data_[Ce4Os1N1Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Os  2.2000  1.3000  0.6730
  N  3.0400  0.6500  0.6300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.6526]
_cell_length_b [3.8040]
_cell_length_c [7.6336]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0702]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Ce4OsNCl2]
_chemical_formula_sum '[Ce4 Os1 N1 Cl2]'
_cell_volume [184.6703]
_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
[
  Ce  Ce0  2  0.2722  0.5000  0.2014  1
  Ce  Ce1  2  0.2856  0.0000  0.8039  1
  Os  Os2  1  0.0000  0.0000  0.0000  1
  N  N3  1  0.5000  0.5000  0.0000  1
  Cl  Cl4  1  0.0000  0.5000  0.5000  1
  Cl  Cl5  1  0.5000  0.0000  0.5000  1
]