data_[Ba4Ga2Ag2Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.9209]
_cell_length_b [6.9467]
_cell_length_c [7.4605]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.5144]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2GaAgAu6]
_chemical_formula_sum '[Ba4 Ga2 Ag2 Au12]'
_cell_volume [526.6898]
_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
[
  Ba  Ba0  4  0.2227  0.5000  0.1679  1.0
  Ga  Ga1  2  0.0000  0.5000  0.5000  1.0
  Ag  Ag2  2  0.0000  0.0000  0.0000  1.0
  Au  Au3  8  0.0469  0.2072  0.3465  1.0
  Au  Au4  4  0.2466  0.5000  0.6619  1.0
]