data_NaAu2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.78
_cell_length_b   3.77
_cell_length_c   7.18
_cell_angle_alpha   90.0
_cell_angle_beta   105.19
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaAu2Cl
_chemical_formula_sum   'Na1 Au2 Cl1'
_cell_volume   98.75
_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  0.44  0.0  0.33  1.0
  Au  Au0  1  0.88  0.89  0.39  1.0
  Au  Au1  1  0.99  0.0  0.94  1.0
  Cl  Cl2  1  0.55  0.89  0.66  1.0

data_NaAu2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.77
_cell_length_b   3.78
_cell_length_c   7.18
_cell_angle_alpha   105.19
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaAu2Cl
_chemical_formula_sum   'Na1 Au2 Cl1'
_cell_volume   98.75
_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  0.56  0.67  1.0
  Au  Au1  1  0.0  0.01  0.06  1.0
  Au  Au2  1  0.11  0.12  0.61  1.0
  Cl  Cl3  1  0.11  0.45  0.34  1.0

Na Au Au Cl