data_[Tb4Pd12Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.0731]
_cell_length_b [4.1370]
_cell_length_c [8.3283]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.8901]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TbPd3Au2]
_chemical_formula_sum '[Tb4 Pd12 Au8]'
_cell_volume [436.0901]
_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
[
  Tb  Tb0  4  0.0947  0.5000  0.2446  1.0
  Pd  Pd1  4  0.0808  0.5000  0.7034  1.0
  Pd  Pd2  4  0.0845  0.0000  0.4707  1.0
  Pd  Pd3  4  0.2477  0.5000  0.6332  1.0
  Au  Au4  4  0.0814  0.0000  0.9494  1.0
  Au  Au5  4  0.2459  0.0000  0.8721  1.0
]