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{
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"updated_at": "2022-09-04T14:35:51.014811Z",
"structure_string": "K2 Nb2 Cu4 Se8\n1.0\n5.458454 0.000000 -1.645002\n0.000000 7.706184 0.000000\n0.000645 -0.000000 9.880778\nK Nb Cu Se\n2 2 4 8\ndirect\n0.925124 0.750000 0.364627 K\n0.560497 0.250000 0.635373 K\n0.610552 0.250000 0.221816 Nb\n0.388736 0.750000 0.778184 Nb\n0.108461 0.250000 0.217019 Cu\n0.891442 0.750000 0.782982 Cu\n0.480884 0.500000 0.000000 Cu\n0.480884 0.000000 0.000000 Cu\n0.751826 0.250000 0.005756 Se\n0.141034 0.490645 0.781665 Se\n0.535758 0.750000 0.570741 Se\n0.746071 0.750000 0.994245 Se\n0.965016 0.250000 0.429259 Se\n0.141034 0.009355 0.781665 Se\n0.359369 0.990644 0.218335 Se\n0.359369 0.509355 0.218335 Se\n",
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"structure_string": "Bi6 O8 F2\n1.0\n0.000000 0.000000 4.053700\n0.000000 11.392280 0.000000\n-6.265016 0.000000 2.026850\nBi O F\n6 8 2\ndirect\n0.667165 0.750000 0.665671 Bi\n0.632829 0.410562 0.734343 Bi\n0.632829 0.089438 0.734343 Bi\n0.367171 0.910562 0.265658 Bi\n0.367171 0.589438 0.265658 Bi\n0.332835 0.250000 0.334330 Bi\n0.537222 0.250000 0.925555 O\n0.247234 0.750000 0.505530 O\n0.775309 0.595279 0.449383 O\n0.775309 0.904721 0.449383 O\n0.224691 0.095279 0.550617 O\n0.224691 0.404721 0.550617 O\n0.752765 0.250000 0.494471 O\n0.462777 0.750000 0.074446 O\n0.000000 0.000000 0.000000 F\n0.000000 0.500000 0.000000 F\n",
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{
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"updated_at": "2022-09-04T14:35:51.020581Z",
"structure_string": "Mg1 Be2 N2\n1.0\n1.477014 -2.558264 0.000000\n1.477014 2.558264 0.000000\n0.000000 0.000000 5.088482\nMg Be N\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.666665 0.333332 0.371569 Be\n0.333332 0.666665 0.628430 Be\n0.666665 0.333332 0.722605 N\n0.333332 0.666665 0.277395 N\n",
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{
"id": "jvasp-87869",
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"updated_at": "2022-09-04T14:35:51.023579Z",
"structure_string": "Ba8 Si16\n1.0\n6.772015 -0.000000 0.000000\n0.000000 8.983549 0.000000\n0.000000 0.000000 11.599846\nBa Si\n8 16\ndirect\n0.749999 0.985090 0.307330 Ba\n0.749999 0.485090 0.192670 Ba\n0.250000 0.514910 0.807330 Ba\n0.749999 0.160166 0.906037 Ba\n0.250000 0.839834 0.093963 Ba\n0.749999 0.660166 0.593963 Ba\n0.250000 0.339834 0.406037 Ba\n0.250000 0.014910 0.692670 Ba\n0.250000 0.918312 0.409529 Si\n0.749999 0.081688 0.590472 Si\n0.250000 0.418312 0.090472 Si\n0.749999 0.581688 0.909529 Si\n0.929236 0.306170 0.645675 Si\n0.250000 0.196876 0.964712 Si\n0.749999 0.803124 0.035288 Si\n0.929236 0.806170 0.854326 Si\n0.429237 0.193830 0.145675 Si\n0.570763 0.306170 0.645675 Si\n0.070763 0.693830 0.354326 Si\n0.070763 0.193830 0.145675 Si\n0.570763 0.806170 0.854326 Si\n0.429237 0.693830 0.354326 Si\n0.749999 0.303124 0.464712 Si\n0.250000 0.696876 0.535288 Si\n",
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"elements": [
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{
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"created_at": "2022-09-04T14:35:51.029153Z",
