data_[Tl4Cd4Ag4S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.1278]
_cell_length_b [4.2422]
_cell_length_c [9.2790]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.3224]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TlCdAgS2]
_chemical_formula_sum '[Tl4 Cd4 Ag4 S8]'
_cell_volume [548.7695]
_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
[
  Tl  Tl0  4  0.1777  0.5000  0.6668  1.0
  Cd  Cd1  4  0.0597  0.0000  0.1905  1.0
  Ag  Ag2  4  0.1780  0.5000  0.0481  1.0
  S  S3  4  0.1197  0.0000  0.9027  1.0
  S  S4  4  0.1364  0.5000  0.3142  1.0
]