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{
"id": "jvasp-9913",
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{
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{
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"updated_at": "2022-09-04T14:38:30.447836Z",
"structure_string": "Sr2 Ga4 B4 O14\n1.0\n5.730987 0.000000 0.000000\n0.000000 6.860283 -2.356851\n0.000000 -0.003502 7.253841\nSr Ga B O\n2 4 4 14\ndirect\n0.250000 0.816383 0.816383 Sr\n0.750000 0.183617 0.183617 Sr\n0.750000 0.123420 0.705510 Ga\n0.250000 0.294490 0.876580 Ga\n0.750000 0.705510 0.123420 Ga\n0.250000 0.876580 0.294490 Ga\n0.250000 0.296054 0.513952 B\n0.250000 0.513952 0.296054 B\n0.750000 0.486048 0.703946 B\n0.750000 0.703946 0.486048 B\n0.500000 0.128424 0.871576 O\n0.750000 0.494857 0.893761 O\n0.750000 0.563645 0.304404 O\n0.250000 0.695596 0.436354 O\n0.750000 0.893761 0.494857 O\n0.250000 0.106239 0.505143 O\n0.000000 0.128424 0.871576 O\n0.000000 0.871576 0.128423 O\n0.750000 0.661213 0.661213 O\n0.750000 0.304404 0.563645 O\n0.500000 0.871576 0.128423 O\n0.250000 0.338787 0.338787 O\n0.250000 0.505143 0.106239 O\n0.250000 0.436355 0.695596 O\n",
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{
"id": "jvasp-34022",
"created_at": "2022-09-04T14:38:30.367577Z",
"updated_at": "2022-09-04T14:38:30.367604Z",
"structure_string": "Te4 Mo6 S8\n1.0\n1.821522 2.775105 0.000019\n-0.000106 0.000038 -13.601111\n-6.258954 6.093975 0.000029\nTe Mo S\n4 6 8\ndirect\n0.875329 0.613392 0.249326 Te\n0.457992 0.113391 0.084011 Te\n0.458002 0.386608 0.084008 Te\n0.875338 0.886609 0.249324 Te\n0.233710 0.249999 0.532578 Mo\n0.439168 0.750001 0.121676 Mo\n0.894163 0.249999 0.211658 Mo\n0.757981 0.750000 0.484045 Mo\n0.575360 0.249999 0.849290 Mo\n0.099627 0.750001 0.800756 Mo\n0.547565 0.863626 0.904892 S\n0.547556 0.636376 0.904894 S\n0.785773 0.136374 0.428443 S\n0.126605 0.364292 0.746823 S\n0.206743 0.864294 0.586509 S\n0.206734 0.635707 0.586511 S\n0.126596 0.135706 0.746825 S\n0.785781 0.363624 0.428441 S\n",
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{
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"updated_at": "2022-09-04T14:38:30.631794Z",
"structure_string": "Pd6 S2\n1.0\n4.597477 0.008992 0.000000\n-1.443637 4.364949 0.000000\n0.000000 0.000000 6.398531\nPd S\n6 2\ndirect\n0.147284 0.538491 0.750000 Pd\n0.535748 0.150039 0.750000 Pd\n0.998629 0.001371 0.000000 Pd\n0.998629 0.001371 0.500000 Pd\n0.461509 0.852716 0.250000 Pd\n0.849961 0.464252 0.250000 Pd\n0.309422 0.312183 0.250000 S\n0.687818 0.690578 0.750000 S\n",
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{
"id": "jvasp-19716",
"created_at": "2022-09-04T14:38:30.633920Z",
"updated_at": "2022-09-04T14:38:30.633949Z",
