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{
"id": "jvasp-38494",
"created_at": "2022-09-04T14:37:58.485341Z",
"updated_at": "2022-09-04T14:37:58.485361Z",
"structure_string": "Pr1 Er1 Zn2\n1.0\n0.000000 3.612572 3.612572\n3.612572 -0.000000 3.612572\n3.612572 3.612572 -0.000000\nPr Er Zn\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Pr\n0.250001 0.250001 0.250001 Er\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n",
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{
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"created_at": "2022-09-04T14:36:54.000489Z",
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"structure_string": "Te1 Pb3 Br2 O4\n1.0\n7.082244 0.033409 0.000000\n-4.829510 5.180263 0.000000\n0.000000 -0.000000 5.671780\nTe Pb Br O\n1 3 2 4\ndirect\n0.815349 0.184650 -0.000000 Te\n0.141854 0.858145 -0.000000 Pb\n0.645929 0.354071 0.500000 Pb\n0.353357 0.646642 0.500000 Pb\n0.492787 0.507213 -0.000000 Br\n0.002481 0.997519 0.500000 Br\n0.983555 0.479570 0.767707 O\n0.520430 0.016445 0.232293 O\n0.520430 0.016445 0.767707 O\n0.983555 0.479570 0.232293 O\n",
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{
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"updated_at": "2022-09-04T14:37:31.800403Z",
"structure_string": "Er6 Mn6 O18\n1.0\n2.908666 -5.037958 0.000000\n2.908666 5.037958 -0.000000\n-0.000000 0.000000 11.882419\nEr Mn O\n6 6 18\ndirect\n0.666668 0.333334 0.772422 Er\n0.333334 0.666668 0.272422 Er\n0.666668 0.333334 0.272422 Er\n0.333334 0.666668 0.772422 Er\n0.000000 0.000000 0.220830 Er\n0.000000 0.000000 0.720830 Er\n0.000000 0.663860 0.002197 Mn\n0.663860 0.663860 0.502197 Mn\n0.336141 0.000000 0.502197 Mn\n0.336141 0.336141 0.002197 Mn\n0.000000 0.336141 0.502197 Mn\n0.663860 0.000000 0.002197 Mn\n0.633344 0.000000 0.162566 O\n0.700960 0.000000 0.840874 O\n0.299041 0.000000 0.340874 O\n0.700961 0.700961 0.340874 O\n0.000000 0.700960 0.840874 O\n0.000000 0.366657 0.662566 O\n0.366657 0.366657 0.162566 O\n0.366657 0.000000 0.662566 O\n0.666668 0.333334 0.486737 O\n0.000000 0.633344 0.162566 O\n0.000000 0.000000 0.521942 O\n0.000000 0.000000 0.021942 O\n0.333334 0.666668 0.986737 O\n0.299041 0.299041 0.840874 O\n0.333334 0.666668 0.486737 O\n0.666668 0.333334 0.986737 O\n0.633344 0.633344 0.662566 O\n0.000000 0.299041 0.340874 O\n",
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"formula_full": "Er6 Mn6 O18",
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{
"id": "jvasp-57809",
"created_at": "2022-09-04T14:37:51.714307Z",
"updated_at": "2022-09-04T14:37:51.714324Z",
"structure_string": "Ba3 Ho2 Cu2 Pt1 O10\n1.0\n5.846553 0.000000 0.000000\n-2.923277 6.043768 -1.709745\n0.000000 -0.014141 7.445705\nBa Ho Cu Pt O\n3 2 2 1 10\ndirect\n0.846874 0.693749 0.458920 Ba\n0.000000 0.000000 0.000000 Ba\n0.153126 0.306251 0.541080 Ba\n0.311264 0.622528 0.125916 Ho\n0.688735 0.377473 0.874084 Ho\n0.589204 0.178407 0.198640 Cu\n0.410796 0.821594 0.801360 Cu\n0.500000 0.000000 0.500000 Pt\n0.667192 0.334383 0.551057 O\n0.298358 0.038027 0.719677 O\n0.455320 0.368657 0.126376 O\n0.913336 0.368657 0.126376 O\n0.701641 0.961973 0.280324 O\n0.332808 0.665617 0.448943 O\n0.544679 0.631343 0.873625 O\n0.739670 0.038027 0.719677 O\n0.086663 0.631343 0.873625 O\n0.260330 0.961973 0.280324 O\n",
