data_[Na2B2H16O14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  B  2.0400  0.8500  0.4100
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.8792]
_cell_length_b [7.0642]
_cell_length_c [7.4173]
_cell_angle_alpha [69.1259]
_cell_angle_beta [77.8553]
_cell_angle_gamma [64.0182]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [NaBH8O7]
_chemical_formula_sum '[Na2 B2 H16 O14]'
_cell_volume [302.1246]
_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
[
  Na  Na0  1  0.0000  0.0000  0.0000  1
  Na  Na1  1  0.5000  0.0000  0.0000  1
  B  B2  2  0.1858  0.4897  0.3673  1
  H  H3  2  0.1706  0.8694  0.3475  1
  H  H4  2  0.1734  0.1021  0.3156  1
  H  H5  2  0.1768  0.5358  0.0810  1
  H  H6  2  0.1873  0.4260  0.8261  1
  H  H7  2  0.2526  0.0787  0.6762  1
  H  H8  2  0.4015  0.4623  0.8104  1
  H  H9  2  0.4092  0.8266  0.7479  1
  H  H10  2  0.4799  0.3264  0.4903  1
  O  O11  2  0.1023  0.6149  0.1794  1
  O  O12  2  0.1107  0.6308  0.4991  1
  O  O13  2  0.1294  0.2894  0.4630  1
  O  O14  2  0.2086  0.9900  0.2507  1
  O  O15  2  0.3033  0.3978  0.9024  1
  O  O16  2  0.3155  0.9557  0.7933  1
  O  O17  2  0.4250  0.4001  0.3616  1
]