data_[Ga24Pd8Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.1944]
_cell_length_b [9.5744]
_cell_length_c [5.0449]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.9345]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ga3PdAu]
_chemical_formula_sum '[Ga24 Pd8 Au8]'
_cell_volume [732.1995]
_cell_formula_units_Z [8]
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
[
  Ga  Ga0  8  0.1881  0.2279  0.2858  1
  Ga  Ga1  4  0.0000  0.1510  0.5000  1
  Ga  Ga2  4  0.0000  0.3116  0.0000  1
  Ga  Ga3  4  0.1645  0.5000  0.6188  1
  Ga  Ga4  4  0.1900  0.0000  0.6980  1
  Pd  Pd5  8  0.1390  0.2483  0.7794  1
  Au  Au6  4  0.0903  0.0000  0.1302  1
  Au  Au7  4  0.1271  0.5000  0.1184  1
]