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{
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{
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{
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"created_at": "2022-09-04T14:46:22.176005Z",
"structure_string": "Sr2 Zn22\n1.0\n-5.394764 5.394764 3.451289\n5.394764 -5.394764 3.451289\n5.394764 5.394764 -3.451289\nSr Zn\n2 22\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.750000 0.500000 Sr\n0.066764 0.650701 0.828321 Zn\n0.822380 0.238443 0.171679 Zn\n0.750000 0.250000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.625000 0.375000 0.750000 Zn\n0.625000 0.375000 0.250000 Zn\n0.125000 0.375000 0.750000 Zn\n0.625000 0.875000 0.250000 Zn\n0.822380 0.650701 0.583937 Zn\n0.900701 0.816764 0.328321 Zn\n0.488443 0.572380 0.671679 Zn\n0.066764 0.238443 0.416063 Zn\n0.761557 0.933236 0.583937 Zn\n0.349299 0.177620 0.416063 Zn\n0.427620 0.511557 0.328321 Zn\n0.183236 0.099299 0.671679 Zn\n0.427620 0.099299 0.916063 Zn\n0.349299 0.933236 0.171679 Zn\n0.761557 0.177620 0.828321 Zn\n0.183236 0.511557 0.083937 Zn\n0.488443 0.816764 0.916063 Zn\n0.900701 0.572380 0.083937 Zn\n",
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{
"id": "mp-1113212",
"created_at": "2022-09-04T14:46:22.177494Z",
"structure_string": "Cs2 Ta1 Au1 F6\n1.0\n0.000000 5.220960 5.220960\n5.220960 0.000000 5.220960\n5.220960 5.220960 0.000000\nCs Ta Au F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.000000 0.000000 0.000000 Ta\n0.500000 0.500000 0.500000 Au\n0.815664 0.184336 0.184336 F\n0.184336 0.184336 0.815664 F\n0.184336 0.815664 0.815664 F\n0.184336 0.815664 0.184336 F\n0.815664 0.184336 0.815664 F\n0.815664 0.815664 0.184336 F\n",
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"formula_full": "Cs2 Ta1 Au1 F6",
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"spacegroup": 225
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{
"id": "mp-1227543",
"created_at": "2022-09-04T14:46:22.198636Z",
"structure_string": "Ca4 Nd8 Mn12 O36\n1.0\n5.495710 0.000000 0.000000\n0.000000 7.696556 0.000000\n0.000000 0.000000 16.749557\nCa Nd Mn O\n4 8 12 36\ndirect\n0.008889 0.750000 0.348154 Ca\n0.491111 0.750000 0.848154 Ca\n0.991111 0.250000 0.651846 Ca\n0.508889 0.250000 0.151846 Ca\n0.012256 0.750000 0.682365 Nd\n0.008202 0.750000 0.013910 Nd\n0.487744 0.750000 0.182365 Nd\n0.491798 0.750000 0.513910 Nd\n0.987744 0.250000 0.317635 Nd\n0.991798 0.250000 0.986090 Nd\n0.508202 0.250000 0.486090 Nd\n0.512256 0.250000 0.817635 Nd\n0.498384 0.501466 0.332962 Mn\n0.501616 0.498534 0.667038 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.001616 0.998534 0.832962 Mn\n0.998384 0.001466 0.167038 Mn\n0.498384 0.998534 0.332962 Mn\n0.501616 0.001466 0.667038 Mn\n0.500000 0.000000 0.000000 Mn\n0.998384 0.498534 0.167038 Mn\n0.000000 0.500000 0.500000 Mn\n0.001616 0.501466 0.832962 Mn\n0.290783 0.537459 0.431004 O\n0.288513 0.543974 0.763236 O\n0.282083 0.546241 0.095606 O\n0.211487 0.956026 0.263236 O\n0.217917 0.953759 0.595606 O\n0.209217 0.962541 0.931004 O\n0.711487 0.043974 0.236764 O\n0.709217 0.037459 0.568996 O\n0.717917 0.046241 0.904394 O\n0.782083 0.453759 0.404394 O\n0.788513 0.456026 0.736764 O\n0.790783 0.462541 0.068996 O\n0.711487 0.456026 0.236764 O\n0.709217 0.462541 0.568996 O\n0.717917 0.453759 0.904394 O\n0.782083 0.046241 0.404394 O\n0.788513 0.043974 0.736764 O\n0.790783 0.037459 0.068996 O\n0.290783 0.962541 0.431004 O\n0.288513 0.956026 0.763236 O\n0.282083 0.953759 0.095606 O\n0.211487 0.543974 0.263236 O\n0.217917 0.546241 0.595606 O\n0.209217 0.537459 0.931004 O\n0.921864 0.750000 0.494400 O\n0.916735 0.750000 0.826525 O\n0.916670 0.750000 0.158658 O\n0.583265 0.750000 0.326525 O\n0.583330 0.750000 0.658658 O\n0.578136 0.750000 0.994400 O\n0.083265 0.250000 0.173475 O\n0.078136 0.250000 0.505600 O\n0.083330 0.250000 0.841342 O\n0.416670 0.250000 0.341342 O\n0.416735 0.250000 0.673475 O\n0.421864 0.250000 0.005600 O\n",
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{
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{
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{
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{
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{
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"structure_string": "Lu4 Si4 Rh4\n1.0\n4.184285 0.000000 0.000000\n0.000000 6.755414 0.000000\n0.000000 0.000000 7.378343\nLu Si Rh\n4 4 4\ndirect\n0.250000 0.003545 0.808942 Lu\n0.750000 0.996455 0.191058 Lu\n0.250000 0.503545 0.691058 Lu\n0.750000 0.496455 0.308942 Lu\n0.250000 0.291200 0.106964 Si\n0.750000 0.708800 0.893036 Si\n0.250000 0.791200 0.393036 Si\n0.750000 0.208800 0.606964 Si\n0.750000 0.844516 0.567659 Rh\n0.250000 0.155484 0.432341 Rh\n0.750000 0.344516 0.932341 Rh\n0.250000 0.655484 0.067659 Rh\n",
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}