# generated using pymatgen
data_Ti
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.67100915
_cell_length_b   10.55017474
_cell_length_c   46.82395012
_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   2307.48251925
_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  0.751624  0.274695  0.282265  1
  Ti  Ti2  1  0.751624  0.809701  0.306811  1
  Ti  Ti3  1  0.751624  0.539498  0.292850  1
  Ti  Ti4  1  0.251624  0.238628  0.312598  1
  Ti  Ti5  1  0.251624  0.970844  0.297753  1
  Ti  Ti6  1  0.251624  0.697382  0.284243  1
  Ti  Ti7  1  0.751624  0.078596  0.322903  1
  Ti  Ti8  1  0.751624  0.617757  0.351547  1
  Ti  Ti9  1  0.751624  0.348339  0.338924  1
  Ti  Ti10  1  0.251624  0.044002  0.356976  1
  Ti  Ti11  1  0.251624  0.774870  0.341253  1
  Ti  Ti12  1  0.251624  0.503281  0.325905  1
  Ti  Ti13  1  0.751624  0.886714  0.367325  1
  Ti  Ti14  1  0.751624  0.427268  0.398579  1
  Ti  Ti15  1  0.751624  0.156094  0.383326  1
  Ti  Ti16  1  0.251624  0.851258  0.402613  1
  Ti  Ti17  1  0.251624  0.582012  0.387001  1
  Ti  Ti18  1  0.251624  0.312627  0.372677  1
  Ti  Ti19  1  0.751624  0.695533  0.413129  1
  Ti  Ti20  1  0.751624  0.234144  0.443995  1
  Ti  Ti21  1  0.751624  0.964212  0.428643  1
  Ti  Ti22  1  0.251624  0.658900  0.448327  1
  Ti  Ti23  1  0.251624  0.389806  0.433404  1
  Ti  Ti24  1  0.251624  0.120080  0.418266  1
  Ti  Ti25  1  0.751624  0.503777  0.459192  1
  Ti  Ti26  1  0.751624  0.041830  0.489627  1
  Ti  Ti27  1  0.751624  0.772525  0.474272  1
  Ti  Ti28  1  0.251624  0.466631  0.494244  1
  Ti  Ti29  1  0.251624  0.197215  0.479083  1
  Ti  Ti30  1  0.251624  0.927903  0.463815  1
  Ti  Ti31  1  0.751624  0.311113  0.504844  1
  Ti  Ti32  1  0.751624  0.849841  0.535274  1
  Ti  Ti33  1  0.751624  0.580528  0.520006  1
  Ti  Ti34  1  0.251624  0.273966  0.539897  1
  Ti  Ti35  1  0.251624  0.005218  0.524817  1
  Ti  Ti36  1  0.251624  0.735913  0.509462  1
  Ti  Ti37  1  0.751624  0.118844  0.550762  1
  Ti  Ti38  1  0.751624  0.657664  0.580823  1
  Ti  Ti39  1  0.751624  0.387937  0.565685  1
  Ti  Ti40  1  0.251624  0.082210  0.585959  1
  Ti  Ti41  1  0.251624  0.813531  0.570446  1
  Ti  Ti42  1  0.251624  0.543600  0.555094  1
  Ti  Ti43  1  0.751624  0.926485  0.596476  1
  Ti  Ti44  1  0.751624  0.465117  0.626412  1
  Ti  Ti45  1  0.751624  0.195731  0.612088  1
  Ti  Ti46  1  0.251624  0.891029  0.631764  1
  Ti  Ti47  1  0.251624  0.621650  0.615763  1
  Ti  Ti48  1  0.251624  0.350475  0.600510  1
  Ti  Ti49  1  0.751624  0.733741  0.642113  1
  Ti  Ti50  1  0.751624  0.274462  0.673184  1
  Ti  Ti51  1  0.751624  1.002873  0.657835  1
  Ti  Ti52  1  0.251624  0.699147  0.676186  1
  Ti  Ti53  1  0.251624  0.429404  0.660165  1
  Ti  Ti54  1  0.251624  0.159986  0.647542  1
  Ti  Ti55  1  0.751624  0.539116  0.686491  1
  Ti  Ti56  1  0.751624  0.080361  0.714846  1
  Ti  Ti57  1  0.751624  0.806900  0.701336  1
  Ti  Ti58  1  0.251624  0.503049  0.716824  1
  Ti  Ti59  1  0.251624  0.238245  0.706239  1
  Ti  Ti60  1  0.251624  0.968042  0.692278  1
