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{
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{
"id": "jvasp-100244",
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"structure_string": "Tl3 Sb1\n1.0\n4.965967 0.000000 0.000000\n0.000000 4.965967 0.000000\n-0.000000 -0.000000 4.965967\nTl Sb\n3 1\ndirect\n0.000000 0.500000 0.500000 Tl\n0.500000 0.000000 0.500000 Tl\n0.500000 0.500000 0.000000 Tl\n0.000000 0.000000 0.000000 Sb\n",
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{
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"structure_string": "Tl1 Sb1\n1.0\n3.899037 -0.000000 0.000000\n-0.000000 3.899037 0.000000\n-0.000000 -0.000000 3.899037\nTl Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Sb\n",
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{
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"structure_string": "Tl1 Sb1\n1.0\n3.380030 3.380030 -0.000000\n3.380030 0.000000 -3.380030\n0.000000 3.380030 -3.380030\nTl Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Tl\n0.750000 0.750000 0.750000 Sb\n",
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{
"id": "jvasp-23549",
"created_at": "2022-09-04T14:37:34.817110Z",
"updated_at": "2022-09-04T14:37:34.817136Z",
"structure_string": "U6 Ti2 Sb10\n1.0\n4.524283 -7.836288 0.000000\n4.524283 7.836288 0.000000\n-0.000000 -0.000000 6.088509\nU Ti Sb\n6 2 10\ndirect\n-0.000000 0.612826 0.250000 U\n0.612825 0.612825 0.750000 U\n0.387174 -0.000000 0.750000 U\n0.612826 -0.000000 0.250000 U\n0.387174 0.387174 0.250000 U\n-0.000000 0.387174 0.750000 U\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.735717 0.735717 0.250000 Sb\n-0.000000 0.735718 0.750000 Sb\n0.666667 0.333333 0.000000 Sb\n0.333333 0.666667 0.500000 Sb\n0.666667 0.333333 0.500000 Sb\n-0.000000 0.264282 0.250000 Sb\n0.333333 0.666667 0.000000 Sb\n0.264282 -0.000000 0.250000 Sb\n0.264282 0.264282 0.750000 Sb\n0.735718 -0.000000 0.750000 Sb\n",
"nsites": 18,
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"elements": [
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"chemical_system": "Sb-Ti-U",
"density": 10.544777729396083,
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"volume": 431.7189376134966,
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"formula_full": "U6 Ti2 Sb10",
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"spacegroup": 193
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{
"id": "jvasp-56272",
"created_at": "2022-09-04T14:37:49.089580Z",
"updated_at": "2022-09-04T14:37:49.089600Z",
"structure_string": "Ti2 Sb2\n1.0\n1.908617 -3.305821 -0.000000\n1.908617 3.305821 -0.000000\n-0.000000 -0.000000 7.049966\nTi Sb\n2 2\ndirect\n0.333334 0.666668 0.250000 Ti\n0.666668 0.333334 0.750000 Ti\n0.000000 0.000000 0.000000 Sb\n0.000000 0.000000 0.500000 Sb\n",
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"spacegroup": 194
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{
"id": "jvasp-110931",
"created_at": "2022-09-04T14:38:37.499850Z",
"updated_at": "2022-09-04T14:38:37.499869Z",
"structure_string": "Ti4 Sb2\n1.0\n3.805917 0.002118 -6.902705\n-0.250340 3.797676 -6.902705\n-0.001982 -0.002118 7.882407\nTi Sb\n4 2\ndirect\n0.170278 0.170279 0.000001 Ti\n0.829722 0.829723 0.000003 Ti\n0.500001 0.000000 0.500001 Ti\n0.000000 0.500000 0.500001 Ti\n0.359221 0.359221 0.000001 Sb\n0.640780 0.640780 0.000002 Sb\n",
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{
"id": "jvasp-14786",
"created_at": "2022-09-04T14:38:32.658960Z",
"updated_at": "2022-09-04T14:38:32.658982Z",
