# generated using pymatgen data_Hf9Re2W2Se _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.67910208 _cell_length_b 8.67910248 _cell_length_c 8.60326666 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.13558725 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9Re2W2Se _chemical_formula_sum 'Hf18 Re4 W4 Se2' _cell_volume 560.46518860 _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 0.19100919 0.80899081 0.45149136 1.0 Hf Hf1 1 0.19112885 0.38175585 0.45211468 1.0 Hf Hf2 1 0.61824415 0.80887115 0.45211468 1.0 Hf Hf3 1 0.80875830 0.19124170 0.55083409 1.0 Hf Hf4 1 0.80814133 0.61687105 0.55079088 1.0 Hf Hf5 1 0.38312895 0.19185867 0.55079088 1.0 Hf Hf6 1 0.80875830 0.19124170 0.94916591 1.0 Hf Hf7 1 0.80814133 0.61687105 0.94920912 1.0 Hf Hf8 1 0.38312895 0.19185867 0.94920912 1.0 Hf Hf9 1 0.19100919 0.80899081 0.04850864 1.0 Hf Hf10 1 0.19112885 0.38175585 0.04788532 1.0 Hf Hf11 1 0.61824415 0.80887115 0.04788532 1.0 Hf Hf12 1 0.54482171 0.45517829 0.25000000 1.0 Hf Hf13 1 0.54465133 0.08901483 0.25000000 1.0 Hf Hf14 1 0.91098517 0.45534867 0.25000000 1.0 Hf Hf15 1 0.45308155 0.54691845 0.75000000 1.0 Hf Hf16 1 0.45344557 0.90608456 0.75000000 1.0 Hf Hf17 1 0.09391544 0.54655443 0.75000000 1.0 Re Re18 1 0.11088084 0.22137784 0.75000000 1.0 Re Re19 1 0.77862216 0.88911916 0.75000000 1.0 Re Re20 1 0.99976819 0.00023181 0.50106705 1.0 Re Re21 1 0.99976819 0.00023181 0.99893295 1.0 W W22 1 0.89074989 0.10925011 0.25000000 1.0 W W23 1 0.88997187 0.78088089 0.25000000 1.0 W W24 1 0.21911911 0.11002813 0.25000000 1.0 W W25 1 0.10838929 0.89161071 0.75000000 1.0 Se Se26 1 0.33332651 0.66667349 0.25000000 1.0 Se Se27 1 0.66768262 0.33231738 0.75000000 1.0