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"structure_string": "Mn1 Zn1\n1.0\n2.989805 -0.000000 -0.000000\n-0.000000 2.989805 -0.000000\n0.000000 0.000000 2.989805\nMn Zn\n1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500001 0.500001 0.500001 Zn\n",
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"structure_string": "Ir3 N3\n1.0\n4.109393 0.000000 -0.000000\n0.000000 4.109393 -0.000000\n0.000000 0.000000 4.109393\nIr N\n3 3\ndirect\n0.500000 0.500000 0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n0.000000 0.500000 0.500000 Ir\n0.000000 0.000000 0.500000 N\n0.000000 0.500000 0.000000 N\n0.500000 0.000000 0.000000 N\n",
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"structure_string": "Pr1 Cd3\n1.0\n-0.000000 3.658644 3.658644\n3.658644 0.000000 3.658644\n3.658644 3.658644 0.000000\nPr Cd\n1 3\ndirect\n0.749998 0.749998 0.749998 Pr\n0.000000 0.000000 0.000000 Cd\n0.499998 0.499998 0.499998 Cd\n0.250000 0.250000 0.250000 Cd\n",
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"structure_string": "Te16 I8\n1.0\n4.177832 0.000000 0.000000\n0.000000 13.963518 0.000000\n0.000000 0.000000 15.461642\nTe I\n16 8\ndirect\n0.250000 0.232458 0.927224 Te\n0.250000 0.298720 0.185079 Te\n0.750000 0.701280 0.814921 Te\n0.750000 0.798720 0.314921 Te\n0.250000 0.201280 0.685079 Te\n0.250000 0.562723 0.781677 Te\n0.250000 0.937277 0.281677 Te\n0.750000 0.062723 0.718323 Te\n0.750000 0.437277 0.218323 Te\n0.250000 0.587533 0.585869 Te\n0.250000 0.912467 0.085869 Te\n0.750000 0.087533 0.914131 Te\n0.250000 0.267542 0.427224 Te\n0.750000 0.732458 0.572776 Te\n0.750000 0.767542 0.072776 Te\n0.750000 0.412467 0.414131 Te\n0.250000 0.873625 0.839043 I\n0.750000 0.397640 0.945327 I\n0.250000 0.602361 0.054673 I\n0.250000 0.897640 0.554673 I\n0.750000 0.102361 0.445327 I\n0.750000 0.373625 0.660957 I\n0.250000 0.626375 0.339043 I\n0.750000 0.126375 0.160957 I\n",
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{
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"structure_string": "Mn3 Re1\n1.0\n3.558585 -0.000000 2.054550\n1.186195 3.355066 2.054550\n-0.000000 -0.000000 4.109100\nMn Re\n3 1\ndirect\n0.250001 0.250000 0.250000 Mn\n0.750002 0.750001 0.749999 Mn\n0.500001 0.500001 0.499999 Mn\n0.000000 0.000000 0.000000 Re\n",
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