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{
"id": "jvasp-68552",
"created_at": "2022-09-04T14:36:06.215243Z",
"updated_at": "2022-09-04T14:36:06.215270Z",
"structure_string": "Be2 Ga1 Ir1\n1.0\n2.984398 0.000000 0.000000\n0.000000 2.984398 0.000000\n0.000000 0.000000 5.201526\nBe Ga Ir\n2 1 1\ndirect\n0.000000 0.000000 0.725762 Be\n0.000000 0.000000 0.274239 Be\n0.500000 0.500000 0.000000 Ga\n0.500000 0.500000 0.500000 Ir\n",
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{
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"structure_string": "Li2 Mn4 F12\n1.0\n0.000000 4.688134 0.057197\n4.687851 0.000000 0.000000\n0.000000 -4.528334 -9.541157\nLi Mn F\n2 4 12\ndirect\n0.000000 0.000000 0.000000 Li\n0.000001 0.500000 0.500000 Li\n0.333574 0.500508 0.834284 Mn\n0.666426 0.000508 0.665716 Mn\n0.333574 0.999492 0.334284 Mn\n0.666426 0.499492 0.165716 Mn\n0.374760 0.202280 0.172069 F\n0.031924 0.297349 0.329494 F\n0.625240 0.702280 0.327931 F\n0.300855 0.801446 0.499446 F\n0.699145 0.198554 0.500554 F\n0.625240 0.797720 0.827931 F\n0.968076 0.702651 0.670506 F\n0.968076 0.797349 0.170505 F\n0.031924 0.202651 0.829495 F\n0.300856 0.698554 0.999446 F\n0.374760 0.297720 0.672069 F\n0.699144 0.301446 0.000554 F\n",
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{
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"created_at": "2022-09-04T14:37:59.166811Z",
"updated_at": "2022-09-04T14:37:59.166836Z",
"structure_string": "Tb2 H2 O4\n1.0\n4.486134 0.000000 0.000000\n0.000000 3.624587 -0.627680\n0.000000 0.958351 5.532251\nTb H O\n2 2 4\ndirect\n0.250000 0.250001 0.186950 Tb\n0.749999 0.749999 0.813050 Tb\n0.250000 0.750001 0.600519 H\n0.749999 0.249999 0.399481 H\n0.250000 0.750007 0.920898 O\n0.749999 0.249994 0.079101 O\n0.250000 0.749993 0.424343 O\n0.749999 0.250007 0.575657 O\n",
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"formula_full": "Tb2 H2 O4",
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"spacegroup": 59
},
{
"id": "jvasp-119036",
"created_at": "2022-09-04T14:38:50.040421Z",
"updated_at": "2022-09-04T14:38:50.040448Z",
"structure_string": "Tb6 Mn2 B14\n1.0\n8.084872 0.003709 0.000000\n-7.345936 3.376745 0.000000\n0.000000 0.000000 9.323465\nTb Mn B\n6 2 14\ndirect\n0.896034 0.103966 0.439121 Tb\n0.103964 0.896033 0.560879 Tb\n0.896034 0.103966 0.060879 Tb\n0.103964 0.896033 0.939122 Tb\n0.240908 0.759090 0.250000 Tb\n0.759090 0.240909 0.750000 Tb\n0.054257 0.945741 0.250000 Mn\n0.945742 0.054258 0.750000 Mn\n0.477793 0.522206 0.599053 B\n0.522206 0.477793 0.400947 B\n0.477793 0.522206 0.900947 B\n0.522206 0.477793 0.099053 B\n0.370028 0.629970 0.653043 B\n0.629970 0.370029 0.346958 B\n0.727151 0.272848 0.032744 B\n0.629970 0.370029 0.153044 B\n0.272847 0.727151 0.967257 B\n0.461280 0.538719 0.250000 B\n0.272847 0.727151 0.532744 B\n0.727151 0.272848 0.467256 B\n0.370028 0.629970 0.846958 B\n0.538719 0.461280 0.750000 B\n",
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{
"id": "jvasp-12642",
"created_at": "2022-09-04T14:37:18.217256Z",
