data_[In2Pd6Au14]
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 [C2/m]
_cell_length_a [9.7058]
_cell_length_b [9.9875]
_cell_length_c [5.0561]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.1382]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [InPd3Au7]
_chemical_formula_sum '[In2 Pd6 Au14]'
_cell_volume [423.8632]
_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  0.5000  1
  Pd  Pd1  4  0.0000  0.2327  0.0000  1
  Pd  Pd2  2  0.0000  0.0000  0.5000  1
  Au  Au3  8  0.1706  0.2375  0.6713  1
  Au  Au4  4  0.1732  0.0000  0.1624  1
  Au  Au5  2  0.0000  0.5000  0.0000  1
]