# generated using pymatgen data_Th3Be4(PPd10)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.58978658 _cell_length_b 8.58978603 _cell_length_c 8.53832014 _cell_angle_alpha 60.19800082 _cell_angle_beta 60.19800291 _cell_angle_gamma 59.60399693 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th3Be4(PPd10)2 _chemical_formula_sum 'Th3 Be4 P2 Pd20' _cell_volume 445.44199724 _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 Th Th0 1 0.25000000 0.25000000 0.25000000 1.0 Th Th1 1 0.75000000 0.75000000 0.75000000 1.0 Th Th2 1 0.00000000 0.00000000 0.00000000 1.0 Be Be3 1 0.72824225 0.27175775 0.27175775 1.0 Be Be4 1 0.27175775 0.72824225 0.72824225 1.0 Be Be5 1 0.27175775 0.72824225 0.27175775 1.0 Be Be6 1 0.72824225 0.27175775 0.72824225 1.0 P P7 1 0.27070083 0.27070083 0.72929917 1.0 P P8 1 0.72929917 0.72929917 0.27070083 1.0 Pd Pd9 1 0.38584209 0.38584209 0.38146250 1.0 Pd Pd10 1 0.61415791 0.61415791 0.61853750 1.0 Pd Pd11 1 0.38584209 0.38584209 0.84685233 1.0 Pd Pd12 1 0.38146250 0.84685233 0.38584209 1.0 Pd Pd13 1 0.61415791 0.61415791 0.15314767 1.0 Pd Pd14 1 0.61853750 0.15314767 0.61415791 1.0 Pd Pd15 1 0.84685233 0.38146250 0.38584209 1.0 Pd Pd16 1 0.15314767 0.61853750 0.61415791 1.0 Pd Pd17 1 0.34369229 0.99601255 0.00398745 1.0 Pd Pd18 1 0.65630771 0.00398745 0.99601255 1.0 Pd Pd19 1 0.99601255 0.34369229 0.65630771 1.0 Pd Pd20 1 0.00398745 0.65630771 0.34369229 1.0 Pd Pd21 1 0.99601255 0.34369229 0.00398745 1.0 Pd Pd22 1 0.65630771 0.00398745 0.34369229 1.0 Pd Pd23 1 0.00398745 0.65630771 0.99601255 1.0 Pd Pd24 1 0.34369229 0.99601255 0.65630771 1.0 Pd Pd25 1 0.00000000 0.00000000 0.34206769 1.0 Pd Pd26 1 0.00000000 0.00000000 0.65793231 1.0 Pd Pd27 1 0.65793231 0.34206769 1.00000000 1.0 Pd Pd28 1 0.34206769 0.65793231 0.00000000 1.0