data_[Cd3Os3Br3Cl3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Os  2.2000  1.3000  0.6730
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [3.5656]
_cell_length_b [3.5656]
_cell_length_c [24.6823]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [CdOsBrCl]
_chemical_formula_sum '[Cd3 Os3 Br3 Cl3]'
_cell_volume [271.7636]
_cell_formula_units_Z [3]
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
[
  Cd  Cd0  3  0.0000  0.0000  0.0592  1
  Os  Os1  3  0.0000  0.0000  0.4767  1
  Br  Br2  3  0.0000  0.0000  0.8615  1
  Cl  Cl3  3  0.0000  0.0000  0.6553  1
]