data_Be2VAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.68
_cell_length_b   4.68
_cell_length_c   4.27
_cell_angle_alpha   107.54
_cell_angle_beta   107.54
_cell_angle_gamma   33.1
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2VAu
_chemical_formula_sum   'Be2 V1 Au1'
_cell_volume   48.37
_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  Be1  1  0.88  0.0  0.98  1.0
  Be  Be2  1  0.13  0.0  0.09  1.0
  V  V3  1  0.75  0.0  0.82  1.0
  Au  Au0  1  0.34  0.0  0.25  1.0

data_Be2VAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.66
_cell_length_b   4.27
_cell_length_c   4.68
_cell_angle_alpha   107.54
_cell_angle_beta   106.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2VAu
_chemical_formula_sum   'Be2 V1 Au1'
_cell_volume   48.37
_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  0.09  0.13  1.0
  Be  Be1  1  0.0  0.98  0.88  1.0
  V  V2  1  0.0  0.82  0.75  1.0
  Au  Au3  1  0.0  0.25  0.34  1.0

Be Be V Au