data_Li2AuCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.04
_cell_length_b   7.04
_cell_length_c   7.04
_cell_angle_alpha   153.23
_cell_angle_beta   152.46
_cell_angle_gamma   38.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2AuCl
_chemical_formula_sum   'Li2 Au1 Cl1'
_cell_volume   72.63
_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
  Li  Li2  1  0.0  0.68  0.9  1.0
  Li  Li3  1  0.0  0.0  0.88  1.0
  Au  Au0  1  0.0  0.68  0.62  1.0
  Cl  Cl1  1  0.0  0.0  0.54  1.0

data_Li2AuCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.26
_cell_length_b   3.35
_cell_length_c   7.04
_cell_angle_alpha   103.77
_cell_angle_beta   103.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2AuCl
_chemical_formula_sum   'Li2 Au1 Cl1'
_cell_volume   72.63
_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
  Li  Li0  1  0.0  0.88  0.88  1.0
  Li  Li1  1  0.32  0.22  0.22  1.0
  Au  Au2  1  0.32  0.94  0.94  1.0
  Cl  Cl3  1  0.0  0.54  0.54  1.0

Li Li Au Cl