[CIF]
data_TiAlCu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.25801027
_cell_length_b   4.25801027
_cell_length_c   5.68272378
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiAlCu5
_chemical_formula_sum   'Ti1 Al1 Cu5'
_cell_volume   103.03148420
_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  0.00000000  1
  Cu  Cu1  1  2.12900513  2.12900513  0.00000000  1
  Cu  Cu2  1  0.00000000  2.12900513  1.43013393  1
  Cu  Cu3  1  2.12900513  0.00000000  1.43013393  1
  Cu  Cu4  1  0.00000000  2.12900513  4.25258985  1
  Cu  Cu5  1  2.12900513  0.00000000  4.25258985  1
  Ti  Ti6  1  0.00000000  0.00000000  2.84136189  1
[/CIF]
