# generated using pymatgen data_Hf9CrRe3B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.38667732 _cell_length_b 8.38673909 _cell_length_c 8.45515379 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99752431 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9CrRe3B _chemical_formula_sum 'Hf18 Cr2 Re6 B2' _cell_volume 515.04602916 _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 0.19969502 0.80028953 0.44400922 1.0 Hf Hf1 1 0.19972709 0.39945115 0.44401931 1.0 Hf Hf2 1 0.60057961 0.80028171 0.44401269 1.0 Hf Hf3 1 0.80030498 0.19971047 0.55599078 1.0 Hf Hf4 1 0.80027291 0.60054885 0.55598069 1.0 Hf Hf5 1 0.39942039 0.19971829 0.55598731 1.0 Hf Hf6 1 0.80030498 0.19971047 0.94400922 1.0 Hf Hf7 1 0.80027291 0.60054885 0.94401931 1.0 Hf Hf8 1 0.39942039 0.19971829 0.94401269 1.0 Hf Hf9 1 0.19969502 0.80028953 0.05599078 1.0 Hf Hf10 1 0.19972709 0.39945115 0.05598069 1.0 Hf Hf11 1 0.60057961 0.80028171 0.05598731 1.0 Hf Hf12 1 0.54125172 0.45874607 0.25000000 1.0 Hf Hf13 1 0.54126423 0.08252205 0.25000000 1.0 Hf Hf14 1 0.91749606 0.45874245 0.25000000 1.0 Hf Hf15 1 0.45874828 0.54125393 0.75000000 1.0 Hf Hf16 1 0.45873577 0.91747795 0.75000000 1.0 Hf Hf17 1 0.08250394 0.54125755 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 0.89082706 0.10917890 0.25000000 1.0 Re Re21 1 0.89080874 0.78161888 0.25000000 1.0 Re Re22 1 0.21836060 0.10918413 0.25000000 1.0 Re Re23 1 0.10917294 0.89082110 0.75000000 1.0 Re Re24 1 0.10919126 0.21838112 0.75000000 1.0 Re Re25 1 0.78163940 0.89081587 0.75000000 1.0 B B26 1 0.33332778 0.66665306 0.25000000 1.0 B B27 1 0.66667222 0.33334694 0.75000000 1.0