data_[Cs2Fe4Sn2Cl16]
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
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.8349]
_cell_length_b [7.3597]
_cell_length_c [8.7181]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9444]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsFe2SnCl8]
_chemical_formula_sum '[Cs2 Fe4 Sn2 Cl16]'
_cell_volume [783.4643]
_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  0.5000  0.5000  1.0
  Fe  Fe1  4  0.2056  0.5000  0.1545  1.0
  Sn  Sn2  2  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  8  0.1335  0.2529  0.2405  1.0
  Cl  Cl4  4  0.1092  0.0000  0.7495  1.0
  Cl  Cl5  4  0.1570  0.5000  0.8907  1.0
]