data_[Ce8Ti4Co4N20]
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
  Co  1.8800  1.3500  0.7683
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.2730]
_cell_length_b [13.5140]
_cell_length_c [9.8769]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ce2TiCoN5]
_chemical_formula_sum '[Ce8 Ti4 Co4 N20]'
_cell_volume [436.8684]
_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  0.1203  0.6923  1.0
  Ce  Ce1  4  0.0000  0.1332  0.3254  1.0
  Ti  Ti2  4  0.0000  0.2017  0.0230  1.0
  Co  Co3  4  0.0000  0.4494  0.4449  1.0
  N  N4  4  0.0000  0.0324  0.0137  1.0
  N  N5  4  0.0000  0.2978  0.6636  1.0
  N  N6  4  0.0000  0.3192  0.3773  1.0
  N  N7  4  0.0000  0.3411  0.0086  1.0
  N  N8  4  0.0000  0.4971  0.7751  1.0
]