data_Al3Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.3
_cell_length_b   8.3
_cell_length_c   8.3
_cell_angle_alpha   153.13
_cell_angle_beta   153.13
_cell_angle_gamma   38.37
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Rh
_chemical_formula_sum   'Al6 Rh2'
_cell_volume   116.71
_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
  Al  Al0  1  0.0  0.93  0.0  1.0
  Al  Al1  1  0.93  0.0  0.0  1.0
  Al  Al2  1  0.93  0.0  0.92  1.0
  Al  Al3  1  0.0  0.93  0.92  1.0
  Al  Al4  1  0.0  0.0  0.77  1.0
  Al  Al5  1  0.0  0.0  0.92  1.0
  Rh  Rh6  1  0.0  0.0  0.86  1.0
  Rh  Rh7  1  0.0  0.0  0.83  1.0

data_Al3Rh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.46
_cell_length_b   5.46
_cell_length_c   8.3
_cell_angle_alpha   90.0
_cell_angle_beta   109.18
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Al3Rh
_chemical_formula_sum   'Al12 Rh4'
_cell_volume   233.43
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  4  0.46  0.46  0.93  1.0
  Al  Al1  4  0.46  0.46  0.01  1.0
  Al  Al2  2  0.0  0.0  0.08  1.0
  Al  Al3  2  0.0  0.0  0.23  1.0
  Rh  Rh4  2  0.0  0.0  0.14  1.0
  Rh  Rh5  2  0.0  0.0  0.17  1.0

Al Al Al Al Al Al Rh Rh