# generated using pymatgen
data_Li3Fe3OF7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11863900
_cell_length_b   5.18893400
_cell_length_c   10.25965315
_cell_angle_alpha   89.77071917
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe3OF7
_chemical_formula_sum   'Li3 Fe3 O1 F7'
_cell_volume   166.02460426
_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  0.00000000  0.61170300  0.04335700  1
  Li  Li1  1  0.00000000  0.52483700  0.35702800  1
  Li  Li2  1  0.50000000  0.05372000  0.44749900  1
  Fe  Fe3  1  0.00000000  0.97720100  0.87152800  1
  Fe  Fe4  1  0.50000000  0.47876600  0.63511700  1
  Fe  Fe5  1  0.50000000  0.03446500  0.13611600  1
  O  O6  1  0.50000000  0.81785800  0.97596100  1
  F  F7  1  0.00000000  0.78915000  0.21918600  1
  F  F8  1  0.50000000  0.69634100  0.46341100  1
  F  F9  1  0.00000000  0.67930100  0.71745900  1
  F  F10  1  0.50000000  0.26855000  0.29530800  1
  F  F11  1  0.00000000  0.25719800  0.52793500  1
  F  F12  1  0.00000000  0.25981400  0.04161300  1
  F  F13  1  0.50000000  0.17693500  0.76848100  1
