data_[Cs2Ti2Ag2F12]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [6.1524]
_cell_length_b [10.6174]
_cell_length_c [5.8510]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.3295]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [CsTiAgF6]
_chemical_formula_sum '[Cs2 Ti2 Ag2 F12]'
_cell_volume [382.1955]
_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  0.0000  0.9989  0.0000  1.0
  Ti  Ti1  2  0.0000  0.6694  0.5000  1.0
  Ag  Ag2  2  0.0000  0.3329  0.5000  1.0
  F  F3  4  0.1261  0.5381  0.3253  1.0
  F  F4  4  0.1462  0.7938  0.3239  1.0
  F  F5  4  0.2475  0.6823  0.7012  1.0
]