data_[Nd4Be4Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Be  1.5700  1.0500  0.5900
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.7214]
_cell_length_b [5.7079]
_cell_length_c [7.4761]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.1861]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [NdBeRh]
_chemical_formula_sum '[Nd4 Be4 Rh4]'
_cell_volume [224.4288]
_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
[
  Nd  Nd0  4  0.1967  0.6371  0.8765  1.0
  Be  Be1  4  0.2633  0.1374  0.0410  1.0
  Rh  Rh2  4  0.3841  0.0993  0.7879  1.0
]