# generated using pymatgen
data_Fe5(O4F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64880900
_cell_length_b   5.54928732
_cell_length_c   12.95903136
_cell_angle_alpha   102.19831047
_cell_angle_beta   90.42237072
_cell_angle_gamma   91.30725478
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5(O4F)2
_chemical_formula_sum   'Fe10 O16 F4'
_cell_volume   326.65308538
_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  0.49093600  0.51545300  0.00690600  1.0
  Fe  Fe1  1  0.48225200  0.89662700  0.59381600  1.0
  Fe  Fe2  1  0.49255300  0.68613400  0.80219200  1.0
  Fe  Fe3  1  0.51325000  0.09040900  0.39555100  1.0
  Fe  Fe4  1  0.51872000  0.28435900  0.19559900  1.0
  Fe  Fe5  1  0.98296500  0.40692000  0.60676400  1.0
  Fe  Fe6  1  0.99549800  0.80967400  0.19842700  1.0
  Fe  Fe7  1  0.02779800  0.20487800  0.79787900  1.0
  Fe  Fe8  1  0.97334700  0.61667600  0.40439200  1.0
  Fe  Fe9  1  0.01576100  0.98770800  0.99778600  1.0
  O  O10  1  0.80107200  0.45410800  0.74482600  1.0
  O  O11  1  0.81552300  0.05471700  0.13304600  1.0
  O  O12  1  0.81004100  0.85167200  0.33139200  1.0
  O  O13  1  0.80243900  0.65811700  0.54288500  1.0
  O  O14  1  0.69316800  0.75395600  0.94173000  1.0
  O  O15  1  0.69221400  0.15321500  0.53417700  1.0
  O  O16  1  0.69154700  0.35376600  0.33778200  1.0
  O  O17  1  0.69575500  0.55235400  0.13877100  1.0
  O  O18  1  0.30554500  0.64743400  0.66260200  1.0
  O  O19  1  0.31070600  0.04478300  0.26090400  1.0
  O  O20  1  0.30468900  0.44574600  0.87192600  1.0
  O  O21  1  0.31384400  0.24569400  0.06017100  1.0
  O  O22  1  0.30311000  0.84533100  0.45346000  1.0
  O  O23  1  0.19326800  0.94261200  0.86071100  1.0
  O  O24  1  0.19482000  0.74648300  0.06729400  1.0
  O  O25  1  0.19330000  0.14847500  0.65904600  1.0
  F  F26  1  0.80387600  0.25360500  0.93840600  1.0
  F  F27  1  0.69414400  0.96288600  0.74213000  1.0
  F  F28  1  0.19318200  0.35032400  0.45979000  1.0
  F  F29  1  0.19467500  0.53588700  0.25964100  1.0