data_[Sr16Ag16Au16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [5.5826]
_cell_length_b [14.1979]
_cell_length_c [16.5475]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [SrAgAu]
_chemical_formula_sum '[Sr16 Ag16 Au16]'
_cell_volume [1311.5628]
_cell_formula_units_Z [16]
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
[
  Sr  Sr0  16  0.0000  0.1376  0.3833  1
  Ag  Ag1  8  0.0000  0.0000  0.0891  1
  Ag  Ag2  8  0.0000  0.1758  0.0000  1
  Au  Au3  16  0.0000  0.1625  0.1958  1
]