data_[Tb4H36C16N8O32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  H  2.2000  0.2500  0.0000
  C  2.5500  0.7000  0.3000
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pca2_1]
_cell_length_a [17.7604]
_cell_length_b [6.4886]
_cell_length_c [7.4476]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [29]
_chemical_formula_structural [TbH9C4(NO4)2]
_chemical_formula_sum '[Tb4 H36 C16 N8 O32]'
_cell_volume [858.2649]
_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
[
  Tb  Tb0  4  0.1026  0.6866  0.7705  1
  H  H1  4  0.0418  0.0702  0.5104  1
  H  H2  4  0.0595  0.5868  0.2098  1
  H  H3  4  0.1108  0.2122  0.2658  1
  H  H4  4  0.1479  0.2221  0.9290  1
  H  H5  4  0.1504  0.9399  0.1501  1
  H  H6  4  0.1582  0.8649  0.3601  1
  H  H7  4  0.1591  0.1936  0.4518  1
  H  H8  4  0.2371  0.9500  0.2492  1
  H  H9  4  0.2443  0.3841  0.5406  1
  C  C10  4  0.0108  0.9882  0.0696  1
  C  C11  4  0.0501  0.5857  0.3565  1
  C  C12  4  0.1419  0.1928  0.7834  1
  C  C13  4  0.2329  0.5373  0.0751  1
  N  N14  4  0.1645  0.1858  0.3143  1
  N  N15  4  0.1799  0.9739  0.2690  1
  O  O16  4  0.0053  0.5126  0.9194  1
  O  O17  4  0.0075  0.1273  0.1884  1
  O  O18  4  0.0720  0.9094  0.0153  1
  O  O19  4  0.0970  0.6851  0.4532  1
  O  O20  4  0.1181  0.3372  0.6860  1
  O  O21  4  0.1595  0.0152  0.7221  1
  O  O22  4  0.1679  0.5833  0.0176  1
  O  O23  4  0.2272  0.6566  0.6687  1
]