# generated using pymatgen
data_Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.68254717
_cell_length_b   5.18225927
_cell_length_c   46.77660500
_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   892.680717755
_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  0.499660  0.377133  0.293169  1
  Fe  Fe2  1  -0.000340  0.627133  0.319734  1
  Fe  Fe3  1  -0.000340  0.127133  0.319734  1
  Fe  Fe4  1  0.499660  0.877133  0.293169  1
  Fe  Fe5  1  0.499660  0.877133  0.347630  1
  Fe  Fe6  1  -0.000340  0.127133  0.375408  1
  Fe  Fe7  1  -0.000340  0.627133  0.375408  1
  Fe  Fe8  1  0.499660  0.377133  0.347630  1
  Fe  Fe9  1  0.499660  0.377133  0.403264  1
  Fe  Fe10  1  -0.000340  0.627133  0.431088  1
  Fe  Fe11  1  -0.000340  0.127133  0.431088  1
  Fe  Fe12  1  0.499660  0.877133  0.403264  1
  Fe  Fe13  1  0.499660  0.877133  0.458923  1
  Fe  Fe14  1  -0.000340  0.127133  0.486754  1
  Fe  Fe15  1  -0.000340  0.627133  0.486754  1
  Fe  Fe16  1  0.499660  0.377133  0.458923  1
  Fe  Fe17  1  0.499660  0.377133  0.514587  1
  Fe  Fe18  1  -0.000340  0.627133  0.542418  1
  Fe  Fe19  1  -0.000340  0.127133  0.542418  1
  Fe  Fe20  1  0.499660  0.877133  0.514587  1
  Fe  Fe21  1  0.499660  0.877133  0.570253  1
  Fe  Fe22  1  -0.000340  0.127133  0.598077  1
  Fe  Fe23  1  -0.000340  0.627133  0.598077  1
  Fe  Fe24  1  0.499660  0.377133  0.570253  1
  Fe  Fe25  1  0.499660  0.377133  0.625933  1
  Fe  Fe26  1  -0.000340  0.627133  0.653711  1
  Fe  Fe27  1  -0.000340  0.127133  0.653711  1
  Fe  Fe28  1  0.499660  0.877133  0.625933  1
  Fe  Fe29  1  0.499660  0.877133  0.681607  1
  Fe  Fe30  1  -0.000340  0.127133  0.708172  1
  Fe  Fe31  1  -0.000340  0.627133  0.708172  1
  Fe  Fe32  1  0.499660  0.377133  0.681607  1
