data_[Ga2Au30]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmma]
_cell_length_a [4.0853]
_cell_length_b [4.0885]
_cell_length_c [48.1020]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [51]
_chemical_formula_structural [GaAu15]
_chemical_formula_sum '[Ga2 Au30]'
_cell_volume [803.4477]
_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
[
  Ga  Ga0  2  0.2500  0.0000  0.6637  1
  Au  Au1  2  0.2500  0.0000  0.0223  1
  Au  Au2  2  0.2500  0.0000  0.1118  1
  Au  Au3  2  0.2500  0.0000  0.2013  1
  Au  Au4  2  0.2500  0.0000  0.2912  1
  Au  Au5  2  0.2500  0.0000  0.7539  1
  Au  Au6  2  0.2500  0.0000  0.8434  1
  Au  Au7  2  0.2500  0.0000  0.9328  1
  Au  Au8  2  0.2500  0.5000  0.0671  1
  Au  Au9  2  0.2500  0.5000  0.1565  1
  Au  Au10  2  0.2500  0.5000  0.2461  1
  Au  Au11  2  0.2500  0.5000  0.3358  1
  Au  Au12  2  0.2500  0.5000  0.7088  1
  Au  Au13  2  0.2500  0.5000  0.7987  1
  Au  Au14  2  0.2500  0.5000  0.8881  1
  Au  Au15  2  0.2500  0.5000  0.9776  1
]