# generated using pymatgen data_Nd8Zr2IrRh5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.14250576 _cell_length_b 11.14504795 _cell_length_c 6.33539995 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.73576455 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd8Zr2IrRh5 _chemical_formula_sum 'Nd16 Zr4 Ir2 Rh10' _cell_volume 786.74542673 _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 Nd Nd0 1 0.08617518 0.28609005 0.12125026 1.0 Nd Nd1 1 0.78635860 0.41365847 0.12229233 1.0 Nd Nd2 1 0.21323179 0.58632273 0.12076434 1.0 Nd Nd3 1 0.91325868 0.71307208 0.12191631 1.0 Nd Nd4 1 0.41382482 0.78609005 0.37874974 1.0 Nd Nd5 1 0.58674132 0.21307208 0.37808369 1.0 Nd Nd6 1 0.28676821 0.08632273 0.37923566 1.0 Nd Nd7 1 0.71364140 0.91365847 0.37770767 1.0 Nd Nd8 1 0.41541694 0.21370950 0.87863223 1.0 Nd Nd9 1 0.71273258 0.08699276 0.87756069 1.0 Nd Nd10 1 0.28722577 0.91337046 0.87855468 1.0 Nd Nd11 1 0.58895017 0.78812523 0.87733189 1.0 Nd Nd12 1 0.08458306 0.71370950 0.62136777 1.0 Nd Nd13 1 0.91104983 0.28812523 0.62266811 1.0 Nd Nd14 1 0.21277423 0.41337046 0.62144532 1.0 Nd Nd15 1 0.78726742 0.58699276 0.62243931 1.0 Zr Zr16 1 0.99910240 0.99926035 0.99976869 1.0 Zr Zr17 1 0.50106574 0.50017838 0.99949340 1.0 Zr Zr18 1 0.50089760 0.49926035 0.50023131 1.0 Zr Zr19 1 0.99893426 0.00017838 0.50050660 1.0 Ir Ir20 1 0.86118504 0.86154732 0.75049499 1.0 Ir Ir21 1 0.63881496 0.36154732 0.74950501 1.0 Rh Rh22 1 0.13915432 0.86193599 0.24981482 1.0 Rh Rh23 1 0.36084568 0.36193599 0.25018518 1.0 Rh Rh24 1 0.63837909 0.63962292 0.24985636 1.0 Rh Rh25 1 0.86162091 0.13962292 0.25014364 1.0 Rh Rh26 1 0.36226270 0.63775145 0.75029350 1.0 Rh Rh27 1 0.13773730 0.13775145 0.74970650 1.0 Rh Rh28 1 0.00083286 0.49948212 0.38485052 1.0 Rh Rh29 1 0.49916714 0.99948212 0.11514948 1.0 Rh Rh30 1 0.49832254 0.99888021 0.61321586 1.0 Rh Rh31 1 0.00167746 0.49888021 0.88678414 1.0