data_[Nd16Al4Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Al  1.6100  1.2500  0.6750
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.7093]
_cell_length_b [5.1680]
_cell_length_c [6.8963]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.2938]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd8Al2Rh]
_chemical_formula_sum '[Nd16 Al4 Rh2]'
_cell_volume [651.5101]
_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
[
  Nd  Nd0  4  0.0206  0.0000  0.7782  1
  Nd  Nd1  4  0.0934  0.5000  0.4520  1
  Nd  Nd2  4  0.1505  0.5000  0.9659  1
  Nd  Nd3  4  0.2077  0.0000  0.2957  1
  Al  Al4  4  0.1884  0.0000  0.7418  1
  Rh  Rh5  2  0.0000  0.5000  0.0000  1
]