data_Al5Rh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.95
_cell_length_b   7.95
_cell_length_c   7.9
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al5Rh2
_chemical_formula_sum   'Al20 Rh8'
_cell_volume   432.77
_cell_formula_units_Z   4
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  0.0  0.0  0.95  1.0
  Al  Al2  1  0.62  0.24  0.98  1.0
  Al  Al3  1  0.0  0.49  0.93  1.0
  Al  Al4  1  0.64  0.64  0.93  1.0
  Al  Al5  1  0.33  0.24  0.98  1.0
  Al  Al6  1  0.98  0.4  0.98  1.0
  Al  Al7  1  0.36  0.64  0.93  1.0
  Al  Al8  1  0.3  0.33  0.45  1.0
  Al  Al9  1  0.0  0.66  0.49  1.0
  Al  Al10  1  0.32  0.56  0.49  1.0
  Al  Al11  1  0.65  0.33  0.45  1.0
  Al  Al12  1  0.98  0.23  0.45  1.0
  Al  Al13  1  0.68  0.56  0.46  1.0
  Al  Al14  1  0.0  0.66  0.46  1.0
  Al  Al15  1  0.68  0.56  0.49  1.0
  Al  Al16  1  0.32  0.56  0.46  1.0
  Al  Al17  1  0.65  0.33  0.41  1.0
  Al  Al18  1  0.3  0.33  0.41  1.0
  Al  Al19  1  0.98  0.23  0.41  1.0
  Rh  Rh20  1  0.98  0.3  0.93  1.0
  Rh  Rh21  1  0.0  0.59  0.98  1.0
  Rh  Rh22  1  0.55  0.89  0.98  1.0
  Rh  Rh23  1  0.0  0.79  0.93  1.0
  Rh  Rh24  1  0.57  0.99  0.93  1.0
  Rh  Rh25  1  0.4  0.89  0.98  1.0
  Rh  Rh26  1  0.98  0.1  0.98  1.0
  Rh  Rh27  1  0.43  0.99  0.93  1.0

data_Al5Rh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   7.9
_cell_length_b   7.95
_cell_length_c   7.95
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al5Rh2
_chemical_formula_sum   'Al20 Rh8'
_cell_volume   432.77
_cell_formula_units_Z   4
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  0.41  0.3  0.33  1.0
  Al  Al2  1  0.41  0.65  0.33  1.0
  Al  Al3  1  0.41  0.98  0.23  1.0
  Al  Al4  1  0.45  0.3  0.33  1.0
  Al  Al5  1  0.45  0.65  0.33  1.0
  Al  Al6  1  0.45  0.98  0.23  1.0
  Al  Al7  1  0.46  0.0  0.66  1.0
  Al  Al8  1  0.46  0.32  0.56  1.0
  Al  Al9  1  0.46  0.68  0.56  1.0
  Al  Al10  1  0.49  0.0  0.66  1.0
  Al  Al11  1  0.49  0.32  0.56  1.0
  Al  Al12  1  0.49  0.68  0.56  1.0
  Al  Al13  1  0.93  0.0  0.49  1.0
  Al  Al14  1  0.93  0.36  0.64  1.0
  Al  Al15  1  0.93  0.64  0.64  1.0
  Al  Al16  1  0.95  0.0  0.0  1.0
  Al  Al17  1  0.98  0.33  0.24  1.0
  Al  Al18  1  0.98  0.62  0.24  1.0
  Al  Al19  1  0.98  0.98  0.4  1.0
  Rh  Rh20  1  0.93  0.0  0.79  1.0
  Rh  Rh21  1  0.93  0.43  0.99  1.0
  Rh  Rh22  1  0.93  0.57  0.99  1.0
  Rh  Rh23  1  0.93  0.98  0.3  1.0
  Rh  Rh24  1  0.98  0.0  0.59  1.0
  Rh  Rh25  1  0.98  0.4  0.89  1.0
  Rh  Rh26  1  0.98  0.55  0.89  1.0
  Rh  Rh27  1  0.98  0.98  0.1  1.0

Al Al Al Al Al Al Al Al Al Al Al Al Al Al Al Al Al Al Al Al Rh Rh Rh Rh Rh Rh Rh Rh