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"structure_string": "B2 C4 N2\n1.0\n4.277244 -0.836559 -0.559129\n-0.658461 4.281994 0.734822\n-0.765139 0.592398 4.148796\nB C N\n2 4 2\ndirect\n0.281095 0.209842 0.197021 B\n0.459829 0.031107 0.552993 B\n0.459076 0.552042 0.031947 C\n0.963936 0.539731 0.548123 C\n0.789737 0.713931 0.201869 C\n0.802045 0.209072 0.718049 C\n0.953791 0.040486 0.036973 N\n0.290489 0.703788 0.713023 N\n",
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