data_[Cr2W4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  W  2.3600  1.3500  0.7667
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.3372]
_cell_length_b [10.4551]
_cell_length_c [5.8751]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.5835]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cr(WCl4)2]
_chemical_formula_sum '[Cr2 W4 Cl16]'
_cell_volume [693.0861]
_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
[
  Cr  Cr0  2  0.0000  0.0000  0.0000  1
  W  W1  4  0.1898  0.0000  0.3305  1
  Cl  Cl2  8  0.1110  0.1981  0.2405  1
  Cl  Cl3  4  0.1262  0.5000  0.7788  1
  Cl  Cl4  4  0.1564  0.0000  0.7162  1
]