# generated using pymatgen
data_Fe2O3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38752790
_cell_length_b   5.38752790
_cell_length_c   14.81011300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999881
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2O3
_chemical_formula_sum   'Fe12 O18'
_cell_volume   372.27860173
_cell_formula_units_Z   6
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  0.02529700  0.64767700  0.23354300  1.0
  Fe  Fe1  1  0.62238000  0.97470300  0.23354300  1.0
  Fe  Fe2  1  0.35232300  0.37762000  0.23354300  1.0
  Fe  Fe3  1  0.38744300  0.99999600  0.73057100  1.0
  Fe  Fe4  1  0.61255300  0.61255700  0.73057100  1.0
  Fe  Fe5  1  0.00000400  0.38744700  0.73057100  1.0
  Fe  Fe6  1  0.00000000  0.00000000  0.91380900  1.0
  Fe  Fe7  1  0.00000000  0.00000000  0.07933900  1.0
  Fe  Fe8  1  0.00000000  0.00000000  0.58419000  1.0
  Fe  Fe9  1  0.33333300  0.66666700  0.93972600  1.0
  Fe  Fe10  1  0.66666700  0.33333300  0.94082900  1.0
  Fe  Fe11  1  0.00000000  0.00000000  0.41466400  1.0
  O  O12  1  0.30991500  0.01668600  0.17653100  1.0
  O  O13  1  0.70677100  0.69008500  0.17653100  1.0
  O  O14  1  0.98331400  0.29322900  0.17653100  1.0
  O  O15  1  0.64101800  0.63712900  0.86001200  1.0
  O  O16  1  0.99611100  0.35898200  0.86001200  1.0
  O  O17  1  0.36287100  0.00388900  0.86001200  1.0
  O  O18  1  0.00593900  0.69225200  0.00093600  1.0
  O  O19  1  0.30774800  0.31368600  0.00093600  1.0
  O  O20  1  0.68631400  0.99406100  0.00093600  1.0
  O  O21  1  0.99813000  0.25904900  0.50815000  1.0
  O  O22  1  0.74095100  0.73908100  0.50815000  1.0
  O  O23  1  0.26091900  0.00187000  0.50815000  1.0
  O  O24  1  0.00017700  0.71479200  0.68063500  1.0
  O  O25  1  0.28520800  0.28538500  0.68063500  1.0
  O  O26  1  0.71461500  0.99982300  0.68063500  1.0
  O  O27  1  0.70216000  0.00041400  0.35207000  1.0
  O  O28  1  0.29825300  0.29784000  0.35207000  1.0
  O  O29  1  0.99958600  0.70174700  0.35207000  1.0