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{
"id": "jvasp-112074",
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"structure_string": "Ca4 Fe2 Ir2 O12\n1.0\n0.000000 5.304436 0.000064\n5.498936 0.000000 0.000000\n0.000000 -5.299505 -7.577540\nCa Fe Ir O\n4 2 2 12\ndirect\n0.265262 0.060105 0.249626 Ca\n0.734740 0.560105 0.250375 Ca\n0.265262 0.439896 0.749626 Ca\n0.734740 0.939896 0.750375 Ca\n0.000000 0.500000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500001 0.500000 0.500000 Ir\n0.500001 0.000000 0.000000 Ir\n0.760447 0.208069 0.950982 O\n0.654943 0.694763 0.952775 O\n0.239556 0.708069 0.549018 O\n0.851789 0.975822 0.256917 O\n0.148214 0.024179 0.743084 O\n0.239555 0.791932 0.049018 O\n0.345060 0.305238 0.047226 O\n0.654942 0.805238 0.452775 O\n0.345060 0.194763 0.547226 O\n0.851789 0.524179 0.756917 O\n0.760446 0.291931 0.450982 O\n0.148213 0.475822 0.243084 O\n",
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{
"id": "jvasp-35983",
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"updated_at": "2022-09-04T14:37:19.338107Z",
"structure_string": "V1 N1\n1.0\n2.227453 2.227453 0.000000\n2.227453 0.000000 -2.227453\n-0.000000 2.227453 -2.227453\nV N\n1 1\ndirect\n0.000000 0.000000 0.000000 V\n0.749999 0.749999 0.749999 N\n",
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{
"id": "jvasp-112828",
"created_at": "2022-09-04T14:38:44.024196Z",
"updated_at": "2022-09-04T14:38:44.024206Z",
"structure_string": "Mn3 Cu1 O8\n1.0\n4.968046 0.038600 2.961473\n1.700945 4.667950 2.961473\n0.054694 0.038600 5.783495\nMn Cu O\n3 1 8\ndirect\n0.500000 0.000000 0.499999 Mn\n0.500001 0.500000 -0.000001 Mn\n0.000000 0.500000 0.499999 Mn\n0.500000 0.500000 0.499999 Cu\n0.263688 0.263688 0.263687 O\n0.708453 0.257422 0.257421 O\n0.257422 0.257422 0.708452 O\n0.257423 0.708453 0.257421 O\n0.742578 0.291547 0.742576 O\n0.742579 0.742578 0.291546 O\n0.291548 0.742578 0.742576 O\n0.736313 0.736312 0.736311 O\n",
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{
"id": "jvasp-78269",
"created_at": "2022-09-04T14:37:15.120452Z",
"updated_at": "2022-09-04T14:37:15.120484Z",
"structure_string": "V1 N1\n1.0\n-2.227455 -2.227455 0.000000\n-2.227455 -0.000000 -2.227455\n0.000000 -2.227455 -2.227455\nV N\n1 1\ndirect\n0.000000 0.000000 0.000000 V\n0.750002 0.750002 0.750002 N\n",
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{
"id": "jvasp-78353",
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"updated_at": "2022-09-04T14:37:50.861427Z",
"structure_string": "V1 N1\n1.0\n-2.227455 -2.227455 0.000000\n-2.227455 -0.000000 -2.227455\n0.000000 -2.227455 -2.227455\nV N\n1 1\ndirect\n0.000000 0.000000 0.000000 V\n0.750002 0.750002 0.750002 N\n",
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{
"id": "jvasp-44027",
"created_at": "2022-09-04T14:36:17.933096Z",
"updated_at": "2022-09-04T14:36:17.933115Z",
"structure_string": "Li4 Mn4 F16\n1.0\n0.000000 5.762892 0.100605\n4.624870 0.000000 0.000000\n0.000000 -0.173358 -9.955233\nLi Mn F\n4 4 16\ndirect\n0.500008 0.249996 0.000002 Li\n0.499996 0.249997 0.500003 Li\n0.000009 0.750004 0.000002 Li\n-0.000004 0.750003 0.500002 Li\n0.208394 0.249351 0.749337 Mn\n0.791609 0.250649 0.250671 Mn\n0.708394 0.750649 0.749337 Mn\n0.291609 0.749351 0.250670 Mn\n0.448844 0.481056 0.829344 F\n0.510764 0.495399 0.331235 F\n0.010764 0.504601 0.331235 F\n0.948844 0.518944 0.829344 F\n0.279944 0.540926 0.092034 F\n0.726036 0.545176 0.590713 F\n0.273961 0.954829 0.409296 F\n0.551159 0.018942 0.170662 F\n0.051159 0.981058 0.170662 F\n0.989237 -0.004600 0.668774 F\n0.226036 0.454825 0.590713 F\n0.489238 0.004600 0.668773 F\n0.220063 0.040925 0.907971 F\n0.773961 0.045171 0.409296 F\n0.720063 0.959075 0.907972 F\n0.779944 0.459074 0.092034 F\n",
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"formula_full": "Li4 Mn4 F16",
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{
