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{
"id": "jvasp-86291",
"created_at": "2022-09-04T14:36:08.495730Z",
"updated_at": "2022-09-04T14:36:08.495751Z",
"structure_string": "Pt2 N4\n1.0\n3.193375 0.000000 0.000000\n0.000000 3.751949 -0.000000\n0.000000 -0.000000 4.861512\nPt N\n2 4\ndirect\n0.000000 0.000000 0.000000 Pt\n0.499999 0.500000 0.500000 Pt\n0.499999 0.348858 0.913967 N\n0.499999 0.651142 0.086033 N\n0.000000 0.151142 0.413967 N\n0.000000 0.848858 0.586033 N\n",
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{
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"structure_string": "Li4 Ti5 Fe3 O16\n1.0\n-5.798190 -0.000065 0.000332\n2.898953 4.923639 -0.030716\n-0.000791 0.042391 -9.521583\nLi Ti Fe O\n4 5 3 16\ndirect\n0.330410 0.660836 0.108403 Li\n0.013121 0.026272 0.006934 Li\n0.004711 0.009448 0.505282 Li\n0.660653 0.321325 0.599911 Li\n0.823969 0.647949 0.276997 Ti\n0.159102 0.807642 0.782255 Ti\n0.330720 0.661454 0.499986 Ti\n0.648518 0.807646 0.782254 Ti\n0.654632 0.309291 0.006508 Ti\n0.825755 0.172627 0.287365 Fe\n0.179696 0.359416 0.787784 Fe\n0.346855 0.172628 0.287364 Fe\n0.834506 0.669037 0.907659 O\n0.336762 0.176741 0.900743 O\n0.664385 0.328793 0.399211 O\n0.966102 0.482625 0.158934 O\n0.516510 0.482628 0.158937 O\n0.165898 0.331822 0.394836 O\n0.481511 0.510407 0.654249 O\n0.479273 0.958577 0.663318 O\n0.667485 0.838029 0.403716 O\n0.006860 0.013732 0.194385 O\n0.004518 0.009064 0.694020 O\n0.339919 0.679858 0.906674 O\n0.518477 0.036966 0.165732 O\n0.170523 0.838028 0.403716 O\n0.028873 0.510408 0.654247 O\n0.839951 0.176741 0.900740 O\n",
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{
"id": "jvasp-12694",
"created_at": "2022-09-04T14:38:11.546768Z",
"updated_at": "2022-09-04T14:38:11.546784Z",
"structure_string": "V2 Fe2 H4 O10\n1.0\n5.254026 -0.009432 -0.002749\n-1.604918 5.364483 -0.039290\n-0.562001 -1.496149 6.213884\nV Fe H O\n2 2 4 10\ndirect\n0.256105 0.618542 0.757081 V\n0.743895 0.381458 0.242918 V\n0.627726 0.206121 0.692112 Fe\n0.372274 0.793878 0.307888 Fe\n0.078197 0.116071 0.701500 H\n0.921804 0.883929 0.298499 H\n0.850941 0.851077 0.705181 H\n0.149059 0.148923 0.294818 H\n0.907005 0.519565 0.730478 O\n0.092996 0.480435 0.269521 O\n0.903018 0.041124 0.749227 O\n0.365831 0.871869 0.613286 O\n0.642060 0.644410 0.347581 O\n0.398766 0.740198 0.018586 O\n0.601234 0.259802 0.981413 O\n0.096982 0.958876 0.250772 O\n0.357941 0.355590 0.652418 O\n0.634170 0.128131 0.386713 O\n",
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"formula_full": "V2 Fe2 H4 O10",
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"spacegroup": 2
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{
"id": "jvasp-44285",
"created_at": "2022-09-04T14:35:47.502512Z",
"updated_at": "2022-09-04T14:35:47.502530Z",
