# generated using pymatgen data_Tb4ScIr2Rh _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.73788235 _cell_length_b 10.73788235 _cell_length_c 6.29359080 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb4ScIr2Rh _chemical_formula_sum 'Tb16 Sc4 Ir8 Rh4' _cell_volume 725.66434478 _cell_formula_units_Z 4 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 0.28643002 0.08603391 0.38350740 1.0 Tb Tb1 1 0.28643002 0.91396609 0.88350740 1.0 Tb Tb2 1 0.71356998 0.08603391 0.88350740 1.0 Tb Tb3 1 0.71356998 0.91396609 0.38350740 1.0 Tb Tb4 1 0.58603391 0.78643002 0.88350740 1.0 Tb Tb5 1 0.58603391 0.21356998 0.38350740 1.0 Tb Tb6 1 0.41396609 0.78643002 0.38350740 1.0 Tb Tb7 1 0.41396609 0.21356998 0.88350740 1.0 Tb Tb8 1 0.21356998 0.41396609 0.61649260 1.0 Tb Tb9 1 0.21356998 0.58603391 0.11649260 1.0 Tb Tb10 1 0.78643002 0.41396609 0.11649260 1.0 Tb Tb11 1 0.78643002 0.58603391 0.61649260 1.0 Tb Tb12 1 0.91396609 0.71356998 0.11649260 1.0 Tb Tb13 1 0.91396609 0.28643002 0.61649260 1.0 Tb Tb14 1 0.08603391 0.71356998 0.61649260 1.0 Tb Tb15 1 0.08603391 0.28643002 0.11649260 1.0 Sc Sc16 1 0.00000000 0.00000000 0.50000000 1.0 Sc Sc17 1 0.00000000 0.00000000 0.00000000 1.0 Sc Sc18 1 0.50000000 0.50000000 0.00000000 1.0 Sc Sc19 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir20 1 0.85212067 0.14787933 0.25000000 1.0 Ir Ir21 1 0.85212067 0.85212067 0.75000000 1.0 Ir Ir22 1 0.14787933 0.14787933 0.75000000 1.0 Ir Ir23 1 0.14787933 0.85212067 0.25000000 1.0 Ir Ir24 1 0.64787933 0.35212067 0.75000000 1.0 Ir Ir25 1 0.64787933 0.64787933 0.25000000 1.0 Ir Ir26 1 0.35212067 0.35212067 0.25000000 1.0 Ir Ir27 1 0.35212067 0.64787933 0.75000000 1.0 Rh Rh28 1 0.50000000 0.00000000 0.12844498 1.0 Rh Rh29 1 0.50000000 0.00000000 0.62844498 1.0 Rh Rh30 1 0.00000000 0.50000000 0.87155502 1.0 Rh Rh31 1 0.00000000 0.50000000 0.37155502 1.0