data_[Cd1Fe2W1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Fe  1.8300  1.4000  0.8525
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.3752]
_cell_length_b [5.4369]
_cell_length_c [5.7448]
_cell_angle_alpha [117.2522]
_cell_angle_beta [90.8412]
_cell_angle_gamma [119.2175]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CdFe2WO6]
_chemical_formula_sum '[Cd1 Fe2 W1 O6]'
_cell_volume [123.9738]
_cell_formula_units_Z [1]
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  1  0.8069  0.5991  0.4122  1.0
  Fe  Fe1  1  0.0250  0.0442  0.0605  1.0
  Fe  Fe2  1  0.5244  0.0459  0.5693  1.0
  W  W3  1  0.3189  0.6359  0.9564  1.0
  O  O4  1  0.1518  0.8460  0.2434  1.0
  O  O5  1  0.2287  0.8165  0.7707  1.0
  O  O6  1  0.3958  0.5278  0.2282  1.0
  O  O7  1  0.5626  0.5188  0.7609  1.0
  O  O8  1  0.7008  0.0822  0.2161  1.0
  O  O9  1  0.9467  0.2068  0.7671  1.0
]