[CIF]
data_Ti2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84839222
_cell_length_b   6.84839222
_cell_length_c   6.84839222
_cell_angle_alpha   24.08609799
_cell_angle_beta   24.08609799
_cell_angle_gamma   24.08609799
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2Cu
_chemical_formula_sum   'Ti2 Cu1'
_cell_volume   47.01042153
_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  0.00000000  1
  Ti  Ti1  1  -0.00000000  -0.00000000  4.45032358  1
  Ti  Ti2  1  -0.00000000  -0.00000000  15.48967252  1
[/CIF]
