data_[Cd4W4C6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  W  2.3600  1.3500  0.7667
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.5933]
_cell_length_b [3.7298]
_cell_length_c [6.7809]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.5572]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd2W2C3]
_chemical_formula_sum '[Cd4 W4 C6]'
_cell_volume [217.9606]
_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  4  0.0951  0.5000  0.8580  1
  W  W1  4  0.2129  0.0000  0.3143  1
  C  C2  4  0.1975  0.0000  0.6108  1
  C  C3  2  0.0000  0.0000  0.0000  1
]