data_LaCdCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.0
_cell_length_b   8.0
_cell_length_c   8.0
_cell_angle_alpha   154.35
_cell_angle_beta   145.42
_cell_angle_gamma   43.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCdCl2
_chemical_formula_sum   'La1 Cd1 Cl2'
_cell_volume   125.54
_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
  La  La3  1  0.78  0.0  0.16  1.0
  Cd  Cd0  1  0.0  0.0  0.18  1.0
  Cl  Cl1  1  0.78  0.0  0.07  1.0
  Cl  Cl2  1  0.0  0.0  0.89  1.0

data_LaCdCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.55
_cell_length_b   4.76
_cell_length_c   8.0
_cell_angle_alpha   107.29
_cell_angle_beta   102.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCdCl2
_chemical_formula_sum   'La1 Cd1 Cl2'
_cell_volume   125.54
_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
  La  La0  1  0.0  0.16  0.38  1.0
  Cd  Cd1  1  0.0  0.18  0.18  1.0
  Cl  Cl2  1  0.0  0.07  0.29  1.0
  Cl  Cl3  1  0.0  0.89  0.89  1.0

La Cd Cl Cl
La Cd Cl Cl 0 2 o o o 1 2 - o o 1 3 o o - 