# generated using pymatgen data_CeSn3Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.83108000 _cell_length_b 9.83108000 _cell_length_c 9.83108000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CeSn3Ru _chemical_formula_sum 'Ce8 Sn24 Ru8' _cell_volume 950.17519903 _cell_formula_units_Z 8 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 0.00000000 0.50000000 0.75000000 1.0 Ce Ce1 1 0.50000000 0.25000000 0.00000000 1.0 Ce Ce2 1 0.75000000 0.00000000 0.50000000 1.0 Ce Ce3 1 0.00000000 0.50000000 0.25000000 1.0 Ce Ce4 1 0.50000000 0.75000000 0.00000000 1.0 Ce Ce5 1 0.25000000 0.00000000 0.50000000 1.0 Ce Ce6 1 0.50000000 0.50000000 0.50000000 1.0 Ce Ce7 1 0.00000000 0.00000000 0.00000000 1.0 Sn Sn8 1 0.81745500 0.34424000 0.50000000 1.0 Sn Sn9 1 0.65576000 0.50000000 0.81745500 1.0 Sn Sn10 1 0.50000000 0.18254500 0.65576000 1.0 Sn Sn11 1 0.18254500 0.65576000 0.50000000 1.0 Sn Sn12 1 0.34424000 0.50000000 0.18254500 1.0 Sn Sn13 1 0.50000000 0.81745500 0.34424000 1.0 Sn Sn14 1 0.81745500 0.65576000 0.50000000 1.0 Sn Sn15 1 0.65576000 0.50000000 0.18254500 1.0 Sn Sn16 1 0.18254500 0.34424000 0.50000000 1.0 Sn Sn17 1 0.34424000 0.50000000 0.81745500 1.0 Sn Sn18 1 0.50000000 0.81745500 0.65576000 1.0 Sn Sn19 1 0.50000000 0.18254500 0.34424000 1.0 Sn Sn20 1 0.31745500 0.00000000 0.84424000 1.0 Sn Sn21 1 0.15576000 0.31745500 0.00000000 1.0 Sn Sn22 1 0.00000000 0.15576000 0.68254500 1.0 Sn Sn23 1 0.68254500 0.00000000 0.15576000 1.0 Sn Sn24 1 0.84424000 0.68254500 0.00000000 1.0 Sn Sn25 1 0.00000000 0.84424000 0.31745500 1.0 Sn Sn26 1 0.31745500 0.00000000 0.15576000 1.0 Sn Sn27 1 0.15576000 0.68254500 0.00000000 1.0 Sn Sn28 1 0.68254500 0.00000000 0.84424000 1.0 Sn Sn29 1 0.84424000 0.31745500 0.00000000 1.0 Sn Sn30 1 0.00000000 0.15576000 0.31745500 1.0 Sn Sn31 1 0.00000000 0.84424000 0.68254500 1.0 Ru Ru32 1 0.75000000 0.25000000 0.75000000 1.0 Ru Ru33 1 0.25000000 0.75000000 0.25000000 1.0 Ru Ru34 1 0.75000000 0.75000000 0.25000000 1.0 Ru Ru35 1 0.25000000 0.25000000 0.75000000 1.0 Ru Ru36 1 0.25000000 0.75000000 0.75000000 1.0 Ru Ru37 1 0.75000000 0.25000000 0.25000000 1.0 Ru Ru38 1 0.25000000 0.25000000 0.25000000 1.0 Ru Ru39 1 0.75000000 0.75000000 0.75000000 1.0