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"structure_string": "Mg2 B2 H2\n1.0\n3.587017 0.000000 -0.875633\n0.000000 3.074073 0.000000\n-1.593147 0.000000 6.020097\nMg B H\n2 2 2\ndirect\n0.720066 0.250000 0.253606 Mg\n0.279936 0.750000 0.746395 Mg\n-0.060347 0.250000 -0.063791 B\n0.060348 0.750000 0.063792 B\n0.686172 0.250000 0.716973 H\n0.313830 0.750000 0.283029 H\n",
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