"id": "jvasp-91701",
"created_at": "2022-09-04T14:35:52.919132Z",
"updated_at": "2022-09-04T14:35:52.919166Z",
"structure_string": "Fe2 Ni6\n1.0\n0.000000 4.057845 0.000000\n0.000000 0.000000 4.346520\n5.013126 0.000000 0.000000\nFe Ni\n2 6\ndirect\n0.499999 0.333776 0.500000 Fe\n0.000000 0.666224 0.000000 Fe\n0.000000 0.669245 0.500000 Ni\n0.499999 0.330755 0.000000 Ni\n0.499999 0.832595 0.748708 Ni\n0.000000 0.167405 0.248708 Ni\n0.000000 0.167405 0.751293 Ni\n0.499999 0.832595 0.251292 Ni\n",
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{
"id": "jvasp-101801",
"created_at": "2022-09-04T14:36:43.872215Z",
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"structure_string": "H5 C6 S2 N1\n1.0\n5.387431 -0.348907 0.652450\n1.770590 4.729816 2.465263\n0.086144 0.156284 6.014441\nH C S N\n5 6 2 1\ndirect\n0.142787 0.778258 0.146719 H\n0.887286 0.248527 0.800006 H\n0.230881 0.243075 0.449867 H\n0.392803 0.670450 0.360239 H\n0.550921 0.690211 0.977638 H\n0.897637 0.137310 0.690313 C\n0.082073 0.134853 0.500027 C\n0.062207 0.972400 0.392057 C\n0.739591 0.972489 0.728606 C\n0.390599 0.042624 0.023392 C\n0.244678 0.858977 0.232440 C\n0.808908 0.827336 0.521155 S\n0.342766 0.381927 0.928806 S\n0.559099 0.891855 0.916644 N\n",
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{
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"created_at": "2022-09-04T14:37:19.449304Z",
"updated_at": "2022-09-04T14:37:19.449336Z",
"structure_string": "Zn4 Cr4 O10\n1.0\n0.000000 5.524081 -0.001742\n3.271338 0.000000 0.000000\n0.000000 -0.003948 -11.009592\nZn Cr O\n4 4 10\ndirect\n0.652741 0.500000 0.883675 Zn\n0.264285 0.500000 0.099744 Zn\n0.152765 0.500000 0.616323 Zn\n0.764311 0.500000 0.400258 Zn\n0.629899 0.000000 0.635494 Cr\n0.252792 0.000000 0.360918 Cr\n0.752775 0.000000 0.139080 Cr\n0.129889 0.000000 0.864501 Cr\n0.797248 0.500000 0.608163 O\n0.277362 0.000000 0.691718 O\n0.297220 0.500000 0.891838 O\n0.653643 0.500000 0.063583 O\n0.554709 0.000000 0.456897 O\n0.417334 0.000000 0.211694 O\n0.917330 0.000000 0.288306 O\n0.054683 0.000000 0.043098 O\n0.777346 0.000000 0.808290 O\n0.153661 0.500000 0.436418 O\n",
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},
{
"id": "jvasp-11159",
"created_at": "2022-09-04T14:37:16.252078Z",
"updated_at": "2022-09-04T14:37:16.252107Z",
"structure_string": "Li4 Pt2 F12\n1.0\n0.000000 4.651434 0.000283\n4.655194 0.000000 0.000000\n0.000000 -4.650927 -9.188611\nLi Pt F\n4 2 12\ndirect\n0.336571 0.999870 0.336568 Li\n0.336571 0.500129 0.836567 Li\n0.663427 0.000130 0.663433 Li\n0.663428 0.499870 0.163433 Li\n-0.000000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n0.967876 0.306021 0.663175 F\n0.032122 0.806020 0.836826 F\n0.032123 0.693979 0.336826 F\n0.967876 0.193979 0.163175 F\n0.298240 0.200345 0.499996 F\n0.298240 0.299655 0.999996 F\n0.701759 0.799654 0.500005 F\n0.358450 0.805890 0.163145 F\n0.641549 0.194109 0.836855 F\n0.358449 0.694109 0.663145 F\n0.701759 0.700345 0.000005 F\n0.641549 0.305890 0.336855 F\n",
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{
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"created_at": "2022-09-04T14:37:15.760508Z",
"updated_at": "2022-09-04T14:37:15.760526Z",
"structure_string": "Mn12 P4\n1.0\n4.192648 0.000000 1.488462\n2.096326 6.304891 0.744223\n-0.013036 0.000009 6.685801\nMn P\n12 4\ndirect\n0.341367 0.676073 0.616780 Mn\n0.041854 0.616780 0.323927 Mn\n0.982561 0.383220 0.676072 Mn\n0.634220 0.323927 0.383219 Mn\n0.930553 0.047184 0.607349 Mn\n0.462097 0.607350 0.952815 Mn\n0.022263 0.392650 0.047184 Mn\n0.585088 0.952816 0.392650 Mn\n0.132261 0.976879 0.186976 Mn\n0.680764 0.186977 0.023121 Mn\n0.890862 0.813023 0.976878 Mn\n0.296115 0.023121 0.813023 Mn\n0.203271 0.250347 0.330723 P\n0.466005 0.330723 0.749652 P\n0.546382 0.669277 0.250347 P\n0.784342 0.749653 0.669276 P\n",
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}
]
}