# generated using pymatgen
data_Ti
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.74715341
_cell_length_b   10.47821164
_cell_length_c   46.89457810
_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   Ti60
_cell_volume   2332.61501063
_cell_formula_units_Z   60
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  0.752635  0.276662  0.278734  1
  Ti  Ti2  1  0.752635  0.812844  0.304128  1
  Ti  Ti3  1  0.752635  0.540513  0.290140  1
  Ti  Ti4  1  0.252635  0.238579  0.309436  1
  Ti  Ti5  1  0.252635  0.969963  0.294259  1
  Ti  Ti6  1  0.252635  0.694586  0.281572  1
  Ti  Ti7  1  0.752635  0.079567  0.320147  1
  Ti  Ti8  1  0.752635  0.620146  0.349726  1
  Ti  Ti9  1  0.752635  0.350018  0.336488  1
  Ti  Ti10  1  0.252635  0.045040  0.354737  1
  Ti  Ti11  1  0.252635  0.776116  0.339625  1
  Ti  Ti12  1  0.252635  0.503050  0.324251  1
  Ti  Ti13  1  0.752635  0.888209  0.365225  1
  Ti  Ti14  1  0.752635  0.427861  0.396129  1
  Ti  Ti15  1  0.752635  0.156736  0.380904  1
  Ti  Ti16  1  0.252635  0.852707  0.400308  1
  Ti  Ti17  1  0.252635  0.583076  0.384853  1
  Ti  Ti18  1  0.252635  0.313103  0.370430  1
  Ti  Ti19  1  0.752635  0.696414  0.410842  1
  Ti  Ti20  1  0.752635  0.234974  0.441555  1
  Ti  Ti21  1  0.752635  0.965150  0.426306  1
  Ti  Ti22  1  0.252635  0.660648  0.445883  1
  Ti  Ti23  1  0.252635  0.391354  0.430944  1
  Ti  Ti24  1  0.252635  0.121459  0.415808  1
  Ti  Ti25  1  0.752635  0.504621  0.456750  1
  Ti  Ti26  1  0.752635  0.043007  0.487170  1
  Ti  Ti27  1  0.752635  0.773562  0.471855  1
  Ti  Ti28  1  0.252635  0.468733  0.491693  1
  Ti  Ti29  1  0.252635  0.199222  0.476535  1
  Ti  Ti30  1  0.252635  0.929777  0.461320  1
  Ti  Ti31  1  0.752635  0.312335  0.502353  1
  Ti  Ti32  1  0.752635  0.851291  0.532726  1
  Ti  Ti33  1  0.752635  0.581847  0.517511  1
  Ti  Ti34  1  0.252635  0.276447  0.537296  1
  Ti  Ti35  1  0.252635  0.007506  0.522191  1
  Ti  Ti36  1  0.252635  0.738061  0.506876  1
  Ti  Ti37  1  0.752635  0.120420  0.548163  1
  Ti  Ti38  1  0.752635  0.659609  0.578238  1
  Ti  Ti39  1  0.752635  0.389714  0.563102  1
  Ti  Ti40  1  0.252635  0.084654  0.583204  1
  Ti  Ti41  1  0.252635  0.815918  0.567740  1
  Ti  Ti42  1  0.252635  0.546094  0.552491  1
  Ti  Ti43  1  0.752635  0.928361  0.593738  1
  Ti  Ti44  1  0.752635  0.467965  0.623616  1
  Ti  Ti45  1  0.752635  0.197992  0.609193  1
  Ti  Ti46  1  0.252635  0.892860  0.628821  1
  Ti  Ti47  1  0.252635  0.624332  0.613142  1
  Ti  Ti48  1  0.252635  0.353207  0.597917  1
  Ti  Ti49  1  0.752635  0.736028  0.639308  1
  Ti  Ti50  1  0.752635  0.278019  0.669795  1
  Ti  Ti51  1  0.752635  1.004952  0.654421  1
  Ti  Ti52  1  0.252635  0.701501  0.673899  1
  Ti  Ti53  1  0.252635  0.431050  0.657558  1
  Ti  Ti54  1  0.252635  0.160922  0.644320  1
  Ti  Ti55  1  0.752635  0.542489  0.684610  1
  Ti  Ti56  1  0.752635  0.086482  0.712474  1
  Ti  Ti57  1  0.752635  0.811105  0.699787  1
  Ti  Ti58  1  0.252635  0.504407  0.715312  1
  Ti  Ti59  1  0.252635  0.240555  0.703906  1
  Ti  Ti60  1  0.252635  0.968224  0.689918  1
