# generated using pymatgen
data_Hf(AlCu)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47157187
_cell_length_b   6.47157201
_cell_length_c   6.47157239
_cell_angle_alpha   134.65207670
_cell_angle_beta   99.09325500
_cell_angle_gamma   97.99914446
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf(AlCu)6
_chemical_formula_sum   'Hf1 Al6 Cu6'
_cell_volume   177.89991264
_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  0.00000000  0.00000000  1.0
  Al  Al1  1  0.34383333  0.34383333  0.00000000  1.0
  Al  Al2  1  0.65616667  0.65616667  1.00000000  1.0
  Al  Al3  1  0.65622758  0.00000000  0.65622758  1.0
  Al  Al4  1  0.34377242  1.00000000  0.34377242  1.0
  Al  Al5  1  0.81541665  0.31541665  0.50000000  1.0
  Al  Al6  1  0.18458335  0.68458335  0.50000000  1.0
  Cu  Cu7  1  0.50000000  0.00000000  0.00000000  1.0
  Cu  Cu8  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu9  1  0.00000000  0.00000000  0.50000000  1.0
  Cu  Cu10  1  0.00000000  0.50000000  0.00000000  1.0
  Cu  Cu11  1  0.23566838  0.50000000  0.73566838  1.0
  Cu  Cu12  1  0.76433162  0.50000000  0.26433162  1.0