data_[Tb1Cd3Cu8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Cd  1.6900  1.5500  1.0900
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [5.1025]
_cell_length_b [5.1025]
_cell_length_c [8.1927]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [TbCd3Cu8]
_chemical_formula_sum '[Tb1 Cd3 Cu8]'
_cell_volume [184.7234]
_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  0.0000  0.0000  0.4373  1.0
  Cd  Cd1  1  0.0000  0.0000  0.0485  1.0
  Cd  Cd2  1  0.6667  0.3333  0.5740  1.0
  Cd  Cd3  1  0.6667  0.3333  0.9408  1.0
  Cu  Cu4  3  0.1663  0.3327  0.7518  1.0
  Cu  Cu5  3  0.5025  0.0049  0.2472  1.0
  Cu  Cu6  1  0.3333  0.6667  0.0032  1.0
  Cu  Cu7  1  0.3333  0.6667  0.4991  1.0
]