"updated_at": "2022-09-04T14:37:18.217277Z",
"structure_string": "Ti2 Fe4 O10\n1.0\n3.737071 0.000000 0.000000\n-1.868535 4.928270 -0.000000\n0.000000 0.000000 10.060593\nTi Fe O\n2 4 10\ndirect\n0.181625 0.363249 0.750000 Ti\n0.818374 0.636751 0.250000 Ti\n0.138845 0.277689 0.438067 Fe\n0.861154 0.722311 0.561934 Fe\n0.861154 0.722311 0.938066 Fe\n0.138845 0.277689 0.061934 Fe\n0.310166 0.620333 0.578378 O\n0.689832 0.379667 0.421623 O\n0.689832 0.379667 0.078378 O\n0.310166 0.620333 0.921621 O\n0.047388 0.094776 0.619327 O\n0.952610 0.905224 0.380671 O\n0.746633 0.493268 0.750000 O\n0.253366 0.506732 0.250000 O\n0.952610 0.905224 0.119329 O\n0.047388 0.094776 0.880672 O\n",
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{
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"created_at": "2022-09-04T14:35:55.811889Z",
"updated_at": "2022-09-04T14:35:55.811911Z",
"structure_string": "Al1 V1 Fe2\n1.0\n3.491068 -0.000000 2.015569\n1.163689 3.291410 2.015569\n0.000000 -0.000000 4.031138\nAl V Fe\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 V\n0.250000 0.250000 0.250000 Fe\n0.750001 0.750000 0.750000 Fe\n",
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{
"id": "jvasp-64972",
"created_at": "2022-09-04T14:35:41.996848Z",
"updated_at": "2022-09-04T14:35:41.996866Z",
"structure_string": "Be1 Ni4 Os1\n1.0\n-0.000000 3.262916 3.262916\n3.262916 0.000000 3.262916\n3.262916 3.262916 0.000000\nBe Ni Os\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.124094 0.625303 0.625303 Ni\n0.625303 0.625303 0.625303 Ni\n0.625303 0.124094 0.625303 Ni\n0.625303 0.625303 0.124094 Ni\n0.250000 0.250000 0.250000 Os\n",
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"spacegroup": 216
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{
"id": "jvasp-52408",
"created_at": "2022-09-04T14:35:42.512729Z",
"updated_at": "2022-09-04T14:35:42.512745Z",
"structure_string": "Na1 Cu2 H2 Se2 O10\n1.0\n4.091156 3.155767 -2.355377\n-4.091156 3.155767 2.355377\n-0.314299 0.000000 7.804134\nNa Cu H Se O\n1 2 2 2 10\ndirect\n0.500000 0.500000 0.500000 Na\n-0.000000 0.500000 0.000000 Cu\n0.500000 -0.000000 -0.000000 Cu\n0.291997 0.708004 0.801196 H\n0.708004 0.291997 0.198804 H\n0.912795 0.087206 0.690358 Se\n0.087206 0.912795 0.309641 Se\n0.183201 0.255019 0.256899 O\n0.744982 0.816800 0.256899 O\n0.816800 0.744982 0.743100 O\n0.255019 0.183201 0.743100 O\n0.180223 0.819778 0.178635 O\n0.765757 0.234244 0.448227 O\n0.329821 0.670180 0.947751 O\n0.819778 0.180223 0.821365 O\n0.234243 0.765757 0.551773 O\n0.670180 0.329821 0.052248 O\n",
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"formula_full": "Na1 Cu2 H2 Se2 O10",
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{
"id": "jvasp-21638",
"created_at": "2022-09-04T14:38:28.865975Z",
"updated_at": "2022-09-04T14:38:28.865994Z",
