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{
"id": "jvasp-48313",
"created_at": "2022-09-04T14:38:16.125548Z",
"updated_at": "2022-09-04T14:38:16.125587Z",
"structure_string": "Li4 Mn8 O4 F12\n1.0\n6.200205 -0.000000 0.000000\n-0.000000 6.258346 0.000000\n0.000000 0.000000 8.972500\nLi Mn O F\n4 8 4 12\ndirect\n0.749999 0.965143 0.104960 Li\n0.250000 0.034858 0.895039 Li\n0.250000 0.534858 0.604960 Li\n0.749999 0.465142 0.395039 Li\n0.000000 0.500000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n0.749999 0.260066 0.734247 Mn\n0.749999 0.760066 0.765753 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.500000 Mn\n0.250000 0.239935 0.234247 Mn\n0.250000 0.739935 0.265753 Mn\n0.749999 0.201064 0.514659 O\n0.250000 0.798937 0.485341 O\n0.250000 0.298937 0.014659 O\n0.749999 0.701064 0.985341 O\n0.749999 0.232251 0.976648 F\n0.250000 0.767750 0.023352 F\n0.999020 0.003902 0.758008 F\n0.500978 0.003902 0.758008 F\n0.999020 0.503902 0.741992 F\n0.500978 0.503902 0.741992 F\n0.250000 0.267749 0.476648 F\n0.749999 0.732251 0.523352 F\n0.499021 0.496099 0.258008 F\n0.000979 0.496099 0.258008 F\n0.000979 0.996099 0.241992 F\n0.499021 0.996099 0.241992 F\n",
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{
"id": "jvasp-72375",
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"structure_string": "Be1 Fe2 Te1\n1.0\n3.907445 0.000000 0.000000\n0.000000 3.907445 -0.000000\n0.000000 0.000000 3.257596\nBe Fe Te\n1 2 1\ndirect\n0.000000 0.000000 0.500001 Be\n0.500001 0.000000 0.000000 Fe\n0.000000 0.500001 0.000000 Fe\n0.500001 0.500001 0.500001 Te\n",
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},
{
"id": "jvasp-42489",
"created_at": "2022-09-04T14:38:32.028467Z",
"updated_at": "2022-09-04T14:38:32.028484Z",
"structure_string": "Mn6 O2 F10\n1.0\n-4.736059 4.736059 3.241860\n0.096690 4.807768 -3.205642\n-4.807768 -0.096690 -3.205642\nMn O F\n6 2 10\ndirect\n0.847730 0.678717 0.678717 Mn\n0.687805 0.334857 0.334857 Mn\n0.312196 0.665143 0.665143 Mn\n0.152271 0.321282 0.321282 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.966614 0.216414 0.216414 O\n0.033387 0.783586 0.783586 O\n0.663600 0.633985 0.036040 F\n0.336401 0.963960 0.366014 F\n0.375620 0.420832 0.420832 F\n0.706402 0.093386 0.093386 F\n0.663600 0.036040 0.633985 F\n0.293599 0.906614 0.906614 F\n0.336401 0.366014 0.963960 F\n0.000000 0.307091 0.692908 F\n0.624381 0.579168 0.579168 F\n0.000000 0.692908 0.307091 F\n",
"nsites": 18,
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"chemical_system": "F-Mn-O",
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"formula_full": "Mn6 O2 F10",
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"spacegroup": 12
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{
"id": "jvasp-9383",
"created_at": "2022-09-04T14:38:10.708456Z",
"updated_at": "2022-09-04T14:38:10.708479Z",
"structure_string": "Na4 S2 O8\n1.0\n5.267265 0.019600 0.000000\n-2.285746 4.745507 0.000000\n0.000000 0.000000 6.952566\nNa S O\n4 2 8\ndirect\n0.189661 0.810340 0.750000 Na\n0.810340 0.189661 0.250000 Na\n0.500000 0.500000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.850513 0.149488 0.750000 S\n0.149487 0.850513 0.250000 S\n0.245187 0.754814 0.076706 O\n0.754814 0.245187 0.576707 O\n0.754814 0.245187 0.923294 O\n0.245187 0.754814 0.423294 O\n0.164716 0.266902 0.750000 O\n0.835284 0.733099 0.250000 O\n0.733098 0.835284 0.750000 O\n0.266902 0.164716 0.250000 O\n",
"nsites": 14,
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"formula_full": "Na4 S2 O8",
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{
"id": "jvasp-71883",
