data_[Be4W2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Be  1.5700  1.0500  0.5900
  W  2.3600  1.3500  0.7667
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.1156]
_cell_length_b [2.6583]
_cell_length_c [4.4253]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.6612]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Be2WAu]
_chemical_formula_sum '[Be4 W2 Au2]'
_cell_volume [102.1784]
_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
[
  Be  Be0  2  0.0214  0.0000  0.9708  1
  Be  Be1  2  0.2294  0.5000  0.2865  1
  W  W2  2  0.4840  0.0000  0.4304  1
  Au  Au3  2  0.2652  0.0000  0.8122  1
]