# generated using pymatgen
data_Nb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.27448598
_cell_length_b   10.42044476
_cell_length_c   54.23063980
_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   Nb48
_cell_volume   1850.43621512
_cell_formula_units_Z   48
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  0.133637  0.409260  0.241723  1
  Nb  Nb2  1  0.133637  0.823557  0.280719  1
  Nb  Nb3  1  0.633637  0.617221  0.260817  1
  Nb  Nb4  1  0.633637  0.206184  0.228310  1
  Nb  Nb5  1  0.633637  0.323557  0.280719  1
  Nb  Nb6  1  0.633637  0.909260  0.241723  1
  Nb  Nb7  1  0.133637  0.706184  0.228310  1
  Nb  Nb8  1  0.133637  0.117221  0.260817  1
  Nb  Nb9  1  0.133637  0.221429  0.319159  1
  Nb  Nb10  1  0.133637  0.621124  0.357746  1
  Nb  Nb11  1  0.633637  0.421598  0.338535  1
  Nb  Nb12  1  0.633637  0.022238  0.299463  1
  Nb  Nb13  1  0.633637  0.121124  0.357746  1
  Nb  Nb14  1  0.633637  0.721429  0.319159  1
  Nb  Nb15  1  0.133637  0.522238  0.299463  1
  Nb  Nb16  1  0.133637  0.921598  0.338535  1
  Nb  Nb17  1  0.133637  0.020829  0.396512  1
  Nb  Nb18  1  0.133637  0.420325  0.435189  1
  Nb  Nb19  1  0.633637  0.220546  0.415834  1
  Nb  Nb20  1  0.633637  0.820995  0.377155  1
  Nb  Nb21  1  0.633637  0.920325  0.435189  1
  Nb  Nb22  1  0.633637  0.520829  0.396512  1
  Nb  Nb23  1  0.133637  0.320995  0.377155  1
  Nb  Nb24  1  0.133637  0.720546  0.415834  1
  Nb  Nb25  1  0.133637  0.819910  0.473894  1
  Nb  Nb26  1  0.133637  0.219461  0.512573  1
  Nb  Nb27  1  0.633637  0.019627  0.493216  1
  Nb  Nb28  1  0.633637  0.620131  0.454539  1
  Nb  Nb29  1  0.633637  0.719461  0.512573  1
  Nb  Nb30  1  0.633637  0.319910  0.473894  1
  Nb  Nb31  1  0.133637  0.120131  0.454539  1
  Nb  Nb32  1  0.133637  0.519627  0.493216  1
  Nb  Nb33  1  0.133637  0.618859  0.551193  1
  Nb  Nb34  1  0.133637  0.018218  0.590266  1
  Nb  Nb35  1  0.633637  0.819027  0.570569  1
  Nb  Nb36  1  0.633637  0.419332  0.531982  1
  Nb  Nb37  1  0.633637  0.518218  0.590266  1
  Nb  Nb38  1  0.633637  0.118859  0.551193  1
  Nb  Nb39  1  0.133637  0.919332  0.531982  1
  Nb  Nb40  1  0.133637  0.319027  0.570569  1
  Nb  Nb41  1  0.133637  0.423236  0.628912  1
  Nb  Nb42  1  0.133637  0.834273  0.661419  1
  Nb  Nb43  1  0.633637  0.631196  0.648005  1
  Nb  Nb44  1  0.633637  0.216900  0.609009  1
  Nb  Nb45  1  0.633637  0.334273  0.661419  1
  Nb  Nb46  1  0.633637  0.923236  0.628912  1
  Nb  Nb47  1  0.133637  0.716900  0.609009  1
  Nb  Nb48  1  0.133637  0.131196  0.648005  1
