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"structure_string": "Ba2 Hf1 U1 O6\n1.0\n5.288215 0.000000 3.053152\n1.762738 4.985777 3.053153\n0.000000 -0.000000 6.106305\nBa Hf U O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750000 0.749999 Ba\n0.000000 0.000000 0.000000 Hf\n0.500000 0.500000 0.500000 U\n0.757652 0.242349 0.242348 O\n0.242349 0.757652 0.757651 O\n0.242349 0.757652 0.242348 O\n0.757652 0.242349 0.757651 O\n0.242349 0.242349 0.757652 O\n0.757652 0.757652 0.242347 O\n",
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"structure_string": "Ba2 Hg1\n1.0\n4.065478 -0.000000 -1.083443\n-0.288735 4.055211 -1.083443\n-0.032541 -0.034941 8.047201\nBa Hg\n2 1\ndirect\n0.369504 0.369504 0.739007 Ba\n0.630496 0.630496 0.260994 Ba\n0.000000 0.000000 0.000000 Hg\n",
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"structure_string": "Ba2 Hg1 Bi1\n1.0\n-6.445594 -4.989164 -11.868528\n-4.551258 -3.351525 -2.113690\n-2.822541 1.536761 -5.107707\nBa Hg Bi\n2 1 1\ndirect\n0.747857 0.004387 0.004388 Ba\n0.252144 -0.004389 -0.004387 Ba\n0.000000 0.000000 0.000000 Hg\n0.500000 -0.000001 0.000000 Bi\n",
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{
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{
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"structure_string": "Ba2 Hg1 Bi1\n1.0\n-13.824297 4.969749 0.134269\n-9.771811 1.676278 3.089803\n-8.041537 6.570574 0.093328\nBa Hg Bi\n2 1 1\ndirect\n0.749468 0.000401 0.000403 Ba\n0.250528 -0.000397 -0.000399 Ba\n0.000010 -0.000008 -0.000008 Hg\n0.499994 0.000005 0.000005 Bi\n",
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{
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