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"structure_string": "Sr2 Br4\n1.0\n7.070457 -0.000000 0.000000\n0.000000 7.070457 0.000000\n-0.000000 -0.000000 4.653333\nSr Br\n2 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.303096 0.303096 -0.000000 Br\n0.696904 0.696904 -0.000000 Br\n0.196904 0.803097 0.500000 Br\n0.803097 0.196904 0.500000 Br\n",
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{
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{
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