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{
"id": "jvasp-40196",
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{
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{
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"created_at": "2022-09-04T14:38:35.623828Z",
"updated_at": "2022-09-04T14:38:35.623850Z",
"structure_string": "Ca2 Sn2 S6\n1.0\n1.135456 -3.603097 -0.000000\n5.322502 3.657756 -0.000000\n-0.000000 -0.000000 9.385772\nCa Sn S\n2 2 6\ndirect\n0.746531 0.493063 0.750000 Ca\n0.253469 0.506938 0.250000 Ca\n0.000000 0.000000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.081160 0.162320 0.750000 S\n0.918840 0.837680 0.250000 S\n0.357050 0.714100 0.548575 S\n0.642950 0.285900 0.451425 S\n0.357050 0.714100 0.951425 S\n0.642950 0.285900 0.048575 S\n",
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"formula_full": "Ca2 Sn2 S6",
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},
{
"id": "jvasp-40205",
"created_at": "2022-09-04T14:38:34.480449Z",
"updated_at": "2022-09-04T14:38:34.480485Z",
"structure_string": "Ca2 Sn2 S6\n1.0\n-0.000000 0.000000 -7.004564\n-5.990911 0.021717 -3.502282\n-2.002883 5.645930 -3.502282\nCa Sn S\n2 2 6\ndirect\n0.710868 0.219636 0.280329 Ca\n0.210834 0.780363 0.719671 Ca\n0.494394 -0.000000 -0.000000 Sn\n0.994402 0.500000 0.500000 Sn\n0.313664 0.380910 0.119088 S\n0.813662 0.619090 0.880913 S\n0.313209 0.158165 0.688503 S\n0.159877 0.841835 0.311498 S\n0.659879 0.811481 0.341845 S\n0.813205 0.188518 0.658156 S\n",
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"formula_full": "Ca2 Sn2 S6",
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{
"id": "jvasp-40201",
"created_at": "2022-09-04T14:38:29.566388Z",
"updated_at": "2022-09-04T14:38:29.566416Z",
"structure_string": "Ca2 Sn2 S6\n1.0\n0.000000 0.000000 -6.315966\n-3.331712 -5.770714 0.000000\n-3.331712 5.770714 -0.000000\nCa Sn S\n2 2 6\ndirect\n0.250000 0.666729 0.333271 Ca\n0.750000 0.333271 0.666729 Ca\n0.000000 0.000000 0.000000 Sn\n0.500000 0.000000 0.000000 Sn\n0.250000 0.174295 0.825705 S\n0.250000 0.651414 0.825730 S\n0.250000 0.174269 0.348586 S\n0.750000 0.825705 0.174295 S\n0.750000 0.348586 0.174269 S\n0.750000 0.825730 0.651414 S\n",
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{
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"created_at": "2022-09-04T14:38:04.746785Z",
"updated_at": "2022-09-04T14:38:04.746811Z",
"structure_string": "Ca2 Sn2 O6\n1.0\n4.962129 -0.000000 2.864886\n1.654043 4.678340 2.864886\n-0.000000 0.000000 5.729773\nCa Sn O\n2 2 6\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500001 Ca\n0.250000 0.250000 0.250000 Sn\n0.750000 0.750000 0.750001 Sn\n0.500000 0.500000 0.000001 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n",
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"formula_full": "Ca2 Sn2 O6",
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{
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"updated_at": "2022-09-04T14:38:09.965623Z",
"structure_string": "Ca2 Sn2 O6\n1.0\n4.923371 -0.014263 3.496394\n1.797674 4.583465 3.496394\n-0.020979 -0.014263 6.038535\nCa Sn O\n2 2 6\ndirect\n0.362363 0.362363 0.362363 Ca\n0.637636 0.637637 0.637636 Ca\n0.153432 0.153432 0.153432 Sn\n0.846567 0.846568 0.846567 Sn\n0.790371 0.444034 0.035489 O\n0.444033 0.035490 0.790371 O\n0.035489 0.790371 0.444033 O\n0.209628 0.555966 0.964509 O\n0.964510 0.209629 0.555965 O\n0.555966 0.964510 0.209628 O\n",
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"formula_full": "Ca2 Sn2 O6",
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{
"id": "jvasp-35056",
"created_at": "2022-09-04T14:37:32.943558Z",
"updated_at": "2022-09-04T14:37:32.943582Z",
"structure_string": "Ca2 Sn2 Hg2\n1.0\n2.455719 -4.253430 -0.000000\n2.455719 4.253430 -0.000000\n0.000000 -0.000000 7.728049\nCa Sn Hg\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.333333 0.666667 0.250000 Sn\n0.666667 0.333333 0.750000 Sn\n0.333333 0.666667 0.750000 Hg\n0.666667 0.333333 0.250000 Hg\n",
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],
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{
"id": "jvasp-35066",
"created_at": "2022-09-04T14:37:35.543150Z",
"updated_at": "2022-09-04T14:37:35.543175Z",
"structure_string": "Ca2 Sn2 Hg2\n1.0\n2.432529 -4.213264 0.000000\n2.432529 4.213264 0.000000\n0.000000 0.000000 7.799463\nCa Sn Hg\n2 2 2\ndirect\n0.000000 0.000000 0.748987 Ca\n0.000000 0.000000 0.248987 Ca\n0.666667 0.333333 0.962039 Sn\n0.333333 0.666667 0.462039 Sn\n0.666667 0.333333 0.563973 Hg\n0.333333 0.666667 0.063973 Hg\n",
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{
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"structure_string": "Ca2 Sn2 Ge4 O12\n1.0\n5.444647 -0.168421 1.036705\n1.204478 7.177242 0.698397\n-0.276802 -0.038107 7.305701\nCa Sn Ge O\n2 2 4 12\ndirect\n0.750001 0.329923 0.670076 Ca\n0.250001 0.670076 0.329924 Ca\n0.750001 0.892404 0.107596 Sn\n0.250001 0.107596 0.892403 Sn\n0.776146 0.394382 0.184789 Ge\n0.723856 0.815211 0.605618 Ge\n0.223856 0.605617 0.815211 Ge\n0.276145 0.184789 0.394382 Ge\n0.642274 0.022699 0.712192 O\n0.857728 0.287807 0.977300 O\n0.632894 0.623716 0.159343 O\n0.867108 0.840657 0.376284 O\n0.367108 0.376284 0.840657 O\n0.962957 0.626005 0.682312 O\n0.037044 0.373995 0.317687 O\n0.462957 0.682313 0.626005 O\n0.142274 0.712193 0.022700 O\n0.537044 0.317687 0.373994 O\n0.132893 0.159343 0.623716 O\n0.357727 0.977300 0.287807 O\n",
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{
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"created_at": "2022-09-04T14:36:08.648920Z",
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"structure_string": "Ca2 Sn2\n1.0\n4.459483 -0.000000 -1.706984\n-0.000000 4.373258 -0.000000\n-0.172512 0.000000 6.227984\nCa Sn\n2 2\ndirect\n0.133072 0.750000 0.266146 Ca\n0.866927 0.250000 0.733854 Ca\n0.413365 0.750000 0.826730 Sn\n0.586635 0.250000 0.173270 Sn\n",
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{
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"structure_string": "Ca2 Sn2\n1.0\n4.459482 0.000000 -1.706984\n0.000000 4.373258 0.000000\n-0.172512 0.000000 6.227983\nCa Sn\n2 2\ndirect\n0.133072 0.750000 0.266146 Ca\n0.866928 0.250000 0.733854 Ca\n0.413365 0.750000 0.826731 Sn\n0.586635 0.250000 0.173270 Sn\n",
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