# generated using pymatgen
data_BaO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.09525900
_cell_length_b   7.06975000
_cell_length_c   10.78143000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaO5
_chemical_formula_sum   'Ba4 O20'
_cell_volume   388.37090661
_cell_formula_units_Z   4
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  0.47569800  0.43712400  0.25000000  1.0
  Ba  Ba1  1  0.52430200  0.56287600  0.75000000  1.0
  Ba  Ba2  1  0.97569800  0.06287600  0.75000000  1.0
  Ba  Ba3  1  0.02430200  0.93712400  0.25000000  1.0
  O  O4  1  0.43960800  0.07185900  0.57978600  1.0
  O  O5  1  0.56039200  0.92814100  0.42021400  1.0
  O  O6  1  0.93960800  0.42814100  0.42021400  1.0
  O  O7  1  0.56039200  0.92814100  0.07978600  1.0
  O  O8  1  0.06039200  0.57185900  0.57978600  1.0
  O  O9  1  0.43960800  0.07185900  0.92021400  1.0
  O  O10  1  0.06039200  0.57185900  0.92021400  1.0
  O  O11  1  0.93960800  0.42814100  0.07978600  1.0
  O  O12  1  0.06484600  0.26922000  0.08620900  1.0
  O  O13  1  0.93515400  0.73078000  0.91379100  1.0
  O  O14  1  0.56484600  0.23078000  0.91379100  1.0
  O  O15  1  0.93515400  0.73078000  0.58620900  1.0
  O  O16  1  0.43515400  0.76922000  0.08620900  1.0
  O  O17  1  0.06484600  0.26922000  0.41379100  1.0
  O  O18  1  0.43515400  0.76922000  0.41379100  1.0
  O  O19  1  0.56484600  0.23078000  0.58620900  1.0
  O  O20  1  0.52796100  0.05900100  0.25000000  1.0
  O  O21  1  0.47203900  0.94099900  0.75000000  1.0
  O  O22  1  0.02796100  0.44099900  0.75000000  1.0
  O  O23  1  0.97203900  0.55900100  0.25000000  1.0