# generated using pymatgen
data_Li2Fe2P2O9F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23588883
_cell_length_b   5.37110413
_cell_length_c   7.30319993
_cell_angle_alpha   106.04614725
_cell_angle_beta   107.68624419
_cell_angle_gamma   98.22347479
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe2P2O9F
_chemical_formula_sum   'Li2 Fe2 P2 O9 F1'
_cell_volume   182.18153519
_cell_formula_units_Z   1
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  0.74014900  0.38738100  0.29854400  1
  Li  Li1  1  0.26239800  0.61651300  0.70319800  1
  Fe  Fe2  1  0.00814200  0.00788600  0.49905100  1
  Fe  Fe3  1  0.99059500  0.99740700  0.00525500  1
  P  P4  1  0.31877700  0.63484700  0.25600100  1
  P  P5  1  0.67955900  0.36472900  0.74251700  1
  O  O6  1  0.63123500  0.75996100  0.39176000  1
  O  O7  1  0.37433400  0.24477700  0.59283800  1
  O  O8  1  0.13996400  0.66785800  0.39343700  1
  O  O9  1  0.87721400  0.34122600  0.61894200  1
  O  O10  1  0.30888900  0.33349000  0.16355200  1
  O  O11  1  0.68315600  0.66219700  0.83989400  1
  O  O12  1  0.23488800  0.76247700  0.09053200  1
  O  O13  1  0.74968700  0.22371100  0.90113800  1
  O  O14  1  0.88775700  0.06618300  0.24109900  1
  F  F15  1  0.11325500  0.92935700  0.76223800  1
