# generated using pymatgen
data_Li2HfO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38461425
_cell_length_b   5.38461425
_cell_length_c   5.27993046
_cell_angle_alpha   80.04927084
_cell_angle_beta   80.04927084
_cell_angle_gamma   119.82331451
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2HfO3
_chemical_formula_sum   'Li4 Hf2 O6'
_cell_volume   124.67353544
_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
  Li  Li0  1  0.15811000  0.84189000  0.00000000  1
  Li  Li1  1  0.84189000  0.15811000  0.00000000  1
  Li  Li2  1  0.50000000  0.50000000  0.00000000  1
  Li  Li3  1  0.00000000  0.00000000  0.50000000  1
  Hf  Hf4  1  0.66640800  0.33359200  0.50000000  1
  Hf  Hf5  1  0.33359200  0.66640800  0.50000000  1
  O  O6  1  0.43079200  0.07906200  0.26852400  1
  O  O7  1  0.56920800  0.92093800  0.73147600  1
  O  O8  1  0.07906200  0.43079200  0.26852400  1
  O  O9  1  0.27632600  0.27632600  0.73566900  1
  O  O10  1  0.92093800  0.56920800  0.73147600  1
  O  O11  1  0.72367400  0.72367400  0.26433100  1
