# generated using pymatgen
data_Li6CuF8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.83628149
_cell_length_b   5.83628149
_cell_length_c   5.98314077
_cell_angle_alpha   62.57039479
_cell_angle_beta   62.57039479
_cell_angle_gamma   58.72180139
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6CuF8
_chemical_formula_sum   'Li6 Cu1 F8'
_cell_volume   147.85988704
_cell_formula_units_Z   1
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  0.84293700  0.84293700  0.96909600  1
  Li  Li1  1  0.50000000  0.50000000  0.50000000  1
  Li  Li2  1  0.00000000  0.00000000  0.50000000  1
  Li  Li3  1  0.00000000  0.50000000  0.50000000  1
  Li  Li4  1  0.15706300  0.15706300  0.03090400  1
  Li  Li5  1  0.50000000  0.00000000  0.50000000  1
  Cu  Cu6  1  0.50000000  0.50000000  0.00000000  1
  F  F7  1  0.25341500  0.74267400  0.76904000  1
  F  F8  1  0.72049000  0.72049000  0.32231200  1
  F  F9  1  0.77535500  0.77535500  0.72558500  1
  F  F10  1  0.74267400  0.25341500  0.76904000  1
  F  F11  1  0.25732600  0.74658500  0.23096000  1
  F  F12  1  0.22464500  0.22464500  0.27441500  1
  F  F13  1  0.27951000  0.27951000  0.67768800  1
  F  F14  1  0.74658500  0.25732600  0.23096000  1
