# generated using pymatgen
data_LiFe6(OF2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.86999790
_cell_length_b   5.81746039
_cell_length_c   5.79733724
_cell_angle_alpha   70.10889635
_cell_angle_beta   68.72085817
_cell_angle_gamma   68.64834609
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe6(OF2)4
_chemical_formula_sum   'Li1 Fe6 O4 F8'
_cell_volume   223.63042296
_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  0.16929300  0.82907300  0.32658000  1
  Fe  Fe1  1  0.84555100  0.63233800  0.66451600  1
  Fe  Fe2  1  0.67403900  0.34987700  0.31000500  1
  Fe  Fe3  1  0.35205400  0.68111300  0.66859300  1
  Fe  Fe4  1  0.16071000  0.32334600  0.35367900  1
  Fe  Fe5  1  0.51164400  0.97769800  0.01680600  1
  Fe  Fe6  1  0.98451400  0.98049000  0.98723900  1
  O  O7  1  0.34048100  0.97790100  0.35776600  1
  O  O8  1  0.68395800  0.64966500  0.01020900  1
  O  O9  1  0.00771800  0.28995400  0.70051700  1
  O  O10  1  0.00082000  0.67868100  0.29817600  1
  F  F11  1  0.65645100  0.03996800  0.62561200  1
  F  F12  1  0.33664900  0.35936100  0.95908200  1
  F  F13  1  0.30964600  0.88747700  0.93554300  1
  F  F14  1  0.98449300  0.19448200  0.25200800  1
  F  F15  1  0.64751100  0.55707300  0.57292900  1
  F  F16  1  0.04172200  0.76615100  0.71731400  1
  F  F17  1  0.35816100  0.46107600  0.41050900  1
  F  F18  1  0.68458700  0.11427300  0.08291900  1
