data_[Rb8Ti8Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Ti  1.5400  1.4000  0.8517
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [13.8067]
_cell_length_b [13.9688]
_cell_length_c [6.3183]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [RbTiCl3]
_chemical_formula_sum '[Rb8 Ti8 Cl24]'
_cell_volume [1218.5616]
_cell_formula_units_Z [8]
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
[
  Rb  Rb0  8  0.2500  0.1234  0.7500  1
  Ti  Ti1  8  0.0000  0.2493  0.0505  1
  Cl  Cl2  16  0.1230  0.1750  0.3020  1
  Cl  Cl3  8  0.0000  0.1099  0.7989  1
]