data_[Ba2Sr2Gd2Sb2O12]
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
  Gd  1.2000  1.8000  1.0750
  Sb  2.0500  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.9808]
_cell_length_b [6.0196]
_cell_length_c [8.4853]
_cell_angle_alpha [90.3019]
_cell_angle_beta [90.1977]
_cell_angle_gamma [90.2246]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BaSrGdSbO6]
_chemical_formula_sum '[Ba2 Sr2 Gd2 Sb2 O12]'
_cell_volume [305.4770]
_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  0.4948  0.4783  0.7504  1.0
  Sr  Sr1  2  0.0050  0.9694  0.7486  1.0
  Gd  Gd2  1  0.0000  0.5000  0.0000  1.0
  Gd  Gd3  1  0.5000  0.0000  0.5000  1.0
  Sb  Sb4  1  0.0000  0.5000  0.5000  1.0
  Sb  Sb5  1  0.5000  0.0000  0.0000  1.0
  O  O6  2  0.0546  0.4778  0.2656  1.0
  O  O7  2  0.1993  0.2313  0.5344  1.0
  O  O8  2  0.2343  0.2026  0.9634  1.0
  O  O9  2  0.2612  0.7085  0.5291  1.0
  O  O10  2  0.2938  0.7381  0.9675  1.0
  O  O11  2  0.4288  0.9956  0.2338  1.0
]