# generated using pymatgen
data_Li2CaHfF8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34374537
_cell_length_b   6.34374537
_cell_length_c   6.34374537
_cell_angle_alpha   132.87721100
_cell_angle_beta   132.87721100
_cell_angle_gamma   68.84704647
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CaHfF8
_chemical_formula_sum   'Li2 Ca1 Hf1 F8'
_cell_volume   134.59394518
_cell_formula_units_Z   1
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  0.75000000  0.25000000  0.50000000  1
  Li  Li1  1  -0.00000000  -0.00000000  0.00000000  1
  Ca  Ca2  1  0.50000000  0.50000000  0.00000000  1
  Hf  Hf3  1  0.25000000  0.75000000  0.50000000  1
  F  F4  1  0.49458625  0.46533729  0.59982700  1
  F  F5  1  0.23488142  0.80165108  0.85816959  1
  F  F6  1  0.53466271  0.13448971  0.02924996  1
  F  F7  1  0.10524075  0.50541375  0.97075004  1
  F  F8  1  0.86551029  0.89475925  0.40017300  1
  F  F9  1  0.19834892  0.05651852  0.43323035  1
  F  F10  1  0.94348148  0.37671183  0.14183041  1
  F  F11  1  0.62328817  0.76511858  0.56676965  1
