data_[Sr4Cd2Au6]
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 [Cm]
_cell_length_a [11.2833]
_cell_length_b [4.8828]
_cell_length_c [7.6947]
_cell_angle_alpha [90.0000]
_cell_angle_beta [131.6090]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Sr2CdAu3]
_chemical_formula_sum '[Sr4 Cd2 Au6]'
_cell_volume [316.9728]
_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  2  0.0422  0.5000  0.7986  1.0
  Sr  Sr1  2  0.4564  0.0000  0.2078  1.0
  Cd  Cd2  2  0.1665  0.0000  0.6019  1.0
  Au  Au3  2  0.1605  0.0000  0.2083  1.0
  Au  Au4  2  0.3326  0.5000  0.7946  1.0
  Au  Au5  2  0.3418  0.5000  0.3888  1.0
]