# generated using pymatgen
data_Li2CuF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15100127
_cell_length_b   5.15100127
_cell_length_c   5.87196000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   110.48757323
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CuF4
_chemical_formula_sum   'Li4 Cu2 F8'
_cell_volume   145.94500451
_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  0.50228600  0.00228600  0.25000000  1
  Li  Li1  1  0.99771400  0.49771400  0.75000000  1
  Li  Li2  1  0.00228600  0.50228600  0.25000000  1
  Li  Li3  1  0.49771400  0.99771400  0.75000000  1
  Cu  Cu4  1  0.00000000  0.00000000  0.00000000  1
  Cu  Cu5  1  0.50000000  0.50000000  0.50000000  1
  F  F6  1  0.76801400  0.23198600  0.00000000  1
  F  F7  1  0.73198600  0.26801400  0.50000000  1
  F  F8  1  0.23404900  0.23404900  0.76701500  1
  F  F9  1  0.26595100  0.26595100  0.26701500  1
  F  F10  1  0.73404900  0.73404900  0.73298500  1
  F  F11  1  0.76595100  0.76595100  0.23298500  1
  F  F12  1  0.26801400  0.73198600  0.50000000  1
  F  F13  1  0.23198600  0.76801400  0.00000000  1
