# generated using pymatgen data_Ce2AlRu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.99474297 _cell_length_b 5.99474297 _cell_length_c 6.67460727 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 121.14744671 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce2AlRu2 _chemical_formula_sum 'Ce4 Al2 Ru4' _cell_volume 205.28581871 _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 Ce Ce0 1 0.34175947 0.65824053 0.07146573 1.0 Ce Ce1 1 0.65824053 0.34175947 0.92853427 1.0 Ce Ce2 1 0.15824053 0.84175947 0.57146573 1.0 Ce Ce3 1 0.84175947 0.15824053 0.42853427 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 0.87108513 0.62891487 0.25000000 1.0 Ru Ru7 1 0.62891487 0.87108513 0.75000000 1.0 Ru Ru8 1 0.12891487 0.37108513 0.75000000 1.0 Ru Ru9 1 0.37108513 0.12891487 0.25000000 1.0