data_[Ce4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.9196]
_cell_length_b [5.1493]
_cell_length_c [10.9656]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.5850]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CeCl4]
_chemical_formula_sum '[Ce4 Cl16]'
_cell_volume [501.2619]
_cell_formula_units_Z [4]
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
[
  Ce  Ce0  4  0.0000  0.4273  0.2500  1
  Cl  Cl1  8  0.1247  0.3760  0.9997  1
  Cl  Cl2  8  0.1606  0.0881  0.7127  1
]