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{
"id": "jvasp-71944",
"created_at": "2022-09-04T14:36:14.881367Z",
"updated_at": "2022-09-04T14:36:14.881390Z",
"structure_string": "Be1 Co2 Se1\n1.0\n-1.853791 1.853791 3.217163\n1.853791 -1.853791 3.217163\n1.853791 1.853791 -3.217163\nBe Co Se\n1 2 1\ndirect\n0.750000 0.250000 0.500000 Be\n0.000000 0.000000 0.000000 Co\n0.499999 0.499999 0.000000 Co\n0.250000 0.750000 0.500000 Se\n",
"nsites": 4,
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{
"id": "jvasp-105509",
"created_at": "2022-09-04T14:36:46.138114Z",
"updated_at": "2022-09-04T14:36:46.138137Z",
"structure_string": "Fe1 Co1 Se2\n1.0\n3.591422 -0.000000 0.000000\n-1.795712 3.110262 0.000000\n0.000000 0.000000 5.245326\nFe Co Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Co\n0.333333 0.666666 0.246537 Se\n0.666666 0.333333 0.753463 Se\n",
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"formula_full": "Fe1 Co1 Se2",
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{
"id": "jvasp-21747",
"created_at": "2022-09-04T14:37:38.303528Z",
"updated_at": "2022-09-04T14:37:38.303557Z",
"structure_string": "Pr4 Cd2 Ni4\n1.0\n7.561040 0.000000 0.000000\n-0.000000 7.561040 0.000000\n-0.000000 0.000000 3.845630\nPr Cd Ni\n4 2 4\ndirect\n0.322169 0.822169 0.500000 Pr\n0.822169 0.677831 0.500000 Pr\n0.177831 0.322169 0.500000 Pr\n0.677831 0.177831 0.500000 Pr\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.000000 Cd\n0.383571 0.116429 0.000000 Ni\n0.883571 0.383571 0.000000 Ni\n0.116429 0.616429 0.000000 Ni\n0.616429 0.883571 0.000000 Ni\n",
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"volume": 219.8520746900574,
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"formula_full": "Pr4 Cd2 Ni4",
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{
"id": "jvasp-57237",
"created_at": "2022-09-04T14:36:33.587368Z",
"updated_at": "2022-09-04T14:36:33.587395Z",
"structure_string": "Ho4 F12\n1.0\n4.373054 0.000000 0.000000\n0.000000 6.363641 0.000000\n0.000000 0.000000 6.853914\nHo F\n4 12\ndirect\n0.562915 0.130533 0.750000 Ho\n0.937083 0.630533 0.750000 Ho\n0.062916 0.369467 0.250000 Ho\n0.437084 0.869467 0.250000 Ho\n0.879414 0.334192 0.937454 F\n0.087914 0.977824 0.750000 F\n0.620584 0.834192 0.562545 F\n0.912085 0.022176 0.250000 F\n0.412086 0.477824 0.750000 F\n0.379415 0.165808 0.437454 F\n0.120585 0.665808 0.437454 F\n0.620584 0.834192 0.937454 F\n0.379415 0.165808 0.062546 F\n0.587913 0.522176 0.250000 F\n0.120585 0.665808 0.062546 F\n0.879414 0.334192 0.562545 F\n",
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"volume": 190.7344591758416,
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"formula_full": "Ho4 F12",
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{
"id": "jvasp-37670",
