data_AlCdW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.37
_cell_length_b   5.37
_cell_length_c   5.37
_cell_angle_alpha   144.63
_cell_angle_beta   130.92
_cell_angle_gamma   61.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCdW2
_chemical_formula_sum   'Al1 Cd1 W2'
_cell_volume   66.96
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.0  0.0  0.6  1.0
  W  W2  1  0.63  0.0  0.23  1.0
  W  W3  1  0.0  0.23  0.37  1.0

data_AlCdW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.26
_cell_length_b   4.46
_cell_length_c   5.37
_cell_angle_alpha   114.54
_cell_angle_beta   107.69
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCdW2
_chemical_formula_sum   'Al1 Cd1 W2'
_cell_volume   66.96
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.4  0.4  0.4  1.0
  W  W2  1  0.4  0.77  0.4  1.0
  W  W3  1  0.63  0.86  0.86  1.0

Al Cd W W
Al Cd W W 0 3 o o o 1 2 - o o 