"structure_string": "Nd2 Ga2\n1.0\n4.164467 0.000000 -0.000000\n0.000000 4.148711 -1.624929\n-0.000000 -0.021391 6.054023\nNd Ga\n2 2\ndirect\n0.750001 0.141106 0.282211 Nd\n0.250000 0.858894 0.717788 Nd\n0.750001 0.427976 0.855952 Ga\n0.250000 0.572024 0.144047 Ga\n",
"nsites": 4,
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"density_atomic": 0.038295236697582655,
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},
{
"id": "jvasp-108007",
"created_at": "2022-09-04T14:38:30.543416Z",
"updated_at": "2022-09-04T14:38:30.543436Z",
"structure_string": "Rb4 Ni2 P4\n1.0\n7.690783 -0.050058 0.000000\n-4.814663 5.997472 0.000000\n-0.000000 -0.000000 5.759157\nRb Ni P\n4 2 4\ndirect\n0.786740 0.213259 0.250000 Rb\n0.213260 0.786740 0.750000 Rb\n0.409696 0.590304 0.250000 Rb\n0.590304 0.409696 0.750000 Rb\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.930877 0.736112 0.250000 P\n0.069123 0.263887 0.750000 P\n0.263887 0.069123 0.250000 P\n0.736112 0.930877 0.750000 P\n",
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"formula_full": "Rb4 Ni2 P4",
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{
"id": "jvasp-58571",
"created_at": "2022-09-04T14:38:30.544167Z",
"updated_at": "2022-09-04T14:38:30.544193Z",
"structure_string": "Mg2 Ag4 O8\n1.0\n3.065778 0.000000 0.000000\n-1.532889 5.280048 -0.000000\n0.000000 0.000000 9.785042\nMg Ag O\n2 4 8\ndirect\n0.390374 0.780748 0.750000 Mg\n0.609627 0.219252 0.250000 Mg\n0.868396 0.736793 0.072989 Ag\n0.131604 0.263207 0.927010 Ag\n0.868396 0.736793 0.427010 Ag\n0.131604 0.263207 0.572989 Ag\n0.209827 0.419656 0.378971 O\n0.790173 0.580344 0.621029 O\n0.790173 0.580344 0.878971 O\n0.209827 0.419656 0.121029 O\n0.972827 0.945655 0.250000 O\n0.027173 0.054345 0.750000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:38:30.601024Z",
"updated_at": "2022-09-04T14:38:30.601047Z",
"structure_string": "Tm2 Al4 Ni2\n1.0\n4.054517 0.000000 -0.000000\n-2.027259 4.976714 -0.000000\n-0.000000 -0.000000 6.864470\nTm Al Ni\n2 4 2\ndirect\n0.062370 0.124739 0.750000 Tm\n0.937630 0.875260 0.250000 Tm\n0.347369 0.694739 0.553319 Al\n0.652631 0.305260 0.446681 Al\n0.347369 0.694739 0.946681 Al\n0.652631 0.305260 0.053319 Al\n0.215097 0.430194 0.250000 Ni\n0.784903 0.569805 0.750000 Ni\n",
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{
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"created_at": "2022-09-04T14:38:30.696802Z",
"updated_at": "2022-09-04T14:38:30.696828Z",
"structure_string": "Y4 Al18 Co6\n1.0\n7.379832 -0.003156 0.000000\n-3.611362 6.435837 0.000000\n0.000000 -0.000000 9.372330\nY Al Co\n4 18 6\ndirect\n0.006131 0.328344 0.750000 Y\n0.328344 0.006131 0.750000 Y\n0.671656 0.993869 0.250000 Y\n0.993869 0.671656 0.250000 Y\n0.998356 0.335040 0.070166 Al\n0.001644 0.664960 0.570166 Al\n0.335041 0.998356 0.429834 Al\n0.664959 0.001644 0.929834 Al\n0.998356 0.335040 0.429834 Al\n0.664959 0.001644 0.570166 Al\n0.124368 0.124368 0.250000 Al\n0.661749 0.446507 