data_[Cd10Ga4Au24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ga  1.8100  1.3000  0.7600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.7241]
_cell_length_b [9.1167]
_cell_length_c [8.6694]
_cell_angle_alpha [90.0000]
_cell_angle_beta [132.3055]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd5(GaAu6)2]
_chemical_formula_sum '[Cd10 Ga4 Au24]'
_cell_volume [743.7567]
_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
[
  Cd  Cd0  4  0.1679  0.5000  0.6997  1.0
  Cd  Cd1  4  0.2460  0.5000  0.4320  1.0
  Cd  Cd2  2  0.0000  0.0000  0.5000  1.0
  Ga  Ga3  4  0.0000  0.2436  0.0000  1.0
  Au  Au4  8  0.0793  0.2662  0.3952  1.0
  Au  Au5  8  0.2230  0.1995  0.8219  1.0
  Au  Au6  4  0.0464  0.0000  0.8824  1.0
  Au  Au7  4  0.0585  0.5000  0.8994  1.0
]