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"structure_string": "Sc1 Be1 Cr1\n1.0\n1.451813 -2.514613 -0.000000\n1.451813 2.514613 0.000000\n-0.000000 -0.000000 5.952037\nSc Be Cr\n1 1 1\ndirect\n0.333332 0.666666 0.664995 Sc\n0.000000 0.000000 0.030834 Be\n0.666666 0.333332 0.304171 Cr\n",
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{
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"structure_string": "Ba6 P12\n1.0\n12.226817 0.000000 0.000000\n-0.000000 5.159178 3.843983\n0.000000 0.002049 7.775897\nBa P\n6 12\ndirect\n0.838886 0.227336 0.667182 Ba\n0.338886 0.772665 0.832818 Ba\n0.161114 0.772665 0.332818 Ba\n0.661115 0.227336 0.167181 Ba\n0.500000 0.500000 0.500000 Ba\n0.000000 0.500000 -0.000000 Ba\n0.203888 0.323427 0.846492 P\n0.703888 0.676574 0.653508 P\n0.625975 0.819132 0.034899 P\n0.125975 0.180869 0.465100 P\n0.374025 0.180869 0.965100 P\n0.393482 0.065249 0.303915 P\n0.893482 0.934752 0.196085 P\n0.296112 0.323427 0.346492 P\n0.106518 0.065249 0.803915 P\n0.606518 0.934752 0.696085 P\n0.874025 0.819132 0.534900 P\n0.796112 0.676574 0.153508 P\n",
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{
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"updated_at": "2022-09-04T14:38:37.409693Z",
"structure_string": "Y1 Br2 O1\n1.0\n-2.107694 2.095390 6.146647\n2.107694 -2.095390 6.146647\n2.107694 2.095390 -6.146647\nY Br O\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.660884 0.160883 0.500001 Br\n0.339118 0.839116 0.499998 Br\n0.000000 0.499998 0.499998 O\n",
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{
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"created_at": "2022-09-04T14:38:45.753248Z",
"updated_at": "2022-09-04T14:38:45.753271Z",
"structure_string": "Na6 Dy2 Br12\n1.0\n7.690819 0.000000 0.000000\n-0.000000 5.899496 3.937981\n0.000000 -0.165637 12.743732\nNa Dy Br\n6 2 12\ndirect\n0.500000 0.500000 -0.000000 Na\n0.000000 0.500000 0.500000 Na\n0.096943 0.705092 0.755990 Na\n0.903057 0.294908 0.244010 Na\n0.596943 0.294907 0.744010 Na\n0.403057 0.705093 0.255990 Na\n0.500000 -0.000000 0.500000 Dy\n0.000000 0.000000 0.000000 Dy\n0.678080 0.394114 0.428497 Br\n0.321920 0.605886 0.571503 Br\n0.057311 0.908208 0.241910 Br\n0.942689 0.091792 0.758090 Br\n0.557311 0.091792 0.258090 Br\n0.187910 0.241615 0.423060 Br\n0.687910 0.758385 0.076940 Br\n0.312090 0.241615 0.923060 Br\n0.821920 0.394114 0.928497 Br\n0.812090 0.758385 0.576940 Br\n0.442689 0.908208 0.741910 Br\n0.178080 0.605886 0.071503 Br\n",
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{
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"created_at": "2022-09-04T14:38:10.144236Z",
"updated_at": "2022-09-04T14:38:10.144263Z",