"structure_string": "Ti2 Sb4\n1.0\n5.369656 -0.018149 -1.533102\n-3.060471 4.412149 -1.533102\n0.009538 0.018149 5.584221\nTi Sb\n2 4\ndirect\n0.750001 0.750000 0.000001 Ti\n0.250000 0.250000 0.000000 Ti\n0.847068 0.652934 0.500001 Sb\n0.347067 0.847067 0.194133 Sb\n0.152934 0.347067 0.500000 Sb\n0.652934 0.152934 0.805868 Sb\n",
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{
"id": "jvasp-19703",
"created_at": "2022-09-04T14:37:55.862099Z",
"updated_at": "2022-09-04T14:37:55.862120Z",
"structure_string": "Ti6 Sb2\n1.0\n5.211058 0.000000 -0.000000\n0.000000 5.211058 -0.000000\n0.000000 0.000000 5.211058\nTi Sb\n6 2\ndirect\n0.500000 0.250000 0.000000 Ti\n0.500000 0.750000 0.000000 Ti\n0.250000 0.000000 0.500000 Ti\n0.750000 0.000000 0.500000 Ti\n0.000000 0.500000 0.250000 Ti\n0.000000 0.500000 0.750000 Ti\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n",
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"spacegroup": 223
},
{
"id": "jvasp-23724",
"created_at": "2022-09-04T14:37:34.093415Z",
"updated_at": "2022-09-04T14:37:34.093441Z",
"structure_string": "Ti20 Sb12\n1.0\n7.209585 -0.000000 0.000000\n-0.000000 8.348185 0.000000\n0.000000 0.000000 10.216298\nTi Sb\n20 12\ndirect\n0.793878 0.936337 0.053800 Ti\n0.826100 0.750000 0.782097 Ti\n0.326099 0.250000 0.717903 Ti\n0.173901 0.250000 0.217903 Ti\n0.673901 0.750000 0.282097 Ti\n0.521429 0.250000 0.995578 Ti\n0.978572 0.250000 0.495578 Ti\n0.478572 0.750000 0.004422 Ti\n0.317319 0.750000 0.735513 Ti\n0.817319 0.250000 0.764487 Ti\n0.021429 0.750000 0.504422 Ti\n0.182681 0.750000 0.235513 Ti\n0.293878 0.436336 0.446200 Ti\n0.793878 0.563664 0.053800 Ti\n0.706123 0.936337 0.553800 Ti\n0.206122 0.063664 0.946200 Ti\n0.706123 0.563664 0.553800 Ti\n0.206122 0.436336 0.946200 Ti\n0.293878 0.063664 0.446200 Ti\n0.682682 0.250000 0.264487 Ti\n0.909357 0.250000 0.025936 Sb\n0.409357 0.750000 0.474065 Sb\n0.435089 0.008867 0.179021 Sb\n0.935089 0.991133 0.320979 Sb\n0.564912 0.508868 0.820979 Sb\n0.435089 0.491133 0.179021 Sb\n0.564912 0.991133 0.820979 Sb\n0.064911 0.008867 0.679021 Sb\n0.935089 0.508868 0.320979 Sb\n0.590644 0.250000 0.525936 Sb\n0.064911 0.491133 0.679021 Sb\n0.090643 0.750000 0.974065 Sb\n",
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{
"id": "jvasp-20613",
"created_at": "2022-09-04T14:38:12.477913Z",
"updated_at": "2022-09-04T14:38:12.477939Z",
"structure_string": "Ti2 Sb2\n1.0\n2.024891 -3.507213 0.000000\n2.024891 3.507213 -0.000000\n0.000000 0.000000 6.251538\nTi Sb\n2 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.333333 0.666667 0.750000 Sb\n0.666667 0.333333 0.250000 Sb\n",
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{
"id": "jvasp-56332",
"created_at": "2022-09-04T14:37:31.023177Z",
"updated_at": "2022-09-04T14:37:31.023204Z",
"structure_string": "Ti12 Sb4\n1.0\n4.932142 0.000000 1.754239\n2.466070 7.474346 0.877120\n-0.038655 -0.000000 7.919293\nTi Sb\n12 4\ndirect\n0.575822 0.708994 0.139360 Ti\n0.715182 0.860640 0.708993 Ti\n0.284817 0.139360 0.291007 Ti\n0.075822 0.139360 0.708993 Ti\n0.750000 -0.000000 0.000000 Ti\n0.784817 0.291007 0.139360 Ti\n0.424176 0.291007 0.860640 Ti\n0.250000 -0.000000 0.000000 Ti\n0.215182 0.708994 0.860640 Ti\n0.924177 0.860640 0.291007 Ti\n0.749999 0.500000 0.500000 Ti\n0.249999 0.500000 0.500000 Ti\n0.837649 0.500000 0.824701 Sb\n0.337649 0.824701 0.500000 Sb\n0.162350 0.500000 0.175300 Sb\n0.662349 0.175300 0.500000 Sb\n",
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{
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}