data_[Tm20Cd4Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Cd  1.6900  1.5500  1.0900
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.1947]
_cell_length_b [6.3982]
_cell_length_c [12.7796]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.7247]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tm5CdBi]
_chemical_formula_sum '[Tm20 Cd4 Bi4]'
_cell_volume [837.9989]
_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  8  0.0766  0.2406  0.0066  1
  Tm  Tm1  8  0.2304  0.0978  0.7174  1
  Tm  Tm2  4  0.0000  0.1431  0.2500  1
  Cd  Cd3  4  0.2500  0.2500  0.5000  1
  Bi  Bi4  4  0.0000  0.3595  0.7500  1
]