# generated using pymatgen
data_LiNi4O4F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.78981425
_cell_length_b   10.78981425
_cell_length_c   10.78981425
_cell_angle_alpha   164.20672403
_cell_angle_beta   164.20672403
_cell_angle_gamma   22.40693818
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNi4O4F
_chemical_formula_sum   'Li1 Ni4 O4 F1'
_cell_volume   93.03224134
_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  0.00000000  0.00000000  0.00000000  1
  Ni  Ni1  1  0.60182600  0.60182600  0.00000000  1
  Ni  Ni2  1  0.19962800  0.19962800  0.00000000  1
  Ni  Ni3  1  0.80037200  0.80037200  0.00000000  1
  Ni  Ni4  1  0.39817400  0.39817400  0.00000000  1
  O  O5  1  0.09985200  0.09985200  0.00000000  1
  O  O6  1  0.70021800  0.70021800  0.00000000  1
  O  O7  1  0.29978200  0.29978200  0.00000000  1
  O  O8  1  0.90014800  0.90014800  0.00000000  1
  F  F9  1  0.50000000  0.50000000  0.00000000  1
