# generated using pymatgen
data_HfNbB4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.12758620
_cell_length_b   6.23996780
_cell_length_c   4.61898323
_cell_angle_alpha   47.50155824
_cell_angle_beta   109.78904262
_cell_angle_gamma   120.08063644
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfNbB4
_chemical_formula_sum   'Hf1 Nb1 B4'
_cell_volume   57.51179218
_cell_formula_units_Z   1
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
  Hf  Hf0  1  0.00000000  0.50000000  -0.00000000  1.0
  Nb  Nb1  1  0.00000000  0.00000000  -0.00000000  1.0
  B  B2  1  0.33385346  0.58364547  0.50041498  1.0
  B  B3  1  0.66618246  0.91601238  0.50034217  1.0
  B  B4  1  0.66614654  0.41635453  0.49958502  1.0
  B  B5  1  0.33381754  0.08398762  0.49965783  1.0