# generated using pymatgen
data_LiFe2F5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.85268865
_cell_length_b   7.85268865
_cell_length_c   10.02513538
_cell_angle_alpha   65.36673942
_cell_angle_beta   65.36673942
_cell_angle_gamma   51.30436093
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2F5
_chemical_formula_sum   'Li4 Fe8 F20'
_cell_volume   427.81411926
_cell_formula_units_Z   4
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  0.70463200  0.92623700  0.31261600  1
  Li  Li1  1  0.07376300  0.29536800  0.18738400  1
  Li  Li2  1  0.92623700  0.70463200  0.81261600  1
  Li  Li3  1  0.29536800  0.07376300  0.68738400  1
  Fe  Fe4  1  0.77398900  0.52546400  0.63424300  1
  Fe  Fe5  1  0.15442000  0.73139100  0.00335800  1
  Fe  Fe6  1  0.26860900  0.84558000  0.49664200  1
  Fe  Fe7  1  0.52546400  0.77398900  0.13424300  1
  Fe  Fe8  1  0.47453600  0.22601100  0.86575700  1
  Fe  Fe9  1  0.73139100  0.15442000  0.50335800  1
  Fe  Fe10  1  0.84558000  0.26860900  0.99664200  1
  Fe  Fe11  1  0.22601100  0.47453600  0.36575700  1
  F  F12  1  0.89222700  0.96439200  0.13304300  1
  F  F13  1  0.11526200  0.28425700  0.54797000  1
  F  F14  1  0.43448400  0.80803500  0.62491700  1
  F  F15  1  0.15700600  0.46853400  0.19682900  1
  F  F16  1  0.53146600  0.84299400  0.30317100  1
  F  F17  1  0.61432100  0.33842400  0.90544000  1
  F  F18  1  0.66157600  0.38567900  0.59456000  1
  F  F19  1  0.03560800  0.10777300  0.36695700  1
  F  F20  1  0.28425700  0.11526200  0.04797000  1
  F  F21  1  0.19196500  0.56551600  0.87508300  1
  F  F22  1  0.80803500  0.43448400  0.12491700  1
  F  F23  1  0.71574300  0.88473800  0.95203000  1
  F  F24  1  0.96439200  0.89222700  0.63304300  1
  F  F25  1  0.33842400  0.61432100  0.40544000  1
  F  F26  1  0.38567900  0.66157600  0.09456000  1
  F  F27  1  0.46853400  0.15700600  0.69682900  1
  F  F28  1  0.84299400  0.53146600  0.80317100  1
  F  F29  1  0.56551600  0.19196500  0.37508300  1
  F  F30  1  0.88473800  0.71574300  0.45203000  1
  F  F31  1  0.10777300  0.03560800  0.86695700  1
