# generated using pymatgen
data_Hf2BSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.52876239
_cell_length_b   3.52876246
_cell_length_c   12.48731894
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998076
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2BSe
_chemical_formula_sum   'Hf4 B2 Se2'
_cell_volume   134.66190708
_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  0.33333300  0.66666700  0.40135071  1.0
  Hf  Hf1  1  0.66666700  0.33333300  0.90135071  1.0
  Hf  Hf2  1  0.66666700  0.33333300  0.59864929  1.0
  Hf  Hf3  1  0.33333300  0.66666700  0.09864929  1.0
  B  B4  1  0.00000000  0.00000000  0.50000000  1.0
  B  B5  1  0.00000000  0.00000000  0.00000000  1.0
  Se  Se6  1  0.66666700  0.33333300  0.25000000  1.0
  Se  Se7  1  0.33333300  0.66666700  0.75000000  1.0