# generated using pymatgen
data_Fe5(O4F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.65671400
_cell_length_b   4.65672823
_cell_length_c   15.06924948
_cell_angle_alpha   89.60087442
_cell_angle_beta   89.59687589
_cell_angle_gamma   88.39399931
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5(O4F)2
_chemical_formula_sum   'Fe10 O16 F4'
_cell_volume   326.63351463
_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  0.99655200  0.99859200  0.00217100  1.0
  Fe  Fe1  1  0.00227400  0.00860600  0.20573100  1.0
  Fe  Fe2  1  0.01880200  0.97927200  0.40002700  1.0
  Fe  Fe3  1  0.98970100  0.99577400  0.59467400  1.0
  Fe  Fe4  1  0.98689300  0.98858800  0.79712600  1.0
  Fe  Fe5  1  0.47191300  0.47551000  0.09967300  1.0
  Fe  Fe6  1  0.48992500  0.50187300  0.50384200  1.0
  Fe  Fe7  1  0.49635100  0.50865000  0.29651400  1.0
  Fe  Fe8  1  0.51842600  0.52140200  0.70043600  1.0
  Fe  Fe9  1  0.52220000  0.52299300  0.90007700  1.0
  O  O10  1  0.81234000  0.80724100  0.30271700  1.0
  O  O11  1  0.80910100  0.80078500  0.49517900  1.0
  O  O12  1  0.81323300  0.81828600  0.69557600  1.0
  O  O13  1  0.81702500  0.81835200  0.90202800  1.0
  O  O14  1  0.30004600  0.69260100  0.00083600  1.0
  O  O15  1  0.29625400  0.68990700  0.19693100  1.0
  O  O16  1  0.31922200  0.67964600  0.40006900  1.0
  O  O17  1  0.30589800  0.69799800  0.60388500  1.0
  O  O18  1  0.31302000  0.70286900  0.79841100  1.0
  O  O19  1  0.69064000  0.30298300  0.00106900  1.0
  O  O20  1  0.68457800  0.30481200  0.19919200  1.0
  O  O21  1  0.69113000  0.31099600  0.60167400  1.0
  O  O22  1  0.70057800  0.31510100  0.79803700  1.0
  O  O23  1  0.17528400  0.18036100  0.10117900  1.0
  O  O24  1  0.19029700  0.18467200  0.49820300  1.0
  O  O25  1  0.19729700  0.18941400  0.30519900  1.0
  F  F26  1  0.79121000  0.79772300  0.10280600  1.0
  F  F27  1  0.69996400  0.29902500  0.40028000  1.0
  F  F28  1  0.20218500  0.20289000  0.89785300  1.0
  F  F29  1  0.19766300  0.20307800  0.69860400  1.0