data_LiGaOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.78
_cell_length_b   3.72
_cell_length_c   5.43
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiGaOs2
_chemical_formula_sum   'Li1 Ga1 Os2'
_cell_volume   56.19
_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
  Li  Li1  1  0.0  0.0  0.0  1.0
  Ga  Ga0  1  0.39  0.86  0.83  1.0
  Os  Os2  1  0.39  0.86  0.06  1.0
  Os  Os3  1  0.0  0.0  0.25  1.0

data_LiGaOs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.78
_cell_length_b   3.72
_cell_length_c   5.43
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiGaOs2
_chemical_formula_sum   'Li1 Ga1 Os2'
_cell_volume   56.19
_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
  Li  Li0  1  0.0  0.0  0.0  1.0
  Ga  Ga1  1  0.39  0.86  0.83  1.0
  Os  Os2  1  0.0  0.0  0.25  1.0
  Os  Os3  1  0.39  0.86  0.06  1.0

Li Ga Os Os