# generated using pymatgen
data_Nb2B3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.13795583
_cell_length_b   3.32185933
_cell_length_c   9.93112236
_cell_angle_alpha   99.62767079
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2B3
_chemical_formula_sum   'Nb4 B6'
_cell_volume   102.06246160
_cell_formula_units_Z   2
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  0.75000000  0.43108094  0.86216087  1.0
  Nb  Nb1  1  0.25000000  0.56891906  0.13783913  1.0
  Nb  Nb2  1  0.75000000  0.70237938  0.40475876  1.0
  Nb  Nb3  1  0.25000000  0.29762062  0.59524124  1.0
  B  B4  1  0.75000000  0.02290864  0.04581728  1.0
  B  B5  1  0.25000000  0.97709136  0.95418272  1.0
  B  B6  1  0.75000000  0.11565721  0.23131542  1.0
  B  B7  1  0.25000000  0.88434279  0.76868458  1.0
  B  B8  1  0.75000000  0.83507445  0.67014890  1.0
  B  B9  1  0.25000000  0.16492555  0.32985110  1.0