# generated using pymatgen
data_Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.07265079
_cell_length_b   4.70742456
_cell_length_c   43.79114624
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe
_chemical_formula_sum   Fe32
_cell_volume   839.550560053
_cell_formula_units_Z   32
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  Fe1  1  0.764340  0.264411  0.313781  1
  Fe  Fe2  1  0.264340  0.535032  0.325193  1
  Fe  Fe3  1  0.764340  0.795808  0.338959  1
  Fe  Fe4  1  0.264340  0.074044  0.351200  1
  Fe  Fe5  1  0.764340  0.343770  0.367277  1
  Fe  Fe6  1  0.264340  0.619013  0.380454  1
  Fe  Fe7  1  0.764340  0.888029  0.394527  1
  Fe  Fe8  1  0.264340  0.160740  0.408085  1
  Fe  Fe9  1  0.764340  0.432674  0.422696  1
  Fe  Fe10  1  0.264340  0.705155  0.436393  1
  Fe  Fe11  1  0.764340  -0.023710  0.450417  1
  Fe  Fe12  1  0.264340  0.248436  0.464273  1
  Fe  Fe13  1  0.764340  0.520352  0.478461  1
  Fe  Fe14  1  0.264340  0.792434  0.492338  1
  Fe  Fe15  1  0.764340  0.064041  0.506345  1
  Fe  Fe16  1  0.264340  0.336067  0.520262  1
  Fe  Fe17  1  0.764340  0.607966  0.534359  1
  Fe  Fe18  1  0.264340  0.879993  0.548276  1
  Fe  Fe19  1  0.764340  0.151600  0.562284  1
  Fe  Fe20  1  0.264340  0.423682  0.576160  1
  Fe  Fe21  1  0.764340  0.695598  0.590348  1
  Fe  Fe22  1  0.264340  0.967744  0.604204  1
  Fe  Fe23  1  0.764340  0.238879  0.618228  1
  Fe  Fe24  1  0.264340  0.511360  0.631926  1
  Fe  Fe25  1  0.764340  0.783293  0.646536  1
  Fe  Fe26  1  0.264340  0.056004  0.660094  1
  Fe  Fe27  1  0.764340  0.325021  0.674167  1
  Fe  Fe28  1  0.264340  0.600264  0.687345  1
  Fe  Fe29  1  0.764340  0.869990  0.703421  1
  Fe  Fe30  1  0.264340  0.148225  0.715662  1
  Fe  Fe31  1  0.764340  0.409002  0.729428  1
  Fe  Fe32  1  0.264340  0.679623  0.740840  1
