data_[Tb4Cd5Cu2]
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 [P2/m]
_cell_length_a [7.6343]
_cell_length_b [3.6449]
_cell_length_c [9.6644]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.6501]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Tb4Cd5Cu2]
_chemical_formula_sum '[Tb4 Cd5 Cu2]'
_cell_volume [268.3837]
_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  2  0.1658  0.5000  0.8569  1.0
  Tb  Tb1  2  0.2334  0.5000  0.4439  1.0
  Cd  Cd2  2  0.1836  0.0000  0.1542  1.0
  Cd  Cd3  2  0.4451  0.0000  0.6871  1.0
  Cd  Cd4  1  0.5000  0.0000  0.0000  1.0
  Cu  Cu5  2  0.0604  0.0000  0.6289  1.0
]