data_[Cs2Ti4Cl14]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [7.2941]
_cell_length_b [6.3614]
_cell_length_c [12.2728]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.9127]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [CsTi2Cl7]
_chemical_formula_sum '[Cs2 Ti4 Cl14]'
_cell_volume [569.1469]
_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  0.5000  0.3743  0.2500  1.0
  Ti  Ti1  4  0.0684  0.2413  0.9308  1.0
  Cl  Cl2  4  0.1110  0.0687  0.1113  1.0
  Cl  Cl3  4  0.2090  0.4231  0.5020  1.0
  Cl  Cl4  4  0.3500  0.1301  0.8792  1.0
  Cl  Cl5  2  0.0000  0.4063  0.7500  1.0
]