# generated using pymatgen data_Tb7Nd(Si3Ir)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.14472105 _cell_length_b 8.14472050 _cell_length_c 8.14898485 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999820 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb7Nd(Si3Ir)4 _chemical_formula_sum 'Tb7 Nd1 Si12 Ir4' _cell_volume 468.15164130 _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 0.49954267 0.50045733 0.75000000 1.0 Tb Tb1 1 0.50048300 0.49951700 0.25000000 1.0 Tb Tb2 1 0.00091567 0.50045733 0.75000000 1.0 Tb Tb3 1 0.99903299 0.49951700 0.25000000 1.0 Tb Tb4 1 0.49954267 0.99908433 0.75000000 1.0 Tb Tb5 1 0.50048300 0.00096701 0.25000000 1.0 Tb Tb6 1 0.00000000 0.00000000 0.75000000 1.0 Nd Nd7 1 0.00000000 0.00000000 0.25000000 1.0 Si Si8 1 0.83280653 0.16719347 0.99773928 1.0 Si Si9 1 0.16719960 0.83280040 0.99805073 1.0 Si Si10 1 0.33438593 0.16719347 0.99773928 1.0 Si Si11 1 0.16719960 0.83280040 0.50194927 1.0 Si Si12 1 0.66559980 0.83280040 0.99805073 1.0 Si Si13 1 0.83280653 0.16719347 0.50226072 1.0 Si Si14 1 0.83280653 0.66561407 0.99773928 1.0 Si Si15 1 0.66559980 0.83280040 0.50194927 1.0 Si Si16 1 0.16719960 0.33440020 0.99805073 1.0 Si Si17 1 0.33438593 0.16719347 0.50226072 1.0 Si Si18 1 0.16719960 0.33440020 0.50194927 1.0 Si Si19 1 0.83280653 0.66561407 0.50226072 1.0 Ir Ir20 1 0.66666700 0.33333300 0.99794379 1.0 Ir Ir21 1 0.33333300 0.66666700 0.00031371 1.0 Ir Ir22 1 0.33333300 0.66666700 0.49968629 1.0 Ir Ir23 1 0.66666700 0.33333300 0.50205621 1.0