data_[Cu1Bi1W2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Bi  2.0200  1.6000  1.0350
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.1618]
_cell_length_b [6.1040]
_cell_length_c [6.2504]
_cell_angle_alpha [108.6403]
_cell_angle_beta [91.8963]
_cell_angle_gamma [113.3556]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CuBi(WO4)2]
_chemical_formula_sum '[Cu1 Bi1 W2 O8]'
_cell_volume [168.3982]
_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
[
  Cu  Cu0  1  0.5000  0.5000  0.5000  1.0
  Bi  Bi1  1  0.0000  0.5000  0.0000  1.0
  W  W2  2  0.2502  0.9852  0.6621  1.0
  O  O3  2  0.0154  0.7519  0.7737  1.0
  O  O4  2  0.0274  0.1885  0.6646  1.0
  O  O5  2  0.4678  0.7989  0.5248  1.0
  O  O6  2  0.4983  0.7687  0.0787  1.0
]