data_[Tb8S8Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  S  2.5800  1.0000  0.8800
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.4878]
_cell_length_b [5.4635]
_cell_length_c [8.0262]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7925]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb2S2Cl]
_chemical_formula_sum '[Tb8 S8 Cl4]'
_cell_volume [515.2479]
_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
[
  Tb  Tb0  4  0.0085  0.5000  0.7443  1.0
  Tb  Tb1  4  0.1643  0.0000  0.5743  1.0
  S  S2  4  0.0073  0.0000  0.7457  1.0
  S  S3  4  0.1666  0.5000  0.5802  1.0
  Cl  Cl4  4  0.1568  0.5000  0.0938  1.0
]