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"structure_string": "Sr1 Be2 Cl1\n1.0\n3.298011 0.000000 0.000000\n-0.000000 3.298011 -0.000000\n0.000000 -0.000000 8.117116\nSr Be Cl\n1 2 1\ndirect\n0.500000 0.500000 0.755634 Sr\n0.000000 0.000000 0.066405 Be\n0.500000 0.500000 0.127261 Be\n0.000000 0.000000 0.550701 Cl\n",
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