data_[Ce12P10O2]
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
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.9703]
_cell_length_b [12.0639]
_cell_length_c [6.9703]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4807]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce6P5O]
_chemical_formula_sum '[Ce12 P10 O2]'
_cell_volume [552.5802]
_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
[
  Ce  Ce0  8  0.2391  0.1592  0.2402  1.0
  Ce  Ce1  4  0.2378  0.0000  0.7572  1.0
  P  P2  4  0.0000  0.1725  0.5000  1.0
  P  P3  4  0.0000  0.3340  0.0000  1.0
  P  P4  2  0.0000  0.5000  0.5000  1.0
  O  O5  2  0.0000  0.0000  0.0000  1.0
]