data_[Cd4B4O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.5227]
_cell_length_b [6.4681]
_cell_length_c [10.0780]
_cell_angle_alpha [105.8039]
_cell_angle_beta [91.3219]
_cell_angle_gamma [91.2679]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cd2B2O5]
_chemical_formula_sum '[Cd4 B4 O10]'
_cell_volume [220.7992]
_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
[
  Cd  Cd0  2  0.2270  0.3475  0.5933  1.0
  Cd  Cd1  2  0.2477  0.7789  0.1250  1.0
  B  B2  2  0.3266  0.8736  0.6801  1.0
  B  B3  2  0.3283  0.3276  0.1560  1.0
  O  O4  2  0.2087  0.0790  0.6977  1.0
  O  O5  2  0.2602  0.2886  0.0175  1.0
  O  O6  2  0.2685  0.7047  0.5639  1.0
  O  O7  2  0.2765  0.5255  0.2472  1.0
  O  O8  2  0.4677  0.1549  0.2028  1.0
]