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{
"id": "jvasp-44057",
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{
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"structure_string": "La4 Cu4 Pb4 S12\n1.0\n4.145298 -0.000000 0.000000\n0.000000 8.102968 0.000000\n-0.000000 -0.000000 15.977879\nLa Cu Pb S\n4 4 4 12\ndirect\n0.250000 0.249898 0.959966 La\n0.250000 0.749898 0.540034 La\n0.750000 0.750102 0.040034 La\n0.750000 0.250102 0.459966 La\n0.250000 0.126173 0.631075 Cu\n0.250000 0.626173 0.868925 Cu\n0.750000 0.873827 0.368925 Cu\n0.750000 0.373827 0.131075 Cu\n0.750000 0.913524 0.780028 Pb\n0.750000 0.413524 0.719972 Pb\n0.250000 0.086477 0.219972 Pb\n0.250000 0.586477 0.280028 Pb\n0.750000 0.989571 0.597955 S\n0.250000 0.181748 0.778718 S\n0.250000 0.681748 0.721282 S\n0.750000 0.818252 0.221282 S\n0.750000 0.318252 0.278718 S\n0.250000 0.380088 0.563046 S\n0.250000 0.880088 0.936954 S\n0.750000 0.619912 0.436954 S\n0.750000 0.119912 0.063046 S\n0.250000 0.010429 0.402045 S\n0.250000 0.510429 0.097955 S\n0.750000 0.489571 0.902045 S\n",
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{
"id": "jvasp-122442",
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"updated_at": "2022-09-04T14:38:53.959386Z",
"structure_string": "K4 Ag4 Te4 S12\n1.0\n10.680776 0.000000 0.000000\n-0.000000 7.011611 2.045657\n-0.000000 0.008372 8.407767\nK Ag Te S\n4 4 4 12\ndirect\n0.247159 0.486637 0.879395 K\n0.752841 0.513363 0.120606 K\n0.747159 0.513363 0.620606 K\n0.252841 0.486637 0.379395 K\n0.253733 0.913952 0.518094 Ag\n0.746267 0.086048 0.481907 Ag\n0.753733 0.086048 0.981907 Ag\n0.246267 0.913952 0.018094 Ag\n0.010061 0.088775 0.726121 Te\n0.989939 0.911225 0.273880 Te\n0.510061 0.911225 0.773880 Te\n0.489939 0.088775 0.226121 Te\n0.952919 0.289251 0.900729 S\n0.049039 0.722077 0.546940 S\n0.950961 0.277922 0.453061 S\n0.549040 0.277922 0.953061 S\n0.450961 0.722078 0.046940 S\n0.734722 0.854442 0.787389 S\n0.265279 0.145557 0.212611 S\n0.234722 0.145557 0.712612 S\n0.765279 0.854442 0.287389 S\n0.452919 0.710748 0.599272 S\n0.547082 0.289251 0.400729 S\n0.047082 0.710749 0.099272 S\n",
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{
"id": "jvasp-34683",
"created_at": "2022-09-04T14:38:12.725511Z",
"updated_at": "2022-09-04T14:38:12.725538Z",
"structure_string": "K2 Sm2 Pd2 O6\n1.0\n3.933072 0.000000 0.000000\n-1.966536 6.387529 -1.662655\n0.000000 0.003629 7.361581\nK Sm Pd O\n2 2 2 6\ndirect\n0.355626 0.711252 0.436078 K\n0.644373 0.288748 0.563922 K\n0.350334 0.700671 0.922331 Sm\n0.649665 0.299329 0.077670 Sm\n0.006891 0.013782 0.770961 Pd\n0.993108 0.986219 0.229040 Pd\n0.830094 0.660191 0.133613 O\n0.847027 0.694056 0.722111 O\n0.169904 0.339809 0.866387 O\n0.493714 0.987430 0.190295 O\n0.506285 0.012571 0.809705 O\n0.152972 0.305944 0.277890 O\n",
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{
"id": "jvasp-28760",
"created_at": "2022-09-04T14:38:12.797590Z",
"updated_at": "2022-09-04T14:38:12.797601Z",
