data_ReWAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.37
_cell_length_b   7.2
_cell_length_c   2.74
_cell_angle_alpha   82.78
_cell_angle_beta   75.57
_cell_angle_gamma   21.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReWAu
_chemical_formula_sum   'Re1 W1 Au1'
_cell_volume   49.62
_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
  Re  Re1  1  0.57  0.24  0.49  1.0
  W  W2  1  0.57  0.24  0.57  1.0
  Au  Au0  1  0.57  0.24  0.03  1.0

data_ReWAu
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.15
_cell_length_b   14.04
_cell_length_c   2.74
_cell_angle_alpha   90.0
_cell_angle_beta   125.06
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ReWAu
_chemical_formula_sum   'Re2 W2 Au2'
_cell_volume   99.24
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Re  Re0  2  0.07  0.5  0.06  1.0
  W  W1  2  0.07  0.5  0.14  1.0
  Au  Au2  2  0.07  0.5  0.6  1.0

Re W Au
Re W Au 0 1 o o o 0 2 o o + 0 2 o o o 1 2 o o + 1 2 o o o 