data_BaOs2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.24
_cell_length_b   4.84
_cell_length_c   5.26
_cell_angle_alpha   90.0
_cell_angle_beta   99.15
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaOs2Au
_chemical_formula_sum   'Ba1 Os2 Au1'
_cell_volume   106.49
_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
  Ba  Ba1  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.79  0.42  0.07  1.0
  Os  Os3  1  0.62  0.42  0.12  1.0
  Au  Au0  1  0.7  0.0  0.59  1.0

data_BaOs2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.24
_cell_length_b   4.84
_cell_length_c   5.26
_cell_angle_alpha   90.0
_cell_angle_beta   99.15
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaOs2Au
_chemical_formula_sum   'Ba1 Os2 Au1'
_cell_volume   106.49
_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
  Ba  Ba0  1  0.0  0.0  0.0  1.0
  Os  Os1  1  0.62  0.42  0.12  1.0
  Os  Os2  1  0.79  0.42  0.07  1.0
  Au  Au3  1  0.7  0.0  0.59  1.0

Ba Os Os Au