[CIF]
data_TiAl2V
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.80503436
_cell_length_b   2.80503436
_cell_length_c   9.17632131
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiAl2V
_chemical_formula_sum   'Ti1 Al2 V1'
_cell_volume   62.52815516
_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
  Al  Al0  1  0.00000000  0.00000000  2.32734440  1
  Al  Al1  1  0.00000001  1.61948734  6.95499636  1
  Ti  Ti2  1  1.40251720  0.80974366  0.07936123  1
  V  V3  1  0.00000000  0.00000000  4.81571443  1
[/CIF]