"created_at": "2022-09-04T14:37:29.970477Z",
"updated_at": "2022-09-04T14:37:29.970496Z",
"structure_string": "Sm2 Zn2 In2\n1.0\n2.350822 -4.071743 0.000000\n2.350822 4.071743 -0.000000\n0.000000 0.000000 7.420952\nSm Zn In\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.000000 0.000000 0.500000 Sm\n0.666666 0.333333 0.250000 Zn\n0.333333 0.666666 0.750000 Zn\n0.666666 0.333333 0.750000 In\n0.333333 0.666666 0.250000 In\n",
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{
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"created_at": "2022-09-04T14:37:12.793104Z",
"updated_at": "2022-09-04T14:37:12.793133Z",
"structure_string": "Lu2 Nb2 O8\n1.0\n0.000000 5.078487 -0.005013\n5.350664 0.000000 0.000000\n0.000000 -0.466704 -5.248030\nLu Nb O\n2 2 8\ndirect\n0.500000 0.242022 0.250000 Lu\n0.500001 0.757977 0.750000 Lu\n0.000000 0.713052 0.250000 Nb\n0.000001 0.286947 0.750000 Nb\n0.756911 0.443640 0.978151 O\n0.747919 0.932670 0.084033 O\n0.252082 0.932670 0.415966 O\n0.243091 0.443640 0.521848 O\n0.756911 0.556360 0.478152 O\n0.747919 0.067329 0.584033 O\n0.252083 0.067329 0.915966 O\n0.243090 0.556360 0.021848 O\n",
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{
"id": "jvasp-113009",
"created_at": "2022-09-04T14:38:44.127179Z",
"updated_at": "2022-09-04T14:38:44.127208Z",
"structure_string": "Nd6 Nb2 Sb10\n1.0\n9.493090 -0.000000 0.000000\n-4.746546 8.221257 0.000000\n0.000000 0.000000 6.246817\nNd Nb Sb\n6 2 10\ndirect\n0.619278 0.000000 0.750000 Nd\n0.380722 0.000000 0.250000 Nd\n-0.000000 0.619278 0.750000 Nd\n-0.000000 0.380722 0.250000 Nd\n0.380722 0.380722 0.750000 Nd\n0.619278 0.619278 0.250000 Nd\n0.000000 0.000000 0.500000 Nb\n0.000000 0.000000 0.000000 Nb\n0.666667 0.333333 0.500000 Sb\n0.333333 0.666667 0.500000 Sb\n0.259925 0.259925 0.250000 Sb\n0.740075 0.740076 0.750000 Sb\n0.259925 0.000000 0.750000 Sb\n-0.000000 0.259925 0.750000 Sb\n0.740075 0.000000 0.250000 Sb\n0.666667 0.333333 -0.000000 Sb\n-0.000000 0.740076 0.250000 Sb\n0.333333 0.666667 -0.000000 Sb\n",
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{
"id": "jvasp-23848",
"created_at": "2022-09-04T14:37:42.487679Z",
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"structure_string": "Sr1 Sb12 Ru4\n1.0\n7.702103 -0.000000 -2.723105\n-3.851052 6.670218 -2.723105\n-0.000000 -0.000000 8.169315\nSr Sb Ru\n1 12 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.658515 0.841455 0.499968 Sb\n0.158546 0.500031 0.341485 Sb\n0.500031 0.341485 0.158545 Sb\n0.817059 0.658515 0.158545 Sb\n0.841454 0.182941 0.341484 Sb\n0.499969 0.658515 0.841453 Sb\n0.341486 0.841455 0.182940 Sb\n0.158546 0.817060 0.658514 Sb\n0.841454 0.499969 0.658514 Sb\n0.341485 0.158546 0.500030 Sb\n0.182941 0.341485 0.841454 Sb\n0.658514 0.158546 0.817058 Sb\n0.500000 0.000000 -0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n0.000000 0.500000 -0.000000 Ru\n0.500000 0.500000 0.499999 Ru\n",
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"volume": 419.69615690561227,
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]
}