data_[Tm16Cd4Re4]
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
  Re  1.9000  1.3500  0.7125
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.5868]
_cell_length_b [12.7242]
_cell_length_c [6.1425]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.2720]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tm4CdRe]
_chemical_formula_sum '[Tm16 Cd4 Re4]'
_cell_volume [640.8667]
_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  0.1053  0.1715  0.0478  1
  Tm  Tm1  8  0.2227  0.4207  0.3895  1
  Cd  Cd2  4  0.0000  0.3744  0.7500  1
  Re  Re3  4  0.0000  0.0007  0.2500  1
]