data_[Cd3H5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [3.8064]
_cell_length_b [5.4373]
_cell_length_c [20.2943]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [102.4110]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Cd3H5]
_chemical_formula_sum '[Cd3 H5]'
_cell_volume [410.2084]
_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
[
  Cd  Cd0  1  0.1187  0.4689  0.5794  1
  Cd  Cd1  1  0.2472  0.0880  0.4427  1
  Cd  Cd2  1  0.6034  0.6628  0.4503  1
  H  H3  1  0.0751  0.1902  0.5265  1
  H  H4  1  0.1117  0.5899  0.6564  1
  H  H5  1  0.4512  0.3936  0.3955  1
  H  H6  1  0.6553  0.6266  0.5384  1
  H  H7  1  0.7373  0.9800  0.4108  1
]