data_ReNiAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.82
_cell_length_b   4.82
_cell_length_c   4.82
_cell_angle_alpha   147.45
_cell_angle_beta   132.87
_cell_angle_gamma   58.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReNiAu
_chemical_formula_sum   'Re1 Ni1 Au1'
_cell_volume   43.88
_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  Re2  1  0.0  0.0  0.68  1.0
  Ni  Ni1  1  0.0  0.0  0.74  1.0
  Au  Au0  1  0.0  0.0  0.0  1.0

data_ReNiAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.7
_cell_length_b   3.86
_cell_length_c   4.82
_cell_angle_alpha   113.57
_cell_angle_beta   106.27
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReNiAu
_chemical_formula_sum   'Re1 Ni1 Au1'
_cell_volume   43.88
_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  Re0  1  0.0  0.68  0.68  1.0
  Ni  Ni1  1  0.0  0.74  0.74  1.0
  Au  Au2  1  0.0  0.0  0.0  1.0

Re Ni Au