data_[Cs8Ag4S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ag  1.9300  1.6000  1.0867
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [8.2369]
_cell_length_b [7.0820]
_cell_length_c [13.0818]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Cs2AgS2]
_chemical_formula_sum '[Cs8 Ag4 S8]'
_cell_volume [763.1107]
_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
[
  Cs  Cs0  4  0.0129  0.2500  0.2840  1
  Cs  Cs1  4  0.1878  0.7500  0.0448  1
  Ag  Ag2  4  0.2352  0.7500  0.3493  1
  S  S3  4  0.0306  0.2500  0.7339  1
  S  S4  4  0.2238  0.2500  0.0291  1
]