# generated using pymatgen data_Nd6ZnIr17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.36765259 _cell_length_b 5.36765265 _cell_length_c 17.45440913 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999963 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd6ZnIr17 _chemical_formula_sum 'Nd6 Zn1 Ir17' _cell_volume 435.51647445 _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 0.33333300 0.66666700 0.53845284 1.0 Nd Nd1 1 0.66666700 0.33333300 0.04089021 1.0 Nd Nd2 1 0.66666700 0.33333300 0.45910979 1.0 Nd Nd3 1 0.33333300 0.66666700 0.96154716 1.0 Nd Nd4 1 0.33333300 0.66666700 0.75000000 1.0 Nd Nd5 1 0.66666700 0.33333300 0.25000000 1.0 Zn Zn6 1 0.00000000 0.00000000 0.25000000 1.0 Ir Ir7 1 0.16667146 0.33334191 0.12859761 1.0 Ir Ir8 1 0.83362389 0.66724779 0.62764407 1.0 Ir Ir9 1 0.66665809 0.83332854 0.12859761 1.0 Ir Ir10 1 0.16667146 0.83332854 0.12859761 1.0 Ir Ir11 1 0.83362389 0.16637611 0.62764407 1.0 Ir Ir12 1 0.33275221 0.16637611 0.62764407 1.0 Ir Ir13 1 0.83362389 0.66724779 0.87235593 1.0 Ir Ir14 1 0.83362389 0.16637611 0.87235593 1.0 Ir Ir15 1 0.33275221 0.16637611 0.87235593 1.0 Ir Ir16 1 0.66665809 0.83332854 0.37140239 1.0 Ir Ir17 1 0.16667146 0.83332854 0.37140239 1.0 Ir Ir18 1 0.16667146 0.33334191 0.37140239 1.0 Ir Ir19 1 0.00000000 0.00000000 0.75000000 1.0 Ir Ir20 1 0.33333300 0.66666700 0.25000000 1.0 Ir Ir21 1 0.66666700 0.33333300 0.75000000 1.0 Ir Ir22 1 0.00000000 0.00000000 0.00194092 1.0 Ir Ir23 1 0.00000000 0.00000000 0.49805908 1.0