# generated using pymatgen
data_Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.07478478
_cell_length_b   4.65391605
_cell_length_c   43.78411274
_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   830.309054532
_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  0.761383  0.279055  0.320674  1
  Fe  Fe2  1  0.261383  0.562553  0.333224  1
  Fe  Fe3  1  0.761383  0.818377  0.347776  1
  Fe  Fe4  1  0.261383  0.097109  0.360077  1
  Fe  Fe5  1  0.761383  0.365152  0.375658  1
  Fe  Fe6  1  0.261383  0.638593  0.389028  1
  Fe  Fe7  1  0.761383  0.908155  0.403044  1
  Fe  Fe8  1  0.261383  0.179389  0.416620  1
  Fe  Fe9  1  0.761383  0.450935  0.431086  1
  Fe  Fe10  1  0.261383  0.722473  0.444848  1
  Fe  Fe11  1  0.761383  -0.006860  0.458813  1
  Fe  Fe12  1  0.261383  0.264388  0.472658  1
  Fe  Fe13  1  0.761383  0.535691  0.486787  1
  Fe  Fe14  1  0.261383  0.807000  0.500670  1
  Fe  Fe15  1  0.761383  0.077961  0.514627  1
  Fe  Fe16  1  0.261383  0.349207  0.528533  1
  Fe  Fe17  1  0.761383  0.620464  0.542588  1
  Fe  Fe18  1  0.261383  0.891710  0.556493  1
  Fe  Fe19  1  0.761383  0.162671  0.570451  1
  Fe  Fe20  1  0.261383  0.433980  0.584333  1
  Fe  Fe21  1  0.761383  0.705283  0.598463  1
  Fe  Fe22  1  0.261383  0.976532  0.612308  1
  Fe  Fe23  1  0.761383  0.247198  0.626272  1
  Fe  Fe24  1  0.261383  0.518736  0.640035  1
  Fe  Fe25  1  0.761383  0.790282  0.654500  1
  Fe  Fe26  1  0.261383  0.061517  0.668077  1
  Fe  Fe27  1  0.761383  0.331079  0.682093  1
  Fe  Fe28  1  0.261383  0.604520  0.695462  1
  Fe  Fe29  1  0.761383  0.872563  0.711043  1
  Fe  Fe30  1  0.261383  0.151295  0.723345  1
  Fe  Fe31  1  0.761383  0.407118  0.737897  1
  Fe  Fe32  1  0.261383  0.690616  0.750447  1
