# generated using pymatgen data_Ta5ZnRu4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.16735885 _cell_length_b 3.16735885 _cell_length_c 15.74894927 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta5ZnRu4 _chemical_formula_sum 'Ta5 Zn1 Ru4' _cell_volume 157.99601153 _cell_formula_units_Z 1 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 0.00000000 0.00000000 0.89083736 1.0 Ta Ta1 1 0.00000000 0.00000000 0.10916264 1.0 Ta Ta2 1 0.00000000 0.00000000 0.31571281 1.0 Ta Ta3 1 0.00000000 0.00000000 0.68428719 1.0 Ta Ta4 1 0.50000000 0.50000000 0.00000000 1.0 Zn Zn5 1 0.00000000 0.00000000 0.50000000 1.0 Ru Ru6 1 0.50000000 0.50000000 0.21200995 1.0 Ru Ru7 1 0.50000000 0.50000000 0.40481704 1.0 Ru Ru8 1 0.50000000 0.50000000 0.59518296 1.0 Ru Ru9 1 0.50000000 0.50000000 0.78799005 1.0