data_BaLaCd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.82
_cell_length_b   7.79
_cell_length_c   4.02
_cell_angle_alpha   75.42
_cell_angle_beta   74.75
_cell_angle_gamma   29.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaLaCd
_chemical_formula_sum   'Ba1 La1 Cd1'
_cell_volume   117.42
_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
  Ba  Ba0  1  0.81  0.88  0.31  1.0
  La  La2  1  0.81  0.88  0.35  1.0
  Cd  Cd1  1  0.81  0.88  0.89  1.0

data_BaLaCd
_symmetry_space_group_name_H-M   Imm2
_cell_length_a   4.02
_cell_length_b   14.54
_cell_length_c   4.02
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   44
_chemical_formula_structural   BaLaCd
_chemical_formula_sum   'Ba2 La2 Cd2'
_cell_volume   234.9
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, z'
  3  '-x, y, z'
  4  'x, -y, z'
  5  'x+1/2, y+1/2, z+1/2'
  6  '-x+1/2, -y+1/2, z+1/2'
  7  '-x+1/2, y+1/2, z+1/2'
  8  'x+1/2, -y+1/2, z+1/2'
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
  Ba  Ba0  2  0.0  0.0  0.11  1.0
  La  La1  2  0.0  0.0  0.15  1.0
  Cd  Cd2  2  0.0  0.0  0.7  1.0

Ba La Cd