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"structure_string": "Mg1 Zn1\n1.0\n3.113675 -0.000000 -0.000000\n-1.556838 2.696522 -0.000000\n-0.000000 0.000000 4.433251\nMg Zn\n1 1\ndirect\n0.333333 0.666667 0.500000 Mg\n0.000000 0.000000 0.000000 Zn\n",
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"structure_string": "Br2 Cl2\n1.0\n3.235564 2.261785 0.000000\n-3.235564 2.261785 0.000000\n0.000000 0.000000 7.817153\nBr Cl\n2 2\ndirect\n0.999861 0.999861 0.375012 Br\n0.000141 0.000141 0.875012 Br\n0.681402 0.681402 0.624988 Cl\n0.318600 0.318600 0.124988 Cl\n",
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