data_[Nd2Ho2Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ho  1.2300  1.7500  1.0410
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.8879]
_cell_length_b [3.7904]
_cell_length_c [7.6338]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.1072]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NdHoAu4]
_chemical_formula_sum '[Nd2 Ho2 Au8]'
_cell_volume [265.0704]
_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  0.0000  0.5000  0.0000  1
  Ho  Ho1  2  0.0000  0.5000  0.5000  1
  Au  Au2  4  0.1626  0.0000  0.8184  1
  Au  Au3  4  0.1667  0.0000  0.3408  1
]