# generated using pymatgen
data_BaYFe4O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47491245
_cell_length_b   6.47491245
_cell_length_c   6.47491245
_cell_angle_alpha   121.45587253
_cell_angle_beta   121.45587253
_cell_angle_gamma   87.49632515
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaYFe4O7
_chemical_formula_sum   'Ba1 Y1 Fe4 O7'
_cell_volume   187.53087105
_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  0.25000000  0.75000000  0.50000000  1.0
  Y  Y1  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe2  1  0.13920300  0.34929100  0.72853100  1.0
  Fe  Fe3  1  0.62076000  0.41067100  0.27146900  1.0
  Fe  Fe4  1  0.65070900  0.37924000  0.78991100  1.0
  Fe  Fe5  1  0.58932900  0.86079700  0.21008900  1.0
  O  O6  1  0.82767100  0.32682200  0.10623000  1.0
  O  O7  1  0.22059200  0.72144200  0.89377000  1.0
  O  O8  1  0.67317800  0.77940800  0.50084900  1.0
  O  O9  1  0.27855800  0.17232900  0.49915100  1.0
  O  O10  1  0.75450600  0.75450600  0.00000000  1.0
  O  O11  1  0.24549400  0.24549400  0.00000000  1.0
  O  O12  1  0.75000000  0.25000000  0.50000000  1.0