data_[Cd1Mo2W1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Mo  2.1600  1.4500  0.7750
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [2.7258]
_cell_length_b [4.5652]
_cell_length_c [5.5440]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.8295]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [CdMo2W]
_chemical_formula_sum '[Cd1 Mo2 W1]'
_cell_volume [67.5228]
_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  0.2531  0.5000  0.7525  1
  Mo  Mo1  1  0.7529  0.5000  0.2515  1
  Mo  Mo2  1  0.9921  0.0000  0.0147  1
  W  W3  1  0.5019  0.0000  0.4813  1
]