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"structure_string": "Ca1 Bi1 B1\n1.0\n0.000000 3.438334 3.438334\n3.438334 0.000000 3.438334\n3.438334 3.438334 0.000000\nCa Bi B\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Ca\n0.499999 0.499999 0.499999 Bi\n0.000000 0.000000 0.000000 B\n",
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