0.750000 Al\n0.875632 0.875632 0.750000 Al\n0.332464 0.332464 0.545058 Al\n0.335041 0.998356 0.070166 Al\n0.667536 0.667536 0.045058 Al\n0.001644 0.664960 0.929834 Al\n0.667536 0.667536 0.454942 Al\n0.553493 0.338251 0.250000 Al\n0.446507 0.661749 0.750000 Al\n0.338251 0.553493 0.250000 Al\n0.332464 0.332464 0.954942 Al\n0.000000 0.000000 0.000000 Co\n0.329196 0.670804 0.000000 Co\n0.670804 0.329195 0.500000 Co\n0.670804 0.329195 0.000000 Co\n0.329196 0.670804 0.500000 Co\n0.000000 0.000000 0.500000 Co\n",
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{
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"created_at": "2022-09-04T14:38:30.770007Z",
"updated_at": "2022-09-04T14:38:30.770026Z",
"structure_string": "Li4 Mn4 P4 O16\n1.0\n5.612330 -0.000000 0.000000\n-0.000000 6.239462 0.000000\n0.000000 0.000000 8.391250\nLi Mn P O\n4 4 4 16\ndirect\n0.750000 0.750028 0.916139 Li\n0.250000 0.749971 0.416139 Li\n0.750000 0.250029 0.583861 Li\n0.250000 0.249971 0.083861 Li\n0.250000 -0.000024 0.749984 Mn\n0.750000 0.500024 0.249984 Mn\n0.250000 0.499976 0.750016 Mn\n0.750000 0.000024 0.250016 Mn\n0.250000 0.250006 0.396181 P\n0.750000 0.249994 0.896181 P\n0.250000 0.750005 0.103819 P\n0.750000 0.749994 0.603819 P\n0.528156 0.249984 0.780941 O\n0.971844 0.249984 0.780941 O\n0.028156 0.250016 0.280941 O\n0.471844 0.250016 0.280941 O\n0.250000 0.453785 0.499022 O\n0.750000 0.453795 0.998997 O\n0.250000 0.546205 0.001003 O\n0.250000 0.953785 0.000978 O\n0.528156 0.749984 0.719059 O\n0.971844 0.749984 0.719059 O\n0.471844 0.750015 0.219059 O\n0.028156 0.750015 0.219059 O\n0.750000 0.046214 0.999022 O\n0.750000 0.953795 0.501003 O\n0.750000 0.546214 0.500978 O\n0.250000 0.046205 0.498997 O\n",
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"formula_full": "Li4 Mn4 P4 O16",
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},
{
"id": "jvasp-30674",
"created_at": "2022-09-04T14:38:31.295590Z",
"updated_at": "2022-09-04T14:38:31.295600Z",
"structure_string": "Zn2 Sn8 O12\n1.0\n3.121387 -0.000000 -0.000000\n-1.560693 6.197230 0.000000\n-0.000000 0.000000 16.757347\nZn Sn O\n2 8 12\ndirect\n0.660582 0.321162 0.750000 Zn\n0.339420 0.678838 0.250000 Zn\n0.872689 0.745378 0.041691 Sn\n0.411003 0.822001 0.665575 Sn\n0.127311 0.254621 0.958309 Sn\n0.588999 0.177999 0.334426 Sn\n0.872689 0.745378 0.458309 Sn\n0.127311 0.254621 0.541691 Sn\n0.588999 0.177999 0.165574 Sn\n0.411003 0.822001 0.834425 Sn\n0.839311 0.678621 0.604393 O\n0.160690 0.321380 0.395607 O\n0.160690 0.321380 0.104393 O\n0.839311 0.678621 0.895607 O\n0.044543 0.089086 0.658871 O\n0.500000 0.000000 0.500000 O\n0.955459 0.910914 0.158871 O\n0.044543 0.089086 0.841130 O\n0.500000 0.000000 0.000000 O\n0.252272 0.504544 0.750000 O\n0.955459 0.910914 0.341129 O\n0.747728 0.495455 0.250000 O\n",
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}
]
}