data_[Ba8Sr6Co2O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sr  0.9500  2.0000  1.3200
  Co  1.8800  1.3500  0.7683
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.2954]
_cell_length_b [7.3644]
_cell_length_c [7.4526]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.6913]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba4Sr3CoO8]
_chemical_formula_sum '[Ba8 Sr6 Co2 O16]'
_cell_volume [607.1463]
_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
[
  Ba  Ba0  4  0.2500  0.2500  0.5000  1
  Ba  Ba1  2  0.0000  0.0000  0.0000  1
  Ba  Ba2  2  0.0000  0.5000  0.0000  1
  Sr  Sr3  4  0.2500  0.2500  0.0000  1
  Sr  Sr4  2  0.0000  0.5000  0.5000  1
  Co  Co5  2  0.0000  0.0000  0.5000  1
  O  O6  8  0.0042  0.2262  0.7194  1
  O  O7  4  0.2310  0.5000  0.2176  1
  O  O8  4  0.2451  0.5000  0.7577  1
]