# generated using pymatgen
data_Ba2Fe3O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.76884000
_cell_length_b   3.81260500
_cell_length_c   12.68319000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Fe3O7
_chemical_formula_sum   'Ba2 Fe3 O7'
_cell_volume   182.24600296
_cell_formula_units_Z   1
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
  Ba  Ba0  1  0.49842900  0.00000000  0.79967400  1.0
  Ba  Ba1  1  0.49842900  0.00000000  0.20032600  1.0
  Fe  Fe2  1  0.99451800  0.50000000  0.61225800  1.0
  Fe  Fe3  1  0.99451800  0.50000000  0.38774200  1.0
  Fe  Fe4  1  0.99400500  0.50000000  0.00000000  1.0
  O  O5  1  0.97923300  0.00000000  0.00000000  1.0
  O  O6  1  0.49458400  0.50000000  0.63795500  1.0
  O  O7  1  0.49458400  0.50000000  0.36204500  1.0
  O  O8  1  0.99451100  0.00000000  0.63524700  1.0
  O  O9  1  0.99451100  0.00000000  0.36475300  1.0
  O  O10  1  0.00146200  0.50000000  0.85584900  1.0
  O  O11  1  0.00146200  0.50000000  0.14415100  1.0