# generated using pymatgen
data_Li6NiCl8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.17562046
_cell_length_b   7.17561399
_cell_length_c   7.17562477
_cell_angle_alpha   60.00000994
_cell_angle_beta   59.99992046
_cell_angle_gamma   59.99991052
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6NiCl8
_chemical_formula_sum   'Li6 Ni1 Cl8'
_cell_volume   261.25386713
_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  0.00000000  0.00000000  1
  Li  Li1  1  -0.00000000  0.50000000  0.50000000  1
  Li  Li2  1  -0.00000000  0.50000000  0.00000000  1
  Li  Li3  1  0.50000000  0.00000000  0.50000000  1
  Li  Li4  1  -0.00000000  0.00000000  0.50000000  1
  Li  Li5  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni6  1  -0.00000000  0.00000000  0.00000000  1
  Cl  Cl7  1  0.25000000  0.25000000  0.25000000  1
  Cl  Cl8  1  0.75000000  0.75000000  0.75000000  1
  Cl  Cl9  1  0.76240323  0.23759677  0.23759677  1
  Cl  Cl10  1  0.23759677  0.76240323  0.76240323  1
  Cl  Cl11  1  0.23759577  0.76240423  0.23759577  1
  Cl  Cl12  1  0.76240423  0.23759577  0.76240423  1
  Cl  Cl13  1  0.23759777  0.23759777  0.76240223  1
  Cl  Cl14  1  0.76240223  0.76240223  0.23759777  1
