data_[Tm20Al8Cd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Al  1.6100  1.2500  0.6750
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [16.1829]
_cell_length_b [7.6431]
_cell_length_c [7.5925]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Tm5(AlCd)2]
_chemical_formula_sum '[Tm20 Al8 Cd8]'
_cell_volume [939.0969]
_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
[
  Tm  Tm0  16  0.1314  0.1840  0.6780  1.0
  Tm  Tm1  4  0.0000  0.0000  0.0000  1.0
  Al  Al2  8  0.0000  0.1195  0.3798  1.0
  Cd  Cd3  8  0.2185  0.0000  0.0000  1.0
]