data_SnOsAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.49
_cell_length_b   5.49
_cell_length_c   5.49
_cell_angle_alpha   144.96
_cell_angle_beta   144.96
_cell_angle_gamma   50.39
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnOsAu
_chemical_formula_sum   'Sn1 Os1 Au1'
_cell_volume   54.25
_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
  Sn  Sn2  1  0.0  0.0  0.76  1.0
  Os  Os1  1  0.0  0.0  0.18  1.0
  Au  Au0  1  0.0  0.0  0.93  1.0

data_SnOsAu
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.67
_cell_length_b   4.67
_cell_length_c   5.49
_cell_angle_alpha   90.0
_cell_angle_beta   115.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   SnOsAu
_chemical_formula_sum   'Sn2 Os2 Au2'
_cell_volume   108.49
_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
  Sn  Sn0  2  0.0  0.0  0.24  1.0
  Os  Os1  2  0.0  0.0  0.82  1.0
  Au  Au2  2  0.0  0.0  0.07  1.0

Sn Os Au