[CIF]
data_LiTiB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.77552736
_cell_length_b   3.77552736
_cell_length_c   3.77552736
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiB2
_chemical_formula_sum   'Li1 Ti1 B2'
_cell_volume   38.05553819
_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
  B  B0  1  1.33485050  1.33485050  1.33485050  1
  B  B1  1  4.00455150  4.00455150  4.00455150  1
  Li  Li2  1  -0.00000000  -0.00000000  0.00000000  1
  Ti  Ti3  1  2.66970100  2.66970100  2.66970100  1
[/CIF]
