data_[Tb16Rh8Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Rh  2.2800  1.3500  0.7450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [8.6621]
_cell_length_b [14.9188]
_cell_length_c [6.9478]
_cell_angle_alpha [90.0000]
_cell_angle_beta [127.1631]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [Tb4Rh2Pb]
_chemical_formula_sum '[Tb16 Rh8 Pb4]'
_cell_volume [715.5196]
_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  0.0595  0.0791  0.2141  1.0
  Tb  Tb1  4  0.0867  0.5089  0.0808  1.0
  Tb  Tb2  4  0.3395  0.2072  0.7773  1.0
  Tb  Tb3  4  0.4875  0.2135  0.3961  1.0
  Rh  Rh4  4  0.2015  0.3308  0.3794  1.0
  Rh  Rh5  4  0.2858  0.0752  0.0646  1.0
  Pb  Pb6  4  0.4150  0.3823  0.0877  1.0
]