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{
"id": "jvasp-119700",
"created_at": "2022-09-04T14:38:50.428152Z",
"updated_at": "2022-09-04T14:38:50.428179Z",
"structure_string": "Fe8 O2 F12\n1.0\n5.041877 -0.239256 0.044735\n-0.376314 7.407893 -0.137706\n0.089474 0.028752 6.643372\nFe O F\n8 2 12\ndirect\n0.393978 0.503816 0.747394 Fe\n0.936657 0.718699 0.478449 Fe\n0.961251 0.716348 0.049495 Fe\n0.464304 0.002677 0.745865 Fe\n0.535658 -0.002707 0.254116 Fe\n0.063366 0.281269 0.521524 Fe\n0.038739 0.283630 0.950493 Fe\n0.606054 0.496175 0.252633 Fe\n0.291067 0.226762 0.746009 O\n0.708921 0.773224 0.253986 O\n0.262721 0.544499 0.447869 F\n0.269316 0.538195 0.056720 F\n0.730649 0.461802 0.943287 F\n0.737375 0.455489 0.552154 F\n0.758164 0.074293 0.525532 F\n0.897080 0.306483 0.239419 F\n0.616119 0.762955 0.718015 F\n0.102995 0.693550 0.760572 F\n0.383941 0.237049 0.281998 F\n0.253149 0.935482 0.034409 F\n0.746716 0.064580 0.965608 F\n0.241784 0.925717 0.474438 F\n",
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{
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"structure_string": "Al1 Co1\n1.0\n2.853685 -0.000000 0.000000\n-0.000000 2.853685 -0.000000\n-0.000000 -0.000000 2.853685\nAl Co\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.499999 0.499999 0.499999 Co\n",
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{
"id": "jvasp-119699",
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"updated_at": "2022-09-04T14:38:50.401876Z",
"structure_string": "Na6 Co2 B2 As2 O14\n1.0\n9.039455 0.008717 0.315154\n-0.004534 6.441847 -0.013936\n0.041840 0.011684 5.233123\nNa Co B As O\n6 2 2 2 14\ndirect\n0.075392 0.250297 0.768275 Na\n0.250357 0.005042 0.247895 Na\n0.250560 0.494973 0.247916 Na\n0.749447 0.505032 0.752087 Na\n0.749650 -0.005034 0.752103 Na\n0.924611 0.749702 0.231725 Na\n0.326775 0.750020 0.784109 Co\n0.673223 0.249975 0.215895 Co\n0.930940 0.250056 0.279426 B\n0.069061 0.749952 0.720571 B\n0.427860 0.249953 0.715442 As\n0.572141 0.750042 0.284559 As\n0.818547 0.250041 0.471326 O\n0.694573 0.950881 0.206126 O\n0.694474 0.549084 0.205925 O\n0.528755 0.749981 0.612576 O\n0.587353 0.249856 0.876879 O\n0.412649 0.750140 0.123117 O\n0.076605 0.250183 0.315963 O\n0.305525 0.450916 0.794058 O\n0.305429 0.049113 0.793874 O\n0.181453 0.749966 0.528671 O\n0.134316 0.750012 0.958882 O\n0.865679 0.249986 0.041119 O\n0.471245 0.250004 0.387425 O\n0.923396 0.749830 0.684027 O\n",
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{
"id": "jvasp-119696",
"created_at": "2022-09-04T14:38:52.486098Z",
"updated_at": "2022-09-04T14:38:52.486122Z",
"structure_string": "Li2 Fe4 O6\n1.0\n2.882211 -0.000108 0.000212\n0.000166 4.991978 0.040643\n-0.000612 -0.142016 7.288945\nLi Fe O\n2 4 6\ndirect\n0.500003 0.499739 0.490927 Li\n-0.000019 0.000293 0.509076 Li\n0.000007 0.678432 0.177378 Fe\n0.499992 0.821562 0.822620 Fe\n0.500017 0.151123 0.176129 Fe\n-0.000011 0.348877 0.823869 Fe\n0.499999 0.526959 0.008031 O\n0.000001 0.973037 0.991967 O\n0.499984 0.149957 0.682105 O\n-0.000013 0.680660 0.673808 O\n0.500012 0.819341 0.326187 O\n0.000018 0.350039 0.317897 O\n",
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{
"id": "jvasp-119694",
"created_at": "2022-09-04T14:38:36.837384Z",
"updated_at": "2022-09-04T14:38:36.837401Z",
