# generated using pymatgen data_Zr6Zn20Pd3Se _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.70844867 _cell_length_b 8.70844782 _cell_length_c 8.71574663 _cell_angle_alpha 59.97227837 _cell_angle_beta 59.97228161 _cell_angle_gamma 60.05544507 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Zn20Pd3Se _chemical_formula_sum 'Zr6 Zn20 Pd3 Se1' _cell_volume 467.38046443 _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 Zr Zr0 1 0.71015166 0.28984834 0.28984834 1.0 Zr Zr1 1 0.28984834 0.71015166 0.71015166 1.0 Zr Zr2 1 0.28984834 0.71015166 0.28984834 1.0 Zr Zr3 1 0.71015166 0.28984834 0.71015166 1.0 Zr Zr4 1 0.28557111 0.28557111 0.71442889 1.0 Zr Zr5 1 0.71442889 0.71442889 0.28557111 1.0 Zn Zn6 1 0.11949541 0.11949541 0.12672987 1.0 Zn Zn7 1 0.88050459 0.88050459 0.87327013 1.0 Zn Zn8 1 0.11949541 0.11949541 0.63428031 1.0 Zn Zn9 1 0.12672987 0.63428031 0.11949541 1.0 Zn Zn10 1 0.88050459 0.88050459 0.36571969 1.0 Zn Zn11 1 0.87327013 0.36571969 0.88050459 1.0 Zn Zn12 1 0.63428031 0.12672987 0.11949541 1.0 Zn Zn13 1 0.36571969 0.87327013 0.88050459 1.0 Zn Zn14 1 0.50000000 0.00000000 0.00000000 1.0 Zn Zn15 1 0.00000000 0.50000000 0.50000000 1.0 Zn Zn16 1 0.00000000 0.50000000 0.00000000 1.0 Zn Zn17 1 0.50000000 0.00000000 0.50000000 1.0 Zn Zn18 1 0.33090432 0.33090432 0.33419876 1.0 Zn Zn19 1 0.66909568 0.66909568 0.66580124 1.0 Zn Zn20 1 0.33090432 0.33090432 0.00399459 1.0 Zn Zn21 1 0.33419876 0.00399459 0.33090432 1.0 Zn Zn22 1 0.66909568 0.66909568 0.99600541 1.0 Zn Zn23 1 0.66580124 0.99600541 0.66909568 1.0 Zn Zn24 1 0.00399459 0.33419876 0.33090432 1.0 Zn Zn25 1 0.99600541 0.66580124 0.66909568 1.0 Pd Pd26 1 0.00000000 0.00000000 0.50000000 1.0 Pd Pd27 1 0.50000000 0.50000000 0.00000000 1.0 Pd Pd28 1 0.00000000 0.00000000 0.00000000 1.0 Se Se29 1 0.50000000 0.50000000 0.50000000 1.0