# generated using pymatgen
data_Nb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.27128540
_cell_length_b   4.64885843
_cell_length_c   47.08011696
_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   Nb18
_cell_volume   715.982304148
_cell_formula_units_Z   18
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  0.005596  0.003142  0.297879  1
  Nb  Nb2  1  0.505596  0.503142  0.297879  1
  Nb  Nb3  1  0.005596  0.503142  0.345832  1
  Nb  Nb4  1  0.505596  0.003142  0.345832  1
  Nb  Nb5  1  0.005596  0.003142  0.396318  1
  Nb  Nb6  1  0.505596  0.503142  0.396318  1
  Nb  Nb7  1  0.005596  0.503142  0.446563  1
  Nb  Nb8  1  0.505596  0.003142  0.446563  1
  Nb  Nb9  1  0.005596  0.003142  0.496821  1
  Nb  Nb10  1  0.505596  0.503142  0.496821  1
  Nb  Nb11  1  0.005596  0.503142  0.547078  1
  Nb  Nb12  1  0.505596  0.003142  0.547078  1
  Nb  Nb13  1  0.005596  0.003142  0.597324  1
  Nb  Nb14  1  0.505596  0.503142  0.597324  1
  Nb  Nb15  1  0.005596  0.503142  0.647810  1
  Nb  Nb16  1  0.505596  0.003142  0.647810  1
  Nb  Nb17  1  0.005596  0.003142  0.695762  1
  Nb  Nb18  1  0.505596  0.503142  0.695762  1
