data_La5Cd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.69
_cell_length_b   6.69
_cell_length_c   8.98
_cell_angle_alpha   109.26
_cell_angle_beta   109.26
_cell_angle_gamma   33.49
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La5Cd
_chemical_formula_sum   'La5 Cd1'
_cell_volume   208.18
_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  La1  1  0.26  0.0  0.95  1.0
  La  La2  1  0.66  0.0  0.91  1.0
  La  La3  1  0.86  0.0  0.91  1.0
  La  La4  1  0.3  0.0  0.06  1.0
  La  La5  1  0.94  0.0  0.84  1.0
  Cd  Cd0  1  0.97  0.0  0.21  1.0

data_La5Cd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.85
_cell_length_b   6.69
_cell_length_c   8.98
_cell_angle_alpha   109.26
_cell_angle_beta   90.0
_cell_angle_gamma   106.74
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La5Cd
_chemical_formula_sum   'La5 Cd1'
_cell_volume   208.18
_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  0.06  0.16  1.0
  La  La1  1  0.0  0.14  0.09  1.0
  La  La2  1  0.0  0.34  0.09  1.0
  La  La3  1  0.0  0.7  0.94  1.0
  La  La4  1  0.0  0.74  0.05  1.0
  Cd  Cd5  1  0.0  0.03  0.79  1.0

La La La La La Cd