# generated using pymatgen
data_Li2CuF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.60216700
_cell_length_b   5.59585300
_cell_length_c   11.05644149
_cell_angle_alpha   69.03753682
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CuF4
_chemical_formula_sum   'Li8 Cu4 F16'
_cell_volume   323.66710982
_cell_formula_units_Z   4
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  0.12201900  0.65042400  0.77182600  1
  Li  Li1  1  0.25906100  0.83807400  0.50225900  1
  Li  Li2  1  0.75906100  0.16192600  0.99774100  1
  Li  Li3  1  0.62201900  0.34957600  0.72817400  1
  Li  Li4  1  0.37798100  0.65042400  0.27182600  1
  Li  Li5  1  0.24093900  0.83807400  0.00225900  1
  Li  Li6  1  0.74093900  0.16192600  0.49774100  1
  Li  Li7  1  0.87798100  0.34957600  0.22817400  1
  Cu  Cu8  1  0.33001200  0.24408300  0.12042100  1
  Cu  Cu9  1  0.83001200  0.75591700  0.37957900  1
  Cu  Cu10  1  0.16998800  0.24408300  0.62042100  1
  Cu  Cu11  1  0.66998800  0.75591700  0.87957900  1
  F  F12  1  0.63983500  0.39271300  0.10188700  1
  F  F13  1  0.82266100  0.47952800  0.84289200  1
  F  F14  1  0.97914800  0.06474800  0.37802900  1
  F  F15  1  0.32266100  0.52047200  0.65710800  1
  F  F16  1  0.53411300  0.90927800  0.39094800  1
  F  F17  1  0.03411300  0.09072200  0.10905200  1
  F  F18  1  0.86016500  0.39271300  0.60188700  1
  F  F19  1  0.47914800  0.93525200  0.12197100  1
  F  F20  1  0.52085200  0.06474800  0.87802900  1
  F  F21  1  0.13983500  0.60728700  0.39811300  1
  F  F22  1  0.96588700  0.90927800  0.89094800  1
  F  F23  1  0.46588700  0.09072200  0.60905200  1
  F  F24  1  0.67733900  0.47952800  0.34289200  1
  F  F25  1  0.02085200  0.93525200  0.62197100  1
  F  F26  1  0.17733900  0.52047200  0.15710800  1
  F  F27  1  0.36016500  0.60728700  0.89811300  1
