data_[Ba2Sr10Cd12]
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
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [5.8354]
_cell_length_b [17.4354]
_cell_length_c [8.0934]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [BaSr5Cd6]
_chemical_formula_sum '[Ba2 Sr10 Cd12]'
_cell_volume [823.4430]
_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
  Sr  Sr1  4  0.0000  0.3325  0.0000  1
  Sr  Sr2  4  0.0000  0.3345  0.5000  1
  Sr  Sr3  2  0.0000  0.0000  0.5000  1
  Cd  Cd4  8  0.0000  0.1694  0.2554  1
  Cd  Cd5  4  0.0000  0.5000  0.2574  1
]