data_[U4Pd24Au16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.8222]
_cell_length_b [7.7081]
_cell_length_c [20.9661]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [U(Pd3Au2)2]
_chemical_formula_sum '[U4 Pd24 Au16]'
_cell_volume [779.3033]
_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
[
  U  U0  4  0.0000  0.2264  0.7500  1
  Pd  Pd1  8  0.0000  0.1025  0.1822  1
  Pd  Pd2  8  0.0000  0.1956  0.5959  1
  Pd  Pd3  4  0.0000  0.4241  0.2500  1
  Pd  Pd4  4  0.0000  0.5000  0.0000  1
  Au  Au5  8  0.0000  0.1496  0.0448  1
  Au  Au6  8  0.0000  0.4595  0.1263  1
]