# generated using pymatgen
data_HfNb2B2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.41741955
_cell_length_b   9.41741988
_cell_length_c   3.05721526
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.08059994
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfNb2B2Ru5
_chemical_formula_sum   'Hf2 Nb4 B4 Ru10'
_cell_volume   271.13740911
_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
  Hf  Hf0  1  0.17572760  0.17572760  0.00000000  1.0
  Hf  Hf1  1  0.82427240  0.82427240  0.00000000  1.0
  Nb  Nb2  1  0.50000000  0.00000000  0.00000000  1.0
  Nb  Nb3  1  0.00000000  0.50000000  0.00000000  1.0
  Nb  Nb4  1  0.67634984  0.32365016  0.00000000  1.0
  Nb  Nb5  1  0.32365016  0.67634984  0.00000000  1.0
  B  B6  1  0.37857378  0.37857378  0.00000000  1.0
  B  B7  1  0.62142622  0.62142622  0.00000000  1.0
  B  B8  1  0.87883526  0.12116474  0.00000000  1.0
  B  B9  1  0.12116474  0.87883526  0.00000000  1.0
  Ru  Ru10  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru11  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru12  1  0.43125754  0.21972575  0.50000000  1.0
  Ru  Ru13  1  0.56874246  0.78027425  0.50000000  1.0
  Ru  Ru14  1  0.92687729  0.28221199  0.50000000  1.0
  Ru  Ru15  1  0.07312271  0.71778801  0.50000000  1.0
  Ru  Ru16  1  0.71778801  0.07312271  0.50000000  1.0
  Ru  Ru17  1  0.28221199  0.92687729  0.50000000  1.0
  Ru  Ru18  1  0.78027425  0.56874246  0.50000000  1.0
  Ru  Ru19  1  0.21972575  0.43125754  0.50000000  1.0