# generated using pymatgen
data_Nb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.26059833
_cell_length_b   4.65813114
_cell_length_c   46.81448986
_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   711.032265555
_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  1.006050  0.000950  0.299702  1
  Nb  Nb2  1  0.506050  0.500950  0.299702  1
  Nb  Nb3  1  1.006050  0.500950  0.347230  1
  Nb  Nb4  1  0.506050  0.000950  0.347230  1
  Nb  Nb5  1  1.006050  0.000950  0.397951  1
  Nb  Nb6  1  0.506050  0.500950  0.397951  1
  Nb  Nb7  1  1.006050  0.500950  0.448165  1
  Nb  Nb8  1  0.506050  0.000950  0.448165  1
  Nb  Nb9  1  1.006050  0.000950  0.498454  1
  Nb  Nb10  1  0.506050  0.500950  0.498454  1
  Nb  Nb11  1  1.006050  0.500950  0.548743  1
  Nb  Nb12  1  0.506050  0.000950  0.548743  1
  Nb  Nb13  1  1.006050  0.000950  0.598957  1
  Nb  Nb14  1  0.506050  0.500950  0.598957  1
  Nb  Nb15  1  1.006050  0.500950  0.649679  1
  Nb  Nb16  1  0.506050  0.000950  0.649679  1
  Nb  Nb17  1  1.006050  0.000950  0.697207  1
  Nb  Nb18  1  0.506050  0.500950  0.697207  1
