# generated using pymatgen data_Hf9CrRe3Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.61881177 _cell_length_b 8.61881077 _cell_length_c 8.35711910 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000002 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9CrRe3Ir _chemical_formula_sum 'Hf18 Cr2 Re6 Ir2' _cell_volume 537.62810591 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Hf Hf0 1 0.19453920 0.80546080 0.44516358 1.0 Hf Hf1 1 0.19453920 0.38907840 0.44516358 1.0 Hf Hf2 1 0.61092160 0.80546080 0.44516358 1.0 Hf Hf3 1 0.80546080 0.19453920 0.55483642 1.0 Hf Hf4 1 0.80546080 0.61092160 0.55483642 1.0 Hf Hf5 1 0.38907840 0.19453920 0.55483642 1.0 Hf Hf6 1 0.80546080 0.19453920 0.94516358 1.0 Hf Hf7 1 0.80546080 0.61092160 0.94516358 1.0 Hf Hf8 1 0.38907840 0.19453920 0.94516358 1.0 Hf Hf9 1 0.19453920 0.80546080 0.05483642 1.0 Hf Hf10 1 0.19453920 0.38907840 0.05483642 1.0 Hf Hf11 1 0.61092160 0.80546080 0.05483642 1.0 Hf Hf12 1 0.54150889 0.45849111 0.25000000 1.0 Hf Hf13 1 0.54150889 0.08301778 0.25000000 1.0 Hf Hf14 1 0.91698222 0.45849111 0.25000000 1.0 Hf Hf15 1 0.45849111 0.54150889 0.75000000 1.0 Hf Hf16 1 0.45849111 0.91698222 0.75000000 1.0 Hf Hf17 1 0.08301778 0.54150889 0.75000000 1.0 Cr Cr18 1 0.00000000 0.00000000 0.50000000 1.0 Cr Cr19 1 0.00000000 0.00000000 0.00000000 1.0 Re Re20 1 0.89185137 0.10814863 0.25000000 1.0 Re Re21 1 0.89185137 0.78370474 0.25000000 1.0 Re Re22 1 0.21629526 0.10814863 0.25000000 1.0 Re Re23 1 0.10814863 0.89185137 0.75000000 1.0 Re Re24 1 0.10814863 0.21629526 0.75000000 1.0 Re Re25 1 0.78370474 0.89185137 0.75000000 1.0 Ir Ir26 1 0.33333300 0.66666700 0.25000000 1.0 Ir Ir27 1 0.66666700 0.33333300 0.75000000 1.0