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"structure_string": "Tb2 Cu2 As4\n1.0\n3.928726 0.000000 0.000000\n0.000000 3.928726 -0.000000\n0.000000 0.000000 9.886624\nTb Cu As\n2 2 4\ndirect\n0.500000 0.000000 0.763333 Tb\n0.000000 0.500000 0.236666 Tb\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 0.500000 Cu\n0.500000 0.500000 0.000000 As\n0.000000 0.000000 0.000000 As\n0.500000 0.000000 0.339034 As\n0.000000 0.500000 0.660965 As\n",
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"structure_string": "Tc1 Br6 O2\n1.0\n-4.757573 -4.757573 0.000000\n-4.757573 -0.000000 -4.757573\n0.000000 -4.757573 -4.757573\nTc Br O\n1 6 2\ndirect\n0.000000 0.000000 0.000000 Tc\n0.745822 0.254178 0.254178 Br\n0.745822 0.254178 0.745822 Br\n0.745822 0.745822 0.254178 Br\n0.254178 0.745822 0.745822 Br\n0.254178 0.745822 0.254178 Br\n0.254178 0.254178 0.745822 Br\n0.250000 0.250000 0.250000 O\n0.749999 0.749999 0.749999 O\n",
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"structure_string": "Ba6 Ir6 O18\n1.0\n5.773806 0.010566 -0.079714\n-2.868772 5.010698 -0.079714\n-0.028128 -0.048618 14.601136\nBa Ir O\n6 6 18\ndirect\n0.655668 0.324239 0.404100 Ba\n0.675763 0.344333 0.095901 Ba\n0.344333 0.675762 0.595901 Ba\n0.324239 0.655667 0.904100 Ba\n0.002552 0.997449 0.250000 Ba\n0.997449 0.002552 0.750001 Ba\n0.675759 0.345168 0.653475 Ir\n0.324242 0.654833 0.346526 Ir\n0.345168 0.675759 0.153475 Ir\n-0.000000 -0.000000 0.500000 Ir\n0.000000 0.000000 0.000000 Ir\n0.654833 0.324242 0.846526 Ir\n0.040159 0.512351 0.241948 O\n0.487651 0.959842 0.258053 O\n0.959843 0.487650 0.758053 O\n0.110158 0.291776 0.407483 O\n0.513247 0.486754 0.750000 O\n0.814958 0.620797 0.946478 O\n0.379204 0.185043 0.553523 O\n0.185044 0.379204 0.053523 O\n0.620797 0.814958 0.446477 O\n0.899460 0.199936 0.592858 O\n0.800065 0.100542 0.907143 O\n0.100542 0.800065 0.407143 O\n0.199936 0.899459 0.092858 O\n0.291776 0.110158 0.907483 O\n0.889843 0.708224 0.592518 O\n0.708225 0.889843 0.092518 O\n0.486754 0.513247 0.250000 O\n0.512351 0.040159 0.741948 O\n",
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