# generated using pymatgen
data_Nb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.26963157
_cell_length_b   14.73784872
_cell_length_c   57.64720599
_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   2777.86525295
_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  0.149716  0.048188  0.249674  1
  Nb  Nb2  1  1.010776  0.737608  0.226097  1
  Nb  Nb3  1  0.210398  0.347979  0.275783  1
  Nb  Nb4  1  0.648674  0.198732  0.263454  1
  Nb  Nb5  1  0.539590  0.898913  0.239820  1
  Nb  Nb6  1  0.320191  0.587792  0.218487  1
  Nb  Nb7  1  0.667314  -0.001743  0.287762  1
  Nb  Nb8  1  0.631110  0.694826  0.262261  1
  Nb  Nb9  1  0.682067  0.403876  0.235783  1
  Nb  Nb10  1  1.033403  0.255571  0.229963  1
  Nb  Nb11  1  0.139697  0.847369  0.274971  1
  Nb  Nb12  1  1.037892  0.539637  0.254909  1
  Nb  Nb13  1  0.158522  -0.054057  0.327097  1
  Nb  Nb14  1  0.149530  0.648955  0.302943  1
  Nb  Nb15  1  0.162256  0.244637  0.353662  1
  Nb  Nb16  1  0.661152  0.094613  0.340316  1
  Nb  Nb17  1  0.650547  0.797286  0.314442  1
  Nb  Nb18  1  0.634950  0.494496  0.291443  1
  Nb  Nb19  1  0.657492  0.896055  0.366240  1
  Nb  Nb20  1  0.654255  0.597768  0.341457  1
  Nb  Nb21  1  0.671143  0.294852  0.315283  1
  Nb  Nb22  1  0.162573  0.146263  0.301825  1
  Nb  Nb23  1  0.154903  0.747538  0.353785  1
  Nb  Nb24  1  0.157021  0.445271  0.328747  1
  Nb  Nb25  1  0.157788  0.846109  0.405292  1
  Nb  Nb26  1  0.157014  0.546425  0.379783  1
  Nb  Nb27  1  0.158790  0.144791  0.430863  1
  Nb  Nb28  1  0.658637  -0.004669  0.418035  1
  Nb  Nb29  1  0.656848  0.696635  0.392595  1
  Nb  Nb30  1  0.659051  0.395456  0.366857  1
  Nb  Nb31  1  0.658273  0.795841  0.444045  1
  Nb  Nb32  1  0.657838  0.495458  0.418184  1
  Nb  Nb33  1  0.659687  0.194644  0.392149  1
  Nb  Nb34  1  0.159243  0.044953  0.379130  1
  Nb  Nb35  1  0.157725  0.645766  0.431137  1
  Nb  Nb36  1  0.158743  0.344974  0.405194  1
  Nb  Nb37  1  0.158743  0.745415  0.482575  1
  Nb  Nb38  1  0.157725  0.444623  0.456633  1
  Nb  Nb39  1  0.159243  0.045436  0.508639  1
  Nb  Nb40  1  0.659687  0.895745  0.495621  1
  Nb  Nb41  1  0.657838  0.594931  0.469585  1
  Nb  Nb42  1  0.658273  0.294548  0.443725  1
  Nb  Nb43  1  0.659051  0.694933  0.520913  1
  Nb  Nb44  1  0.656848  0.393753  0.495174  1
  Nb  Nb45  1  0.658637  0.095058  0.469734  1
  Nb  Nb46  1  0.158790  -0.054402  0.456906  1
  Nb  Nb47  1  0.157014  0.543964  0.507986  1
  Nb  Nb48  1  0.157788  0.244280  0.482477  1
  Nb  Nb49  1  0.157021  0.645118  0.559022  1
  Nb  Nb50  1  0.154903  0.342851  0.533985  1
  Nb  Nb51  1  0.162573  0.944126  0.585944  1
  Nb  Nb52  1  0.671143  0.795537  0.572487  1
  Nb  Nb53  1  0.654255  0.492621  0.546312  1
  Nb  Nb54  1  0.657492  0.194334  0.521529  1
  Nb  Nb55  1  0.634950  0.595892  0.596327  1
  Nb  Nb56  1  0.650547  0.293103  0.573328  1
  Nb  Nb57  1  0.661152  -0.004224  0.547453  1
  Nb  Nb58  1  0.162256  0.845752  0.534108  1
  Nb  Nb59  1  0.149530  0.441434  0.584826  1
  Nb  Nb60  1  0.158522  0.144446  0.560673  1
  Nb  Nb61  1  1.037892  0.550752  0.632861  1
  Nb  Nb62  1  0.139697  0.243020  0.612799  1
  Nb  Nb63  1  1.033403  0.834818  0.657806  1
  Nb  Nb64  1  0.682067  0.686513  0.651986  1
  Nb  Nb65  1  0.631110  0.395562  0.625508  1
  Nb  Nb66  1  0.667314  0.092132  0.600008  1
  Nb  Nb67  1  0.320191  0.502597  0.669282  1
  Nb  Nb68  1  0.539590  0.191476  0.647949  1
  Nb  Nb69  1  0.648674  0.891657  0.624316  1
  Nb  Nb70  1  0.210398  0.742410  0.611986  1
  Nb  Nb71  1  1.010776  0.352781  0.661673  1
  Nb  Nb72  1  0.149716  0.042201  0.638095  1
