data_SrOsAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.9
_cell_length_b   6.9
_cell_length_c   6.9
_cell_angle_alpha   153.55
_cell_angle_beta   153.55
_cell_angle_gamma   37.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrOsAu
_chemical_formula_sum   'Sr1 Os1 Au1'
_cell_volume   65.15
_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
  Sr  Sr2  1  0.0  0.0  0.77  1.0
  Os  Os1  1  0.0  0.0  0.57  1.0
  Au  Au0  1  0.0  0.0  0.78  1.0

data_SrOsAu
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.47
_cell_length_b   4.47
_cell_length_c   6.9
_cell_angle_alpha   90.0
_cell_angle_beta   108.88
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   SrOsAu
_chemical_formula_sum   'Sr2 Os2 Au2'
_cell_volume   130.31
_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
  Sr  Sr0  2  0.0  0.0  0.23  1.0
  Os  Os1  2  0.0  0.0  0.43  1.0
  Au  Au2  2  0.0  0.0  0.22  1.0

Sr Os Au