data_[Cs8Li4S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Li  0.9800  1.4500  0.9000
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.2184]
_cell_length_b [6.8098]
_cell_length_c [9.6535]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.7262]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs2LiS2]
_chemical_formula_sum '[Cs8 Li4 S8]'
_cell_volume [886.7321]
_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  0.0358  0.0000  0.7685  1
  Cs  Cs1  4  0.1848  0.5000  0.5598  1
  Li  Li2  4  0.1590  0.5000  0.1576  1
  S  S3  4  0.0069  0.5000  0.8950  1
  S  S4  4  0.1817  0.0000  0.6224  1
]