# generated using pymatgen
data_LiCuNiF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56138182
_cell_length_b   4.56138182
_cell_length_c   8.89559211
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCuNiF6
_chemical_formula_sum   'Li2 Cu2 Ni2 F12'
_cell_volume   185.08350496
_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  0.50000000  0.50000000  0.16677229  1.0
  Li  Li1  1  0.00000000  0.00000000  0.66677229  1.0
  Cu  Cu2  1  0.50000000  0.50000000  0.49874616  1.0
  Cu  Cu3  1  0.00000000  0.00000000  0.99874616  1.0
  Ni  Ni4  1  0.50000000  0.50000000  0.83606177  1.0
  Ni  Ni5  1  0.00000000  0.00000000  0.33606077  1.0
  F  F6  1  0.19352534  0.80647466  0.16212645  1.0
  F  F7  1  0.80647466  0.19352534  0.16212645  1.0
  F  F8  1  0.30647466  0.30647466  0.66212645  1.0
  F  F9  1  0.69352534  0.69352534  0.66212645  1.0
  F  F10  1  0.80513910  0.19486090  0.83633273  1.0
  F  F11  1  0.19486090  0.80513910  0.83633273  1.0
  F  F12  1  0.69486090  0.69486090  0.33633273  1.0
  F  F13  1  0.30513910  0.30513910  0.33633273  1.0
  F  F14  1  0.20286581  0.79713419  0.50075020  1.0
  F  F15  1  0.79713419  0.20286581  0.50075020  1.0
  F  F16  1  0.29713419  0.29713419  0.00075020  1.0
  F  F17  1  0.70286581  0.70286581  0.00075020  1.0