"structure_string": "Mg2 Co12 P7\n1.0\n4.495139 -7.785808 -0.000000\n4.495139 7.785808 -0.000000\n0.000000 0.000000 3.473781\nMg Co P\n2 12 7\ndirect\n0.333333 0.666667 0.000000 Mg\n0.666667 0.333333 0.500000 Mg\n0.557286 0.939270 0.500000 Co\n0.443024 0.066398 0.000000 Co\n0.623374 0.556976 0.000000 Co\n0.153327 0.273748 0.000000 Co\n0.120421 0.846673 0.000000 Co\n0.933602 0.376626 0.000000 Co\n0.894406 0.135188 0.500000 Co\n0.864812 0.759217 0.500000 Co\n0.240783 0.105595 0.500000 Co\n0.060730 0.618016 0.500000 Co\n0.381984 0.442714 0.500000 Co\n0.726252 0.879580 0.000000 Co\n0.407280 0.290767 0.000000 P\n0.593763 0.708039 0.500000 P\n0.291961 0.885724 0.500000 P\n0.114276 0.406237 0.500000 P\n0.709233 0.116513 0.000000 P\n0.883487 0.592720 0.000000 P\n0.000000 0.000000 0.000000 P\n",
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{
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"created_at": "2022-09-04T14:38:46.352358Z",
"updated_at": "2022-09-04T14:38:46.352370Z",
"structure_string": "Ho4 Fe2 Mo2 O14\n1.0\n6.209332 0.015311 3.525738\n2.130454 5.822419 3.545130\n0.130453 0.061667 7.150738\nHo Fe Mo O\n4 2 2 14\ndirect\n0.500000 -0.000000 0.000000 Ho\n-0.000000 0.000000 0.500000 Ho\n-0.000000 0.500000 0.000000 Ho\n0.499999 0.500000 0.500001 Ho\n0.500000 0.000000 0.500000 Fe\n-0.000001 0.500000 0.500000 Fe\n0.500000 0.500000 0.000000 Mo\n0.000000 0.000000 0.000000 Mo\n0.173257 0.617855 0.178273 O\n0.823607 0.825828 0.384842 O\n0.384451 0.827452 0.820552 O\n0.826741 0.382146 0.821728 O\n0.608537 0.606919 0.119717 O\n0.117367 0.602563 0.605933 O\n0.394804 0.881142 0.393411 O\n0.391462 0.393082 0.880284 O\n0.882631 0.397437 0.394068 O\n0.615548 0.172549 0.179449 O\n0.886258 0.884533 0.888190 O\n0.113740 0.115468 0.111811 O\n0.605194 0.118858 0.606590 O\n0.176391 0.174172 0.615159 O\n",
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{
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"structure_string": "Na1 Li5 N2\n1.0\n3.710257 -0.000000 0.000000\n0.000000 3.806603 0.205657\n-0.000000 -0.010268 6.557816\nNa Li N\n1 5 2\ndirect\n0.500000 0.212333 0.887900 Na\n-0.000000 0.951786 0.644593 Li\n-0.000000 0.586460 0.013189 Li\n0.500000 0.024764 0.253294 Li\n0.500000 0.499790 0.547007 Li\n-0.000000 0.496011 0.352589 Li\n0.500000 0.535350 0.207908 N\n-0.000000 0.449501 0.675528 N\n",
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{
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"updated_at": "2022-09-04T14:38:48.022870Z",
"structure_string": "Si4 W2 O12\n1.0\n6.365150 0.281966 1.595605\n0.286967 6.364926 1.595605\n-0.028356 -0.028333 5.140802\nSi W O\n4 2 12\ndirect\n0.784097 0.590532 0.775901 Si\n0.409469 0.215904 0.724096 Si\n0.590531 0.784098 0.275901 Si\n0.215903 0.409469 0.224096 Si\n0.930031 0.069969 0.749999 W\n0.069969 0.930032 0.249999 W\n0.042741 0.226832 0.334846 O\n0.773169 0.957260 0.165151 O\n0.353625 0.894654 0.325294 O\n0.105347 0.646376 0.174704 O\n0.646375 0.105348 0.674704 O\n0.354538 0.374251 0.453813 O\n0.625750 0.645462 0.046185 O\n0.957259 0.773170 0.665151 O\n0.374250 0.354539 0.953813 O\n0.645462 0.625751 0.546185 O\n0.894653 0.353626 0.825293 O\n0.226831 0.042742 0.834846 O\n",
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]
}