data_[Cs2Ti2Ag2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ti  1.5400  1.4000  0.8517
  Ag  1.9300  1.6000  1.0867
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.6920]
_cell_length_b [3.7478]
_cell_length_c [9.9808]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.7475]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsTiAgS3]
_chemical_formula_sum '[Cs2 Ti2 Ag2 S6]'
_cell_volume [295.2713]
_cell_formula_units_Z [2]
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  2  0.2513  0.7500  0.2322  1
  Ti  Ti1  2  0.1836  0.2500  0.6524  1
  Ag  Ag2  2  0.4288  0.7500  0.8867  1
  S  S3  2  0.0207  0.2500  0.3798  1
  S  S4  2  0.2372  0.2500  0.9086  1
  S  S5  2  0.3608  0.7500  0.6222  1
]