data_Be2ZnAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.71
_cell_length_b   3.88
_cell_length_c   4.84
_cell_angle_alpha   90.0
_cell_angle_beta   104.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2ZnAu
_chemical_formula_sum   'Be2 Zn1 Au1'
_cell_volume   49.26
_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  0.53  0.0  0.0  1.0
  Be  Be2  1  0.52  0.94  0.18  1.0
  Zn  Zn3  1  0.89  0.0  0.06  1.0
  Au  Au0  1  0.64  0.94  0.78  1.0

data_Be2ZnAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.71
_cell_length_b   3.88
_cell_length_c   4.84
_cell_angle_alpha   90.0
_cell_angle_beta   104.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2ZnAu
_chemical_formula_sum   'Be2 Zn1 Au1'
_cell_volume   49.26
_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  0.52  0.94  0.18  1.0
  Be  Be1  1  0.53  0.0  0.0  1.0
  Zn  Zn2  1  0.89  0.0  0.06  1.0
  Au  Au3  1  0.64  0.94  0.78  1.0

Be Be Zn Au
Be Be Zn Au 0 1 o - o 0 2 o o o 0 3 o - - 2 3 o - - 