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"structure_string": "Na3 Sc1 Br6\n1.0\n6.622427 0.000000 3.823460\n2.207475 6.243684 3.823460\n0.000000 0.000000 7.646920\nNa Sc Br\n3 1 6\ndirect\n0.750001 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.757677 0.242323 0.242323 Br\n0.242324 0.242323 0.757677 Br\n0.242324 0.757676 0.757677 Br\n0.242324 0.757676 0.242323 Br\n0.757677 0.242323 0.757676 Br\n0.757678 0.757676 0.242323 Br\n",
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"structure_string": "K2 Tl1 Cu1 Br6\n1.0\n6.621872 -0.000000 3.823140\n2.207291 6.243161 3.823140\n-0.000000 -0.000000 7.646279\nK Tl Cu Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Cu\n0.737230 0.262770 0.262770 Br\n0.262770 0.262770 0.737230 Br\n0.262770 0.737230 0.737230 Br\n0.262770 0.737230 0.262770 Br\n0.737230 0.262770 0.737230 Br\n0.737230 0.737230 0.262770 Br\n",
"nsites": 10,
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{
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"created_at": "2022-09-04T14:36:41.994186Z",
"updated_at": "2022-09-04T14:36:41.994209Z",
"structure_string": "Te2 Pb6\n1.0\n6.944383 -0.000000 0.000000\n-3.472190 6.014013 0.000000\n0.000000 0.000000 6.055111\nTe Pb\n2 6\ndirect\n0.333333 0.666667 0.750000 Te\n0.666667 0.333333 0.250000 Te\n0.166539 0.333077 0.250000 Pb\n0.666922 0.833461 0.250000 Pb\n0.166538 0.833461 0.250000 Pb\n0.833461 0.666922 0.750000 Pb\n0.333077 0.166539 0.750000 Pb\n0.833461 0.166539 0.750000 Pb\n",
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{
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"structure_string": "Cd3 Te3\n1.0\n2.284601 -3.957046 -0.000000\n2.284601 3.957046 0.000000\n0.000000 0.000000 10.489469\nCd Te\n3 3\ndirect\n-0.000000 0.446728 0.666667 Cd\n0.446728 -0.000000 0.333333 Cd\n0.553272 0.553272 -0.000000 Cd\n-0.000000 0.474821 0.166667 Te\n0.474821 -0.000000 0.833333 Te\n0.525179 0.525179 0.500000 Te\n",
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{
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"created_at": "2022-09-04T14:38:29.798942Z",
"updated_at": "2022-09-04T14:38:29.798978Z",
"structure_string": "Pr6 Te8\n1.0\n7.839091 -0.000000 -2.771537\n-3.919545 6.788852 -2.771537\n0.000000 0.000000 8.314611\nPr Te\n6 8\ndirect\n0.750000 0.875000 0.124999 Pr\n0.625000 0.375000 0.250000 Pr\n0.875000 0.125000 0.750000 Pr\n0.125000 0.750000 0.875000 Pr\n0.375000 0.250000 0.625000 Pr\n0.250000 0.625000 0.375000 Pr\n0.650257 0.650257 0.650256 Te\n0.349743 0.500000 -0.000000 Te\n0.500000 0.000000 0.349743 Te\n0.000000 0.349743 0.500000 Te\n0.500000 -0.000000 0.849743 Te\n0.000000 0.849743 0.500000 Te\n0.150257 0.150257 0.150257 Te\n0.849743 0.500000 -0.000000 Te\n",
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"updated_at": "2022-09-04T14:37:07.624180Z",
"structure_string": "Ba1 Se1\n1.0\n3.983533 -0.000000 0.000000\n0.000000 3.983533 0.000000\n0.000000 0.000000 3.983533\nBa Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Se\n",
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{
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"created_at": "2022-09-04T14:37:16.770246Z",
"updated_at": "2022-09-04T14:37:16.770269Z",
"structure_string": "Te2 Mo1 W2 Se2 S2\n1.0\n3.353902 0.000000 0.000000\n-1.676951 2.904567 -0.000047\n0.000000 -0.000537 29.198883\nTe Mo W Se S\n2 1 2 2 2\ndirect\n0.333392 0.666784 0.414860 Te\n0.333371 0.666742 0.284076 Te\n0.333273 0.666546 0.111236 Mo\n0.333325 0.666650 0.580237 W\n0.666713 0.333427 0.349444 W\n0.666589 0.333177 0.054296 Se\n0.666624 0.333248 0.168276 Se\n0.666654 0.333308 0.528064 S\n0.666661 0.333320 0.632351 S\n",
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{
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"created_at": "2022-09-04T14:37:35.493956Z",
"updated_at": "2022-09-04T14:37:35.493972Z",
"structure_string": "Sr4 Bi2 O1\n1.0\n5.027977 -0.000000 -0.000000\n-0.000000 5.027977 -0.000000\n-2.513988 -2.513988 8.750238\nSr Bi O\n4 2 1\ndirect\n0.166540 0.166540 0.333080 Sr\n0.833461 0.833461 0.666920 Sr\n0.000000 0.500000 0.000000 Sr\n0.500000 0.000000 0.000000 Sr\n0.360627 0.360627 0.721252 Bi\n0.639374 0.639374 0.278748 Bi\n0.000000 0.000000 0.000000 O\n",
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"created_at": "2022-09-04T14:38:53.693334Z",
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"structure_string": "Cd1 Sb1 Br1\n1.0\n3.348271 0.000000 0.000000\n0.000000 3.348271 0.000000\n0.000000 0.000000 8.456303\nCd Sb Br\n1 1 1\ndirect\n0.000000 -0.000000 0.639917 Cd\n0.000000 0.000000 -0.006953 Sb\n0.000000 -0.000000 0.315398 Br\n",
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{
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"created_at": "2022-09-04T14:36:10.843143Z",
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"structure_string": "Ag1 Bi1 Te3 Pb1\n1.0\n5.787206 -0.008114 -5.101683\n-0.588802 4.238142 -6.419538\n0.004353 0.008114 7.714850\nAg Bi Te Pb\n1 1 3 1\ndirect\n0.002116 0.002116 0.000000 Ag\n0.327863 0.327863 0.000000 Bi\n0.492963 0.992962 0.500000 Te\n0.155562 0.655561 0.499999 Te\n0.847478 0.347478 0.500001 Te\n0.674022 0.674022 0.000001 Pb\n",
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