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{
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"structure_string": "Y1 C1 N2\n1.0\n1.744428 1.007146 5.235331\n-1.744428 1.007146 5.235331\n0.000000 -2.014292 5.235331\nY C N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.500001 0.500001 0.499998 C\n0.421004 0.421004 0.421002 N\n0.578998 0.578998 0.578995 N\n",
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{
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