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"id": "jvasp-43014",
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"structure_string": "Li2 V4 Fe2 O12\n1.0\n6.683365 -0.281291 -0.125774\n-0.965006 6.619310 0.125774\n-1.520766 1.372082 5.127955\nLi V Fe O\n2 4 2 12\ndirect\n0.260289 0.260290 0.250000 Li\n0.739709 0.739710 0.750001 Li\n0.196333 0.614501 0.783426 V\n0.385498 0.803666 0.283426 V\n0.614501 0.196333 0.716575 V\n0.803665 0.385498 0.216575 V\n0.084967 0.084967 0.750001 Fe\n0.915032 0.915033 0.250000 Fe\n0.811965 0.013506 0.854194 O\n0.585246 0.293032 0.366988 O\n0.640161 0.894124 0.275078 O\n0.706967 0.414753 0.866988 O\n0.293031 0.585247 0.133013 O\n0.105875 0.359838 0.775079 O\n0.414752 0.706968 0.633013 O\n0.188033 0.986493 0.145807 O\n0.894123 0.640162 0.224922 O\n0.013506 0.811966 0.645808 O\n0.359838 0.105875 0.724923 O\n0.986493 0.188034 0.354193 O\n",
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{
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{
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"created_at": "2022-09-04T14:38:03.078272Z",
"updated_at": "2022-09-04T14:38:03.078304Z",
"structure_string": "Ta4 H4 O12\n1.0\n7.487077 -0.142865 0.202041\n3.619814 6.555430 0.202041\n3.867262 2.232765 6.315214\nTa H O\n4 4 12\ndirect\n-0.000000 0.500000 -0.000000 Ta\n0.500000 0.000000 -0.000000 Ta\n0.000000 0.000000 0.000000 Ta\n0.000000 -0.000000 0.500000 Ta\n0.177276 0.177275 0.572724 H\n0.822724 0.822725 0.427275 H\n0.427275 0.427275 0.822724 H\n0.572724 0.572725 0.177275 H\n0.050527 0.699473 0.050527 O\n0.050527 0.699472 0.699472 O\n0.699473 0.050528 0.050527 O\n0.331780 0.331780 0.918219 O\n0.699473 0.050528 0.699472 O\n0.668220 0.668220 0.081780 O\n0.300527 0.949472 0.949472 O\n0.949473 0.300528 0.300527 O\n0.949473 0.300528 0.949472 O\n0.918219 0.918220 0.331780 O\n0.081780 0.081780 0.668219 O\n0.300527 0.949473 0.300527 O\n",
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{
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"updated_at": "2022-09-04T14:38:09.652108Z",
"structure_string": "Zn2 Mo4 O8\n1.0\n5.888608 -0.881234 0.011992\n2.181133 5.540301 0.011992\n2.699704 1.558675 4.408599\nZn Mo O\n2 4 8\ndirect\n0.124999 0.625000 0.625000 Zn\n0.624999 0.125001 0.625000 Zn\n0.103241 0.103241 -0.103241 Mo\n0.146759 0.146760 0.353241 Mo\n0.625000 0.625001 0.125000 Mo\n0.624999 0.625001 0.625000 Mo\n0.346984 0.346985 0.406925 O\n0.412637 0.851889 0.367736 O\n0.346984 0.346985 0.899105 O\n0.851888 0.412639 0.367736 O\n0.398110 0.837363 0.882263 O\n0.837361 0.398113 0.882263 O\n0.903015 0.903016 0.350894 O\n0.903015 0.903017 0.843074 O\n",
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"structure_string": "K2 Ca1 N4 O8\n1.0\n5.322777 -0.465990 0.116324\n2.256520 4.843265 0.116324\n-0.011054 -0.006384 9.106635\nK Ca N O\n2 1 4 8\ndirect\n0.655518 0.655517 0.367722 K\n0.344483 0.344483 0.632277 K\n0.000000 0.000000 0.000000 Ca\n0.558069 0.558068 0.044403 N\n0.301292 0.301291 0.282284 N\n0.698710 0.698709 0.717715 N\n0.441933 0.441932 0.955596 N\n0.427140 0.797899 0.089749 O\n0.797900 0.427139 0.089749 O\n0.572862 0.202101 0.910250 O\n0.532411 0.182851 0.334703 O\n0.817150 0.467589 0.665295 O\n0.182851 0.532411 0.334703 O\n0.202101 0.572861 0.910250 O\n0.467590 0.817149 0.665295 O\n",
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{
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"created_at": "2022-09-04T14:35:48.782070Z",
"updated_at": "2022-09-04T14:35:48.782090Z",
"structure_string": "Lu2 Ni2 B2 C2\n1.0\n3.502178 -0.000000 -0.000000\n0.000000 3.502178 -0.000000\n0.000000 0.000000 7.527501\nLu Ni B C\n2 2 2 2\ndirect\n0.500000 0.000000 0.838886 Lu\n0.000000 0.500000 0.161113 Lu\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.500000 0.652430 B\n0.500000 0.000000 0.347570 B\n0.500000 0.000000 0.150699 C\n0.000000 0.500000 0.849301 C\n",
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{
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"created_at": "2022-09-04T14:38:52.427386Z",
"updated_at": "2022-09-04T14:38:52.427406Z",
"structure_string": "Li1 Hf2 O3\n1.0\n3.192942 0.000000 0.000000\n-1.596471 2.765169 0.000000\n-0.000000 0.000000 7.492979\nLi Hf O\n1 2 3\ndirect\n0.000000 0.000000 0.500000 Li\n0.666667 0.333334 0.163800 Hf\n0.333334 0.666668 0.836200 Hf\n0.666667 0.333334 0.671678 O\n0.000000 0.000000 0.000000 O\n0.333334 0.666668 0.328322 O\n",
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{
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"structure_string": "Ti2 Mn1 Sn1\n1.0\n3.160014 3.160014 -0.000000\n3.160014 -0.000000 -3.160014\n0.000000 3.160014 -3.160014\nTi Mn Sn\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.749999 0.749999 0.749999 Ti\n0.499999 0.499999 0.499999 Mn\n0.250000 0.250000 0.250000 Sn\n",
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{
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"structure_string": "Ce1 Co2 Si2\n1.0\n3.701960 -0.000000 -1.386653\n-0.519402 3.665341 -1.386653\n-0.003664 -0.004220 5.625122\nCe Co Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.250001 0.750000 0.500000 Co\n0.750001 0.250000 0.500000 Co\n0.630280 0.630279 0.260557 Si\n0.369722 0.369721 0.739443 Si\n",
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"structure_string": "Li2 Fe5 O10\n1.0\n4.948109 -0.083365 -0.108416\n0.890898 4.813962 -0.011812\n2.278010 1.893578 6.763661\nLi Fe O\n2 5 10\ndirect\n0.503812 0.759005 0.427839 Li\n0.496189 0.240994 0.572161 Li\n0.000557 0.894113 0.685351 Fe\n0.500000 -0.000000 -0.000000 Fe\n0.993018 0.312692 0.892809 Fe\n0.006983 0.687307 0.107191 Fe\n-0.000557 0.105887 0.314649 Fe\n0.217878 0.338433 0.063244 O\n0.761694 0.213702 0.764397 O\n0.792948 0.453540 0.324726 O\n0.207053 0.546460 0.675273 O\n0.767457 0.893575 0.531177 O\n0.782123 0.661567 0.936756 O\n0.232544 0.106424 0.468823 O\n0.212155 0.957893 0.860909 O\n0.238307 0.786297 0.235602 O\n0.787846 0.042107 0.139090 O\n",
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{
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}