data_Ca2CdCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66
_cell_length_b   6.66
_cell_length_c   5.0
_cell_angle_alpha   90.52
_cell_angle_beta   90.52
_cell_angle_gamma   33.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2CdCl
_chemical_formula_sum   'Ca2 Cd1 Cl1'
_cell_volume   121.25
_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
  Ca  Ca0  1  0.26  0.0  0.35  1.0
  Ca  Ca1  1  0.62  0.0  0.76  1.0
  Cd  Cd2  1  0.14  0.0  0.87  1.0
  Cl  Cl3  1  1.0  0.0  0.52  1.0

data_Ca2CdCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.8
_cell_length_b   5.0
_cell_length_c   6.66
_cell_angle_alpha   90.52
_cell_angle_beta   106.59
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2CdCl
_chemical_formula_sum   'Ca2 Cd1 Cl1'
_cell_volume   121.25
_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
  Ca  Ca0  1  0.0  0.35  0.26  1.0
  Ca  Ca1  1  0.0  0.76  0.62  1.0
  Cd  Cd2  1  0.0  0.87  0.14  1.0
  Cl  Cl3  1  0.0  0.52  1.0  1.0

Ca Ca Cd Cl