data_[Tb8Th4Rh8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Th  1.3000  1.8000  1.0800
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.9440]
_cell_length_b [3.8114]
_cell_length_c [11.6074]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.8247]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb2ThRh2]
_chemical_formula_sum '[Tb8 Th4 Rh8]'
_cell_volume [496.7955]
_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  4  0.0503  0.5000  0.6967  1
  Tb  Tb1  4  0.1615  0.5000  0.0642  1
  Th  Th2  4  0.1972  0.0000  0.3491  1
  Rh  Rh3  4  0.0052  0.0000  0.8767  1
  Rh  Rh4  4  0.1262  0.0000  0.5520  1
]