"structure_string": "Li4 Mn2 Co2 O8\n1.0\n4.944620 0.073680 -0.182057\n-0.918849 4.729979 -1.227666\n0.213817 -0.206145 5.701328\nLi Mn Co O\n4 2 2 8\ndirect\n0.750001 0.500037 0.124959 Li\n0.750000 0.499982 0.624986 Li\n0.253863 0.493915 0.369050 Li\n0.246124 0.506085 0.880991 Li\n0.499779 -0.000052 0.749661 Mn\n0.000219 0.000052 0.500340 Mn\n-0.000200 0.000098 0.000762 Co\n0.500211 -0.000097 0.249242 Co\n0.870923 0.226932 0.805566 O\n0.629075 0.773078 0.444433 O\n0.873428 0.221182 0.307967 O\n0.626569 0.778813 0.942030 O\n0.373333 0.221708 0.052869 O\n0.126682 0.778288 0.197130 O\n0.371084 0.226158 0.557876 O\n0.128916 0.773829 0.692130 O\n",
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{
"id": "jvasp-119693",
"created_at": "2022-09-04T14:38:53.284933Z",
"updated_at": "2022-09-04T14:38:53.284960Z",
"structure_string": "Sr4 Mn2 Ga2 O10\n1.0\n5.239030 0.003010 -1.626017\n-0.587793 5.201757 -1.639315\n-0.038508 -0.020102 9.006656\nSr Mn Ga O\n4 2 2 10\ndirect\n0.877582 0.403162 0.780750 Sr\n0.122420 0.596840 0.219250 Sr\n0.403167 0.877588 0.780750 Sr\n0.596835 0.122414 0.219250 Sr\n0.000001 -0.000000 -0.000000 Mn\n0.499999 0.500000 -0.000002 Mn\n0.183089 0.183130 0.500007 Ga\n0.816909 0.816871 0.499992 Ga\n0.620695 0.620660 0.287599 O\n0.379303 0.379340 0.712403 O\n0.171484 0.828545 0.500000 O\n0.828514 0.171456 0.500000 O\n0.243461 0.243463 0.986922 O\n0.250008 0.750012 0.000014 O\n0.756540 0.756536 0.013077 O\n0.833070 0.833036 0.712380 O\n0.749994 0.249990 0.999985 O\n0.166929 0.166965 0.287621 O\n",
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{
"id": "jvasp-119692",
"created_at": "2022-09-04T14:38:50.390135Z",
"updated_at": "2022-09-04T14:38:50.390173Z",
"structure_string": "V6 O8 F4\n1.0\n4.623959 -0.027189 0.012688\n0.045246 7.518622 -0.608680\n-0.015538 -0.035980 5.489860\nV O F\n6 8 4\ndirect\n0.010249 0.675185 0.689441 V\n0.513333 0.355747 0.824556 V\n0.013340 0.977589 0.008777 V\n0.510260 0.658143 0.143909 V\n0.470910 0.012178 0.482745 V\n0.970909 0.321153 0.350585 V\n0.200845 0.905027 0.697420 O\n0.700854 0.428312 0.135912 O\n0.298490 0.569462 0.864568 O\n0.798487 0.763867 0.968779 O\n0.802683 0.092480 0.296845 O\n0.305424 0.889867 0.200413 O\n0.805429 0.443464 0.632908 O\n0.302690 0.240845 0.536474 O\n0.696425 0.766327 0.465924 F\n0.701633 0.105701 0.799554 F\n0.201597 0.227651 0.033758 F\n0.196447 0.567000 0.367436 F\n",
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{
"id": "jvasp-119691",
"created_at": "2022-09-04T14:38:51.897152Z",
"updated_at": "2022-09-04T14:38:51.897179Z",
"structure_string": "Co4 Ag4 O12\n1.0\n4.968134 -0.320799 0.180256\n0.279870 5.706869 1.244460\n-0.311778 -0.030507 7.682234\nCo Ag O\n4 4 12\ndirect\n0.500051 0.825359 0.662646 Co\n0.499949 0.174645 0.337356 Co\n0.000052 0.325358 0.162647 Co\n-0.000053 0.674645 0.837354 Co\n-0.001438 0.726399 0.364171 Ag\n0.498557 0.226397 0.864171 Ag\n0.001441 0.273602 0.635827 Ag\n0.501439 0.773600 0.135829 Ag\n0.886430 0.366224 0.927234 O\n0.386430 0.866225 0.427233 O\n0.299361 0.554402 0.740297 O\n0.799362 0.054404 0.240297 O\n0.700637 0.445596 0.259703 O\n0.311321 0.167734 0.127239 O\n0.113570 0.633775 0.072766 O\n0.613566 0.133772 0.572766 O\n0.188679 0.332265 0.372762 O\n0.811320 0.667734 0.627237 O\n0.200639 0.945596 0.759702 O\n0.688677 0.832264 0.872763 O\n",
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},
{
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"created_at": "2022-09-04T14:38:52.216749Z",
"updated_at": "2022-09-04T14:38:52.216778Z",
"structure_string": "Li8 Cr4 O8\n1.0\n3.481875 0.123466 -0.697767\n1.414856 9.776639 1.572172\n-0.003302 0.015627 5.787218\nLi Cr O\n8 4 8\ndirect\n0.807113 0.740342 0.894422 Li\n0.307127 0.990336 0.644448 Li\n0.807137 0.240341 0.394422 Li\n0.307145 0.490338 0.144446 Li\n0.192856 0.759663 0.605552 Li\n0.692868 0.009660 0.355576 Li\n0.192877 0.259665 0.105554 Li\n0.692890 0.509660 0.855580 Li\n0.500021 0.250002 0.749995 Cr\n-0.000024 0.000001 0.000002 Cr\n0.500008 0.750000 0.249990 Cr\n0.000000 0.499998 0.500012 Cr\n0.732507 0.666012 0.597517 O\n0.232521 0.916009 0.347527 O\n0.732524 0.166013 0.097522 O\n0.232540 0.416014 0.847527 O\n0.267462 0.833988 0.902476 O\n0.767483 0.083987 0.652480 O\n0.267483 0.333992 0.402472 O\n0.767492 0.583991 0.152481 O\n",
