data_[In4Pb4Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Pb  2.3300  1.8000  1.1225
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.2196]
_cell_length_b [4.1937]
_cell_length_c [7.9810]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.0086]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [InPbAu]
_chemical_formula_sum '[In4 Pb4 Au4]'
_cell_volume [314.9046]
_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
[
  In  In0  2  0.1291  0.0000  0.6257  1.0
  In  In1  2  0.3916  0.5000  0.0650  1.0
  Pb  Pb2  2  0.2161  0.5000  0.3351  1.0
  Pb  Pb3  2  0.4559  0.0000  0.7702  1.0
  Au  Au4  2  0.1746  0.0000  0.0146  1.0
  Au  Au5  2  0.4509  0.0000  0.3742  1.0
]