# generated using pymatgen
data_HfO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.09373135
_cell_length_b   5.14134738
_cell_length_c   5.25900202
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfO2
_chemical_formula_sum   'Hf8 O16'
_cell_volume   272.91790420
_cell_formula_units_Z   8
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  0.13811216  0.95931184  0.34269293  1.0
  Hf  Hf1  1  0.13811216  0.54068816  0.84269293  1.0
  Hf  Hf2  1  0.36188784  0.45931184  0.34269293  1.0
  Hf  Hf3  1  0.36188784  0.04068816  0.84269293  1.0
  Hf  Hf4  1  0.63811216  0.95931184  0.15730707  1.0
  Hf  Hf5  1  0.63811216  0.54068816  0.65730707  1.0
  Hf  Hf6  1  0.86188784  0.45931184  0.15730707  1.0
  Hf  Hf7  1  0.86188784  0.04068816  0.65730707  1.0
  O  O8  1  0.03364634  0.83141708  0.66708938  1.0
  O  O9  1  0.03364634  0.66858292  0.16708938  1.0
  O  O10  1  0.22371351  0.24759954  0.08750211  1.0
  O  O11  1  0.22371351  0.25240046  0.58750211  1.0
  O  O12  1  0.27628649  0.74759954  0.08750211  1.0
  O  O13  1  0.27628649  0.75240046  0.58750211  1.0
  O  O14  1  0.46635366  0.16858292  0.16708938  1.0
  O  O15  1  0.46635366  0.33141708  0.66708938  1.0
  O  O16  1  0.53364634  0.66858292  0.33291062  1.0
  O  O17  1  0.53364634  0.83141708  0.83291062  1.0
  O  O18  1  0.72371351  0.24759954  0.41249789  1.0
  O  O19  1  0.72371351  0.25240046  0.91249789  1.0
  O  O20  1  0.77628649  0.74759954  0.41249789  1.0
  O  O21  1  0.77628649  0.75240046  0.91249789  1.0
  O  O22  1  0.96635366  0.16858292  0.33291062  1.0
  O  O23  1  0.96635366  0.33141708  0.83291062  1.0