# generated using pymatgen
data_Hf5Nb5(Sn3B)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.32503716
_cell_length_b   8.32503789
_cell_length_c   5.58526717
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.15027721
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf5Nb5(Sn3B)2
_chemical_formula_sum   'Hf5 Nb5 Sn6 B2'
_cell_volume   334.72437578
_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  0.23746009  0.00269335  0.75000000  1.0
  Hf  Hf1  1  0.00269335  0.23746009  0.75000000  1.0
  Hf  Hf2  1  0.22765479  0.22765479  0.25000000  1.0
  Hf  Hf3  1  0.76570762  0.99823642  0.25000000  1.0
  Hf  Hf4  1  0.99823642  0.76570762  0.25000000  1.0
  Nb  Nb5  1  0.66640174  0.33149416  0.00043039  1.0
  Nb  Nb6  1  0.33149416  0.66640174  0.00043039  1.0
  Nb  Nb7  1  0.33149416  0.66640174  0.49956961  1.0
  Nb  Nb8  1  0.66640174  0.33149416  0.49956961  1.0
  Nb  Nb9  1  0.77327146  0.77327146  0.75000000  1.0
  Sn  Sn10  1  0.40831923  0.40831923  0.75000000  1.0
  Sn  Sn11  1  0.59982410  0.99821746  0.75000000  1.0
  Sn  Sn12  1  0.99821746  0.59982410  0.75000000  1.0
  Sn  Sn13  1  0.59536258  0.59536258  0.25000000  1.0
  Sn  Sn14  1  0.40191886  0.99962086  0.25000000  1.0
  Sn  Sn15  1  0.99962086  0.40191886  0.25000000  1.0
  B  B16  1  0.99796069  0.99796069  0.99380503  1.0
  B  B17  1  0.99796069  0.99796069  0.50619497  1.0