data_Cd3(ClO)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.45
_cell_length_b   6.77
_cell_length_c   6.7
_cell_angle_alpha   90.0
_cell_angle_beta   115.95
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3(ClO)2
_chemical_formula_sum   'Cd6 Cl4 O4'
_cell_volume   262.99
_cell_formula_units_Z   2
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  0.0  1.0
  Cd  Cd1  1  0.13  0.92  0.41  1.0
  Cd  Cd2  1  0.86  0.54  0.6  1.0
  Cd  Cd3  1  0.53  0.38  0.01  1.0
  Cd  Cd4  1  0.66  0.23  0.42  1.0
  Cd  Cd5  1  0.39  0.84  0.62  1.0
  Cl  Cl6  1  0.03  0.47  0.4  1.0
  Cl  Cl7  1  0.95  0.85  0.61  1.0
  Cl  Cl8  1  0.57  0.92  0.42  1.0
  Cl  Cl9  1  0.49  0.3  0.62  1.0
  O  O10  1  0.96  0.77  0.38  1.0
  O  O11  1  0.02  0.15  0.64  1.0
  O  O12  1  0.5  0.62  0.39  1.0
  O  O13  1  0.56  0.0  0.65  1.0

data_Cd3(ClO)2
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.45
_cell_length_b   6.7
_cell_length_c   6.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   115.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3(ClO)2
_chemical_formula_sum   'Cd6 Cl4 O4'
_cell_volume   262.99
_cell_formula_units_Z   2
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  0.0  1.0
  Cd  Cd1  1  0.14  0.4  0.46  1.0
  Cd  Cd2  1  0.34  0.58  0.77  1.0
  Cd  Cd3  1  0.47  0.99  0.62  1.0
  Cd  Cd4  1  0.61  0.38  0.16  1.0
  Cd  Cd5  1  0.87  0.59  0.08  1.0
  Cl  Cl6  1  0.05  0.39  0.15  1.0
  Cl  Cl7  1  0.43  0.58  0.08  1.0
  Cl  Cl8  1  0.51  0.38  0.7  1.0
  Cl  Cl9  1  0.97  0.6  0.53  1.0
  O  O10  1  0.04  0.62  0.23  1.0
  O  O11  1  0.44  0.35  1.0  1.0
  O  O12  1  0.5  0.61  0.38  1.0
  O  O13  1  0.98  0.36  0.85  1.0

Cd Cd Cd Cd Cd Cd Cl Cl Cl Cl O O O O