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{
"id": "jvasp-10821",
"created_at": "2022-09-04T14:37:13.814309Z",
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"structure_string": "Ca1 Ni4 S8\n1.0\n6.904266 0.038647 0.027327\n3.485603 6.037239 0.000000\n3.485603 2.012413 5.691965\nCa Ni S\n1 4 8\ndirect\n0.500000 0.000000 0.000000 Ca\n-0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.258259 0.269347 0.269346 S\n0.258259 0.269346 0.703049 S\n0.258258 0.703049 0.269346 S\n0.713014 0.262329 0.262329 S\n0.286986 0.737671 0.737671 S\n0.741741 0.730654 0.296951 S\n0.741741 0.296951 0.730653 S\n0.741741 0.730654 0.730653 S\n",
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{
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"updated_at": "2022-09-04T14:37:01.297577Z",
"structure_string": "Co2 Te2 Mo2 O12\n1.0\n0.000022 5.056775 -0.000632\n5.279773 0.000023 0.000003\n-0.000006 -0.001111 -8.844127\nCo Te Mo O\n2 2 2 12\ndirect\n0.750001 0.000007 0.528047 Co\n0.249999 0.500005 0.471954 Co\n0.750007 0.500008 0.749977 Te\n0.249992 0.000008 0.250024 Te\n0.749995 0.500008 0.191931 Mo\n0.250003 0.000009 0.808067 Mo\n0.014104 0.323400 0.295692 O\n0.524782 0.677865 0.607619 O\n0.901233 0.715184 0.073535 O\n0.598764 0.284833 0.073537 O\n0.975234 0.322136 0.607626 O\n0.985893 0.823398 0.704309 O\n0.024764 0.822137 0.392376 O\n0.401236 0.784831 0.926463 O\n0.475216 0.177866 0.392383 O\n0.514126 0.176611 0.704316 O\n0.098765 0.215183 0.926464 O\n0.485872 0.676611 0.295683 O\n",
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{
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"updated_at": "2022-09-04T14:38:34.309547Z",
"structure_string": "Cu4 Se8\n1.0\n6.180998 0.000000 0.000000\n-0.000000 6.180998 0.000000\n0.000000 0.000000 6.180998\nCu Se\n4 8\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.500000 0.500000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n0.388991 0.388991 0.388991 Se\n0.111009 0.611009 0.888991 Se\n0.888991 0.111009 0.611009 Se\n0.611009 0.888991 0.111009 Se\n0.611009 0.611009 0.611009 Se\n0.888991 0.388991 0.111009 Se\n0.111009 0.888991 0.388991 Se\n0.388991 0.111009 0.888991 Se\n",
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"volume": 236.14339851250816,
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{
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"created_at": "2022-09-04T14:35:57.407386Z",
"updated_at": "2022-09-04T14:35:57.407414Z",
"structure_string": "Sr4 Cr2 Cu2 S2 O6\n1.0\n3.903644 0.000000 -0.000000\n-0.000000 3.903644 0.000000\n0.000000 -0.000000 15.496598\nSr Cr Cu S O\n4 2 2 2 6\ndirect\n0.749999 0.749999 0.184412 Sr\n0.250000 0.250000 0.815588 Sr\n0.749999 0.749999 0.411719 Sr\n0.250000 0.250000 0.588281 Sr\n0.250000 0.250000 0.307901 Cr\n0.749999 0.749999 0.692099 Cr\n0.250000 0.749999 0.000000 Cu\n0.749999 0.250000 0.000000 Cu\n0.749999 0.749999 0.907049 S\n0.250000 0.250000 0.092952 S\n0.749999 0.749999 0.570302 O\n0.250000 0.250000 0.429698 O\n0.250000 0.749999 0.711302 O\n0.250000 0.749999 0.288699 O\n0.749999 0.250000 0.288699 O\n0.749999 0.250000 0.711302 O\n",
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{
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"updated_at": "2022-09-04T14:35:55.244067Z",
"structure_string": "Sr3 Mg3\n1.0\n4.048202 0.000000 -0.000000\n-2.024102 3.505847 -0.000000\n-0.000000 0.000000 16.638978\nSr Mg\n3 3\ndirect\n0.666667 0.333333 0.711072 Sr\n0.000000 0.000000 0.500000 Sr\n0.666667 0.333333 0.288928 Sr\n0.666667 0.333333 0.000000 Mg\n0.000000 0.000000 0.875539 Mg\n0.000000 0.000000 0.124461 Mg\n",
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{
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"created_at": "2022-09-04T14:37:53.975608Z",
"updated_at": "2022-09-04T14:37:53.975626Z",
