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{
"id": "jvasp-47552",
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"updated_at": "2022-09-04T14:36:35.036669Z",
"structure_string": "Li2 V2 Si2 O8\n1.0\n-0.000000 3.897442 3.897442\n4.197291 -0.091294 3.988737\n4.197291 3.988737 -0.091294\nLi V Si O\n2 2 2 8\ndirect\n0.006042 0.993960 0.993960 Li\n0.243960 0.256040 0.256040 Li\n0.625001 0.625000 0.125000 V\n0.625001 0.125000 0.625000 V\n0.625001 0.625000 0.625000 Si\n0.125001 0.625000 0.625000 Si\n0.831157 0.411425 0.411425 O\n0.345993 0.411425 0.411425 O\n0.380316 0.830594 0.408776 O\n0.869686 0.841224 0.419406 O\n0.869686 0.419406 0.841224 O\n0.380316 0.408776 0.830594 O\n0.418845 0.838574 0.838574 O\n0.904009 0.838574 0.838574 O\n",
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"structure_string": "Y2 H6 O6\n1.0\n3.143069 -5.443956 0.000000\n3.143070 5.443955 0.000000\n-0.000000 -0.000000 3.545499\nY H O\n2 6 6\ndirect\n0.666667 0.333333 0.326284 Y\n0.333333 0.666667 0.826284 Y\n0.134389 0.274404 0.328729 H\n0.140015 0.865611 0.328729 H\n0.725596 0.859985 0.328729 H\n0.865611 0.725596 0.828729 H\n0.859985 0.134389 0.828729 H\n0.274404 0.140015 0.828729 H\n0.309860 0.394140 0.325634 O\n0.084280 0.690140 0.325634 O\n0.605860 0.915720 0.325634 O\n0.690140 0.605860 0.825634 O\n0.915721 0.309860 0.825634 O\n0.394140 0.084280 0.825634 O\n",
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{
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"updated_at": "2022-09-04T14:36:13.309512Z",
"structure_string": "Li2 Mn4 O2 F6\n1.0\n0.000000 6.217567 0.000000\n-5.384633 3.108783 0.000101\n0.000020 0.000000 5.185106\nLi Mn O F\n2 4 2 6\ndirect\n0.666658 0.666684 0.021587 Li\n0.333342 0.333316 0.978413 Li\n0.500000 0.500000 0.500000 Mn\n-0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.666669 0.666660 0.664338 O\n0.333331 0.333339 0.335663 O\n0.348402 0.825800 0.210982 F\n0.825798 0.825800 0.210982 F\n0.174222 0.651554 0.789058 F\n0.825778 0.348445 0.210942 F\n0.651599 0.174200 0.789018 F\n0.174202 0.174200 0.789018 F\n",
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"volume": 173.5938046025215,
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{
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"created_at": "2022-09-04T14:36:34.999822Z",
"updated_at": "2022-09-04T14:36:34.999852Z",
"structure_string": "Co4 Rh2 S8\n1.0\n5.829340 -0.013162 3.344737\n1.930894 5.461394 3.344407\n-0.018043 -0.013162 6.720725\nCo Rh S\n4 2 8\ndirect\n0.000939 0.999059 0.000941 Co\n0.249060 0.250940 0.249060 Co\n0.625000 0.125000 0.625000 Co\n0.625000 0.625000 0.625000 Co\n0.125000 0.625000 0.625000 Rh\n0.625000 0.625000 0.125001 Rh\n0.385096 0.368297 0.385096 S\n0.390485 0.375249 0.859015 S\n0.385096 0.861510 0.385097 S\n0.859015 0.375249 0.390485 S\n0.390984 0.874751 0.859515 S\n0.864904 0.388489 0.864904 S\n0.859515 0.874751 0.390985 S\n0.864904 0.881703 0.864904 S\n",
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{
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"created_at": "2022-09-04T14:36:35.484783Z",
