# generated using pymatgen data_Zr4IrPdO _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.86599557 _cell_length_b 8.80832806 _cell_length_c 8.86599504 _cell_angle_alpha 59.78319022 _cell_angle_beta 59.99999832 _cell_angle_gamma 59.78319079 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4IrPdO _chemical_formula_sum 'Zr16 Ir4 Pd4 O4' _cell_volume 487.98048668 _cell_formula_units_Z 4 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 Zr Zr0 1 0.31629255 0.68462181 0.31629255 1.0 Zr Zr1 1 0.93282704 0.56918315 0.93282704 1.0 Zr Zr2 1 0.68466466 0.31395483 0.68466466 1.0 Zr Zr3 1 0.68466466 0.31395483 0.31671484 1.0 Zr Zr4 1 0.31629255 0.68462181 0.68279409 1.0 Zr Zr5 1 0.62616042 0.11976756 0.12703601 1.0 Zr Zr6 1 0.93498947 0.93257992 0.56621581 1.0 Zr Zr7 1 0.68279409 0.68462181 0.31629255 1.0 Zr Zr8 1 0.11393928 0.65818215 0.11393928 1.0 Zr Zr9 1 0.12703601 0.11976756 0.62616042 1.0 Zr Zr10 1 0.31671484 0.31395483 0.68466466 1.0 Zr Zr11 1 0.12703601 0.11976756 0.12703601 1.0 Zr Zr12 1 0.56516277 0.56918315 0.93282704 1.0 Zr Zr13 1 0.56621581 0.93257992 0.93498947 1.0 Zr Zr14 1 0.93282704 0.56918315 0.56516277 1.0 Zr Zr15 1 0.56621581 0.93257992 0.56621581 1.0 Ir Ir16 1 0.29808538 0.91021807 0.89584827 1.0 Ir Ir17 1 0.89584827 0.91021807 0.89584827 1.0 Ir Ir18 1 0.89584827 0.91021807 0.29808538 1.0 Ir Ir19 1 0.34908760 0.95273620 0.34908760 1.0 Pd Pd20 1 0.33662834 0.34818666 0.33662834 1.0 Pd Pd21 1 0.97855666 0.34818666 0.33662834 1.0 Pd Pd22 1 0.33662834 0.34818666 0.97855666 1.0 Pd Pd23 1 0.91052211 0.26843467 0.91052211 1.0 O O24 1 0.62661013 0.62071003 0.62661013 1.0 O O25 1 0.12606970 0.62071003 0.62661013 1.0 O O26 1 0.62661013 0.62071003 0.12606970 1.0 O O27 1 0.62567104 0.12298587 0.62567104 1.0