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"formula_full": "Li8 Cr4 O8",
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},
{
"id": "jvasp-11969",
"created_at": "2022-09-04T14:36:04.321838Z",
"updated_at": "2022-09-04T14:36:04.321866Z",
"structure_string": "Mg8 Ni16\n1.0\n4.804482 -0.000000 -0.000000\n-2.402241 4.160803 -0.000000\n-0.000000 0.000000 15.769305\nMg Ni\n8 16\ndirect\n0.000000 0.000000 0.093127 Mg\n0.000000 0.000000 0.593127 Mg\n0.000000 0.000000 0.906873 Mg\n0.000000 0.000000 0.406873 Mg\n0.333333 0.666666 0.844107 Mg\n0.666667 0.333333 0.344106 Mg\n0.666667 0.333333 0.155894 Mg\n0.333333 0.666666 0.655894 Mg\n0.666667 0.333333 0.625162 Ni\n0.333333 0.666666 0.125162 Ni\n0.835831 0.164169 0.750000 Ni\n0.671662 0.835830 0.250000 Ni\n0.164169 0.328338 0.250000 Ni\n0.835831 0.671662 0.750000 Ni\n0.328338 0.164169 0.750000 Ni\n0.500000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n-0.000000 0.500000 0.000000 Ni\n0.666667 0.333333 0.874839 Ni\n0.500000 0.000000 0.500000 Ni\n-0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.164169 0.835830 0.250000 Ni\n0.333333 0.666666 0.374838 Ni\n",
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"formula_full": "Mg8 Ni16",
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"spacegroup": 194
},
{
"id": "jvasp-119688",
"created_at": "2022-09-04T14:38:52.195662Z",
"updated_at": "2022-09-04T14:38:52.195695Z",
"structure_string": "Li4 Cr2 Co2 O8\n1.0\n5.742702 0.009975 -0.068288\n2.848972 4.094457 -2.886254\n0.006217 -0.009952 5.743135\nLi Cr Co O\n4 2 2 8\ndirect\n0.497520 0.004773 0.503313 Li\n0.997508 0.504762 0.003284 Li\n0.997463 0.504823 0.503347 Li\n0.997474 0.004797 0.503334 Li\n0.997462 0.004825 0.003364 Cr\n0.497451 0.504828 0.503353 Cr\n0.497467 0.004817 0.003349 Co\n0.497468 0.504815 0.003344 Co\n0.739718 0.019397 0.245747 O\n0.255068 0.519396 0.761096 O\n0.739846 0.490254 0.245621 O\n0.255190 0.990256 0.760973 O\n0.274552 0.483074 0.237087 O\n0.731222 0.026533 0.780432 O\n0.263726 0.983072 0.226262 O\n0.720382 0.526538 0.769593 O\n",
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"formula_full": "Li4 Cr2 Co2 O8",
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{
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"created_at": "2022-09-04T14:38:36.820001Z",
"updated_at": "2022-09-04T14:38:36.820020Z",
"structure_string": "Al1 Cu7 O12\n1.0\n5.898630 -0.000000 -2.085481\n-2.949315 5.108364 -2.085481\n-0.000000 -0.000000 6.256442\nAl Cu O\n1 7 12\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Cu\n-0.000001 0.500000 -0.000000 Cu\n0.500000 0.000000 0.000000 Cu\n0.499999 0.500000 0.500000 Cu\n-0.000001 0.500000 0.500000 Cu\n0.500000 0.000000 0.500000 Cu\n0.499999 0.500000 -0.000000 Cu\n0.534636 0.833913 0.700723 O\n0.299276 0.465363 0.166086 O\n0.833913 0.700723 0.534636 O\n0.866809 0.166086 0.700723 O\n0.833914 0.299276 0.133190 O\n0.700723 0.866809 0.166086 O\n0.465363 0.166086 0.299276 O\n0.700723 0.534636 0.833913 O\n0.166085 0.700723 0.866809 O\n0.299276 0.133190 0.833914 O\n0.166086 0.299276 0.465363 O\n0.133189 0.833913 0.299276 O\n",
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"formula_full": "Al1 Cu7 O12",
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}
]
}