data_[Li1Ce1H2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ce  1.1200  1.8500  1.0800
  H  2.2000  0.2500  0.0000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.5366]
_cell_length_b [6.7270]
_cell_length_c [7.7792]
_cell_angle_alpha [90.7030]
_cell_angle_beta [106.4535]
_cell_angle_gamma [94.2504]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [LiCe(HCl4)2]
_chemical_formula_sum '[Li1 Ce1 H2 Cl8]'
_cell_volume [326.9544]
_cell_formula_units_Z [1]
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
[
  Li  Li0  1  0.0000  0.0000  0.5000  1.0
  Ce  Ce1  1  0.0000  0.0000  0.0000  1.0
  H  H2  2  0.4033  0.7519  0.6044  1.0
  Cl  Cl3  2  0.1626  0.6332  0.0325  1.0
  Cl  Cl4  2  0.2056  0.6735  0.5431  1.0
  Cl  Cl5  2  0.2561  0.1270  0.8173  1.0
  Cl  Cl6  2  0.2575  0.1306  0.3127  1.0
]