# generated using pymatgen data_Sr2Pd2I _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.52437091 _cell_length_b 4.52447566 _cell_length_c 17.50857457 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00083930 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2Pd2I _chemical_formula_sum 'Sr4 Pd4 I2' _cell_volume 310.38748831 _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 0.00000015 0.00000019 0.10755308 1.0 Sr Sr1 1 0.99999985 0.99999981 0.89244692 1.0 Sr Sr2 1 0.99999985 0.99999981 0.60755308 1.0 Sr Sr3 1 0.00000015 0.00000019 0.39244692 1.0 Pd Pd4 1 0.33332726 0.66666160 0.50149683 1.0 Pd Pd5 1 0.66667274 0.33333840 0.49850317 1.0 Pd Pd6 1 0.66667274 0.33333840 0.00149683 1.0 Pd Pd7 1 0.33332726 0.66666160 0.99850317 1.0 I I8 1 0.33333954 0.66666603 0.25000000 1.0 I I9 1 0.66666046 0.33333397 0.75000000 1.0