data_NaGaAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.58
_cell_length_b   4.58
_cell_length_c   3.41
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaGaAu
_chemical_formula_sum   'Na1 Ga1 Au1'
_cell_volume   61.8
_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  Na2  1  0.0  0.0  0.0  1.0
  Ga  Ga1  1  0.29  0.32  0.7  1.0
  Au  Au0  1  1.0  0.64  0.7  1.0

data_NaGaAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.41
_cell_length_b   4.58
_cell_length_c   4.58
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaGaAu
_chemical_formula_sum   'Na1 Ga1 Au1'
_cell_volume   61.8
_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  0.0  0.0  1.0
  Ga  Ga1  1  0.7  0.29  0.32  1.0
  Au  Au2  1  0.7  1.0  0.64  1.0

Na Ga Au
Na Ga Au 0 2 - - - 0 1 o o - 