data_TlOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.97
_cell_length_b   2.97
_cell_length_c   9.14
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlOs
_chemical_formula_sum   'Tl2 Os2'
_cell_volume   80.59
_cell_formula_units_Z   2
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
  Tl  Tl2  1  0.48  0.0  0.06  1.0
  Tl  Tl3  1  0.0  0.48  0.08  1.0
  Os  Os0  1  0.48  0.0  0.38  1.0
  Os  Os1  1  0.0  0.48  0.76  1.0

data_TlOs
_symmetry_space_group_name_H-M   C2/m
_cell_length_a   4.2
_cell_length_b   4.2
_cell_length_c   9.14
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   12
_chemical_formula_structural   TlOs
_chemical_formula_sum   'Tl4 Os4'
_cell_volume   161.17
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, -z'
  3  '-x, y, -z'
  4  'x, -y, z'
  5  'x+1/2, y+1/2, z'
  6  '-x+1/2, -y+1/2, -z'
  7  '-x+1/2, y+1/2, -z'
  8  '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
  Tl  Tl0  4  0.24  0.5  0.99  1.0
  Os  Os1  4  0.24  0.5  0.31  1.0

Tl Tl Os Os
Tl Tl Os Os 0 1 o - o 0 1 o o o 0 1 + - o 0 1 + o o 0 2 o o o 0 3 + o - 0 3 + - - 0 3 o o - 0 3 o - - 1 2 o + o 1 2 o o o 1 2 - + o 1 2 - o o 1 3 o o - 2 2 + o o 2 2 o + o 3 3 + o o 3 3 o + o 