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"structure_string": "Rb2 Sb1 Au1 I6\n1.0\n7.290098 -0.000000 4.208940\n2.430033 6.873170 4.208940\n-0.000000 -0.000000 8.417880\nRb Sb Au I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n0.746155 0.253845 0.253845 I\n0.253845 0.253845 0.746155 I\n0.253845 0.746155 0.746155 I\n0.253845 0.746155 0.253845 I\n0.746155 0.253845 0.746155 I\n0.746155 0.746155 0.253845 I\n",
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"structure_string": "Ca2 Br1\n1.0\n5.596199 0.000000 1.781338\n0.000000 3.768932 0.000000\n2.512786 0.000000 6.800056\nCa Br\n2 1\ndirect\n-0.032258 0.000000 -0.034183 Ca\n-0.034410 0.000000 0.466901 Ca\n0.466668 0.000000 -0.032718 Br\n",
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