data_[La12Ag2Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.7294]
_cell_length_b [8.0617]
_cell_length_c [12.5795]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.9531]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [La6AgAu2]
_chemical_formula_sum '[La12 Ag2 Au4]'
_cell_volume [579.0402]
_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
[
  La  La0  4  0.0657  0.2089  0.4267  1.0
  La  La1  4  0.2809  0.6501  0.4466  1.0
  La  La2  4  0.4018  0.0590  0.2343  1.0
  Ag  Ag3  2  0.5000  0.0000  0.5000  1.0
  Au  Au4  4  0.1468  0.1123  0.7274  1.0
]