# generated using pymatgen data_Sr2(AsPd)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.37207250 _cell_length_b 4.33285136 _cell_length_c 35.79107548 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2(AsPd)3 _chemical_formula_sum 'Sr8 As12 Pd12' _cell_volume 678.00967935 _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 Sr Sr0 1 0.49999900 0.49999900 0.07081269 1.0 Sr Sr1 1 0.00000000 0.49999900 0.17637169 1.0 Sr Sr2 1 0.49999900 0.00000000 0.32300845 1.0 Sr Sr3 1 0.00000000 0.00000000 0.42894758 1.0 Sr Sr4 1 0.00000000 0.00000000 0.57105242 1.0 Sr Sr5 1 0.49999900 0.00000000 0.67699055 1.0 Sr Sr6 1 0.00000000 0.49999900 0.82362831 1.0 Sr Sr7 1 0.49999900 0.49999900 0.92918731 1.0 As As8 1 0.00000000 0.00000000 0.04008746 1.0 As As9 1 0.49999900 0.00000000 0.14083917 1.0 As As10 1 0.49999900 0.00000000 0.21251953 1.0 As As11 1 0.00000000 0.49999900 0.28667723 1.0 As As12 1 0.00000000 0.49999900 0.35855940 1.0 As As13 1 0.49999900 0.49999900 0.45979721 1.0 As As14 1 0.49999900 0.49999900 0.54020279 1.0 As As15 1 0.00000000 0.49999900 0.64144060 1.0 As As16 1 0.00000000 0.49999900 0.71332277 1.0 As As17 1 0.49999900 0.00000000 0.78748047 1.0 As As18 1 0.49999900 0.00000000 0.85916083 1.0 As As19 1 0.00000000 0.00000000 0.95991254 1.0 Pd Pd20 1 0.49999900 0.00000000 0.00000000 1.0 Pd Pd21 1 0.00000000 0.49999900 0.00000000 1.0 Pd Pd22 1 0.00000000 0.00000000 0.10940852 1.0 Pd Pd23 1 0.00000000 0.00000000 0.24872804 1.0 Pd Pd24 1 0.49999900 0.49999900 0.25033974 1.0 Pd Pd25 1 0.49999900 0.49999900 0.39028978 1.0 Pd Pd26 1 0.49999900 0.00000000 0.50000000 1.0 Pd Pd27 1 0.00000000 0.49999900 0.50000000 1.0 Pd Pd28 1 0.49999900 0.49999900 0.60971022 1.0 Pd Pd29 1 0.49999900 0.49999900 0.74966026 1.0 Pd Pd30 1 0.00000000 0.00000000 0.75127196 1.0 Pd Pd31 1 0.00000000 0.00000000 0.89059148 1.0