# generated using pymatgen
data_Hf6Cu2CN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78443371
_cell_length_b   5.78443185
_cell_length_c   8.75757231
_cell_angle_alpha   90.37859238
_cell_angle_beta   89.62140743
_cell_angle_gamma   146.88984245
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf6Cu2CN
_chemical_formula_sum   'Hf6 Cu2 C1 N1'
_cell_volume   160.06146587
_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  0.63106298  0.36893702  0.43998260  1.0
  Hf  Hf1  1  0.36893702  0.63106298  0.56001740  1.0
  Hf  Hf2  1  0.62867008  0.37132992  0.05368998  1.0
  Hf  Hf3  1  0.37132992  0.62867008  0.94631002  1.0
  Hf  Hf4  1  0.94154096  0.05845904  0.25071528  1.0
  Hf  Hf5  1  0.05845904  0.94154096  0.74928472  1.0
  Cu  Cu6  1  0.24962867  0.75037133  0.24534143  1.0
  Cu  Cu7  1  0.75037133  0.24962867  0.75465857  1.0
  C  C8  1  0.00000000  0.00000000  0.50000000  1.0
  N  N9  1  0.00000000  0.00000000  0.00000000  1.0