data_[Tb32Co16Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Co  1.8800  1.3500  0.7683
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Fdd2]
_cell_length_a [11.9682]
_cell_length_b [12.8219]
_cell_length_c [8.4818]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [43]
_chemical_formula_structural [Tb4Co2Au]
_chemical_formula_sum '[Tb32 Co16 Au8]'
_cell_volume [1301.5728]
_cell_formula_units_Z [8]
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
[
  Tb  Tb0  16  0.0665  0.3885  0.9215  1.0
  Tb  Tb1  16  0.1184  0.2999  0.3230  1.0
  Co  Co2  16  0.0623  0.3217  0.6273  1.0
  Au  Au3  8  0.0000  0.0000  0.7592  1.0
]