"structure_string": "Li7 Cr5 O12\n1.0\n2.490447 -4.314511 -0.014017\n2.490113 4.313388 0.007008\n-0.812980 1.408426 9.561400\nLi Cr O\n7 5 12\ndirect\n0.994277 0.499906 0.010573 Li\n0.345965 0.174940 0.010419 Li\n0.153942 0.824889 0.489567 Li\n0.505628 0.499906 0.489426 Li\n0.828976 0.174941 0.489580 Li\n0.670947 0.824889 0.010433 Li\n0.749934 0.499868 0.250000 Li\n0.416582 0.833168 0.250000 Cr\n0.583112 0.166226 0.750000 Cr\n0.917050 0.834101 0.750000 Cr\n0.083308 0.166619 0.250000 Cr\n0.250081 0.500163 0.750000 Cr\n0.548681 0.836754 0.636054 O\n0.212089 0.163577 0.636053 O\n0.432860 0.145036 0.363698 O\n0.142956 0.499900 0.364076 O\n0.712175 0.145036 0.136301 O\n0.951486 0.163577 0.863946 O\n0.356943 0.499901 0.135924 O\n0.624587 0.500161 0.865966 O\n0.067041 0.854766 0.136301 O\n0.288072 0.836754 0.863946 O\n0.875574 0.500161 0.634033 O\n0.787725 0.854766 0.363699 O\n",
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{
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"created_at": "2022-09-04T14:38:52.514283Z",
"updated_at": "2022-09-04T14:38:52.514309Z",
"structure_string": "Li4 Mn8 O12 F4\n1.0\n5.755915 -0.019910 -0.000069\n0.019749 6.058969 -0.000005\n0.000104 0.000006 8.648422\nLi Mn O F\n4 8 12 4\ndirect\n0.969146 -0.000031 0.024198 Li\n0.469146 -0.000031 0.225802 Li\n0.530855 0.500032 0.524198 Li\n0.030854 0.500032 0.725802 Li\n0.500000 0.750001 0.875001 Mn\n0.500000 0.250000 0.875000 Mn\n0.251430 0.000021 0.615482 Mn\n0.748570 0.499980 0.134518 Mn\n0.000000 0.250000 0.375000 Mn\n0.248569 0.499980 0.115483 Mn\n0.751431 0.000021 0.634517 Mn\n0.000000 0.750000 0.375000 Mn\n0.998516 0.214104 0.599649 O\n0.998450 0.785933 0.599647 O\n0.498450 0.785933 0.650353 O\n0.498515 0.214105 0.650351 O\n0.001485 0.285896 0.150352 O\n0.501551 0.714068 0.099647 O\n0.200525 0.000037 0.364506 O\n0.501485 0.285896 0.099649 O\n0.700525 0.000038 0.885493 O\n0.299474 0.499964 0.864506 O\n0.799474 0.499963 0.385494 O\n0.001550 0.714068 0.150354 O\n0.214754 -0.000055 0.881667 F\n0.714754 -0.000056 0.368332 F\n0.285246 0.500056 0.381668 F\n0.785246 0.500057 0.868332 F\n",
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"structure_string": "Zr1 Cu1 F6\n1.0\n5.180784 -0.044312 -0.018617\n0.044527 5.591658 -0.350599\n-2.595291 -2.945308 4.000896\nZr Cu F\n1 1 6\ndirect\n0.500000 0.500000 -0.000000 Zr\n0.000000 0.000000 0.000000 Cu\n0.883489 0.382240 0.131137 F\n0.617401 0.751869 0.500885 F\n0.116510 0.617760 -0.131137 F\n0.382599 0.248131 0.499115 F\n0.752196 0.883972 0.134719 F\n0.247804 0.116029 0.865281 F\n",
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"structure_string": "La3 Al4 Si6\n1.0\n4.217381 0.000000 0.000000\n-2.108690 3.652359 0.000000\n0.000000 -0.000000 18.460697\nLa Al Si\n3 4 6\ndirect\n0.000000 0.000000 0.113284 La\n0.000000 0.000000 0.886716 La\n0.000000 0.000000 0.500000 La\n0.333333 0.666667 0.743265 Al\n0.666667 0.333333 0.256735 Al\n0.333333 0.666667 0.360462 Al\n0.666667 0.333333 0.639538 Al\n0.333333 0.666667 0.604262 Si\n0.666667 0.333333 0.395738 Si\n0.333333 0.666667 0.996056 Si\n0.666667 0.333333 0.003944 Si\n0.333333 0.666667 0.221768 Si\n0.666667 0.333333 0.778232 Si\n",
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}