data_[Ce4P4Cl4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  P  2.1900  1.0000  0.5500
  Cl  3.1600  1.0000  0.7800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.8627]
_cell_length_b [6.9987]
_cell_length_c [6.5673]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.6293]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CePClO4]
_chemical_formula_sum '[Ce4 P4 Cl4 O16]'
_cell_volume [438.6141]
_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  0.2398  0.0000  0.1487  1.0
  P  P1  4  0.1369  0.5000  0.2659  1.0
  Cl  Cl2  4  0.0194  0.0000  0.7667  1.0
  O  O3  8  0.1870  0.3255  0.1524  1.0
  O  O4  4  0.0226  0.5000  0.7674  1.0
  O  O5  4  0.2115  0.5000  0.5018  1.0
]