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{
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"id": "jvasp-112064",
"created_at": "2022-09-04T14:38:43.588422Z",
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"structure_string": "Al1 H16 C10 Cl1 O4\n1.0\n4.496240 -0.200018 -1.138609\n-2.550008 6.994079 -1.400807\n-0.263689 0.476400 9.790473\nAl H C Cl O\n1 16 10 1 4\ndirect\n0.196207 0.312812 0.902877 Al\n0.406441 0.728737 0.533225 H\n0.794590 0.499479 0.443904 H\n0.448214 0.403007 0.494956 H\n0.721191 0.653748 0.732193 H\n0.084099 0.729585 0.687969 H\n0.573598 0.192320 0.263573 H\n0.795984 0.054451 0.226325 H\n0.351664 0.626502 0.351268 H\n0.922437 0.178277 0.491910 H\n-0.005698 0.921982 0.570000 H\n0.917271 0.835181 0.383158 H\n0.395950 0.830372 0.976419 H\n0.980363 0.737384 0.960546 H\n0.296935 0.752510 0.199095 H\n0.085117 -0.093308 0.206633 H\n0.521674 0.050854 0.479556 H\n0.209304 0.861777 0.012128 C\n0.288080 0.889050 0.177600 C\n0.804627 0.873129 0.462056 C\n0.710434 0.046368 0.432107 C\n0.602381 0.054493 0.270907 C\n0.655168 0.534957 0.510365 C\n0.533247 0.690455 0.460734 C\n0.971038 0.467052 0.745686 C\n0.162403 0.027458 0.956904 C\n0.863575 0.606928 0.673360 C\n0.572502 0.520795 0.088307 Cl\n0.835723 0.381496 0.831184 O\n0.021363 0.127368 0.007777 O\n0.274492 0.088297 0.855991 O\n0.224366 0.433918 0.740947 O\n",
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{
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{
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"updated_at": "2022-09-04T14:35:52.279855Z",
"structure_string": "Ca4 Al2 H22 C1 O20\n1.0\n5.706138 0.013519 0.748200\n0.857457 7.597689 3.467082\n0.061282 -0.088358 9.700647\nCa Al H C O\n4 2 22 1 20\ndirect\n0.523471 0.117126 0.802988 Ca\n0.481223 0.883980 0.196058 Ca\n0.016522 0.619706 0.310569 Ca\n0.978684 0.378706 0.698460 Ca\n0.003949 0.997270 0.000696 Al\n0.495803 0.502730 0.504932 Al\n0.234570 0.997434 0.476865 H\n0.969964 0.973790 0.537771 H\n0.219584 0.502545 0.037017 H\n0.856936 0.526281 0.930998 H\n0.062202 0.632308 0.820861 H\n0.557210 0.140475 0.318995 H\n0.287388 0.213274 0.271915 H\n0.447797 0.863608 0.677218 H\n0.701750 0.784794 0.735292 H\n0.465601 0.482848 0.777063 H\n0.487677 0.506568 0.994526 H\n0.032005 0.011895 0.731286 H\n0.520647 0.512002 0.235197 H\n0.826829 0.735243 0.007110 H\n0.324418 0.774425 0.965523 H\n0.685149 0.217824 0.042138 H\n0.187649 0.257768 0.997193 H\n0.657825 0.771619 0.499202 H\n0.817091 0.288800 0.456942 H\n0.168544 0.722131 0.542015 H\n0.979296 0.001555 0.259447 H\n0.341435 0.237755 0.501986 H\n0.879638 0.323945 0.202206 C\n0.739956 0.407023 0.093889 O\n0.430565 0.571390 0.296795 O\n0.131176 0.929851 0.568200 O\n0.336158 0.560252 0.949551 O\n0.903870 0.602343 0.821632 O\n0.396450 0.104062 0.320554 O\n0.605775 0.894986 0.674319 O\n0.563158 0.431832 0.711368 O\n0.936184 0.065856 0.795615 O\n0.692067 0.111737 0.022232 O\n0.185322 0.610114 0.529947 O\n0.806002 0.390762 0.483307 O\n0.644255 0.717343 0.429330 O\n0.348863 0.287732 0.575669 O\n0.315231 0.887411 0.975031 O\n0.853115 0.784538 0.077833 O\n0.154567 0.211028 0.926160 O\n0.079149 0.383700 0.195912 O\n0.067250 0.929713 0.207185 O\n0.821989 0.184826 0.315963 O\n",
