270 0.728255 S\n0.128730 0.217232 0.728255 S\n0.782768 0.911498 0.728255 S\n0.488714 0.569948 0.047110 S\n0.430052 0.918766 0.047110 S\n0.081234 0.511286 0.047110 S\n0.511286 0.430052 0.547110 S\n0.569948 0.081234 0.547110 S\n0.918766 0.488714 0.547110 S\n0.666667 0.333333 0.996154 S\n0.333333 0.666667 0.496154 S\n",
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{
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"elements": [
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"formula_full": "Na4",
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{
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"structure_string": "Nb4 Se6\n1.0\n3.349215 0.000000 0.000000\n-3.349215 6.896093 1.931015\n0.000000 2.565508 10.007831\nNb Se\n4 6\ndirect\n0.012368 0.012368 0.585508 Nb\n0.027014 0.527014 0.747110 Nb\n0.993980 0.993980 0.945081 Nb\n0.003608 0.503608 0.093857 Nb\n0.250613 0.750613 0.192690 Se\n0.681454 0.681454 0.862316 Se\n0.699100 0.699100 0.526505 Se\n0.283688 0.283688 0.314412 Se\n0.691922 0.191922 0.028953 Se\n0.689585 0.189585 0.703568 Se\n",
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}