data_[Cs2Fe4Ag2Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Fe  1.8300  1.4000  0.8525
  Ag  1.9300  1.6000  1.0867
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.7553]
_cell_length_b [7.4086]
_cell_length_c [10.0794]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.4930]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsFe2AgCl8]
_chemical_formula_sum '[Cs2 Fe4 Ag2 Cl16]'
_cell_volume [792.1447]
_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  0.0000  0.5000  1.0
  Fe  Fe1  4  0.1063  0.5000  0.7917  1.0
  Ag  Ag2  2  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  8  0.0151  0.2577  0.2051  1.0
  Cl  Cl4  4  0.1823  0.5000  0.6016  1.0
  Cl  Cl5  4  0.2496  0.0000  0.0260  1.0
]