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"structure_string": "Na3 Cl2\n1.0\n0.000000 0.000000 -3.473793\n0.000000 -3.482148 0.000000\n-10.086324 1.741074 0.000000\nNa Cl\n3 2\ndirect\n0.000000 0.500000 0.000000 Na\n0.000000 0.331105 0.662209 Na\n0.000000 0.668896 0.337791 Na\n0.500000 0.913983 0.827964 Cl\n0.500000 0.086019 0.172036 Cl\n",
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