# generated using pymatgen
data_Li6FeCl8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.29885519
_cell_length_b   7.29885519
_cell_length_c   7.29885519
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6FeCl8
_chemical_formula_sum   'Li6 Fe1 Cl8'
_cell_volume   274.94716380
_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  0.50000000  0.50000000  0.00000000  1
  Li  Li1  1  0.00000000  0.50000000  0.50000000  1
  Li  Li2  1  0.50000000  0.00000000  0.00000000  1
  Li  Li3  1  0.00000000  0.00000000  0.50000000  1
  Li  Li4  1  0.00000000  0.50000000  0.00000000  1
  Li  Li5  1  0.50000000  0.00000000  0.50000000  1
  Fe  Fe6  1  0.00000000  0.00000000  0.00000000  1
  Cl  Cl7  1  0.75000000  0.75000000  0.75000000  1
  Cl  Cl8  1  0.75989200  0.24010800  0.24010800  1
  Cl  Cl9  1  0.25000000  0.25000000  0.25000000  1
  Cl  Cl10  1  0.24010800  0.24010800  0.75989200  1
  Cl  Cl11  1  0.24010800  0.75989200  0.75989200  1
  Cl  Cl12  1  0.75989200  0.24010800  0.75989200  1
  Cl  Cl13  1  0.24010800  0.75989200  0.24010800  1
  Cl  Cl14  1  0.75989200  0.75989200  0.24010800  1
