data_[Sr16Cd4Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [11.1915]
_cell_length_b [15.8267]
_cell_length_c [5.5517]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Sr8Cd2Au3]
_chemical_formula_sum '[Sr16 Cd4 Au6]'
_cell_volume [983.3499]
_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
[
  Sr  Sr0  8  0.2447  0.1184  0.5000  1
  Sr  Sr1  4  0.0000  0.1159  0.0000  1
  Sr  Sr2  4  0.0000  0.3800  0.0000  1
  Cd  Cd3  4  0.0000  0.2550  0.5000  1
  Au  Au4  4  0.2391  0.5000  0.0000  1
  Au  Au5  2  0.0000  0.0000  0.5000  1
]