# generated using pymatgen
data_Li3Fe2F9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.19651835
_cell_length_b   5.19651835
_cell_length_c   14.82706000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000442
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2F9
_chemical_formula_sum   'Li6 Fe4 F18'
_cell_volume   346.74530336
_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  0.33333300  0.66666700  0.47920400  1
  Li  Li1  1  0.33333300  0.66666700  0.25000000  1
  Li  Li2  1  0.33333300  0.66666700  0.02079600  1
  Li  Li3  1  0.66666700  0.33333300  0.97920400  1
  Li  Li4  1  0.66666700  0.33333300  0.52079600  1
  Li  Li5  1  0.66666700  0.33333300  0.75000000  1
  Fe  Fe6  1  0.00000000  0.00000000  0.14996700  1
  Fe  Fe7  1  0.00000000  0.00000000  0.35003300  1
  Fe  Fe8  1  0.00000000  0.00000000  0.64996700  1
  Fe  Fe9  1  0.00000000  0.00000000  0.85003300  1
  F  F10  1  0.98760400  0.71694400  0.75000000  1
  F  F11  1  0.30821200  0.97719600  0.08861700  1
  F  F12  1  0.30821200  0.97719600  0.41138300  1
  F  F13  1  0.02280400  0.33101700  0.08861700  1
  F  F14  1  0.02280400  0.33101700  0.41138300  1
  F  F15  1  0.28305600  0.27066000  0.75000000  1
  F  F16  1  0.27066000  0.28305600  0.25000000  1
  F  F17  1  0.33101700  0.02280400  0.58861700  1
  F  F18  1  0.33101700  0.02280400  0.91138300  1
  F  F19  1  0.66898300  0.69178800  0.41138300  1
  F  F20  1  0.66898300  0.69178800  0.08861700  1
  F  F21  1  0.72934000  0.01239600  0.75000000  1
  F  F22  1  0.69178800  0.66898300  0.58861700  1
  F  F23  1  0.69178800  0.66898300  0.91138300  1
  F  F24  1  0.01239600  0.72934000  0.25000000  1
  F  F25  1  0.97719600  0.30821200  0.91138300  1
  F  F26  1  0.97719600  0.30821200  0.58861700  1
  F  F27  1  0.71694400  0.98760400  0.25000000  1
