data_[B20H16N4O40]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  B  2.0400  0.8500  0.4100
  H  2.2000  0.2500  0.0000
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [9.3778]
_cell_length_b [7.7173]
_cell_length_c [11.6868]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.6243]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [B5H4NO10]
_chemical_formula_sum '[B20 H16 N4 O40]'
_cell_volume [840.1412]
_cell_formula_units_Z [4]
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
[
  B  B0  4  0.1741  0.6123  0.5573  1
  B  B1  4  0.2492  0.0151  0.4586  1
  B  B2  4  0.2954  0.5481  0.7556  1
  B  B3  4  0.3681  0.0945  0.0785  1
  B  B4  4  0.4347  0.6891  0.9265  1
  H  H5  4  0.0482  0.0914  0.2702  1
  H  H6  4  0.0604  0.6583  0.4047  1
  H  H7  4  0.0931  0.1667  0.5071  1
  H  H8  4  0.0968  0.7037  0.2294  1
  N  N9  4  0.3239  0.0610  0.7642  1
  O  O10  4  0.0473  0.6153  0.2740  1
  O  O11  4  0.0670  0.6941  0.4892  1
  O  O12  4  0.1753  0.0940  0.5375  1
  O  O13  4  0.1891  0.6404  0.6741  1
  O  O14  4  0.2164  0.0406  0.3413  1
  O  O15  4  0.2655  0.0021  0.0082  1
  O  O16  4  0.3602  0.5955  0.0019  1
  O  O17  4  0.3776  0.0785  0.1961  1
  O  O18  4  0.3992  0.6746  0.8103  1
  O  O19  4  0.4575  0.2023  0.0253  1
]