# generated using pymatgen data_Zr4Ta6ReRu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.63135747 _cell_length_b 5.63135702 _cell_length_c 8.49152802 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000264 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4Ta6ReRu _chemical_formula_sum 'Zr4 Ta6 Re1 Ru1' _cell_volume 233.20756023 _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 Zr Zr0 1 0.33333300 0.66666700 0.43947113 1.0 Zr Zr1 1 0.66666700 0.33333300 0.56052887 1.0 Zr Zr2 1 0.66666700 0.33333300 0.93860433 1.0 Zr Zr3 1 0.33333300 0.66666700 0.06139567 1.0 Ta Ta4 1 0.83213844 0.16786156 0.24933861 1.0 Ta Ta5 1 0.83213844 0.66427988 0.24933861 1.0 Ta Ta6 1 0.33572012 0.16786156 0.24933861 1.0 Ta Ta7 1 0.16786156 0.83213844 0.75066139 1.0 Ta Ta8 1 0.16786156 0.33572012 0.75066139 1.0 Ta Ta9 1 0.66427988 0.83213844 0.75066139 1.0 Re Re10 1 0.00000000 0.00000000 0.50000000 1.0 Ru Ru11 1 0.00000000 0.00000000 0.00000000 1.0