# generated using pymatgen
data_Li2CuF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.91333000
_cell_length_b   7.31676500
_cell_length_c   8.62508300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CuF5
_chemical_formula_sum   'Li4 Cu2 F10'
_cell_volume   183.85357142
_cell_formula_units_Z   2
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  0.93565500  0.85776700  1
  Li  Li1  1  0.00000000  0.43565500  0.64223300  1
  Li  Li2  1  0.00000000  0.56434500  0.35776700  1
  Li  Li3  1  0.00000000  0.06434500  0.14223300  1
  Cu  Cu4  1  0.50000000  0.50000000  0.00000000  1
  Cu  Cu5  1  0.50000000  0.00000000  0.50000000  1
  F  F6  1  0.50000000  0.00000000  0.00000000  1
  F  F7  1  0.00000000  0.66383900  0.94166800  1
  F  F8  1  0.50000000  0.40586800  0.79572000  1
  F  F9  1  0.50000000  0.90586800  0.70428000  1
  F  F10  1  0.00000000  0.16383900  0.55833200  1
  F  F11  1  0.50000000  0.50000000  0.50000000  1
  F  F12  1  0.00000000  0.83616100  0.44166800  1
  F  F13  1  0.50000000  0.09413200  0.29572000  1
  F  F14  1  0.50000000  0.59413200  0.20428000  1
  F  F15  1  0.00000000  0.33616100  0.05833200  1
