data_Os2AuSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.66
_cell_length_b   8.66
_cell_length_c   8.66
_cell_angle_alpha   19.42
_cell_angle_beta   19.42
_cell_angle_gamma   19.42
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Os2AuSe
_chemical_formula_sum   'Os2 Au1 Se1'
_cell_volume   62.84
_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
  Os  Os1  1  0.0  0.0  0.57  1.0
  Os  Os2  1  0.0  0.0  0.92  1.0
  Au  Au0  1  0.0  0.0  0.75  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

data_Os2AuSe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.06
_cell_length_b   2.92
_cell_length_c   8.66
_cell_angle_alpha   90.0
_cell_angle_beta   101.23
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Os2AuSe
_chemical_formula_sum   'Os4 Au2 Se2'
_cell_volume   125.68
_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
  Os  Os0  2  0.0  0.0  0.08  1.0
  Os  Os1  2  0.0  0.0  0.43  1.0
  Au  Au2  2  0.0  0.0  0.25  1.0
  Se  Se3  2  0.0  0.0  0.0  1.0

Os Os Au Se