data_[Nd4Rh2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Rh  2.2800  1.3500  0.7450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.8844]
_cell_length_b [4.5650]
_cell_length_c [7.9277]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.6765]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Nd2RhAu]
_chemical_formula_sum '[Nd4 Rh2 Au2]'
_cell_volume [199.2363]
_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  0.2144  0.7500  0.9365  1.0
  Nd  Nd1  2  0.2308  0.7500  0.4249  1.0
  Rh  Rh2  2  0.3229  0.2500  0.2095  1.0
  Au  Au3  2  0.3299  0.2500  0.7099  1.0
]