"updated_at": "2022-09-04T14:35:51.029185Z",
"structure_string": "Be2 V1 Ga1\n1.0\n-1.703512 1.703512 3.952809\n1.703512 -1.703512 3.952809\n1.703512 1.703512 -3.952809\nBe V Ga\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.499999 Be\n0.750000 0.250000 0.499999 V\n0.500000 0.500000 0.000000 Ga\n",
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{
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"structure_string": "Nd4 W6 O24\n1.0\n6.914792 0.002318 -1.317741\n-2.979470 6.239960 -1.317741\n-0.010880 -0.017258 11.624333\nNd W O\n4 6 24\ndirect\n0.694603 0.946797 0.404891 Nd\n0.053203 0.305397 0.095109 Nd\n0.305396 0.053203 0.595109 Nd\n0.946797 0.694603 0.904891 Nd\n0.118110 0.881890 0.250000 W\n0.489753 0.201682 0.951931 W\n0.510247 0.798318 0.048069 W\n0.201682 0.489753 0.451931 W\n0.798317 0.510247 0.548069 W\n0.881890 0.118110 0.750000 W\n0.227464 0.628478 0.039163 O\n0.793545 0.651203 0.693748 O\n0.348797 0.206455 0.806251 O\n0.012141 0.598379 0.221079 O\n0.401621 0.987858 0.278921 O\n0.987858 0.401621 0.778921 O\n0.598379 0.012141 0.721079 O\n0.901768 0.327301 0.423867 O\n0.628478 0.227464 0.539163 O\n0.026753 0.945278 0.110240 O\n0.054722 0.973246 0.389760 O\n0.973246 0.054722 0.889760 O\n0.945277 0.026753 0.610240 O\n0.651203 0.793545 0.193748 O\n0.206455 0.348797 0.306252 O\n0.601038 0.672445 0.938241 O\n0.327555 0.398962 0.561759 O\n0.398962 0.327555 0.061759 O\n0.672445 0.601038 0.438241 O\n0.327301 0.901768 0.923867 O\n0.098231 0.672699 0.576132 O\n0.672699 0.098231 0.076133 O\n0.772535 0.371522 0.960837 O\n0.371522 0.772536 0.460837 O\n",
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{
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"created_at": "2022-09-04T14:35:51.036668Z",
"updated_at": "2022-09-04T14:35:51.036688Z",
"structure_string": "K6 Rh2\n1.0\n3.842834 -6.655984 0.000000\n3.842834 6.655984 -0.000000\n0.000000 -0.000000 5.515985\nK Rh\n6 2\ndirect\n0.186682 0.813317 0.750001 K\n0.626634 0.813317 0.750001 K\n0.186682 0.373365 0.750001 K\n0.813317 0.186682 0.250000 K\n0.373365 0.186682 0.250000 K\n0.813317 0.626634 0.250000 K\n0.333333 0.666666 0.250000 Rh\n0.666666 0.333333 0.750001 Rh\n",
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{
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"structure_string": "Na1 Be1 Ru2\n1.0\n-2.121121 2.121121 2.999889\n2.121121 -2.121121 2.999889\n2.121121 2.121121 -2.999889\nNa Be Ru\n1 1 2\ndirect\n0.750000 0.250000 0.500000 Na\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Ru\n0.250000 0.750000 0.500000 Ru\n",
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"structure_string": "Cu8 S4\n1.0\n4.100102 0.000002 0.000035\n0.000000 4.100201 -0.000003\n-0.000034 0.000003 10.760306\nCu S\n8 4\ndirect\n0.083948 0.578919 0.331090 Cu\n0.416051 0.078920 0.418911 Cu\n0.921113 0.583935 0.081090 Cu\n-0.083943 0.421079 0.831090 Cu\n0.421116 -0.083937 0.168908 Cu\n0.583944 0.921079 0.918909 Cu\n0.078883 0.416064 0.581093 Cu\n0.578886 0.083934 0.668908 Cu\n0.421031 0.578953 0.749999 S\n0.078971 0.078953 0.000001 S\n0.921032 0.921046 0.500000 S\n0.578970 0.421048 0.249999 S\n",
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}