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{
"id": "mp-1073100",
"created_at": "2022-09-04T14:48:25.699530Z",
"structure_string": "Mg8 Si12\n1.0\n1.919058 5.881434 0.000000\n-1.919058 5.881434 0.000000\n0.000000 3.383405 17.177985\nMg Si\n8 12\ndirect\n0.031900 0.031900 0.753747 Mg\n0.470767 0.470767 0.254896 Mg\n0.043235 0.043235 0.924871 Mg\n0.458861 0.458861 0.071987 Mg\n0.182914 0.182914 0.248742 Mg\n0.309817 0.309817 0.748876 Mg\n0.923738 0.923738 0.421067 Mg\n0.302303 0.302303 0.570036 Mg\n0.336660 0.336660 0.952068 Si\n0.158826 0.158826 0.045901 Si\n0.832316 0.832316 0.868810 Si\n0.662494 0.662494 0.130596 Si\n0.810363 0.810363 0.306669 Si\n0.694480 0.694480 0.677088 Si\n0.172179 0.172179 0.455030 Si\n0.002770 0.002770 0.557113 Si\n0.615464 0.615464 0.383483 Si\n0.508293 0.508293 0.638594 Si\n0.652753 0.652753 0.820847 Si\n0.848007 0.848007 0.169680 Si\n",
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{
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{
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"structure_string": "Ir1 N1\n1.0\n0.000000 2.202588 2.202588\n2.202588 0.000000 2.202588\n2.202588 2.202588 0.000000\nIr N\n1 1\ndirect\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 N\n",
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{
"id": "mp-576",
"created_at": "2022-09-04T14:48:28.624188Z",
"structure_string": "B13 C2\n1.0\n4.357850 -2.829631 0.000000\n4.357850 2.829631 0.000000\n2.520518 0.000000 4.543639\nB C\n13 2\ndirect\n0.500000 0.500000 0.500000 B\n0.318452 0.803502 0.803502 B\n0.803502 0.803502 0.318452 B\n0.803502 0.318452 0.803502 B\n0.196498 0.681548 0.196498 B\n0.681548 0.196498 0.196498 B\n0.196498 0.196498 0.681548 B\n0.323576 0.007874 0.007874 B\n0.007874 0.007874 0.323576 B\n0.007874 0.323576 0.007874 B\n0.992126 0.676424 0.992126 B\n0.676424 0.992126 0.992126 B\n0.992126 0.992126 0.676424 B\n0.619079 0.619079 0.619079 C\n0.380921 0.380921 0.380921 C\n",
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{
"id": "mp-9983",
"created_at": "2022-09-04T14:48:31.227614Z",
"structure_string": "Ta4 Se6\n1.0\n3.427364 0.000000 0.000000\n0.000000 6.628628 0.000000\n0.000000 2.314831 9.018551\nTa Se\n4 6\ndirect\n0.250000 0.886335 0.634943 Ta\n0.750000 0.113665 0.365057 Ta\n0.250000 0.678197 0.000800 Ta\n0.750000 0.321803 0.999200 Ta\n0.250000 0.272191 0.513086 Se\n0.750000 0.727809 0.486914 Se\n0.250000 0.027743 0.157269 Se\n0.750000 0.972257 0.842731 Se\n0.750000 0.523490 0.205622 Se\n0.250000 0.476510 0.794378 Se\n",
"nsites": 10,
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"formula_full": "Ta4 Se6",
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"spacegroup": 11
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{
"id": "mp-999473",
"created_at": "2022-09-04T14:48:31.230401Z",
"structure_string": "Zn1 N1\n1.0\n0.000000 2.156901 2.156901\n2.156901 0.000000 2.156901\n2.156901 2.156901 0.000000\nZn N\n1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 N\n",
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"formula_full": "Zn1 N1",
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{
"id": "mp-984718",
"created_at": "2022-09-04T14:39:05.324094Z",
"structure_string": "B2 As2\n1.0\n1.695467 -2.936635 0.000000\n1.695467 2.936635 0.000000\n0.000000 0.000000 5.609546\nB As\n2 2\ndirect\n0.666667 0.333333 0.874676 B\n0.333333 0.666667 0.374676 B\n0.666667 0.333333 0.500323 As\n0.333333 0.666667 0.000323 As\n",
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"volume": 55.85949706767284,
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{
"id": "mp-973676",
"created_at": "2022-09-04T14:39:05.329297Z",
"structure_string": "Hg2 S2\n1.0\n2.122706 -3.676635 0.000000\n2.122706 3.676635 0.000000\n0.000000 0.000000 6.944057\nHg S\n2 2\ndirect\n0.666667 0.333333 0.499884 Hg\n0.333333 0.666667 0.999884 Hg\n0.666667 0.333333 0.875116 S\n0.333333 0.666667 0.375116 S\n",
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"volume": 108.38860764414714,
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"updated_at": "2021-11-28T01:34:24.402000Z",
"spacegroup": 186
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{
"id": "mp-1208655",
"created_at": "2022-09-04T14:48:27.925061Z",
"structure_string": "Sr1 O10\n1.0\n5.237133 0.000000 0.000000\n0.000000 5.237133 0.000000\n0.000000 0.000000 5.477834\nSr O\n1 10\ndirect\n0.000000 0.000000 0.000000 Sr\n0.354688 0.354688 0.247943 O\n0.645312 0.645312 0.752057 O\n0.645312 0.645312 0.247943 O\n0.645312 0.354688 0.247943 O\n0.645312 0.354688 0.752057 O\n0.354688 0.354688 0.752057 O\n0.354688 0.645312 0.752057 O\n0.354688 0.645312 0.247943 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n",
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{
"id": "mp-1094409",
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"structure_string": "Y2 Mg4\n1.0\n1.691643 -8.746817 0.000000\n1.691643 8.746817 0.000000\n0.000000 0.000000 5.450520\nY Mg\n2 4\ndirect\n0.782813 0.217187 0.500000 Y\n0.107457 0.892543 0.500000 Y\n0.997398 0.002602 0.000000 Mg\n0.333682 0.666318 0.000000 Mg\n0.668482 0.331518 0.000000 Mg\n0.443501 0.556499 0.500000 Mg\n",
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{
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"structure_string": "Ni2 F4\n1.0\n3.118153 0.000000 0.000000\n0.000000 4.644076 0.000000\n0.000000 0.000000 4.743565\nNi F\n2 4\ndirect\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.000000 0.288007 0.319894 F\n0.500000 0.211993 0.819894 F\n0.000000 0.711993 0.680106 F\n0.500000 0.788007 0.180106 F\n",
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{
"id": "mp-1186781",
"created_at": "2022-09-04T14:39:06.371814Z",
"structure_string": "Sr2 Sn6\n1.0\n3.575234 -6.192486 0.000000\n3.575234 6.192486 0.000000\n0.000000 0.000000 5.376441\nSr Sn\n2 6\ndirect\n0.333333 0.666667 0.750000 Sr\n0.666667 0.333333 0.250000 Sr\n0.149581 0.299162 0.250000 Sn\n0.700838 0.850419 0.250000 Sn\n0.149581 0.850419 0.250000 Sn\n0.850419 0.700838 0.750000 Sn\n0.299162 0.149581 0.750000 Sn\n0.850419 0.149581 0.750000 Sn\n",
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]
}