data_[Ba2Os4O14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Os  2.2000  1.3000  0.6730
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [6.2580]
_cell_length_b [10.3232]
_cell_length_c [3.8542]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [BaOs2O7]
_chemical_formula_sum '[Ba2 Os4 O14]'
_cell_volume [248.9919]
_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  2  0.0000  0.0000  0.0000  1.0
  Os  Os1  4  0.0000  0.3106  0.5000  1.0
  O  O2  8  0.1845  0.1484  0.5000  1.0
  O  O3  4  0.0000  0.3068  0.0000  1.0
  O  O4  2  0.0000  0.5000  0.5000  1.0
]