# generated using pymatgen data_ErTh3(SiPd14)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.91326415 _cell_length_b 8.91326415 _cell_length_c 7.04463083 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErTh3(SiPd14)2 _chemical_formula_sum 'Er1 Th3 Si2 Pd28' _cell_volume 559.66969748 _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 Er Er0 1 0.50000000 0.50000000 0.50000000 1.0 Th Th1 1 0.50000000 0.00000000 0.93054620 1.0 Th Th2 1 0.00000000 0.50000000 0.06945380 1.0 Th Th3 1 0.00000000 0.00000000 0.50000000 1.0 Si Si4 1 0.50000000 0.00000000 0.44398727 1.0 Si Si5 1 0.00000000 0.50000000 0.55601273 1.0 Pd Pd6 1 0.33664273 0.83357953 0.61399832 1.0 Pd Pd7 1 0.33664273 0.16642047 0.61399832 1.0 Pd Pd8 1 0.66335727 0.83357953 0.61399832 1.0 Pd Pd9 1 0.66335727 0.16642047 0.61399832 1.0 Pd Pd10 1 0.16642047 0.66335727 0.38600168 1.0 Pd Pd11 1 0.16642047 0.33664273 0.38600168 1.0 Pd Pd12 1 0.83357953 0.66335727 0.38600168 1.0 Pd Pd13 1 0.83357953 0.33664273 0.38600168 1.0 Pd Pd14 1 0.50000000 0.76839194 0.25808791 1.0 Pd Pd15 1 0.50000000 0.23160806 0.25808791 1.0 Pd Pd16 1 0.27086833 0.00000000 0.25591113 1.0 Pd Pd17 1 0.72913167 0.00000000 0.25591113 1.0 Pd Pd18 1 0.00000000 0.72913167 0.74408887 1.0 Pd Pd19 1 0.00000000 0.27086833 0.74408887 1.0 Pd Pd20 1 0.23160806 0.50000000 0.74191209 1.0 Pd Pd21 1 0.76839194 0.50000000 0.74191209 1.0 Pd Pd22 1 0.50000000 0.34915322 0.85226196 1.0 Pd Pd23 1 0.50000000 0.65084678 0.85226196 1.0 Pd Pd24 1 0.84810619 0.00000000 0.85145970 1.0 Pd Pd25 1 0.15189381 0.00000000 0.85145970 1.0 Pd Pd26 1 0.00000000 0.15189381 0.14854030 1.0 Pd Pd27 1 0.00000000 0.84810619 0.14854030 1.0 Pd Pd28 1 0.65084678 0.50000000 0.14773804 1.0 Pd Pd29 1 0.34915322 0.50000000 0.14773804 1.0 Pd Pd30 1 0.25043719 0.74956281 0.00000000 1.0 Pd Pd31 1 0.25043719 0.25043719 0.00000000 1.0 Pd Pd32 1 0.74956281 0.74956281 0.00000000 1.0 Pd Pd33 1 0.74956281 0.25043719 0.00000000 1.0