"structure_string": "Fe6 O8 F4\n1.0\n0.000000 5.433150 0.027037\n4.376379 0.000000 0.000000\n0.000000 -0.458356 -7.350193\nFe O F\n6 8 4\ndirect\n0.228411 0.484856 0.501385 Fe\n0.567119 0.542267 0.840508 Fe\n0.908096 0.493409 0.185014 Fe\n0.771588 0.984856 0.498614 Fe\n0.432880 0.042267 0.159491 Fe\n0.091903 0.993409 0.814985 Fe\n0.793653 0.796067 0.726429 O\n0.279229 0.708214 0.711460 O\n0.632459 0.708119 0.074220 O\n0.970919 0.709010 0.392973 O\n0.367541 0.208119 0.925779 O\n0.029080 0.209010 0.607026 O\n0.720770 0.208214 0.288539 O\n0.206346 0.296067 0.273570 O\n0.118902 0.778668 0.054073 F\n0.881097 0.278667 0.945926 F\n0.534706 0.279390 0.601628 F\n0.465294 0.779390 0.398371 F\n",
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{
"id": "jvasp-58576",
"created_at": "2022-09-04T14:37:07.251579Z",
"updated_at": "2022-09-04T14:37:07.251604Z",
"structure_string": "Mn4 Zn2 O8\n1.0\n2.910804 -0.000000 -0.000000\n-1.455402 4.815779 0.000000\n0.000000 -0.000000 9.693092\nMn Zn O\n4 2 8\ndirect\n0.869651 0.739305 0.069909 Mn\n0.130348 0.260695 0.930090 Mn\n0.869651 0.739305 0.430090 Mn\n0.130348 0.260695 0.569909 Mn\n0.386640 0.773279 0.750000 Zn\n0.613359 0.226721 0.250000 Zn\n0.224114 0.448228 0.388512 O\n0.775886 0.551772 0.611487 O\n0.775886 0.551772 0.888512 O\n0.224114 0.448228 0.111488 O\n0.957731 0.915465 0.250000 O\n0.042268 0.084535 0.750000 O\n0.499999 0.000000 0.000000 O\n0.499999 0.000000 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:37:03.122591Z",
"updated_at": "2022-09-04T14:37:03.122616Z",
"structure_string": "Li4 Ni4 O4 F8\n1.0\n0.000000 4.887302 0.008049\n4.845479 0.000000 0.000000\n0.000000 -4.636660 -8.204209\nLi Ni O F\n4 4 4 8\ndirect\n0.274503 0.969077 0.242251 Li\n0.725497 0.469077 0.257749 Li\n0.274503 0.530923 0.742251 Li\n0.725497 0.030923 0.757749 Li\n0.000000 0.500000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 -0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.935726 0.107180 0.037944 O\n0.064274 0.607180 0.462056 O\n0.935726 0.392820 0.537944 O\n0.064274 0.892820 0.962056 O\n0.638449 0.410694 0.741220 F\n0.733028 0.857970 0.587799 F\n0.266972 0.357970 0.912201 F\n0.361550 0.910694 0.758780 F\n0.638449 0.089306 0.241220 F\n0.733028 0.642031 0.087799 F\n0.266972 0.142031 0.412201 F\n0.361550 0.589306 0.258780 F\n",
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"formula_full": "Li4 Ni4 O4 F8",
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"spacegroup": 14
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{
"id": "jvasp-11654",
"created_at": "2022-09-04T14:37:01.052007Z",
"updated_at": "2022-09-04T14:37:01.052019Z",
"structure_string": "Li2 Cr4 O8\n1.0\n5.850659 0.026333 0.015162\n2.902991 5.055402 0.047056\n2.903558 1.699386 4.626399\nLi Cr O\n2 4 8\ndirect\n0.000009 0.999996 0.999986 Li\n-0.000004 0.499999 0.500002 Li\n0.000003 0.499992 0.000003 Cr\n0.500002 -0.000006 0.000004 Cr\n0.500003 0.499990 0.000007 Cr\n0.500004 0.499995 0.499995 Cr\n0.264770 0.712949 0.757286 O\n0.253684 0.263807 0.760481 O\n0.260786 0.265563 0.213076 O\n0.277959 0.736429 0.239263 O\n0.739218 0.734423 0.786932 O\n0.746324 0.736182 0.239519 O\n0.722036 0.263564 0.760741 O\n0.735241 0.287031 0.242718 O\n",
