# generated using pymatgen data_Zr2InAu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.57703162 _cell_length_b 7.57703162 _cell_length_c 7.09117306 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2InAu2 _chemical_formula_sum 'Zr8 In4 Au8' _cell_volume 407.11423096 _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 0.14753168 0.14753168 0.00000000 1.0 Zr Zr1 1 0.85246832 0.85246832 0.00000000 1.0 Zr Zr2 1 0.64753168 0.35246832 0.50000000 1.0 Zr Zr3 1 0.35246832 0.64753168 0.50000000 1.0 Zr Zr4 1 0.69601152 0.30398848 0.00000000 1.0 Zr Zr5 1 0.30398848 0.69601152 0.00000000 1.0 Zr Zr6 1 0.80398848 0.80398848 0.50000000 1.0 Zr Zr7 1 0.19601152 0.19601152 0.50000000 1.0 In In8 1 0.50000000 -0.00000000 0.25000000 1.0 In In9 1 0.50000000 -0.00000000 0.75000000 1.0 In In10 1 0.00000000 0.50000000 0.25000000 1.0 In In11 1 0.00000000 0.50000000 0.75000000 1.0 Au Au12 1 0.37067143 0.37067143 0.20496867 1.0 Au Au13 1 0.62932857 0.62932857 0.79503133 1.0 Au Au14 1 0.62932857 0.62932857 0.20496867 1.0 Au Au15 1 0.87067143 0.12932857 0.70496867 1.0 Au Au16 1 0.87067143 0.12932857 0.29503133 1.0 Au Au17 1 0.37067143 0.37067143 0.79503133 1.0 Au Au18 1 0.12932857 0.87067143 0.29503133 1.0 Au Au19 1 0.12932857 0.87067143 0.70496867 1.0