# generated using pymatgen data_Sn14PdRu5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.16557527 _cell_length_b 8.16557577 _cell_length_c 8.16557559 _cell_angle_alpha 109.59918603 _cell_angle_beta 109.21559177 _cell_angle_gamma 109.59919131 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sn14PdRu5 _chemical_formula_sum 'Sn14 Pd1 Ru5' _cell_volume 419.11384154 _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 Sn Sn0 1 0.25310454 0.74534015 0.50776339 1.0 Sn Sn1 1 0.76242325 0.25465985 0.50776339 1.0 Sn Sn2 1 0.75038302 0.50000000 0.25038302 1.0 Sn Sn3 1 0.25038302 0.50000000 0.75038302 1.0 Sn Sn4 1 0.50776339 0.74534015 0.25310454 1.0 Sn Sn5 1 0.50776339 0.25465985 0.76242325 1.0 Sn Sn6 1 0.99288829 1.00000000 0.32200673 1.0 Sn Sn7 1 0.67586370 0.00000000 0.99940845 1.0 Sn Sn8 1 0.99288829 0.67088156 0.99288829 1.0 Sn Sn9 1 0.32200673 0.32911844 0.32200673 1.0 Sn Sn10 1 0.99940845 0.32354476 0.99940845 1.0 Sn Sn11 1 0.67586370 0.67645524 0.67586370 1.0 Sn Sn12 1 0.32200673 1.00000000 0.99288829 1.0 Sn Sn13 1 0.99940845 1.00000000 0.67586370 1.0 Pd Pd14 1 0.34230655 1.00000000 0.34230655 1.0 Ru Ru15 1 0.99890574 0.34401886 0.34292460 1.0 Ru Ru16 1 0.99890574 0.65598114 0.65488688 1.0 Ru Ru17 1 0.34292460 0.34401886 0.99890574 1.0 Ru Ru18 1 0.65488688 0.65598114 0.99890574 1.0 Ru Ru19 1 0.64991453 0.00000000 0.64991453 1.0