# generated using pymatgen
data_HfBe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.30274715
_cell_length_b   3.72927786
_cell_length_c   5.29152796
_cell_angle_alpha   90.00000000
_cell_angle_beta   71.81544214
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfBe
_chemical_formula_sum   'Hf2 Be2'
_cell_volume   61.91993042
_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  0.15104174  0.75000000  0.69791552  1.0
  Hf  Hf1  1  0.84895826  0.25000000  0.30208448  1.0
  Be  Be2  1  0.43974267  0.75000000  0.12051566  1.0
  Be  Be3  1  0.56025733  0.25000000  0.87948434  1.0