data_[Ce6Ti4N6O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ti  1.5400  1.4000  0.8517
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [4.0430]
_cell_length_b [20.1265]
_cell_length_c [3.9155]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [Ce3Ti2N3O4]
_chemical_formula_sum '[Ce6 Ti4 N6 O8]'
_cell_volume [318.6061]
_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  4  0.0000  0.1811  0.9530  1
  Ce  Ce1  2  0.0000  0.0000  0.1299  1
  Ti  Ti2  4  0.0000  0.4031  0.9997  1
  N  N3  4  0.0000  0.1038  0.4692  1
  N  N4  2  0.0000  0.5000  0.9742  1
  O  O5  4  0.0000  0.2907  0.0468  1
  O  O6  4  0.0000  0.3911  0.4958  1
]