"structure_string": "Te2 Mo2 W2 S6\n1.0\n3.280338 -0.000000 -0.000000\n-1.640170 2.840941 0.000167\n-0.000000 0.002182 39.405945\nTe Mo W S\n2 2 2 6\ndirect\n0.666751 0.333501 0.419839 Te\n0.666484 0.332966 0.518439 Te\n0.333211 0.666420 0.093523 Mo\n0.666759 0.333517 0.280500 Mo\n0.333275 0.666550 0.469123 W\n0.666768 0.333536 0.659827 W\n0.333352 0.666706 0.319507 S\n0.333338 0.666679 0.698880 S\n0.666547 0.333093 0.054556 S\n0.666531 0.333062 0.132505 S\n0.333503 0.667007 0.241471 S\n0.333480 0.666961 0.620578 S\n",
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{
"id": "jvasp-120724",
"created_at": "2022-09-04T14:38:53.795992Z",
"updated_at": "2022-09-04T14:38:53.796017Z",
"structure_string": "Rb4 Cu4 Te4 S12\n1.0\n10.570131 0.000000 0.000000\n-0.000000 7.103955 2.022549\n-0.000000 0.003138 8.083214\nRb Cu Te S\n4 4 4 12\ndirect\n0.239847 0.474456 0.883383 Rb\n0.760153 0.525545 0.116617 Rb\n0.739847 0.525545 0.616616 Rb\n0.260153 0.474456 0.383383 Rb\n0.249507 0.914661 0.520336 Cu\n0.750493 0.085340 0.479663 Cu\n0.749507 0.085340 0.979663 Cu\n0.250493 0.914661 0.020336 Cu\n0.999171 0.063928 0.732935 Te\n0.000828 0.936073 0.267064 Te\n0.499171 0.936074 0.767064 Te\n0.500828 0.063927 0.232936 Te\n0.938116 0.263260 0.914804 S\n0.060201 0.738542 0.548604 S\n0.939799 0.261459 0.451395 S\n0.560201 0.261459 0.951395 S\n0.439799 0.738542 0.048605 S\n0.729921 0.892978 0.776180 S\n0.270079 0.107023 0.223819 S\n0.229921 0.107023 0.723819 S\n0.770079 0.892978 0.276181 S\n0.438116 0.736741 0.585195 S\n0.561884 0.263260 0.414805 S\n0.061884 0.736741 0.085195 S\n",
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{
"id": "jvasp-9772",
"created_at": "2022-09-04T14:37:05.746211Z",
"updated_at": "2022-09-04T14:37:05.746234Z",
"structure_string": "Ag2 Hg2 As2 S6\n1.0\n6.461802 0.020222 -1.448880\n-3.587431 5.374536 -1.448880\n-0.019786 -0.037136 7.849230\nAg Hg As S\n2 2 2 6\ndirect\n0.016481 0.992314 0.252504 Ag\n0.992312 0.016480 0.752503 Ag\n0.658826 0.307890 0.228219 Hg\n0.307890 0.658826 0.728219 Hg\n0.323534 0.624226 0.209091 As\n0.624225 0.323534 0.709091 As\n0.972454 0.226824 0.051905 S\n0.226824 0.972455 0.551906 S\n0.815706 0.234209 0.513381 S\n0.566428 0.579906 0.577299 S\n0.579906 0.566429 0.077299 S\n0.234210 0.815707 0.013381 S\n",
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{
"id": "jvasp-28647",
"created_at": "2022-09-04T14:36:45.686795Z",
"updated_at": "2022-09-04T14:36:45.686815Z",
"structure_string": "Mo2 W2 Se2 S6\n1.0\n3.224996 -0.000012 0.000003\n-1.612508 2.792911 -0.000021\n0.000033 -0.000263 34.073212\nMo W Se S\n2 2 2 6\ndirect\n0.333322 0.666640 0.093392 Mo\n0.333331 0.666655 0.472004 Mo\n0.666666 0.333337 0.282673 W\n0.666682 0.333370 0.654844 W\n0.333339 0.666685 0.333193 Se\n0.333325 0.666652 0.232156 Se\n0.333336 0.666677 0.700721 S\n0.666643 0.333284 0.047767 S\n0.666665 0.333320 0.426325 S\n0.666669 0.333331 0.139075 S\n0.666666 0.333329 0.517666 S\n0.333361 0.666725 0.608933 S\n",
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{
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"created_at": "2022-09-04T14:38:13.484130Z",
"updated_at": "2022-09-04T14:38:13.484155Z",
"structure_string": "Mo2 W2 Se6 S2\n1.0\n3.292715 0.000000 0.000000\n-1.646357 2.852108 -0.003825\n0.000000 -0.041987 31.362417\nMo W Se S\n2 2 6 2\ndirect\n0.338669 0.677338 0.064362 Mo\n0.323379 0.646759 0.479645 Mo\n0.666324 0.332649 0.275823 W\n0.671640 0.343281 0.683089 W\n0.333960 0.667924 0.329869 Se\n0.339311 0.678626 0.737093 Se\n0.671734 0.343470 0.010667 Se\n0.672290 0.344585 0.118123 Se\n0.332075 0.664153 0.221764 Se\n0.337174 0.674351 0.629031 Se\n0.655805 0.311610 0.430691 S\n0.657625 0.315251 0.528594 S\n",
