# generated using pymatgen
data_Ti
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.63296189
_cell_length_b   2.87004886
_cell_length_c   47.64081222
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti
_chemical_formula_sum   Ti15
_cell_volume   633.471638423
_cell_formula_units_Z   15
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
  Ti  Ti1  1  0.166203  0.923074  0.315030  1
  Ti  Ti2  1  0.166203  0.389408  0.366973  1
  Ti  Ti3  1  0.666203  0.439762  0.334980  1
  Ti  Ti4  1  0.666203  0.924504  0.389802  1
  Ti  Ti5  1  0.666203  0.307945  0.447401  1
  Ti  Ti6  1  0.166203  0.699957  0.422128  1
  Ti  Ti7  1  0.166203  0.012433  0.477254  1
  Ti  Ti8  1  0.166203  0.319672  0.532437  1
  Ti  Ti9  1  0.666203  0.666052  0.504845  1
  Ti  Ti10  1  0.666203  0.024159  0.562290  1
  Ti  Ti11  1  0.666203  0.407600  0.619889  1
  Ti  Ti12  1  0.166203  0.632148  0.587563  1
  Ti  Ti13  1  0.166203  0.942696  0.642718  1
  Ti  Ti14  1  0.166203  0.409030  0.694661  1
  Ti  Ti15  1  0.666203  0.892342  0.674711  1
