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{
"id": "jvasp-112860",
"created_at": "2022-09-04T14:38:44.967265Z",
"updated_at": "2022-09-04T14:38:44.967292Z",
"structure_string": "Zn2 Si4 Sn2 O12\n1.0\n6.627786 0.093817 1.602487\n0.173352 6.626183 1.602487\n-0.187077 -0.184846 5.381717\nZn Si Sn O\n2 4 2 12\ndirect\n0.602398 0.397602 0.250001 Zn\n0.397602 0.602397 0.750001 Zn\n0.871317 0.690901 0.776314 Si\n0.309099 0.128683 0.723689 Si\n0.690901 0.871317 0.276313 Si\n0.128683 0.309099 0.223688 Si\n0.786358 0.213641 0.750001 Sn\n0.213641 0.786358 0.250001 Sn\n0.898943 0.390137 0.307905 O\n0.609863 0.101057 0.192097 O\n0.522078 0.699240 0.358545 O\n0.300759 0.477922 0.141456 O\n0.477922 0.300759 0.641457 O\n0.149893 0.187374 0.981352 O\n0.850107 0.812626 0.018651 O\n0.187374 0.149893 0.481351 O\n0.101057 0.609862 0.692097 O\n0.812626 0.850106 0.518651 O\n0.699241 0.522077 0.858546 O\n0.390137 0.898942 0.807905 O\n",
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{
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"structure_string": "Lu1 Ga1 Co1 O4\n1.0\n3.339729 0.008249 7.985831\n1.609290 2.926439 7.985831\n0.013911 0.008249 8.656044\nLu Ga Co O\n1 1 1 4\ndirect\n0.998906 0.998908 0.998905 Lu\n0.213706 0.213707 0.213706 Ga\n0.783551 0.783553 0.783551 Co\n0.705767 0.705768 0.705766 O\n0.290083 0.290083 0.290083 O\n0.878248 0.878249 0.878247 O\n0.136136 0.136136 0.136136 O\n",
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"formula_full": "Lu1 Ga1 Co1 O4",
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{
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"structure_string": "Ba1 Mn1 Al1 Cu1 O5\n1.0\n3.732152 0.000000 0.000000\n0.000000 3.732152 0.000000\n0.000000 0.000000 7.757984\nBa Mn Al Cu O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.002751 Ba\n0.500000 0.500000 0.316852 Mn\n0.000000 0.000000 0.544946 Al\n0.500000 0.500000 0.732067 Cu\n0.500000 0.000000 0.378586 O\n0.000000 0.500000 0.378586 O\n0.500000 0.000000 0.694834 O\n0.000000 0.500000 0.694834 O\n0.500000 0.500000 0.068647 O\n",
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],
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"volume": 108.06063757612803,
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"formula_full": "Ba1 Mn1 Al1 Cu1 O5",
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{
"id": "jvasp-78764",
"created_at": "2022-09-04T14:36:35.256461Z",
"updated_at": "2022-09-04T14:36:35.256485Z",
"structure_string": "Cu2\n1.0\n2.564626 0.000000 -0.000000\n-1.282313 2.221030 0.000000\n-0.000000 -0.000000 4.216043\nCu\n2\ndirect\n0.333336 0.666669 0.250000 Cu\n0.666669 0.333334 0.750000 Cu\n",
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{
"id": "jvasp-68279",
"created_at": "2022-09-04T14:36:06.651753Z",
"updated_at": "2022-09-04T14:36:06.651779Z",
"structure_string": "Be1 V2 Cu1\n1.0\n-1.780743 1.780743 3.786658\n1.780743 -1.780743 3.786658\n1.780743 1.780743 -3.786658\nBe V Cu\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 V\n0.250000 0.749999 0.499999 V\n0.749999 0.250000 0.499999 Cu\n",
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{
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"created_at": "2022-09-04T14:36:15.710223Z",
"updated_at": "2022-09-04T14:36:15.710249Z",
"structure_string": "Li2 V2 Ge2 O10\n1.0\n6.497913 0.073717 0.000000\n0.073717 6.497913 -0.000000\n0.000000 -0.000000 4.550822\nLi V Ge O\n2 2 2 10\ndirect\n0.000000 0.500000 0.000000 Li\n0.500000 0.000000 0.000000 Li\n0.250000 0.250000 0.618033 V\n0.750000 0.750000 0.381967 V\n0.250000 0.750000 0.500000 Ge\n0.750000 0.250000 0.500000 Ge\n0.030375 0.742444 0.268885 O\n0.250000 0.250000 0.260477 O\n0.242445 0.530375 0.731115 O\n0.257556 0.969625 0.731115 O\n0.469625 0.757555 0.268885 O\n0.530375 0.242445 0.731115 O\n0.742444 0.030375 0.268885 O\n0.757555 0.469625 0.268885 O\n0.750000 0.750000 0.739523 O\n0.969625 0.257556 0.731115 O\n",
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{
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"created_at": "2022-09-04T14:38:50.121155Z",
"updated_at": "2022-09-04T14:38:50.121171Z",
"structure_string": "Mn2 S1 O2\n1.0\n3.370770 0.000000 0.000000\n-1.685385 2.919173 0.000000\n-0.000000 0.000000 6.101749\nMn S O\n2 1 2\ndirect\n0.666666 0.333333 0.776874 Mn\n0.333332 0.666665 0.223127 Mn\n0.000000 0.000000 0.500000 S\n0.666666 0.333333 0.137553 O\n0.333332 0.666665 0.862448 O\n",
