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"structure_string": "Tl3 Bi1\n1.0\n5.014692 -0.000000 0.000000\n0.000000 5.014692 0.000000\n0.000000 0.000000 5.014692\nTl Bi\n3 1\ndirect\n-0.000000 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 Bi\n",
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