data_NaBeAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.6
_cell_length_b   5.6
_cell_length_c   4.8
_cell_angle_alpha   114.51
_cell_angle_beta   114.51
_cell_angle_gamma   30.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaBeAu2
_chemical_formula_sum   'Na1 Be1 Au2'
_cell_volume   69.82
_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
  Na  Na3  1  0.92  0.0  0.12  1.0
  Be  Be2  1  0.44  0.0  0.77  1.0
  Au  Au0  1  0.65  0.0  0.01  1.0
  Au  Au1  1  0.78  0.0  0.93  1.0

data_NaBeAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.98
_cell_length_b   4.8
_cell_length_c   5.6
_cell_angle_alpha   114.51
_cell_angle_beta   105.47
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaBeAu2
_chemical_formula_sum   'Na1 Be1 Au2'
_cell_volume   69.82
_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
  Na  Na0  1  0.0  0.12  0.92  1.0
  Be  Be1  1  0.0  0.77  0.44  1.0
  Au  Au2  1  0.0  0.01  0.65  1.0
  Au  Au3  1  0.0  0.93  0.78  1.0

Na Be Au Au