data_CdCuCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.88
_cell_length_b   4.88
_cell_length_c   3.42
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.54
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdCuCl2
_chemical_formula_sum   'Cd1 Cu1 Cl2'
_cell_volume   81.27
_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  0.37  0.0  0.0  1.0
  Cu  Cu3  1  0.0  0.0  0.0  1.0
  Cl  Cl1  1  0.68  0.24  0.71  1.0
  Cl  Cl2  1  0.68  0.76  0.71  1.0

data_CdCuCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.42
_cell_length_b   4.88
_cell_length_c   4.88
_cell_angle_alpha   92.54
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdCuCl2
_chemical_formula_sum   'Cd1 Cu1 Cl2'
_cell_volume   81.27
_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  0.37  0.0  1.0
  Cu  Cu1  1  0.0  0.0  0.0  1.0
  Cl  Cl2  1  0.71  0.68  0.24  1.0
  Cl  Cl3  1  0.71  0.68  0.76  1.0

Cd Cu Cl Cl