data_CdBi2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.22
_cell_length_b   3.22
_cell_length_c   10.55
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   107.42
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdBi2W
_chemical_formula_sum   'Cd1 Bi2 W1'
_cell_volume   104.41
_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  Cd2  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.91  0.0  0.47  1.0
  Bi  Bi1  1  0.91  0.0  0.09  1.0
  W  W3  1  0.0  0.0  0.28  1.0

data_CdBi2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.22
_cell_length_b   3.22
_cell_length_c   10.55
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   107.42
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdBi2W
_chemical_formula_sum   'Cd1 Bi2 W1'
_cell_volume   104.41
_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  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.91  0.0  0.09  1.0
  Bi  Bi2  1  0.91  0.0  0.47  1.0
  W  W3  1  0.0  0.0  0.28  1.0

Cd Bi Bi W
Cd Bi Bi W 0 2 - o o 1 3 + o o 2 3 + o o 