# generated using pymatgen data_Pa2AlRu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.24762896 _cell_length_b 5.24762874 _cell_length_c 7.56620074 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 111.92997455 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pa2AlRu2 _chemical_formula_sum 'Pa4 Al2 Ru4' _cell_volume 193.27870882 _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 Pa Pa0 1 0.35439194 0.64560806 0.09950833 1.0 Pa Pa1 1 0.64560806 0.35439194 0.90049167 1.0 Pa Pa2 1 0.14560806 0.85439194 0.59950833 1.0 Pa Pa3 1 0.85439194 0.14560806 0.40049167 1.0 Al Al4 1 0.00000000 0.00000000 0.00000000 1.0 Al Al5 1 0.50000000 0.50000000 0.50000000 1.0 Ru Ru6 1 0.87334006 0.62665994 0.25000000 1.0 Ru Ru7 1 0.62665994 0.87334006 0.75000000 1.0 Ru Ru8 1 0.12665994 0.37334006 0.75000000 1.0 Ru Ru9 1 0.37334006 0.12665994 0.25000000 1.0