data_[Tm2Cd22Ga2]
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
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.8912]
_cell_length_b [14.1030]
_cell_length_c [7.5783]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.2436]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TmCd11Ga]
_chemical_formula_sum '[Tm2 Cd22 Ga2]'
_cell_volume [582.7767]
_cell_formula_units_Z [2]
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  2  0.0000  0.0000  0.0000  1
  Cd  Cd1  8  0.1041  0.6046  0.2123  1
  Cd  Cd2  8  0.1793  0.1741  0.3523  1
  Cd  Cd3  4  0.2500  0.2500  0.0000  1
  Cd  Cd4  2  0.0000  0.0000  0.5000  1
  Ga  Ga5  2  0.0000  0.5000  0.5000  1
]