# generated using pymatgen
data_Li3Fe4O3F5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.12085062
_cell_length_b   6.00198778
_cell_length_c   6.16259512
_cell_angle_alpha   60.47051805
_cell_angle_beta   88.26064818
_cell_angle_gamma   118.65132751
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe4O3F5
_chemical_formula_sum   'Li3 Fe4 O3 F5'
_cell_volume   161.98240722
_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  0.49245500  0.98711800  0.00447500  1
  Li  Li1  1  0.49516900  0.99747900  0.49989500  1
  Li  Li2  1  0.49672700  0.50254600  0.49389800  1
  Fe  Fe3  1  0.48085500  0.50312600  0.01427600  1
  Fe  Fe4  1  0.99942700  0.99862800  0.00011700  1
  Fe  Fe5  1  0.00898300  0.01911000  0.49090600  1
  Fe  Fe6  1  0.01752900  0.50092600  0.47744700  1
  O  O7  1  0.77511700  0.99991600  0.76944500  1
  O  O8  1  0.27222400  0.50470300  0.26576100  1
  O  O9  1  0.22598400  0.99981300  0.23188400  1
  F  F10  1  0.72595900  0.47241000  0.27900600  1
  F  F11  1  0.26837300  0.02298300  0.72837200  1
  F  F12  1  0.72841300  0.49433200  0.73635100  1
  F  F13  1  0.73643800  0.97326500  0.28121800  1
  F  F14  1  0.27634400  0.52364500  0.72694700  1
