data_Sr2LiOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.59
_cell_length_b   4.59
_cell_length_c   8.64
_cell_angle_alpha   95.04
_cell_angle_beta   95.04
_cell_angle_gamma   42.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2LiOs
_chemical_formula_sum   'Sr2 Li1 Os1'
_cell_volume   121.75
_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
  Sr  Sr2  1  0.32  0.0  0.57  1.0
  Sr  Sr3  1  0.42  0.0  0.03  1.0
  Li  Li0  1  0.0  0.0  0.0  1.0
  Os  Os1  1  0.87  0.0  0.3  1.0

data_Sr2LiOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.31
_cell_length_b   4.59
_cell_length_c   8.64
_cell_angle_alpha   95.04
_cell_angle_beta   90.0
_cell_angle_gamma   111.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2LiOs
_chemical_formula_sum   'Sr2 Li1 Os1'
_cell_volume   121.75
_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
  Sr  Sr0  1  0.0  0.58  0.97  1.0
  Sr  Sr1  1  0.0  0.68  0.43  1.0
  Li  Li2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.13  0.7  1.0

Sr Sr Li Os