# generated using pymatgen data_Ta3Be2IrRu4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.35319265 _cell_length_b 9.35319265 _cell_length_c 3.13745068 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3Be2IrRu4 _chemical_formula_sum 'Ta6 Be4 Ir2 Ru8' _cell_volume 274.47112757 _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 Ta Ta0 1 0.82301549 0.67698451 0.00000000 1.0 Ta Ta1 1 0.17698451 0.32301549 0.00000000 1.0 Ta Ta2 1 0.32301549 0.82301549 0.00000000 1.0 Ta Ta3 1 0.67698451 0.17698451 0.00000000 1.0 Ta Ta4 1 0.50000000 0.50000000 0.00000000 1.0 Ta Ta5 1 0.00000000 0.00000000 0.00000000 1.0 Be Be6 1 0.62121369 0.87878631 0.00000000 1.0 Be Be7 1 0.37878631 0.12121369 0.00000000 1.0 Be Be8 1 0.12121369 0.62121369 0.00000000 1.0 Be Be9 1 0.87878631 0.37878631 0.00000000 1.0 Ir Ir10 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir11 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru12 1 0.57166774 0.71275251 0.50000000 1.0 Ru Ru13 1 0.42833226 0.28724749 0.50000000 1.0 Ru Ru14 1 0.07166774 0.78724749 0.50000000 1.0 Ru Ru15 1 0.92833226 0.21275251 0.50000000 1.0 Ru Ru16 1 0.28724749 0.57166774 0.50000000 1.0 Ru Ru17 1 0.71275251 0.42833226 0.50000000 1.0 Ru Ru18 1 0.21275251 0.07166774 0.50000000 1.0 Ru Ru19 1 0.78724749 0.92833226 0.50000000 1.0