# generated using pymatgen
data_LiCuF2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.85062273
_cell_length_b   2.85062326
_cell_length_c   6.67012661
_cell_angle_alpha   64.69350058
_cell_angle_beta   64.69350094
_cell_angle_gamma   59.99844128
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCuF2
_chemical_formula_sum   'Li1 Cu1 F2'
_cell_volume   40.82307718
_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  0.50000000  1
  Cu  Cu1  1  -0.00000000  -0.00000000  0.00000000  1
  F  F2  1  0.79007644  0.79007644  0.31484553  1
  F  F3  1  0.20992356  0.20992356  0.68515447  1
