data_Li2WAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.67
_cell_length_b   4.6
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   94.77
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2WAu
_chemical_formula_sum   'Li2 W1 Au1'
_cell_volume   63.46
_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  Li1  1  0.23  0.0  0.2  1.0
  Li  Li2  1  0.88  0.3  0.02  1.0
  W  W3  1  0.27  0.0  0.85  1.0
  Au  Au0  1  0.98  0.3  0.69  1.0

data_Li2WAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.67
_cell_length_b   4.6
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   94.77
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2WAu
_chemical_formula_sum   'Li2 W1 Au1'
_cell_volume   63.46
_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  0.23  0.0  0.2  1.0
  Li  Li1  1  0.88  0.3  0.02  1.0
  W  W2  1  0.27  0.0  0.85  1.0
  Au  Au3  1  0.98  0.3  0.69  1.0

Li Li W Au
Li Li W Au 0 1 - o o 0 2 o o - 1 2 + o - 1 3 o o - 2 3 - o o 