data_LiMgOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.78
_cell_length_b   2.78
_cell_length_c   7.06
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMgOs
_chemical_formula_sum   'Li1 Mg1 Os1'
_cell_volume   47.19
_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  0.92  1.0
  Mg  Mg1  1  0.0  0.6  0.46  1.0
  Os  Os2  1  0.39  0.8  0.74  1.0

data_LiMgOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.78
_cell_length_b   2.78
_cell_length_c   7.06
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMgOs
_chemical_formula_sum   'Li1 Mg1 Os1'
_cell_volume   47.19
_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  0.92  1.0
  Mg  Mg1  1  0.0  0.6  0.46  1.0
  Os  Os2  1  0.39  0.8  0.74  1.0

Li Mg Os
Li Mg Os 0 2 - - o 0 2 o o o 0 2 o - o 1 2 - - o 1 2 - o o 1 2 o o o 1 1 + + o 1 1 o + o 1 1 + o o 