data_Cd2CuCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91
_cell_length_b   5.91
_cell_length_c   5.91
_cell_angle_alpha   149.56
_cell_angle_beta   125.38
_cell_angle_gamma   63.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2CuCl
_chemical_formula_sum   'Cd2 Cu1 Cl1'
_cell_volume   84.36
_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  0.41  1.0
  Cd  Cd1  1  0.0  0.71  0.62  1.0
  Cu  Cu3  1  0.55  0.0  0.57  1.0
  Cl  Cl2  1  0.0  0.0  0.43  1.0

data_Cd2CuCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.1
_cell_length_b   5.42
_cell_length_c   5.91
_cell_angle_alpha   117.31
_cell_angle_beta   105.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2CuCl
_chemical_formula_sum   'Cd2 Cu1 Cl1'
_cell_volume   84.36
_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  0.38  0.09  0.09  1.0
  Cd  Cd1  1  0.59  0.59  0.59  1.0
  Cu  Cu2  1  0.98  0.43  0.98  1.0
  Cl  Cl3  1  0.57  0.57  0.57  1.0

Cd Cd Cu Cl