data_[Ti1Tl1Os1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Tl  1.6200  1.9000  1.3325
  Os  2.2000  1.3000  0.6730
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P3]
_cell_length_a [5.2346]
_cell_length_b [5.2346]
_cell_length_c [5.8350]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [143]
_chemical_formula_structural [TiTlOsO6]
_chemical_formula_sum '[Ti1 Tl1 Os1 O6]'
_cell_volume [138.4628]
_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
[
  Ti  Ti0  1  0.3333  0.6667  0.4631  1.0
  Tl  Tl1  1  0.0000  0.0000  0.9997  1.0
  Os  Os2  1  0.6667  0.3333  0.5222  1.0
  O  O3  3  0.3949  0.3815  0.3160  1.0
  O  O4  3  0.3988  0.0059  0.6890  1.0
]