# generated using pymatgen
data_Fe5(O4F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.63829600
_cell_length_b   4.64151600
_cell_length_c   15.82493058
_cell_angle_alpha   73.27653694
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5(O4F)2
_chemical_formula_sum   'Fe10 O16 F4'
_cell_volume   326.28098289
_cell_formula_units_Z   2
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
  Fe  Fe0  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe1  1  0.01098900  0.79033500  0.20519900  1.0
  Fe  Fe2  1  0.97938200  0.57590600  0.40094400  1.0
  Fe  Fe3  1  0.02061800  0.42409400  0.59905600  1.0
  Fe  Fe4  1  0.98901100  0.20966500  0.79480100  1.0
  Fe  Fe5  1  0.47938200  0.42409400  0.09905600  1.0
  Fe  Fe6  1  0.50000000  0.00000000  0.50000000  1.0
  Fe  Fe7  1  0.51098900  0.20966500  0.29480100  1.0
  Fe  Fe8  1  0.48901100  0.79033500  0.70519900  1.0
  Fe  Fe9  1  0.52061800  0.57590600  0.90094400  1.0
  O  O10  1  0.80445300  0.88513600  0.30189200  1.0
  O  O11  1  0.80565100  0.69379400  0.49994800  1.0
  O  O12  1  0.80632300  0.50847600  0.69565000  1.0
  O  O13  1  0.81680400  0.27629300  0.90025000  1.0
  O  O14  1  0.30565100  0.30620600  0.00005200  1.0
  O  O15  1  0.30445300  0.11486400  0.19810800  1.0
  O  O16  1  0.31680400  0.72370700  0.59975000  1.0
  O  O17  1  0.30632300  0.49152400  0.80435000  1.0
  O  O18  1  0.69434900  0.69379400  0.99994800  1.0
  O  O19  1  0.69367700  0.50847600  0.19565000  1.0
  O  O20  1  0.68319600  0.27629300  0.40025000  1.0
  O  O21  1  0.69554700  0.88513600  0.80189200  1.0
  O  O22  1  0.18319600  0.72370700  0.09975000  1.0
  O  O23  1  0.19434900  0.30620600  0.50005200  1.0
  O  O24  1  0.19367700  0.49152400  0.30435000  1.0
  O  O25  1  0.19554700  0.11486400  0.69810800  1.0
  F  F26  1  0.79791500  0.10602600  0.10106000  1.0
  F  F27  1  0.29791500  0.89397400  0.39894000  1.0
  F  F28  1  0.70208500  0.10602600  0.60106000  1.0
  F  F29  1  0.20208500  0.89397400  0.89894000  1.0