data_Al3Cd5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.22
_cell_length_b   6.22
_cell_length_c   4.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Cd5
_chemical_formula_sum   'Al3 Cd5'
_cell_volume   165.68
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Al  Al1  1  0.06  0.0  0.14  1.0
  Al  Al2  1  0.72  0.0  0.14  1.0
  Cd  Cd3  1  0.39  0.0  0.0  1.0
  Cd  Cd4  1  0.2  0.21  0.0  1.0
  Cd  Cd5  1  0.2  0.79  0.0  1.0
  Cd  Cd6  1  0.39  0.21  0.14  1.0
  Cd  Cd7  1  0.39  0.79  0.14  1.0

data_Al3Cd5
_symmetry_space_group_name_H-M   Pm
_cell_length_a   4.28
_cell_length_b   6.22
_cell_length_c   6.22
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Al3Cd5
_chemical_formula_sum   'Al3 Cd5'
_cell_volume   165.69
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Al  Al1  1  0.14  0.0  0.06  1.0
  Al  Al2  1  0.14  0.0  0.72  1.0
  Cd  Cd3  2  0.0  0.21  0.2  1.0
  Cd  Cd4  2  0.14  0.21  0.39  1.0
  Cd  Cd5  1  0.0  0.0  0.39  1.0

Al Al Al Cd Cd Cd Cd Cd
Al Al Al Cd Cd Cd Cd Cd 0 1 o o o 0 2 - o o 1 2 - o o 1 4 o o o 1 5 o - o 2 3 o o o 3 6 o o o 3 7 o - o 4 6 o o o 5 7 o o o 