# generated using pymatgen
data_Li2FeOF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80709000
_cell_length_b   5.29003400
_cell_length_c   9.84287206
_cell_angle_alpha   82.76339815
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeOF3
_chemical_formula_sum   'Li8 Fe4 O4 F12'
_cell_volume   299.96156220
_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  0.40264300  0.49441100  0.25933800  1
  Li  Li1  1  0.62310500  0.73815300  0.01272400  1
  Li  Li2  1  0.59735700  0.49441100  0.75933800  1
  Li  Li3  1  0.37689500  0.73815300  0.51272400  1
  Li  Li4  1  0.12788900  0.96958800  0.24621700  1
  Li  Li5  1  0.63000700  0.00869000  0.24656900  1
  Li  Li6  1  0.87211100  0.96958800  0.74621700  1
  Li  Li7  1  0.36999300  0.00869000  0.74656900  1
  Fe  Fe8  1  0.86377400  0.25684200  0.99801800  1
  Fe  Fe9  1  0.13622600  0.25684200  0.49801800  1
  Fe  Fe10  1  0.10665400  0.74177100  0.99862800  1
  Fe  Fe11  1  0.89334600  0.74177100  0.49862800  1
  O  O12  1  0.12993900  0.59618000  0.39719800  1
  O  O13  1  0.88972300  0.92267100  0.10322800  1
  O  O14  1  0.87006100  0.59618000  0.89719800  1
  O  O15  1  0.11027700  0.92267100  0.60322800  1
  F  F16  1  0.35658200  0.13998000  0.35880400  1
  F  F17  1  0.89244100  0.08951200  0.37431600  1
  F  F18  1  0.12592600  0.39268400  0.11013400  1
  F  F19  1  0.62582800  0.35721500  0.12672600  1
  F  F20  1  0.64341800  0.13998000  0.85880400  1
  F  F21  1  0.10755900  0.08951200  0.87431600  1
  F  F22  1  0.87407400  0.39268400  0.61013400  1
  F  F23  1  0.37417200  0.35721500  0.62672600  1
  F  F24  1  0.62111300  0.68415000  0.38100800  1
  F  F25  1  0.36837100  0.82728400  0.13397400  1
  F  F26  1  0.37888700  0.68415000  0.88100800  1
  F  F27  1  0.63162900  0.82728400  0.63397400  1
