data_[In2Pd2Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [4.6182]
_cell_length_b [5.6114]
_cell_length_c [8.6234]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [InPdAu4]
_chemical_formula_sum '[In2 Pd2 Au8]'
_cell_volume [223.4719]
_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
[
  In  In0  2  0.0000  0.5000  0.8165  1.0
  Pd  Pd1  2  0.0000  0.0000  0.8155  1.0
  Au  Au2  4  0.0000  0.2508  0.4785  1.0
  Au  Au3  2  0.0000  0.0000  0.1381  1.0
  Au  Au4  2  0.0000  0.5000  0.1449  1.0
]