data_La2TiOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.73
_cell_length_b   5.73
_cell_length_c   3.25
_cell_angle_alpha   102.11
_cell_angle_beta   102.11
_cell_angle_gamma   113.79
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2TiOs
_chemical_formula_sum   'La2 Ti1 Os1'
_cell_volume   90.16
_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
  La  La0  1  0.94  0.4  0.5  1.0
  La  La1  1  0.94  0.6  0.5  1.0
  Ti  Ti3  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.13  0.0  0.0  1.0

data_La2TiOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.25
_cell_length_b   5.73
_cell_length_c   5.73
_cell_angle_alpha   113.79
_cell_angle_beta   102.11
_cell_angle_gamma   102.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2TiOs
_chemical_formula_sum   'La2 Ti1 Os1'
_cell_volume   90.16
_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
  La  La0  1  0.5  0.94  0.6  1.0
  La  La1  1  0.5  0.94  0.4  1.0
  Ti  Ti2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.13  0.0  1.0

La La Ti Os