# generated using pymatgen
data_Hf6FeCuN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78093242
_cell_length_b   5.78093277
_cell_length_c   8.62021034
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   147.20944816
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf6FeCuN2
_chemical_formula_sum   'Hf6 Fe1 Cu1 N2'
_cell_volume   156.01557155
_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  0.86894229  0.13105971  0.05402142  1.0
  Hf  Hf1  1  0.55642034  0.44358166  0.25000000  1.0
  Hf  Hf2  1  0.86894229  0.13105971  0.44597958  1.0
  Hf  Hf3  1  0.13376279  0.86623921  0.56370279  1.0
  Hf  Hf4  1  0.43894931  0.56105269  0.75000000  1.0
  Hf  Hf5  1  0.13376279  0.86623921  0.93629821  1.0
  Fe  Fe6  1  0.75447793  0.24552407  0.75000000  1.0
  Cu  Cu7  1  0.24721999  0.75278201  0.25000000  1.0
  N  N8  1  0.49876665  0.50123535  0.00192029  1.0
  N  N9  1  0.49876665  0.50123535  0.49807971  1.0