"updated_at": "2022-09-04T14:36:35.484804Z",
"structure_string": "Pr5 Ag1 Se8\n1.0\n7.770780 0.056058 -0.000000\n-2.537409 7.345048 0.000000\n-2.616686 -3.700552 6.312451\nPr Ag Se\n5 1 8\ndirect\n0.114026 0.744570 0.871937 Pr\n0.255430 0.627368 0.369456 Pr\n0.372632 0.242090 0.628063 Pr\n0.757911 0.885974 0.130544 Pr\n0.625000 0.375000 0.250000 Pr\n0.875000 0.125001 0.750000 Ag\n0.989558 0.851160 0.500921 Se\n0.148841 0.149761 0.138399 Se\n0.369155 0.516291 0.008313 Se\n0.639158 0.630846 0.647136 Se\n0.483709 0.992023 0.852864 Se\n0.511363 0.010443 0.361601 Se\n0.850238 0.488638 0.999078 Se\n0.007978 0.360842 0.491687 Se\n",
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{
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"created_at": "2022-09-04T14:36:13.941360Z",
"updated_at": "2022-09-04T14:36:13.941388Z",
"structure_string": "Cu2 Bi4 O8\n1.0\n4.997491 0.000000 2.421234\n2.498746 6.249206 1.210616\n-0.225984 -0.000000 6.834533\nCu Bi O\n2 4 8\ndirect\n0.680039 -0.000000 -0.000000 Cu\n0.180039 -0.000000 -0.000000 Cu\n0.656289 0.500007 0.164237 Bi\n0.820527 0.835763 0.500006 Bi\n0.156296 0.164238 0.499993 Bi\n0.320533 0.499994 0.835762 Bi\n0.763771 0.091572 0.704284 O\n0.355342 0.908436 0.704273 O\n0.559628 0.908429 0.295715 O\n0.468055 0.295716 0.091572 O\n0.059616 0.295726 0.908435 O\n0.968050 0.091565 0.295726 O\n0.855344 0.704285 0.908427 O\n0.263777 0.704274 0.091565 O\n",
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"volume": 216.86417920521683,
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"formula_full": "Cu2 Bi4 O8",
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"spacegroup": 108
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{
"id": "jvasp-62858",
"created_at": "2022-09-04T14:36:10.626690Z",
"updated_at": "2022-09-04T14:36:10.626724Z",
"structure_string": "B10 Mo4\n1.0\n1.955364 -3.386789 0.000000\n1.955364 3.386789 0.000000\n0.000000 0.000000 10.245996\nB Mo\n10 4\ndirect\n0.333332 0.666666 0.339235 B\n0.666666 0.333332 0.839235 B\n0.666666 0.333332 0.660765 B\n0.333332 0.666666 0.160765 B\n0.500000 -0.000001 0.000000 B\n-0.000001 0.500000 0.000000 B\n0.499999 0.499999 0.000000 B\n0.500000 -0.000001 0.500000 B\n-0.000001 0.500000 0.500000 B\n0.499999 0.499999 0.500000 B\n0.000000 0.000000 0.367943 Mo\n0.000000 0.000000 0.867943 Mo\n0.000000 0.000000 0.632058 Mo\n0.000000 0.000000 0.132058 Mo\n",
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{
"id": "jvasp-57496",
"created_at": "2022-09-04T14:36:35.804298Z",
"updated_at": "2022-09-04T14:36:35.804320Z",
"structure_string": "Ge4 Pb1 O9\n1.0\n4.589984 0.000877 -1.070866\n-2.285963 5.820709 -2.883362\n-0.005559 -0.002899 6.886219\nGe Pb O\n4 1 9\ndirect\n0.500000 0.487387 0.512613 Ge\n0.679991 0.486945 0.069132 Ge\n0.000000 0.307910 0.692090 Ge\n0.320009 0.930868 0.513055 Ge\n-0.000000 -0.002985 0.002985 Pb\n0.605239 0.091497 0.456557 O\n0.394761 0.543443 0.908504 O\n0.840570 0.285411 0.922441 O\n0.866188 0.555183 0.713614 O\n0.159429 0.077559 0.714590 O\n0.133812 0.286386 0.444817 O\n0.513299 0.375437 0.227758 O\n0.000000 0.756119 0.243881 O\n0.486701 0.772242 0.624564 O\n",