"created_at": "2022-09-04T14:36:09.712265Z",
"updated_at": "2022-09-04T14:36:09.712293Z",
"structure_string": "Li2 Be1 Si1\n1.0\n-1.780433 1.780433 3.922937\n1.780433 -1.780433 3.922937\n1.780433 1.780433 -3.922937\nLi Be Si\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.000000 Li\n0.749999 0.250000 0.499999 Be\n0.250000 0.749999 0.499999 Si\n",
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"volume": 49.741925820937176,
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"formula_full": "Li2 Be1 Si1",
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{
"id": "jvasp-101369",
"created_at": "2022-09-04T14:36:22.359018Z",
"updated_at": "2022-09-04T14:36:22.359042Z",
"structure_string": "Mn4 Si2 P8 O28\n1.0\n5.037461 0.000043 -0.000015\n-2.518946 8.331063 -2.016575\n0.000028 -0.010024 12.447651\nMn Si P O\n4 2 8 28\ndirect\n0.092221 0.491566 0.631280 Mn\n0.400814 0.491573 0.131276 Mn\n0.599930 0.507091 0.867870 Mn\n0.908537 0.507083 0.367883 Mn\n0.157813 0.999337 0.749589 Si\n0.842928 0.999323 0.249577 Si\n0.692828 0.730205 0.586639 P\n0.038825 0.730210 0.086634 P\n0.488337 0.240795 0.629541 P\n0.753859 0.240796 0.129550 P\n0.512437 0.757851 0.369617 P\n0.246866 0.757869 0.869615 P\n0.307941 0.268437 0.412523 P\n0.961894 0.268446 0.912526 P\n0.484039 0.275101 0.114310 O\n0.130788 0.818124 0.987241 O\n0.312001 0.180522 0.511915 O\n0.609420 0.621618 0.299641 O\n-0.012916 0.377039 0.199516 O\n0.391361 0.377039 0.699506 O\n0.013643 0.621635 0.799641 O\n0.033307 0.130816 0.826702 O\n0.792462 0.275102 0.614301 O\n0.901888 0.867822 0.672463 O\n0.967394 0.867831 0.172458 O\n0.098885 0.130817 0.326698 O\n0.779578 0.591204 0.046544 O\n0.187712 0.407443 0.452615 O\n0.221151 0.407446 0.952610 O\n0.813057 0.591197 0.546551 O\n0.282828 0.695168 0.132949 O\n0.586983 0.303477 0.366204 O\n0.717899 0.303492 0.866206 O\n0.413783 0.695168 0.632955 O\n0.869919 0.180538 0.011921 O\n0.688789 0.818112 0.487241 O\n0.387292 0.081697 0.672158 O\n0.304957 0.916985 0.827017 O\n0.613464 0.916959 0.327010 O\n0.695793 0.081684 0.172154 O\n0.516676 0.723555 0.884861 O\n0.208316 0.723535 0.384867 O\n",
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],
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"formula_full": "Mn4 Si2 P8 O28",
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"formula_anonymous": "AB2C4D14",
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{
"id": "jvasp-14672",
"created_at": "2022-09-04T14:36:31.916812Z",
"updated_at": "2022-09-04T14:36:31.916843Z",
"structure_string": "Si4 Ni4\n1.0\n3.371982 -0.000000 0.000000\n-0.000000 5.209392 0.000000\n0.000000 0.000000 5.663501\nSi Ni\n4 4\ndirect\n0.750000 0.817904 0.582946 Si\n0.250000 0.182095 0.417054 Si\n0.750000 0.317905 0.917054 Si\n0.250000 0.682095 0.082946 Si\n0.250000 0.506773 0.690317 Ni\n0.750000 0.493226 0.309683 Ni\n0.250000 0.006774 0.809683 Ni\n0.750000 0.993226 0.190317 Ni\n",
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{
"id": "jvasp-70999",
"created_at": "2022-09-04T14:35:50.394953Z",
"updated_at": "2022-09-04T14:35:50.394976Z",
"structure_string": "Be1 P1 Rh2\n1.0\n3.062763 0.000000 0.000000\n0.000000 3.062763 0.000000\n0.000000 0.000000 5.302762\nBe P Rh\n1 1 2\ndirect\n0.000000 0.000000 0.483858 Be\n0.500000 0.500000 0.753772 P\n0.000000 0.000000 0.943395 Rh\n0.500000 0.500000 0.318974 Rh\n",
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{
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{
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{
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{
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}
]
}