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{
"id": "jvasp-115209",
"created_at": "2022-09-04T14:38:44.439913Z",
"updated_at": "2022-09-04T14:38:44.439944Z",
"structure_string": "Li1 Sn1 P1\n1.0\n5.656253 2.078780 0.000000\n-1.355498 3.604762 0.000000\n0.000000 0.000000 3.126954\nLi Sn P\n1 1 1\ndirect\n0.263885 -0.163736 0.000000 Li\n0.720627 0.830102 0.000000 Sn\n0.015487 0.333634 0.000000 P\n",
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{
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"structure_string": "Yb8 Br12 O2\n1.0\n4.660734 -8.072628 -0.000000\n4.660734 8.072628 0.000000\n-0.000000 0.000000 7.071402\nYb Br O\n8 12 2\ndirect\n0.797338 0.202661 0.003388 Yb\n0.666667 0.333333 0.411928 Yb\n0.797338 0.594677 0.003388 Yb\n0.405323 0.202662 0.003388 Yb\n0.594677 0.797338 0.503388 Yb\n0.333333 0.666667 0.911928 Yb\n0.202662 0.405323 0.503388 Yb\n0.202661 0.797338 0.503388 Yb\n0.135375 0.864624 0.883743 Br\n0.070954 0.535477 0.204691 Br\n0.464523 0.929045 0.204691 Br\n0.135376 0.270750 0.883743 Br\n0.464523 0.535476 0.204691 Br\n0.270750 0.135376 0.383743 Br\n0.864624 0.729249 0.383743 Br\n0.535476 0.464523 0.704691 Br\n0.535477 0.070954 0.704691 Br\n0.929045 0.464523 0.704691 Br\n0.864624 0.135375 0.383743 Br\n0.729249 0.864624 0.883743 Br\n0.666667 0.333333 0.101920 O\n0.333333 0.666667 0.601920 O\n",
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"formula_full": "Yb8 Br12 O2",
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{
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"structure_string": "Re1 Cl6\n1.0\n-2.990441 -5.179594 -0.000000\n2.990440 -5.179594 -0.000000\n-0.000000 -3.453064 5.465105\nRe Cl\n1 6\ndirect\n0.000000 0.000000 0.000000 Re\n0.393584 0.764275 0.757713 Cl\n0.764275 0.084426 0.757713 Cl\n0.084426 0.393585 0.757713 Cl\n0.606415 0.235724 0.242286 Cl\n0.235724 0.915573 0.242286 Cl\n0.915573 0.606415 0.242286 Cl\n",
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"volume": 169.30094839195695,
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"formula_full": "Re1 Cl6",
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{
"id": "jvasp-108838",
"created_at": "2022-09-04T14:38:19.015175Z",
"updated_at": "2022-09-04T14:38:19.015199Z",
"structure_string": "Ti1 Tl3\n1.0\n4.590645 -0.000000 0.000000\n0.000000 4.590645 0.000000\n0.000000 0.000000 4.590645\nTi Tl\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n-0.000000 0.499999 0.499999 Tl\n0.499999 0.000000 0.499999 Tl\n0.499999 0.499999 -0.000000 Tl\n",
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"density": 11.345941287812686,
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"spacegroup": 221
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{
"id": "jvasp-93721",
"created_at": "2022-09-04T14:36:07.771359Z",
"updated_at": "2022-09-04T14:36:07.771379Z",
"structure_string": "Ce2 Mg4\n1.0\n3.127953 -0.000000 -0.000000\n-1.563976 2.708887 0.000000\n-0.000000 0.000000 17.126065\nCe Mg\n2 4\ndirect\n0.333332 0.666668 0.750000 Ce\n0.666666 0.333333 0.250000 Ce\n0.666666 0.333333 0.922413 Mg\n0.666666 0.333333 0.577587 Mg\n0.333332 0.666668 0.422413 Mg\n0.333332 0.666668 0.077587 Mg\n",
"nsites": 6,
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{
"id": "jvasp-109183",
"created_at": "2022-09-04T14:38:18.044503Z",
"updated_at": "2022-09-04T14:38:18.044535Z",
"structure_string": "Ga1 Ge1\n1.0\n3.541840 -0.000000 2.044882\n1.180613 3.339279 2.044882\n-0.000000 -0.000000 4.089764\nGa Ge\n1 1\ndirect\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Ge\n",
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{
"id": "jvasp-17411",
"created_at": "2022-09-04T14:38:29.157233Z",
"updated_at": "2022-09-04T14:38:29.157258Z",
