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"structure_string": "Ba1 Bi1 Br1\n1.0\n3.676724 0.000000 -0.000000\n0.000000 3.676724 0.000000\n0.000000 -0.000000 9.530686\nBa Bi Br\n1 1 1\ndirect\n0.000000 0.000000 0.266425 Ba\n0.000000 0.000000 0.640121 Bi\n0.000000 0.000000 -0.041846 Br\n",
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