data_[In4Pb10Au8]
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 [C2/m]
_cell_length_a [21.0312]
_cell_length_b [3.5521]
_cell_length_c [8.2015]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.6447]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [In2Pb5Au4]
_chemical_formula_sum '[In4 Pb10 Au8]'
_cell_volume [595.3952]
_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  4  0.0714  0.5000  0.6285  1
  Pb  Pb1  4  0.1673  0.0000  0.9883  1
  Pb  Pb2  4  0.1744  0.0000  0.4209  1
  Pb  Pb3  2  0.0000  0.5000  0.0000  1
  Au  Au4  4  0.0301  0.0000  0.3163  1
  Au  Au5  4  0.2093  0.5000  0.7337  1
]