[CIF]
data_TiFe2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.89737595
_cell_length_b   8.89737595
_cell_length_c   8.89737595
_cell_angle_alpha   16.87912344
_cell_angle_beta   16.87912344
_cell_angle_gamma   16.87912344
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiFe2Cu
_chemical_formula_sum   'Ti1 Fe2 Cu1'
_cell_volume   51.79643990
_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
  Cu  Cu0  1  0.00000000  0.00000000  13.15301577  1
  Fe  Fe1  1  0.00000000  0.00000000  6.49547189  1
  Fe  Fe2  1  0.00000000  0.00000000  19.81055964  1
  Ti  Ti3  1  -0.00000000  -0.00000000  -0.00000000  1
[/CIF]