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{
"id": "jvasp-42722",
"created_at": "2022-09-04T14:35:55.712686Z",
"updated_at": "2022-09-04T14:35:55.712709Z",
"structure_string": "Li2 Co2 O2 F4\n1.0\n4.918844 0.024415 0.044161\n-2.200487 4.399042 -0.044247\n-2.135071 -1.734655 4.464433\nLi Co O F\n2 2 2 4\ndirect\n0.878501 0.419988 0.345677 Li\n0.926827 0.968328 0.845666 Li\n0.476427 0.740100 0.217998 Co\n0.479024 0.242683 0.718003 Co\n0.389258 0.375922 0.991705 O\n0.616955 0.103591 0.491736 O\n0.659379 0.015064 0.003702 F\n0.979036 0.639929 0.972252 F\n0.333432 0.494309 0.472232 F\n0.989773 0.845444 0.503702 F\n",
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{
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"created_at": "2022-09-04T14:36:56.759062Z",
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{
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"created_at": "2022-09-04T14:38:26.553743Z",
"updated_at": "2022-09-04T14:38:26.553772Z",
"structure_string": "Li2 V6 O12\n1.0\n4.431024 -0.001521 -2.210065\n-1.196091 8.142393 -2.404578\n-0.078546 0.076699 5.390914\nLi V O\n2 6 12\ndirect\n0.429014 0.142976 0.858009 Li\n0.929014 0.642975 0.858008 Li\n0.697814 0.899244 0.395534 V\n0.997947 -0.000678 -0.004220 V\n0.249264 0.749786 0.498473 V\n0.197815 0.399244 0.395536 V\n0.497949 0.499322 -0.004218 V\n0.749263 0.249786 0.498472 V\n0.550688 0.934798 0.701446 O\n0.050690 0.434798 0.701448 O\n0.024063 0.807932 0.701507 O\n0.524062 0.307932 0.701507 O\n0.433835 0.698771 0.216473 O\n0.951433 0.867544 0.216453 O\n0.939502 0.541987 0.216416 O\n0.439501 0.041987 0.216416 O\n0.977631 0.108041 0.701497 O\n0.451433 0.367544 0.216454 O\n0.933833 0.198772 0.216472 O\n0.477633 0.608041 0.701498 O\n",
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{
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"structure_string": "Li4 Rh4 O8\n1.0\n5.224776 0.000000 3.016526\n1.741592 4.925966 3.016526\n0.000000 0.000000 6.033051\nLi Rh O\n4 4 8\ndirect\n0.500000 0.500000 0.000000 Li\n0.500000 -0.000000 0.500000 Li\n-0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n-0.000000 0.500000 0.000000 Rh\n0.500000 -0.000000 0.000000 Rh\n0.000000 0.000000 0.500000 Rh\n0.000000 0.000000 0.000000 Rh\n0.229056 0.756982 0.756982 O\n0.243019 0.243019 0.243019 O\n0.756982 0.229056 0.756982 O\n0.756982 0.756982 0.229056 O\n0.756982 0.756982 0.756982 O\n0.243019 0.243019 0.770944 O\n0.770945 0.243019 0.243019 O\n0.243018 0.770945 0.243019 O\n",
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{
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"structure_string": "Ge2 O4\n1.0\n0.000000 0.000000 -2.918003\n0.000000 -4.466376 0.000000\n-4.467547 0.000000 0.000000\nGe O\n2 4\ndirect\n0.500000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.500000 0.806026 0.193701 O\n0.500000 0.193974 0.806299 O\n0.000000 0.693975 0.693702 O\n0.000000 0.306026 0.306299 O\n",
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]
}