# generated using pymatgen
data_Li2CuF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.46967800
_cell_length_b   6.32236700
_cell_length_c   7.49298748
_cell_angle_alpha   73.44988197
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CuF5
_chemical_formula_sum   'Li8 Cu4 F20'
_cell_volume   430.02546735
_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  0.73977700  0.89513900  0.53924800  1
  Li  Li1  1  0.32214200  0.62333100  0.97387900  1
  Li  Li2  1  0.76022300  0.89513900  0.03924800  1
  Li  Li3  1  0.17785800  0.62333100  0.47387900  1
  Li  Li4  1  0.82214200  0.37666900  0.52612100  1
  Li  Li5  1  0.23977700  0.10486100  0.96075200  1
  Li  Li6  1  0.67785800  0.37666900  0.02612100  1
  Li  Li7  1  0.26022300  0.10486100  0.46075200  1
  Cu  Cu8  1  0.99119000  0.65701200  0.77792500  1
  Cu  Cu9  1  0.50881000  0.65701200  0.27792500  1
  Cu  Cu10  1  0.49119000  0.34298800  0.72207500  1
  Cu  Cu11  1  0.00881000  0.34298800  0.22207500  1
  F  F12  1  0.88460300  0.85879500  0.84611600  1
  F  F13  1  0.15228200  0.86478900  0.55836600  1
  F  F14  1  0.11835400  0.65724100  0.95778100  1
  F  F15  1  0.61539700  0.85879500  0.34611600  1
  F  F16  1  0.34771800  0.86478900  0.05836600  1
  F  F17  1  0.85008300  0.63202300  0.62033300  1
  F  F18  1  0.58325800  0.55874600  0.78842700  1
  F  F19  1  0.38164600  0.65724100  0.45778100  1
  F  F20  1  0.08325800  0.44125400  0.71157300  1
  F  F21  1  0.64991700  0.63202300  0.12033300  1
  F  F22  1  0.35008300  0.36797700  0.87966700  1
  F  F23  1  0.91674200  0.55874600  0.28842700  1
  F  F24  1  0.61835400  0.34275900  0.54221900  1
  F  F25  1  0.41674200  0.44125400  0.21157300  1
  F  F26  1  0.14991700  0.36797700  0.37966700  1
  F  F27  1  0.65228200  0.13521100  0.94163400  1
  F  F28  1  0.38460300  0.14120500  0.65388400  1
  F  F29  1  0.88164600  0.34275900  0.04221900  1
  F  F30  1  0.84771800  0.13521100  0.44163400  1
  F  F31  1  0.11539700  0.14120500  0.15388400  1
