# generated using pymatgen
data_Fe4O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28707393
_cell_length_b   5.28707393
_cell_length_c   12.80586700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   148.08017215
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4O5
_chemical_formula_sum   'Fe8 O10'
_cell_volume   189.26723233
_cell_formula_units_Z   2
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  0.00000000  0.00000000  0.50000000  1.0
  Fe  Fe1  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe2  1  0.73877900  0.26122100  0.38467700  1.0
  Fe  Fe3  1  0.26122100  0.73877900  0.61532300  1.0
  Fe  Fe4  1  0.73877900  0.26122100  0.11532300  1.0
  Fe  Fe5  1  0.26122100  0.73877900  0.88467700  1.0
  Fe  Fe6  1  0.49510100  0.50489900  0.25000000  1.0
  Fe  Fe7  1  0.50489900  0.49510100  0.75000000  1.0
  O  O8  1  0.85041100  0.14958900  0.25000000  1.0
  O  O9  1  0.14958900  0.85041100  0.75000000  1.0
  O  O10  1  0.63208300  0.36791700  0.96375900  1.0
  O  O11  1  0.36791700  0.63208300  0.03624100  1.0
  O  O12  1  0.63208300  0.36791700  0.53624100  1.0
  O  O13  1  0.36791700  0.63208300  0.46375900  1.0
  O  O14  1  0.91927600  0.08072400  0.85134200  1.0
  O  O15  1  0.08072400  0.91927600  0.14865800  1.0
  O  O16  1  0.91927600  0.08072400  0.64865800  1.0
  O  O17  1  0.08072400  0.91927600  0.35134200  1.0