data_OsAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29
_cell_length_b   5.29
_cell_length_c   5.29
_cell_angle_alpha   102.64
_cell_angle_beta   102.64
_cell_angle_gamma   124.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   OsAu2
_chemical_formula_sum   'Os2 Au4'
_cell_volume   108.16
_cell_formula_units_Z   2
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
  Os  Os4  1  0.0  0.0  0.71  1.0
  Os  Os5  1  0.0  0.0  0.24  1.0
  Au  Au0  1  0.27  0.04  0.47  1.0
  Au  Au1  1  0.96  0.27  0.47  1.0
  Au  Au2  1  0.35  0.04  0.0  1.0
  Au  Au3  1  0.04  0.27  0.0  1.0

data_OsAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.95
_cell_length_b   5.29
_cell_length_c   5.29
_cell_angle_alpha   77.36
_cell_angle_beta   62.11
_cell_angle_gamma   62.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   OsAu2
_chemical_formula_sum   'Os2 Au4'
_cell_volume   108.16
_cell_formula_units_Z   2
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
  Os  Os0  1  0.0  0.0  0.29  1.0
  Os  Os1  1  0.0  0.0  0.76  1.0
  Au  Au2  1  0.04  0.23  0.53  1.0
  Au  Au3  1  0.04  0.31  0.0  1.0
  Au  Au4  1  0.27  0.69  0.53  1.0
  Au  Au5  1  0.27  0.77  0.0  1.0

Os Os Au Au Au Au