# generated using pymatgen
data_LiFe2F5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.39204453
_cell_length_b   8.36631960
_cell_length_c   6.47456206
_cell_angle_alpha   89.98529628
_cell_angle_beta   89.99590498
_cell_angle_gamma   89.95919794
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2F5
_chemical_formula_sum   'Li4 Fe8 F20'
_cell_volume   454.58228075
_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  0.17146000  0.32099000  0.74996200  1
  Li  Li1  1  0.32859900  0.82103800  0.74997100  1
  Li  Li2  1  0.67139300  0.17897200  0.25002600  1
  Li  Li3  1  0.82854500  0.67901900  0.25003800  1
  Fe  Fe4  1  0.99999800  0.00000100  0.99999200  1
  Fe  Fe5  1  0.00000400  0.99999900  0.50001500  1
  Fe  Fe6  1  0.12030700  0.35005500  0.24999900  1
  Fe  Fe7  1  0.37973200  0.85003200  0.25000400  1
  Fe  Fe8  1  0.50001800  0.49997700  0.99998900  1
  Fe  Fe9  1  0.50001300  0.49997900  0.50001100  1
  Fe  Fe10  1  0.62032000  0.14982700  0.74998600  1
  Fe  Fe11  1  0.87968700  0.64995900  0.75000800  1
  F  F12  1  0.04900200  0.50230100  0.74998900  1
  F  F13  1  0.13053300  0.20801600  0.99722800  1
  F  F14  1  0.13051300  0.20799900  0.50278700  1
  F  F15  1  0.11908800  0.89828200  0.75002400  1
  F  F16  1  0.14477800  0.91005900  0.25000300  1
  F  F17  1  0.35519800  0.41007200  0.25000300  1
  F  F18  1  0.38091000  0.39831200  0.74999700  1
  F  F19  1  0.36946600  0.70801700  0.50277900  1
  F  F20  1  0.36947500  0.70800300  0.99722400  1
  F  F21  1  0.45100000  0.00232100  0.75000600  1
  F  F22  1  0.54899100  0.99771700  0.24999600  1
  F  F23  1  0.63052200  0.29199800  0.00281800  1
  F  F24  1  0.63053100  0.29198500  0.49717800  1
  F  F25  1  0.61907600  0.60170300  0.25000300  1
  F  F26  1  0.64479800  0.58994600  0.74999400  1
  F  F27  1  0.85522900  0.08997000  0.74999800  1
  F  F28  1  0.88092000  0.10171600  0.24997800  1
  F  F29  1  0.86946000  0.79198400  0.00280000  1
  F  F30  1  0.86948000  0.79200000  0.49718500  1
  F  F31  1  0.95095800  0.49775500  0.25001000  1
