# generated using pymatgen data_Th2Si6Pd20Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.65268564 _cell_length_b 8.65268546 _cell_length_c 8.65268519 _cell_angle_alpha 60.00000479 _cell_angle_beta 60.00000547 _cell_angle_gamma 60.00000296 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th2Si6Pd20Au _chemical_formula_sum 'Th2 Si6 Pd20 Au1' _cell_volume 458.07626642 _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 Si Si2 1 0.73643695 0.26356305 0.26356305 1.0 Si Si3 1 0.26356305 0.73643695 0.73643695 1.0 Si Si4 1 0.26356305 0.73643695 0.26356305 1.0 Si Si5 1 0.73643695 0.26356305 0.73643695 1.0 Si Si6 1 0.26356305 0.26356305 0.73643695 1.0 Si Si7 1 0.73643695 0.73643695 0.26356305 1.0 Pd Pd8 1 0.34616578 0.00000000 0.00000000 1.0 Pd Pd9 1 0.65383422 1.00000000 1.00000000 1.0 Pd Pd10 1 1.00000000 0.34616578 0.65383422 1.0 Pd Pd11 1 0.00000000 0.65383422 0.34616578 1.0 Pd Pd12 1 0.00000000 0.34616578 0.00000000 1.0 Pd Pd13 1 0.65383422 0.00000000 0.34616578 1.0 Pd Pd14 1 1.00000000 0.65383422 1.00000000 1.0 Pd Pd15 1 0.34616578 1.00000000 0.65383422 1.0 Pd Pd16 1 0.00000000 0.00000000 0.34616578 1.0 Pd Pd17 1 1.00000000 1.00000000 0.65383422 1.0 Pd Pd18 1 0.65383422 0.34616578 1.00000000 1.0 Pd Pd19 1 0.34616578 0.65383422 0.00000000 1.0 Pd Pd20 1 0.38487552 0.38487552 0.38487552 1.0 Pd Pd21 1 0.61512448 0.61512448 0.61512448 1.0 Pd Pd22 1 0.38487552 0.38487552 0.84537144 1.0 Pd Pd23 1 0.38487552 0.84537144 0.38487552 1.0 Pd Pd24 1 0.61512448 0.61512448 0.15462856 1.0 Pd Pd25 1 0.61512448 0.15462856 0.61512448 1.0 Pd Pd26 1 0.84537144 0.38487552 0.38487552 1.0 Pd Pd27 1 0.15462856 0.61512448 0.61512448 1.0 Au Au28 1 0.00000000 0.00000000 0.00000000 1.0