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"structure_string": "Sm4 B4 S12\n1.0\n6.040839 0.000000 0.000000\n0.000000 7.377523 0.000000\n0.000000 0.000000 8.850500\nSm B S\n4 4 12\ndirect\n0.064065 0.616205 0.758345 Sm\n0.435935 0.116205 0.758345 Sm\n0.564065 0.883794 0.258345 Sm\n0.935935 0.383795 0.258345 Sm\n0.599412 0.643897 0.928164 B\n0.400588 0.356102 0.428164 B\n0.900588 0.143898 0.928164 B\n0.099412 0.856102 0.428164 B\n0.665463 0.175159 0.054965 S\n0.390099 0.504392 0.266221 S\n0.609901 0.495608 0.766221 S\n0.890100 0.995608 0.766221 S\n0.109901 0.004392 0.266221 S\n0.364213 0.794992 0.958406 S\n0.864213 0.705007 0.458406 S\n0.135787 0.294992 0.958406 S\n0.635787 0.205008 0.458406 S\n0.334537 0.824841 0.554965 S\n0.165463 0.324841 0.554965 S\n0.834538 0.675159 0.054965 S\n",
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