# generated using pymatgen
data_Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.57472288
_cell_length_b   2.57472288
_cell_length_c   50.58005918
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   59.99999999
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe
_chemical_formula_sum   Fe10
_cell_volume   290.38284124
_cell_formula_units_Z   10
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  0.337791  0.342250  0.304409  1
  Fe  Fe2  1  0.671125  0.675583  0.345758  1
  Fe  Fe3  1  0.337791  0.342250  0.387446  1
  Fe  Fe4  1  0.671125  0.675583  0.429158  1
  Fe  Fe5  1  0.337791  0.342250  0.470872  1
  Fe  Fe6  1  0.671125  0.675583  0.512586  1
  Fe  Fe7  1  0.337791  0.342250  0.554300  1
  Fe  Fe8  1  0.671125  0.675583  0.596012  1
  Fe  Fe9  1  0.337791  0.342250  0.637700  1
  Fe  Fe10  1  0.671125  0.675583  0.679049  1
