data_BaAgOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11
_cell_length_b   3.11
_cell_length_c   8.08
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaAgOs
_chemical_formula_sum   'Ba1 Ag1 Os1'
_cell_volume   67.83
_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  0.8  0.84  1.0
  Ag  Ag0  1  0.0  0.0  0.79  1.0
  Os  Os2  1  0.56  0.9  0.53  1.0

data_BaAgOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.11
_cell_length_b   3.11
_cell_length_c   8.08
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaAgOs
_chemical_formula_sum   'Ba1 Ag1 Os1'
_cell_volume   67.83
_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  0.8  0.84  1.0
  Ag  Ag1  1  0.0  0.0  0.79  1.0
  Os  Os2  1  0.56  0.9  0.53  1.0

Ba Ag Os
Ba Ag Os 0 1 o + o 0 2 o o o 0 2 - o o 1 2 o o o 1 2 o - o 1 2 - - o 2 2 + + o 2 2 o + o 2 2 + o o 