data_[Ce4Os4Br4]
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
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.2994]
_cell_length_b [4.2288]
_cell_length_c [11.3489]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.6834]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeOsBr]
_chemical_formula_sum '[Ce4 Os4 Br4]'
_cell_volume [350.2933]
_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  0.0036  0.5000  0.1773  1
  Os  Os1  4  0.1668  0.0000  0.9805  1
  Br  Br2  4  0.1726  0.0000  0.3434  1
]