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{
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"created_at": "2022-09-04T14:36:36.432960Z",
"updated_at": "2022-09-04T14:36:36.432971Z",
"structure_string": "Ho4 Cu2 O8\n1.0\n5.467321 -0.000000 0.000000\n-0.000000 2.735452 5.863681\n0.000000 -5.470903 0.000000\nHo Cu O\n4 2 8\ndirect\n0.000000 0.307643 0.653821 Ho\n0.000000 0.692356 0.346178 Ho\n0.500000 0.692356 0.846178 Ho\n0.500000 0.307643 0.153822 Ho\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.202919 0.000000 0.297796 O\n0.250000 0.500000 0.990482 O\n0.250000 0.500000 0.490483 O\n0.297081 0.000000 0.797796 O\n0.702919 0.000000 0.202203 O\n0.750000 0.500000 0.509517 O\n0.750000 0.500000 0.009517 O\n0.797081 0.000000 0.702203 O\n",
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{
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"structure_string": "Al5 Cu1 S8\n1.0\n7.079127 0.000000 0.000000\n3.539564 6.130704 0.000000\n3.539564 2.043568 5.780083\nAl Cu S\n5 1 8\ndirect\n0.019659 0.493447 0.493447 Al\n0.493447 0.493447 0.019660 Al\n0.493447 0.019660 0.493447 Al\n0.493447 0.493447 0.493447 Al\n0.875000 0.875000 0.875000 Al\n0.125000 0.125000 0.125000 Cu\n0.256929 0.256929 0.256929 S\n0.256929 0.729213 0.256929 S\n0.256928 0.256929 0.729212 S\n0.729213 0.256929 0.256929 S\n0.274885 0.741705 0.741704 S\n0.741705 0.741705 0.274885 S\n0.741705 0.274886 0.741704 S\n0.741705 0.741705 0.741704 S\n",
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{
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"created_at": "2022-09-04T14:36:38.324447Z",
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"structure_string": "Sb4 O10\n1.0\n9.764069 0.000000 0.000000\n0.000000 5.093345 -1.993390\n0.000000 -0.000000 3.986782\nSb O\n4 10\ndirect\n0.184959 0.770134 0.885066 Sb\n0.315041 0.229867 0.614934 Sb\n0.684959 0.229867 0.614934 Sb\n0.815041 0.770134 0.885066 Sb\n0.000000 0.921861 0.960931 O\n0.129621 0.399144 0.699572 O\n0.213464 0.867166 0.433583 O\n0.286536 0.132833 0.066416 O\n0.370379 0.600857 0.800428 O\n0.500000 0.078140 0.539069 O\n0.629621 0.600857 0.800428 O\n0.870379 0.399144 0.699572 O\n0.713464 0.132833 0.066416 O\n0.786536 0.867166 0.433583 O\n",
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{
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"created_at": "2022-09-04T14:36:39.788516Z",
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"structure_string": "B4 Pd10\n1.0\n4.672687 0.000000 -1.810314\n-0.246056 5.473679 -0.635107\n0.004067 -0.000621 6.946099\nB Pd\n4 10\ndirect\n0.587947 0.421911 0.770825 B\n0.817123 0.078089 0.229176 B\n0.412053 0.578089 0.229176 B\n0.182877 0.921911 0.770824 B\n0.004396 0.420106 0.192060 Pd\n0.812338 0.079895 0.807941 Pd\n0.358108 0.685958 0.575586 Pd\n0.782522 0.814042 0.424414 Pd\n0.641892 0.314042 0.424415 Pd\n0.217479 0.185958 0.575586 Pd\n0.187663 0.920106 0.192060 Pd\n0.995605 0.579895 0.807941 Pd\n0.430611 0.250000 0.000000 Pd\n0.569389 0.750000 -0.000000 Pd\n",
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}
]
}