# generated using pymatgen data_Th3Be2(SiPd5)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.71378935 _cell_length_b 8.62960378 _cell_length_c 8.62960377 _cell_angle_alpha 60.64645796 _cell_angle_beta 59.67677229 _cell_angle_gamma 59.67676874 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th3Be2(SiPd5)4 _chemical_formula_sum 'Th3 Be2 Si4 Pd20' _cell_volume 458.76500639 _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 0.72831252 0.27168748 0.27168748 1.0 Be Be4 1 0.27168748 0.72831252 0.72831252 1.0 Si Si5 1 0.26962250 0.73037750 0.26962250 1.0 Si Si6 1 0.73037750 0.26962250 0.73037750 1.0 Si Si7 1 0.26962250 0.26962250 0.73037750 1.0 Si Si8 1 0.73037750 0.73037750 0.26962250 1.0 Pd Pd9 1 0.38808110 0.38226869 0.38226869 1.0 Pd Pd10 1 0.61191890 0.61773131 0.61773131 1.0 Pd Pd11 1 0.38226869 0.38808110 0.84738352 1.0 Pd Pd12 1 0.38226869 0.84738352 0.38808110 1.0 Pd Pd13 1 0.61773131 0.61191890 0.15261648 1.0 Pd Pd14 1 0.61773131 0.15261648 0.61191890 1.0 Pd Pd15 1 0.84738352 0.38226869 0.38226869 1.0 Pd Pd16 1 0.15261648 0.61773131 0.61773131 1.0 Pd Pd17 1 0.34650987 0.00000000 0.00000000 1.0 Pd Pd18 1 0.65349013 1.00000000 1.00000000 1.0 Pd Pd19 1 1.00000000 0.34650987 0.65349013 1.0 Pd Pd20 1 0.00000000 0.65349013 0.34650987 1.0 Pd Pd21 1 0.99484513 0.34396927 0.00515487 1.0 Pd Pd22 1 0.65603073 0.00515487 0.34396927 1.0 Pd Pd23 1 0.00515487 0.65603073 0.99484513 1.0 Pd Pd24 1 0.34396927 0.99484513 0.65603073 1.0 Pd Pd25 1 0.99484513 0.00515487 0.34396927 1.0 Pd Pd26 1 0.00515487 0.99484513 0.65603073 1.0 Pd Pd27 1 0.65603073 0.34396927 0.00515487 1.0 Pd Pd28 1 0.34396927 0.65603073 0.99484513 1.0