data_[Sr8Bi20Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Bi  2.0200  1.6000  1.0350
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [11.4551]
_cell_length_b [16.7042]
_cell_length_c [6.6510]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Sr2Bi5Au3]
_chemical_formula_sum '[Sr8 Bi20 Au12]'
_cell_volume [1272.6515]
_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
[
  Sr  Sr0  8  0.2307  0.0951  0.0000  1.0
  Bi  Bi1  8  0.0000  0.2932  0.2500  1.0
  Bi  Bi2  8  0.0991  0.1269  0.5000  1.0
  Bi  Bi3  4  0.0000  0.5000  0.2500  1.0
  Au  Au4  8  0.1620  0.4016  0.0000  1.0
  Au  Au5  4  0.0000  0.0000  0.2500  1.0
]