# generated using pymatgen data_Tb20Cd6NiRu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.64773751 _cell_length_b 9.64773813 _cell_length_c 9.75061769 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000478 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb20Cd6NiRu _chemical_formula_sum 'Tb20 Cd6 Ni1 Ru1' _cell_volume 785.98403535 _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 Tb Tb0 1 0.00000000 0.00000000 0.50026079 1.0 Tb Tb1 1 0.00000000 0.00000000 0.99973921 1.0 Tb Tb2 1 0.21073225 0.78926775 0.43524821 1.0 Tb Tb3 1 0.21073225 0.42146550 0.43524821 1.0 Tb Tb4 1 0.57853450 0.78926775 0.43524821 1.0 Tb Tb5 1 0.79052961 0.20947039 0.56228261 1.0 Tb Tb6 1 0.79052961 0.58105822 0.56228261 1.0 Tb Tb7 1 0.41894178 0.20947039 0.56228261 1.0 Tb Tb8 1 0.79052961 0.20947039 0.93771739 1.0 Tb Tb9 1 0.79052961 0.58105822 0.93771739 1.0 Tb Tb10 1 0.41894178 0.20947039 0.93771739 1.0 Tb Tb11 1 0.21073225 0.78926775 0.06475179 1.0 Tb Tb12 1 0.21073225 0.42146550 0.06475179 1.0 Tb Tb13 1 0.57853450 0.78926775 0.06475179 1.0 Tb Tb14 1 0.54391782 0.45608218 0.25000000 1.0 Tb Tb15 1 0.54391782 0.08783563 0.25000000 1.0 Tb Tb16 1 0.91216437 0.45608218 0.25000000 1.0 Tb Tb17 1 0.45752482 0.54247518 0.75000000 1.0 Tb Tb18 1 0.45752482 0.91505064 0.75000000 1.0 Tb Tb19 1 0.08494936 0.54247518 0.75000000 1.0 Cd Cd20 1 0.88477245 0.11522755 0.25000000 1.0 Cd Cd21 1 0.88477245 0.76954690 0.25000000 1.0 Cd Cd22 1 0.23045310 0.11522755 0.25000000 1.0 Cd Cd23 1 0.11546523 0.88453477 0.75000000 1.0 Cd Cd24 1 0.11546523 0.23093146 0.75000000 1.0 Cd Cd25 1 0.76906854 0.88453477 0.75000000 1.0 Ni Ni26 1 0.33333300 0.66666700 0.25000000 1.0 Ru Ru27 1 0.66666700 0.33333300 0.75000000 1.0