data_BeWAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.74
_cell_length_b   4.74
_cell_length_c   4.74
_cell_angle_alpha   129.13
_cell_angle_beta   129.13
_cell_angle_gamma   74.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeWAu2
_chemical_formula_sum   'Be1 W1 Au2'
_cell_volume   62.52
_cell_formula_units_Z   1
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  Be2  1  0.0  0.0  0.0  1.0
  W  W3  1  0.04  0.0  0.88  1.0
  Au  Au0  1  0.0  0.0  0.77  1.0
  Au  Au1  1  0.0  0.04  0.88  1.0

data_BeWAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.07
_cell_length_b   4.07
_cell_length_c   4.74
_cell_angle_alpha   115.43
_cell_angle_beta   115.43
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeWAu2
_chemical_formula_sum   'Be1 W1 Au2'
_cell_volume   62.52
_cell_formula_units_Z   1
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  1  0.0  0.0  0.0  1.0
  W  W1  1  0.88  0.85  0.85  1.0
  Au  Au2  1  0.77  0.77  0.77  1.0
  Au  Au3  1  0.85  0.88  0.85  1.0

Be W Au Au