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{
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"created_at": "2022-09-04T14:36:53.709061Z",
"updated_at": "2022-09-04T14:36:53.709097Z",
"structure_string": "Ca1 Al2 Zn2\n1.0\n3.917989 0.000000 -1.306187\n-0.435460 3.893714 -1.306187\n-0.044081 -0.049286 6.396993\nCa Al Zn\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.750000 0.249999 0.499999 Al\n0.250000 0.749999 0.499999 Al\n0.391288 0.391287 0.782576 Zn\n0.608712 0.608711 0.217422 Zn\n",
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{
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"created_at": "2022-09-04T14:36:30.796514Z",
"updated_at": "2022-09-04T14:36:30.796550Z",
"structure_string": "Ca1 Yb1 Al4\n1.0\n4.894865 0.000000 2.826051\n1.631621 4.614924 2.826051\n0.000000 0.000000 5.652104\nYb Ca Al\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Yb\n0.250000 0.250000 0.250000 Ca\n0.625149 0.625150 0.124551 Al\n0.625149 0.124551 0.625150 Al\n0.124551 0.625150 0.625150 Al\n0.625149 0.625150 0.625150 Al\n",
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},
{
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"created_at": "2022-09-04T14:36:55.523982Z",
"updated_at": "2022-09-04T14:36:55.524003Z",
"structure_string": "Sr1 Ca1 Al4\n1.0\n4.999904 -0.000000 2.886696\n1.666635 4.713955 2.886696\n0.000000 -0.000000 5.773392\nSr Ca Al\n1 1 4\ndirect\n0.499999 0.499999 0.500001 Sr\n0.749999 0.749999 0.750002 Ca\n0.625603 0.124799 0.124800 Al\n0.124799 0.625603 0.124800 Al\n0.124799 0.124799 0.625604 Al\n0.124799 0.124799 0.124799 Al\n",
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{
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"created_at": "2022-09-04T14:36:51.888868Z",
"updated_at": "2022-09-04T14:36:51.888888Z",
"structure_string": "Ca1 Al2 Sn2\n1.0\n4.504273 0.000000 0.000000\n-2.252136 3.900815 0.000000\n-0.000000 -0.000000 7.522788\nCa Al Sn\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666666 0.333333 0.369969 Al\n0.333332 0.666666 0.630031 Al\n0.666666 0.333333 0.749319 Sn\n0.333332 0.666666 0.250681 Sn\n",
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{
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"created_at": "2022-09-04T14:36:53.586065Z",
"updated_at": "2022-09-04T14:36:53.586082Z",
"structure_string": "Ca1 Al2 Si2\n1.0\n2.085112 -3.611520 0.000000\n2.085112 3.611520 -0.000000\n-0.000000 0.000000 7.083326\nCa Al Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333332 0.666666 0.368119 Al\n0.666666 0.333332 0.631882 Al\n0.333332 0.666666 0.737730 Si\n0.666666 0.333332 0.262270 Si\n",
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{
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"structure_string": "Ca1 Al1 Si1\n1.0\n2.107818 -3.650850 0.000000\n2.107818 3.650850 0.000000\n0.000000 -0.000000 4.364885\nCa Al Si\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666667 0.333333 0.499999 Al\n0.333333 0.666667 0.499999 Si\n",
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{
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{
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]
}