[CIF]
data_LiTl2Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.47896972
_cell_length_b   4.33952550
_cell_length_c   5.22724759
_cell_angle_alpha   90.00000000
_cell_angle_beta   103.94807067
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTl2Ni
_chemical_formula_sum   'Li1 Tl2 Ni1'
_cell_volume   76.58928810
_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  0.51408979  0.00000000  2.40591557  1
  Ni  Ni1  1  0.53208813  2.16976275  3.95526880  1
  Tl  Tl2  1  2.28905980  0.00000000  4.62881579  1
  Tl  Tl3  1  2.21221610  2.16976275  1.69279997  1
[/CIF]
