# generated using pymatgen data_Sr2AlPdI _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.42192215 _cell_length_b 4.42192188 _cell_length_c 18.49897161 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000941 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2AlPdI _chemical_formula_sum 'Sr4 Al2 Pd2 I2' _cell_volume 313.25667515 _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 Sr Sr0 1 0.00000000 0.00000000 0.38617665 1.0 Sr Sr1 1 0.00000000 0.00000000 0.88617665 1.0 Sr Sr2 1 0.00000000 0.00000000 0.61473087 1.0 Sr Sr3 1 0.00000000 0.00000000 0.11473087 1.0 Al Al4 1 0.33333300 0.66666700 0.50145967 1.0 Al Al5 1 0.66666700 0.33333300 0.00145967 1.0 Pd Pd6 1 0.66666700 0.33333300 0.49807059 1.0 Pd Pd7 1 0.33333300 0.66666700 0.99807059 1.0 I I8 1 0.33333300 0.66666700 0.24956322 1.0 I I9 1 0.66666700 0.33333300 0.74956322 1.0