data_[Cd2Os2Cl12]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.0742]
_cell_length_b [10.6311]
_cell_length_c [6.7000]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.8952]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CdOsCl6]
_chemical_formula_sum '[Cd2 Os2 Cl12]'
_cell_volume [533.6269]
_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
[
  Cd  Cd0  2  0.0000  0.0000  0.5000  1
  Os  Os1  2  0.0000  0.0000  0.0000  1
  Cl  Cl2  8  0.1247  0.1527  0.2687  1
  Cl  Cl3  4  0.2499  0.5000  0.0992  1
]