# generated using pymatgen
data_Li2CuF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.34605300
_cell_length_b   6.25108100
_cell_length_c   7.88421698
_cell_angle_alpha   87.82845572
_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   361.78933047
_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  0.35302300  0.94113800  0.82788900  1
  Li  Li1  1  0.14697700  0.44113800  0.82788900  1
  Li  Li2  1  0.12848800  0.67905500  0.50635000  1
  Li  Li3  1  0.62848800  0.82094500  0.49365000  1
  Li  Li4  1  0.37151200  0.17905500  0.50635000  1
  Li  Li5  1  0.87151200  0.32094500  0.49365000  1
  Li  Li6  1  0.85302300  0.55886200  0.17211100  1
  Li  Li7  1  0.64697700  0.05886200  0.17211100  1
  Cu  Cu8  1  0.89218300  0.88686000  0.84071800  1
  Cu  Cu9  1  0.60781700  0.38686000  0.84071800  1
  Cu  Cu10  1  0.39218300  0.61314000  0.15928200  1
  Cu  Cu11  1  0.10781700  0.11314000  0.15928200  1
  F  F12  1  0.43661400  0.67452300  0.93545600  1
  F  F13  1  0.06338600  0.17452300  0.93545600  1
  F  F14  1  0.81582100  0.51451900  0.90229800  1
  F  F15  1  0.68417900  0.01451900  0.90229800  1
  F  F16  1  0.10381400  0.76760900  0.77516100  1
  F  F17  1  0.39618600  0.26760900  0.77516100  1
  F  F18  1  0.84044600  0.95924200  0.62450300  1
  F  F19  1  0.39952900  0.87729300  0.60471800  1
  F  F20  1  0.65955400  0.45924200  0.62450300  1
  F  F21  1  0.10047100  0.37729300  0.60471800  1
  F  F22  1  0.89952900  0.62270700  0.39528200  1
  F  F23  1  0.34044600  0.54075800  0.37549700  1
  F  F24  1  0.60047100  0.12270700  0.39528200  1
  F  F25  1  0.15955400  0.04075800  0.37549700  1
  F  F26  1  0.60381400  0.73239100  0.22483900  1
  F  F27  1  0.89618600  0.23239100  0.22483900  1
  F  F28  1  0.31582100  0.98548100  0.09770200  1
  F  F29  1  0.18417900  0.48548100  0.09770200  1
  F  F30  1  0.93661400  0.82547700  0.06454400  1
  F  F31  1  0.56338600  0.32547700  0.06454400  1
