# generated using pymatgen
data_Nb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.32618000
_cell_length_b   7.42781578
_cell_length_c   28.55341190
_cell_angle_alpha   90.00001035
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb
_chemical_formula_sum   Nb38
_cell_volume   705.44779784
_cell_formula_units_Z   38
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  Nb0  1  0.500000  0.897351  0.427555  1
  Nb  Nb1  1  0.000000  0.975010  0.500000  1
  Nb  Nb2  1  0.500000  0.289962  0.500000  1
  Nb  Nb3  1  0.000000  0.202182  0.590875  1
  Nb  Nb4  1  0.000000  0.202182  0.409125  1
  Nb  Nb5  1  0.500000  0.897351  0.572445  1
  Nb  Nb6  1  0.000000  0.800282  0.646820  1
  Nb  Nb7  1  0.000000  0.589699  0.545251  1
  Nb  Nb8  1  0.000000  0.602063  0.802889  1
  Nb  Nb9  1  0.500000  0.506931  0.880267  1
  Nb  Nb10  1  0.000000  0.000000  0.250000  1
  Nb  Nb11  1  0.500000  0.897235  0.172650  1
  Nb  Nb12  1  0.500000  0.710038  0.000000  1
  Nb  Nb13  1  0.000000  0.024990  0.000000  1
  Nb  Nb14  1  0.500000  0.102649  0.927555  1
  Nb  Nb15  1  0.000000  0.199718  0.853180  1
  Nb  Nb16  1  0.500000  0.897235  0.827350  1
  Nb  Nb17  1  0.000000  0.410301  0.045251  1
  Nb  Nb18  1  0.500000  0.102649  0.072445  1
  Nb  Nb19  1  0.000000  0.797818  0.090875  1
  Nb  Nb20  1  0.000000  0.199718  0.146820  1
  Nb  Nb21  1  0.500000  0.506931  0.119733  1
  Nb  Nb22  1  0.000000  0.797818  0.909125  1
  Nb  Nb23  1  0.000000  0.800282  0.353180  1
  Nb  Nb24  1  0.500000  0.102765  0.327350  1
  Nb  Nb25  1  0.000000  0.397937  0.302889  1
  Nb  Nb26  1  0.500000  0.298892  0.224467  1
  Nb  Nb27  1  0.000000  0.602063  0.197111  1
  Nb  Nb28  1  0.500000  0.701108  0.275533  1
  Nb  Nb29  1  0.000000  0.589699  0.454749  1
  Nb  Nb30  1  0.500000  0.493069  0.380267  1
  Nb  Nb31  1  0.500000  0.493069  0.619733  1
  Nb  Nb32  1  0.000000  0.397937  0.697111  1
  Nb  Nb33  1  0.500000  0.701108  0.724467  1
  Nb  Nb34  1  0.500000  0.298892  0.775533  1
  Nb  Nb35  1  0.000000  0.000000  0.750000  1
  Nb  Nb36  1  0.500000  0.102765  0.672650  1
  Nb  Nb37  1  0.000000  0.410301  0.954749  1