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{
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"created_at": "2022-09-04T14:36:04.862083Z",
"updated_at": "2022-09-04T14:36:04.862116Z",
"structure_string": "Sr4 Li4 B4 O12\n1.0\n6.083266 0.000000 -2.194235\n0.000000 6.733810 0.000000\n-0.017395 0.000000 6.919157\nSr Li B O\n4 4 4 12\ndirect\n0.197834 0.124411 0.864874 Sr\n0.802166 0.875589 0.135126 Sr\n0.697835 0.375589 0.364874 Sr\n0.302165 0.624411 0.635126 Sr\n0.601621 0.090925 0.694689 Li\n0.898379 0.590925 0.805311 Li\n0.398379 0.909075 0.305311 Li\n0.101621 0.409075 0.194689 Li\n0.189910 0.135737 0.426076 B\n0.689910 0.364263 0.926075 B\n0.810090 0.864263 0.573924 B\n0.310090 0.635737 0.073924 B\n0.840330 0.886339 0.782700 O\n0.392559 0.801134 0.007256 O\n0.159669 0.113661 0.217300 O\n0.340330 0.613660 0.282700 O\n0.804217 0.509916 0.062395 O\n0.304216 0.990084 0.562395 O\n0.195783 0.490084 0.937605 O\n0.892559 0.698865 0.507256 O\n0.107441 0.301135 0.492744 O\n0.659669 0.386339 0.717300 O\n0.695783 0.009916 0.437604 O\n0.607441 0.198865 0.992744 O\n",
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{
"id": "jvasp-91421",
"created_at": "2022-09-04T14:35:50.752816Z",
"updated_at": "2022-09-04T14:35:50.752842Z",
"structure_string": "Yb4 Se4 O12 F4\n1.0\n6.498913 0.000000 -0.441467\n0.000000 6.838090 0.000000\n0.501159 0.000000 6.713239\nYb Se O F\n4 4 12 4\ndirect\n0.132522 0.176589 0.868261 Yb\n0.132522 0.323411 0.368261 Yb\n0.867478 0.823411 0.131739 Yb\n0.867478 0.676589 0.631739 Yb\n0.670348 0.360922 0.187068 Se\n0.329652 0.860922 0.312931 Se\n0.329652 0.639078 0.812932 Se\n0.670348 0.139078 0.687068 Se\n0.804055 0.968576 0.818124 O\n0.860699 0.302102 0.641260 O\n0.491307 0.763389 0.136267 O\n0.508693 0.263389 0.363733 O\n0.195945 0.468576 0.681876 O\n0.860699 0.197898 0.141259 O\n0.139301 0.697898 0.358740 O\n0.804055 0.531424 0.318124 O\n0.139301 0.802102 0.858740 O\n0.195945 0.031424 0.181875 O\n0.491307 0.736611 0.636267 O\n0.508693 0.236611 0.863733 O\n0.786101 0.925467 0.430425 F\n0.213899 0.074533 0.569575 F\n0.786101 0.574533 0.930425 F\n0.213899 0.425467 0.069575 F\n",
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"formula_full": "Yb4 Se4 O12 F4",
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{
"id": "jvasp-28644",
"created_at": "2022-09-04T14:36:44.577549Z",
"updated_at": "2022-09-04T14:36:44.577581Z",
"structure_string": "Mo2 W2 Se6 S2\n1.0\n3.292711 0.000001 0.000000\n-1.646354 2.851540 0.000000\n-0.000001 0.000140 35.021028\nMo W Se S\n2 2 6 2\ndirect\n0.333369 0.666735 0.096673 Mo\n0.666648 0.333297 0.658253 Mo\n0.333330 0.666658 0.468862 W\n0.666653 0.333307 0.279126 W\n0.333321 0.666640 0.327536 Se\n0.333313 0.666624 0.706332 Se\n0.666669 0.333337 0.420452 Se\n0.666656 0.333311 0.517274 Se\n0.333329 0.666656 0.230724 Se\n0.333321 0.666641 0.610115 Se\n0.666699 0.333398 0.052875 S\n0.666698 0.333394 0.140525 S\n",
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}
]
}