data_[Cs2Ce2Cu4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ce  1.1200  1.8500  1.0800
  Cu  1.9000  1.3500  0.8200
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.4490]
_cell_length_b [7.4046]
_cell_length_c [10.4315]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.2109]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsCe(CuCl4)2]
_chemical_formula_sum '[Cs2 Ce2 Cu4 Cl16]'
_cell_volume [804.9034]
_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
  Ce  Ce1  2  0.0000  0.0000  0.0000  1.0
  Cu  Cu2  4  0.1379  0.5000  0.7870  1.0
  Cl  Cl3  8  0.0007  0.2442  0.1871  1.0
  Cl  Cl4  4  0.1728  0.5000  0.5854  1.0
  Cl  Cl5  4  0.2434  0.5000  0.9841  1.0
]