data_Cd4W3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.34
_cell_length_b   15.34
_cell_length_c   15.34
_cell_angle_alpha   168.96
_cell_angle_beta   168.96
_cell_angle_gamma   15.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd4W3
_chemical_formula_sum   'Cd4 W3'
_cell_volume   132.5
_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  0.54  1.0
  Cd  Cd1  1  0.0  0.0  0.03  1.0
  Cd  Cd2  1  0.0  0.0  0.37  1.0
  Cd  Cd3  1  0.0  0.0  0.86  1.0
  W  W4  1  0.0  0.0  0.0  1.0
  W  W5  1  0.0  0.0  0.43  1.0
  W  W6  1  0.0  0.0  0.97  1.0

data_Cd4W3
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.18
_cell_length_b   4.18
_cell_length_c   15.34
_cell_angle_alpha   90.0
_cell_angle_beta   97.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Cd4W3
_chemical_formula_sum   'Cd8 W6'
_cell_volume   265.01
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.14  1.0
  Cd  Cd1  2  0.0  0.0  0.46  1.0
  Cd  Cd2  2  0.0  0.0  0.63  1.0
  Cd  Cd3  2  0.0  0.0  0.97  1.0
  W  W4  2  0.0  0.0  0.0  1.0
  W  W5  2  0.0  0.0  0.03  1.0
  W  W6  2  0.0  0.0  0.57  1.0

Cd Cd Cd Cd W W W