data_[Np1Cd1H2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Np  1.3600  1.7500  1.0000
  Cd  1.6900  1.5500  1.0900
  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 [5.1878]
_cell_length_b [5.2962]
_cell_length_c [5.8143]
_cell_angle_alpha [63.9028]
_cell_angle_beta [68.2406]
_cell_angle_gamma [65.3666]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [NpCd(HO3)2]
_chemical_formula_sum '[Np1 Cd1 H2 O6]'
_cell_volume [126.9273]
_cell_formula_units_Z [1]
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
[
  Np  Np0  1  0.0000  0.0000  0.0000  1
  Cd  Cd1  1  0.5000  0.5000  0.5000  1
  H  H2  2  0.3995  0.2284  0.2453  1
  O  O3  2  0.0889  0.3548  0.7759  1
  O  O4  2  0.2272  0.9314  0.2254  1
  O  O5  2  0.4187  0.7530  0.7572  1
]