data_[H8Pd10Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [5.6450]
_cell_length_b [8.1281]
_cell_length_c [4.7624]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [H4Pd5Au]
_chemical_formula_sum '[H8 Pd10 Au2]'
_cell_volume [218.5111]
_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
[
  Pd  Pd0  8  0.2484  0.1706  0.2482  1
  H  H1  4  0.0000  0.3110  0.0068  1
  H  H2  4  0.2249  0.5000  0.5130  1
  Pd  Pd3  2  0.0000  0.5000  0.2366  1
  Au  Au4  2  0.0000  0.0000  0.7698  1
]