# generated using pymatgen
data_HfAlFe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.10888327
_cell_length_b   5.10888327
_cell_length_c   8.27893400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.28900330
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfAlFe
_chemical_formula_sum   'Hf4 Al4 Fe4'
_cell_volume   186.58850464
_cell_formula_units_Z   4
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  0.33277000  0.66723000  0.18168000  1.0
  Hf  Hf1  1  0.66306800  0.33693200  0.29492800  1.0
  Hf  Hf2  1  0.66306800  0.33693200  0.70507200  1.0
  Hf  Hf3  1  0.33277000  0.66723000  0.81832000  1.0
  Al  Al4  1  0.83305000  0.16695000  0.00000000  1.0
  Al  Al5  1  0.16552000  0.33134700  0.50000000  1.0
  Al  Al6  1  0.66865300  0.83448000  0.50000000  1.0
  Al  Al7  1  0.16618600  0.83381400  0.50000000  1.0
  Fe  Fe8  1  0.00299200  0.99700800  0.24534300  1.0
  Fe  Fe9  1  0.00299200  0.99700800  0.75465700  1.0
  Fe  Fe10  1  0.83516300  0.66613600  0.00000000  1.0
  Fe  Fe11  1  0.33386400  0.16483700  0.00000000  1.0