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"formula_full": "Mn2 S1 O2",
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"spacegroup": 164
},
{
"id": "jvasp-19771",
"created_at": "2022-09-04T14:38:17.475470Z",
"updated_at": "2022-09-04T14:38:17.475490Z",
"structure_string": "Ni4 Ge2\n1.0\n2.016135 -3.492048 0.000000\n2.016135 3.492048 0.000000\n-0.000000 0.000000 5.116958\nNi Ge\n4 2\ndirect\n0.666668 0.333334 0.750000 Ni\n0.333334 0.666668 0.250000 Ni\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.666668 0.333334 0.250000 Ge\n0.333334 0.666668 0.750000 Ge\n",
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},
{
"id": "jvasp-49669",
"created_at": "2022-09-04T14:36:41.546862Z",
"updated_at": "2022-09-04T14:36:41.546884Z",
"structure_string": "Mg4 Ta2 Sb2 O12\n1.0\n0.000000 5.528799 0.000229\n7.855421 0.000000 0.000000\n0.000000 -0.294080 -5.530057\nMg Ta Sb O\n4 2 2 12\ndirect\n0.515027 0.750000 0.467403 Mg\n0.484973 0.250000 0.532597 Mg\n0.981114 0.750000 0.968750 Mg\n0.018887 0.250000 0.031251 Mg\n0.500000 0.500000 -0.000000 Ta\n0.500000 0.000000 -0.000000 Ta\n0.000000 0.500000 0.500000 Sb\n0.000000 0.000000 0.500000 Sb\n0.366976 0.570139 0.679127 O\n0.630204 0.750000 0.087006 O\n0.633024 0.070139 0.320873 O\n0.142645 0.250000 0.385236 O\n0.191963 0.928392 0.140958 O\n0.808037 0.071608 0.859043 O\n0.191963 0.571608 0.140958 O\n0.366976 0.929861 0.679127 O\n0.857355 0.750000 0.614764 O\n0.633024 0.429861 0.320873 O\n0.808037 0.428392 0.859043 O\n0.369796 0.250000 0.912994 O\n",
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{
"id": "jvasp-20928",
"created_at": "2022-09-04T14:38:05.178721Z",
"updated_at": "2022-09-04T14:38:05.178736Z",
"structure_string": "Sm4 P4 O16\n1.0\n0.000000 6.393439 0.018779\n6.917508 0.000000 0.000000\n0.000000 -4.760187 -6.530681\nSm P O\n4 4 16\ndirect\n0.183376 0.655223 0.781178 Sm\n0.816623 0.155223 0.718822 Sm\n0.816623 0.344777 0.218822 Sm\n0.183376 0.844777 0.281178 Sm\n0.688401 0.661245 0.801904 P\n0.311598 0.161245 0.698095 P\n0.311598 0.338755 0.198095 P\n0.688401 0.838755 0.301904 P\n0.119641 0.164793 0.117145 O\n0.880359 0.664793 0.382855 O\n0.812500 0.502958 0.750252 O\n0.187499 0.002958 0.749748 O\n0.187500 0.497042 0.249748 O\n0.812500 0.997042 0.250252 O\n0.659393 0.897584 0.472324 O\n0.407727 0.789804 0.120753 O\n0.340607 0.102417 0.527676 O\n0.659392 0.602417 0.972324 O\n0.119641 0.335207 0.617145 O\n0.592273 0.289804 0.379247 O\n0.592273 0.210196 0.879247 O\n0.407727 0.710197 0.620752 O\n0.340607 0.397584 0.027676 O\n0.880359 0.835207 0.882855 O\n",
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{
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"structure_string": "Be1 Fe1 Ru2\n1.0\n-1.745755 1.745755 3.940354\n1.745755 -1.745755 3.940354\n1.745755 1.745755 -3.940354\nBe Fe Ru\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Be\n0.750001 0.250000 0.500001 Fe\n0.000000 0.000000 0.000000 Ru\n0.250000 0.750001 0.500001 Ru\n",
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"structure_string": "Tm6 Fe6 O18\n1.0\n6.055850 -0.000000 0.000000\n-3.027925 5.244521 -0.000000\n-0.000000 -0.000000 11.343713\nTm Fe O\n6 6 18\ndirect\n0.666667 0.333333 0.730849 Tm\n0.666667 0.333333 0.230849 Tm\n0.000000 0.000000 0.278484 Tm\n0.333332 0.666667 0.230849 Tm\n0.000000 0.000000 0.778484 Tm\n0.333332 0.666667 0.730849 Tm\n0.333724 0.333724 0.501130 Fe\n0.666275 0.666276 0.001130 Fe\n0.666276 0.000000 0.501130 Fe\n-0.000000 0.333724 0.001130 Fe\n0.333724 0.000000 0.001130 Fe\n-0.000001 0.666276 0.501130 Fe\n0.638147 0.000000 0.337217 O\n0.695989 0.695990 0.165805 O\n0.695990 0.000000 0.665804 O\n-0.000000 0.304010 0.165805 O\n-0.000001 0.638147 0.337217 O\n0.361852 0.361852 0.337217 O\n0.638147 0.638147 0.837216 O\n0.304010 0.000000 0.165805 O\n0.666667 0.333333 0.021719 O\n0.361853 0.000000 0.837216 O\n0.000000 0.000000 0.477825 O\n0.666667 0.333333 0.521719 O\n-0.000001 0.695990 0.665804 O\n0.000000 0.000000 0.977824 O\n0.304010 0.304010 0.665804 O\n-0.000000 0.361852 0.837216 O\n0.333332 0.666667 0.521719 O\n0.333332 0.666667 0.021719 O\n",
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}
]
}