# generated using pymatgen data_Nd20Ir5Pd2Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.18293661 _cell_length_b 11.18293633 _cell_length_c 6.61869876 _cell_angle_alpha 90.02401823 _cell_angle_beta 90.02401813 _cell_angle_gamma 89.65153471 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd20Ir5Pd2Ru5 _chemical_formula_sum 'Nd20 Ir5 Pd2 Ru5' _cell_volume 827.70622698 _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 Nd Nd0 1 0.09369944 0.29545615 0.11438034 1.0 Nd Nd1 1 0.79485731 0.41753756 0.11697309 1.0 Nd Nd2 1 0.20286271 0.58860214 0.12538629 1.0 Nd Nd3 1 0.91141055 0.70799980 0.11518468 1.0 Nd Nd4 1 0.41139786 0.79713729 0.37461371 1.0 Nd Nd5 1 0.58246244 0.20514269 0.38302691 1.0 Nd Nd6 1 0.29200020 0.08858945 0.38481532 1.0 Nd Nd7 1 0.70454385 0.90630056 0.38561966 1.0 Nd Nd8 1 0.41155354 0.20739150 0.88493338 1.0 Nd Nd9 1 0.70327011 0.08683510 0.87490447 1.0 Nd Nd10 1 0.29353676 0.91689350 0.88324818 1.0 Nd Nd11 1 0.59318304 0.79482960 0.88536670 1.0 Nd Nd12 1 0.08310650 0.70646324 0.61675182 1.0 Nd Nd13 1 0.91316490 0.29672989 0.62509553 1.0 Nd Nd14 1 0.20517040 0.40681696 0.61463330 1.0 Nd Nd15 1 0.79260850 0.58844646 0.61506662 1.0 Nd Nd16 1 0.00285794 0.99805082 0.00148304 1.0 Nd Nd17 1 0.50147453 0.49845369 0.99919478 1.0 Nd Nd18 1 0.50154631 0.49852547 0.50080522 1.0 Nd Nd19 1 0.00194918 0.99714206 0.49851696 1.0 Ir Ir20 1 0.34937606 0.34884500 0.25084553 1.0 Ir Ir21 1 0.65115500 0.65062394 0.24915447 1.0 Ir Ir22 1 0.15189794 0.15179004 0.75073429 1.0 Ir Ir23 1 0.84820996 0.84810206 0.74926571 1.0 Ir Ir24 1 0.65497406 0.34502594 0.75000000 1.0 Pd Pd25 1 0.84483732 0.15516268 0.25000000 1.0 Pd Pd26 1 0.34523371 0.65476629 0.75000000 1.0 Ru Ru27 1 0.15389093 0.84610907 0.25000000 1.0 Ru Ru28 1 0.00058148 0.49887325 0.37693561 1.0 Ru Ru29 1 0.50112675 0.99941852 0.12306439 1.0 Ru Ru30 1 0.50049405 0.99843233 0.62367296 1.0 Ru Ru31 1 0.00156767 0.49950595 0.87632704 1.0