"structure_string": "Yb1 Tl1 S2\n1.0\n3.687641 -0.155838 6.089751\n1.581592 3.334899 6.089751\n-0.258298 -0.155838 7.114565\nYb Tl S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500001 Tl\n0.742109 0.742109 0.742111 S\n0.257890 0.257890 0.257891 S\n",
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"volume": 96.73732171436963,
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"formula_full": "Yb1 Tl1 S2",
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"spacegroup": 166
},
{
"id": "jvasp-59172",
"created_at": "2022-09-04T14:38:36.355672Z",
"updated_at": "2022-09-04T14:38:36.355687Z",
"structure_string": "Rb12 Co4 O8\n1.0\n6.164626 0.000000 0.000000\n-0.000000 7.670757 0.000000\n0.000000 0.000000 12.274174\nRb Co O\n12 4 8\ndirect\n0.792003 0.750000 0.100089 Rb\n0.320796 0.999112 0.138250 Rb\n0.179204 0.500889 0.638249 Rb\n0.679204 0.499112 0.861750 Rb\n0.179204 0.999112 0.638249 Rb\n0.679204 0.000889 0.861750 Rb\n0.820797 0.000889 0.361750 Rb\n0.320796 0.500889 0.138250 Rb\n0.707998 0.750000 0.600088 Rb\n0.207998 0.250000 0.899911 Rb\n0.292003 0.250000 0.399911 Rb\n0.820797 0.499112 0.361750 Rb\n0.193601 0.750000 0.881611 Co\n0.693601 0.250000 0.618388 Co\n0.806400 0.250000 0.118388 Co\n0.306400 0.750000 0.381612 Co\n0.516618 0.750000 0.285425 O\n0.587448 0.250000 0.027523 O\n0.087448 0.750000 0.472477 O\n0.412552 0.750000 0.972477 O\n0.912553 0.250000 0.527523 O\n0.016617 0.250000 0.214575 O\n0.483383 0.250000 0.714575 O\n0.983383 0.750000 0.785425 O\n",
"nsites": 24,
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],
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"formula_full": "Rb12 Co4 O8",
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{
"id": "jvasp-5809",
"created_at": "2022-09-04T14:37:58.229287Z",
"updated_at": "2022-09-04T14:37:58.229311Z",
"structure_string": "Mg2 P2 Se6\n1.0\n5.840011 -0.007249 5.011887\n2.298963 5.368481 5.011884\n-0.011002 -0.007243 7.695754\nMg P Se\n2 2 6\ndirect\n0.167995 0.167995 0.167995 Mg\n0.832005 0.832005 0.832004 Mg\n0.444447 0.444448 0.444447 P\n0.555552 0.555553 0.555552 P\n0.410285 0.748842 0.084450 Se\n0.084450 0.410285 0.748842 Se\n0.748842 0.084450 0.410285 Se\n0.589715 0.251158 0.915550 Se\n0.915550 0.589715 0.251158 Se\n0.251157 0.915550 0.589714 Se\n",
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{
"id": "jvasp-65103",
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"updated_at": "2022-09-04T14:35:49.135993Z",
"structure_string": "Be1 Tl1 Se4\n1.0\n0.000000 4.170683 4.170683\n4.170683 -0.000000 4.170683\n4.170683 4.170683 0.000000\nBe Tl Se\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Tl\n0.119494 0.626835 0.626835 Se\n0.626835 0.626835 0.626835 Se\n0.626835 0.119494 0.626835 Se\n0.626835 0.626835 0.119494 Se\n",
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{
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"created_at": "2022-09-04T14:37:26.931322Z",
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"structure_string": "Pd2 Pb4\n1.0\n5.562806 -0.018050 -1.526225\n-3.238926 4.522665 -1.526225\n0.009312 0.018049 5.768370\nPd Pb\n2 4\ndirect\n0.750000 0.750001 -0.000001 Pd\n0.250000 0.250000 -0.000000 Pd\n0.837475 0.662526 0.499999 Pb\n0.337474 0.837475 0.174948 Pb\n0.162525 0.337475 0.500000 Pb\n0.662526 0.162526 0.825049 Pb\n",
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{
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"structure_string": "Ca1 Ge2\n1.0\n-2.004910 -3.472605 0.000000\n-4.009818 0.000000 0.000000\n-2.004910 -1.157535 -5.209949\nCa Ge\n1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.796899 0.796897 0.609309 Ge\n0.203103 0.203102 0.390691 Ge\n",
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