# generated using pymatgen
data_LiFe2F7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.18460400
_cell_length_b   5.58297900
_cell_length_c   10.10663785
_cell_angle_alpha   81.17674542
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2F7
_chemical_formula_sum   'Li2 Fe4 F14'
_cell_volume   289.08016053
_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  0.05655900  0.50000000  0.75000000  1
  Li  Li1  1  0.94344100  0.50000000  0.25000000  1
  Fe  Fe2  1  0.74993400  0.92398900  0.93034200  1
  Fe  Fe3  1  0.25006600  0.92398900  0.43034200  1
  Fe  Fe4  1  0.74993400  0.07601100  0.56965800  1
  Fe  Fe5  1  0.25006600  0.07601100  0.06965800  1
  F  F6  1  0.59731900  0.00000000  0.75000000  1
  F  F7  1  0.40268100  0.00000000  0.25000000  1
  F  F8  1  0.06073500  0.86060800  0.60849600  1
  F  F9  1  0.93926500  0.86060800  0.10849600  1
  F  F10  1  0.56774100  0.78484300  0.51253600  1
  F  F11  1  0.43225900  0.78484300  0.01253600  1
  F  F12  1  0.90028000  0.65254500  0.87666900  1
  F  F13  1  0.09972000  0.65254500  0.37666900  1
  F  F14  1  0.90028000  0.34745500  0.62333100  1
  F  F15  1  0.09972000  0.34745500  0.12333100  1
  F  F16  1  0.56774100  0.21515700  0.98746400  1
  F  F17  1  0.43225900  0.21515700  0.48746400  1
  F  F18  1  0.06073500  0.13939200  0.89150400  1
  F  F19  1  0.93926500  0.13939200  0.39150400  1
