# generated using pymatgen data_Th3Si6(Pd9Pt)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.73102444 _cell_length_b 8.73102463 _cell_length_c 8.73102472 _cell_angle_alpha 60.04027858 _cell_angle_beta 60.04028175 _cell_angle_gamma 60.04028175 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th3Si6(Pd9Pt)2 _chemical_formula_sum 'Th3 Si6 Pd18 Pt2' _cell_volume 471.06081720 _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 0.25096070 0.25096070 0.25096070 1.0 Th Th1 1 0.74903930 0.74903930 0.74903930 1.0 Th Th2 1 0.00000000 0.00000000 0.00000000 1.0 Si Si3 1 0.73104747 0.26804210 0.26804210 1.0 Si Si4 1 0.26895253 0.73195790 0.73195790 1.0 Si Si5 1 0.26804210 0.73104747 0.26804210 1.0 Si Si6 1 0.73195790 0.26895253 0.73195790 1.0 Si Si7 1 0.26804210 0.26804210 0.73104747 1.0 Si Si8 1 0.73195790 0.73195790 0.26895253 1.0 Pd Pd9 1 0.38204748 0.38204748 0.84918437 1.0 Pd Pd10 1 0.38204748 0.84918437 0.38204748 1.0 Pd Pd11 1 0.61795252 0.61795252 0.15081563 1.0 Pd Pd12 1 0.61795252 0.15081563 0.61795252 1.0 Pd Pd13 1 0.84918437 0.38204748 0.38204748 1.0 Pd Pd14 1 0.15081563 0.61795252 0.61795252 1.0 Pd Pd15 1 0.34746921 0.99880885 0.99880885 1.0 Pd Pd16 1 0.65253079 0.00119115 0.00119115 1.0 Pd Pd17 1 1.00000000 0.34708334 0.65291666 1.0 Pd Pd18 1 0.00000000 0.65291666 0.34708334 1.0 Pd Pd19 1 0.99880885 0.34746921 0.99880885 1.0 Pd Pd20 1 0.65291666 1.00000000 0.34708334 1.0 Pd Pd21 1 0.00119115 0.65253079 0.00119115 1.0 Pd Pd22 1 0.34708334 0.00000000 0.65291666 1.0 Pd Pd23 1 0.99880885 0.99880885 0.34746921 1.0 Pd Pd24 1 0.00119115 0.00119115 0.65253079 1.0 Pd Pd25 1 0.65291666 0.34708334 1.00000000 1.0 Pd Pd26 1 0.34708334 0.65291666 0.00000000 1.0 Pt Pt27 1 0.38661974 0.38661974 0.38661974 1.0 Pt Pt28 1 0.61338026 0.61338026 0.61338026 1.0