"structure_string": "Lu4 Mn4 O14\n1.0\n6.008631 -0.000000 3.469085\n2.002877 5.664992 3.469085\n-0.000000 -0.000000 6.938170\nLu Mn O\n4 4 14\ndirect\n0.499999 0.500001 0.500000 Lu\n0.000000 0.500001 0.500000 Lu\n0.499999 0.000000 0.500000 Lu\n0.499999 0.500001 0.000001 Lu\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.499999 0.000000 0.000000 Mn\n0.000000 0.500001 0.999999 Mn\n0.668430 0.081570 0.081569 O\n0.668430 0.081570 0.668432 O\n0.081570 0.668430 0.081569 O\n0.625000 0.624999 0.625002 O\n0.918431 0.331569 0.331570 O\n0.331569 0.918431 0.331570 O\n0.331569 0.331569 0.918432 O\n0.918431 0.918431 0.331570 O\n0.918431 0.331569 0.918432 O\n0.081570 0.668430 0.668432 O\n0.331569 0.918431 0.918432 O\n0.374999 0.375000 0.375001 O\n0.668431 0.668430 0.081571 O\n0.081570 0.081570 0.668430 O\n",
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{
"id": "jvasp-59658",
"created_at": "2022-09-04T14:37:37.396996Z",
"updated_at": "2022-09-04T14:37:37.397022Z",
"structure_string": "Sr2 Sm1 Cu3 Pb2 O8\n1.0\n3.844858 0.000000 -0.000000\n-0.000000 3.844858 0.000000\n-0.000000 0.000000 15.976977\nSr Sm Cu Pb O\n2 1 3 2 8\ndirect\n0.000000 0.000000 0.778486 Sr\n0.000000 0.000000 0.221514 Sr\n0.000000 0.000000 0.000000 Sm\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 0.893164 Cu\n0.500000 0.500000 0.106836 Cu\n0.500000 0.500000 0.387390 Pb\n0.500000 0.500000 0.612610 Pb\n0.000000 0.500000 0.905031 O\n0.500000 0.000000 0.094969 O\n0.000000 0.500000 0.094969 O\n0.500000 0.000000 0.905031 O\n0.000000 0.000000 0.383571 O\n0.500000 0.500000 0.748878 O\n0.500000 0.500000 0.251122 O\n0.000000 0.000000 0.616429 O\n",
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{
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"created_at": "2022-09-04T14:37:29.806716Z",
"updated_at": "2022-09-04T14:37:29.806733Z",
"structure_string": "Mo3 W1 Se4 S4\n1.0\n3.257372 0.000001 -0.000000\n-1.628685 2.821003 -0.000271\n0.000003 0.005166 25.703137\nMo W Se S\n3 1 4 4\ndirect\n0.334490 0.668985 0.996490 Mo\n0.331695 0.663393 0.504913 Mo\n0.665197 0.330397 0.255421 Mo\n0.668611 0.337226 0.746095 W\n0.331815 0.663634 0.321483 Se\n0.667875 0.335754 0.930429 Se\n0.667773 0.335549 0.062572 Se\n0.331910 0.663823 0.189336 Se\n0.335264 0.670535 0.806551 S\n0.665037 0.330074 0.444747 S\n0.665018 0.330039 0.565049 S\n0.335293 0.670591 0.685664 S\n",
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"structure_string": "Li12 Cu4 N8\n1.0\n4.945038 -0.000000 -3.297527\n0.000000 7.242666 0.000000\n0.001913 0.000000 6.593505\nLi Cu N\n12 4 8\ndirect\n0.258294 0.997327 0.911698 Li\n0.340489 0.720900 0.170318 Li\n0.340488 0.779101 0.670319 Li\n0.659511 0.279101 0.829682 Li\n0.258304 0.997363 0.346696 Li\n0.741697 0.497363 0.153304 Li\n0.659512 0.220899 0.329682 Li\n0.258303 0.502637 0.846696 Li\n0.258294 0.502674 0.411698 Li\n0.741706 0.002673 0.088302 Li\n0.741706 0.497327 0.588302 Li\n0.741696 0.002637 0.653304 Li\n0.851515 0.801755 0.425631 Cu\n0.148485 0.301755 0.074369 Cu\n0.148485 0.198245 0.574369 Cu\n0.851515 0.698246 0.925631 Cu\n0.009708 0.750012 0.254732 N\n0.453402 0.042742 0.726713 N\n0.546598 0.542742 0.773288 N\n0.546598 0.957259 0.273287 N\n0.453402 0.457259 0.226713 N\n0.990292 0.249988 0.745268 N\n0.009707 0.749988 0.754733 N\n0.990292 0.250012 0.245268 N\n",
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{
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"structure_string": "Ba4 Ta1 Ga1\n1.0\n-0.000000 4.906277 4.906277\n4.906277 -0.000000 4.906277\n4.906277 4.906277 0.000000\nBa Ta Ga\n4 1 1\ndirect\n0.124872 0.625043 0.625043 Ba\n0.625043 0.625043 0.625043 Ba\n0.625043 0.124872 0.625043 Ba\n0.625043 0.625043 0.124872 Ba\n0.000000 0.000000 0.000000 Ta\n0.250000 0.250000 0.250000 Ga\n",
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}