# generated using pymatgen
data_Ti
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.93341004
_cell_length_b   2.93341004
_cell_length_c   62.91784321
_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   Ti14
_cell_volume   541.401398933
_cell_formula_units_Z   14
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  0.556086  0.556086  0.205356  1
  Ti  Ti2  1  1.056086  1.056086  0.172492  1
  Ti  Ti3  1  0.556086  0.556086  0.272047  1
  Ti  Ti4  1  1.056086  1.056086  0.238656  1
  Ti  Ti5  1  0.556086  0.556086  0.338817  1
  Ti  Ti6  1  1.056086  1.056086  0.305432  1
  Ti  Ti7  1  0.556086  0.556086  0.405587  1
  Ti  Ti8  1  1.056086  1.056086  0.372202  1
  Ti  Ti9  1  0.556086  0.556086  0.472357  1
  Ti  Ti10  1  1.056086  1.056086  0.438972  1
  Ti  Ti11  1  0.556086  0.556086  0.539133  1
  Ti  Ti12  1  1.056086  1.056086  0.505742  1
  Ti  Ti13  1  0.556086  0.556086  0.605297  1
  Ti  Ti14  1  1.056086  1.056086  0.572433  1
