# generated using pymatgen
data_Nb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.27476284
_cell_length_b   16.76743510
_cell_length_c   54.34749146
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb
_chemical_formula_sum   Nb72
_cell_volume   2984.1867025
_cell_formula_units_Z   72
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
  Nb  Nb1  1  0.133584  0.437324  0.253059  1
  Nb  Nb2  1  0.133584  0.059055  0.276383  1
  Nb  Nb3  1  0.133584  0.679958  0.300944  1
  Nb  Nb4  1  0.633584  0.559950  0.276389  1
  Nb  Nb5  1  0.633584  0.312782  0.235040  1
  Nb  Nb6  1  0.633584  0.937747  0.256466  1
  Nb  Nb7  1  0.633584  0.370828  0.289219  1
  Nb  Nb8  1  0.633584  0.124409  0.245058  1
  Nb  Nb9  1  0.633584  0.749190  0.264687  1
  Nb  Nb10  1  0.133584  0.626204  0.246565  1
  Nb  Nb11  1  0.133584  0.248918  0.265059  1
  Nb  Nb12  1  0.133584  0.869350  0.287921  1
  Nb  Nb13  1  0.133584  0.293463  0.325133  1
  Nb  Nb14  1  0.133584  0.907996  0.348628  1
  Nb  Nb15  1  0.133584  0.523832  0.372680  1
  Nb  Nb16  1  0.633584  0.408890  0.348909  1
  Nb  Nb17  1  0.633584  0.177924  0.301583  1
  Nb  Nb18  1  0.633584  0.793670  0.324439  1
  Nb  Nb19  1  0.633584  0.216297  0.361114  1
  Nb  Nb20  1  0.633584  -0.014324  0.313326  1
  Nb  Nb21  1  0.633584  0.600965  0.336707  1
  Nb  Nb22  1  0.133584  0.486477  0.312499  1
  Nb  Nb23  1  0.133584  0.100622  0.336945  1
  Nb  Nb24  1  0.133584  0.716090  0.360741  1
  Nb  Nb25  1  0.133584  0.138895  0.396857  1
  Nb  Nb26  1  0.133584  0.753917  0.420669  1
  Nb  Nb27  1  0.133584  0.369463  0.444834  1
  Nb  Nb28  1  0.633584  0.254265  0.420890  1
  Nb  Nb29  1  0.633584  0.023554  0.372940  1
  Nb  Nb30  1  0.633584  0.638845  0.396699  1
  Nb  Nb31  1  0.633584  0.061573  0.432730  1
  Nb  Nb32  1  0.633584  0.831049  0.384615  1
  Nb  Nb33  1  0.633584  0.446693  0.408813  1
  Nb  Nb34  1  0.133584  0.331601  0.384928  1
  Nb  Nb35  1  0.133584  -0.053795  0.408651  1
  Nb  Nb36  1  0.133584  0.561713  0.432725  1
  Nb  Nb37  1  0.133584  -0.015795  0.468540  1
  Nb  Nb38  1  0.133584  0.599625  0.492731  1
  Nb  Nb39  1  0.133584  0.214916  0.516491  1
  Nb  Nb40  1  0.633584  0.099575  0.492573  1
  Nb  Nb41  1  0.633584  0.869007  0.444596  1
  Nb  Nb42  1  0.633584  0.484553  0.468761  1
  Nb  Nb43  1  0.633584  0.906869  0.504502  1
  Nb  Nb44  1  0.633584  0.676757  0.456705  1
  Nb  Nb45  1  0.633584  0.292265  0.480780  1
  Nb  Nb46  1  0.133584  0.176897  0.456701  1
  Nb  Nb47  1  0.133584  0.791777  0.480618  1
  Nb  Nb48  1  0.133584  0.407421  0.504815  1
  Nb  Nb49  1  0.133584  0.829580  0.540522  1
  Nb  Nb50  1  0.133584  0.444800  0.564991  1
  Nb  Nb51  1  0.133584  0.060546  0.587847  1
  Nb  Nb52  1  0.633584  0.945007  0.564297  1
  Nb  Nb53  1  0.633584  0.714638  0.516750  1
  Nb  Nb54  1  0.633584  0.330475  0.540803  1
  Nb  Nb55  1  0.633584  0.751993  0.576931  1
  Nb  Nb56  1  0.633584  0.522381  0.528689  1
  Nb  Nb57  1  0.633584  0.137848  0.552485  1
  Nb  Nb58  1  0.133584  0.022173  0.528317  1
  Nb  Nb59  1  0.133584  0.637506  0.552723  1
  Nb  Nb60  1  0.133584  0.252794  0.576104  1
  Nb  Nb61  1  0.133584  0.678521  0.613041  1
  Nb  Nb62  1  0.133584  0.300723  0.632965  1
  Nb  Nb63  1  0.133584  0.925688  0.654390  1
  Nb  Nb64  1  0.633584  0.801147  0.636372  1
  Nb  Nb65  1  0.633584  0.558512  0.588486  1
  Nb  Nb66  1  0.633584  0.179415  0.613047  1
  Nb  Nb67  1  0.633584  0.612267  0.642865  1
  Nb  Nb68  1  0.633584  0.369121  0.601509  1
  Nb  Nb69  1  0.633584  -0.010448  0.624372  1
  Nb  Nb70  1  0.133584  0.867642  0.600211  1
  Nb  Nb71  1  0.133584  0.489280  0.624743  1
  Nb  Nb72  1  0.133584  0.114061  0.644373  1
