data_LiIn2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.78
_cell_length_b   9.78
_cell_length_c   9.78
_cell_angle_alpha   17.84
_cell_angle_beta   17.84
_cell_angle_gamma   17.84
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiIn2Os
_chemical_formula_sum   'Li1 In2 Os1'
_cell_volume   76.71
_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  Li2  1  0.0  0.0  0.18  1.0
  In  In0  1  0.0  0.0  0.31  1.0
  In  In1  1  0.0  0.0  0.07  1.0
  Os  Os3  1  0.0  0.0  0.75  1.0

data_LiIn2Os
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.25
_cell_length_b   3.03
_cell_length_c   9.78
_cell_angle_alpha   90.0
_cell_angle_beta   100.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LiIn2Os
_chemical_formula_sum   'Li2 In4 Os2'
_cell_volume   153.42
_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
  Li  Li0  2  -0.0  0.0  0.82  1.0
  In  In1  2  -0.0  0.0  0.93  1.0
  In  In2  2  -0.0  0.0  0.69  1.0
  Os  Os3  2  -0.0  0.0  0.25  1.0

Li In In Os