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"structure_string": "Ce2\n1.0\n3.168863 -0.000000 -0.000000\n-1.584432 3.099721 0.000000\n-0.000000 -0.000000 5.259956\nCe\n2\ndirect\n0.099489 0.198977 0.750001 Ce\n0.900511 0.801022 0.250000 Ce\n",
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