data_[Nd6Ru2Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ru  2.2000  1.3000  0.6610
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.7681]
_cell_length_b [4.1648]
_cell_length_c [8.3741]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.7378]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Nd3RuRh]
_chemical_formula_sum '[Nd6 Ru2 Rh2]'
_cell_volume [259.4509]
_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  2  0.0975  0.7500  0.2471  1.0
  Nd  Nd1  2  0.3155  0.7500  0.9406  1.0
  Nd  Nd2  2  0.3647  0.2500  0.6026  1.0
  Ru  Ru3  2  0.3728  0.2500  0.2107  1.0
  Rh  Rh4  2  0.0731  0.7500  0.6086  1.0
]