data_[Li2Cd1H6Ru1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cd  1.6900  1.5500  1.0900
  H  2.2000  0.2500  0.0000
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.8661]
_cell_length_b [4.9545]
_cell_length_c [4.9772]
_cell_angle_alpha [115.3697]
_cell_angle_beta [104.0606]
_cell_angle_gamma [104.0245]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li2CdH6Ru]
_chemical_formula_sum '[Li2 Cd1 H6 Ru1]'
_cell_volume [96.6133]
_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
[
  Li  Li0  1  0.1022  0.8011  0.4679  1.0
  Li  Li1  1  0.7001  0.1903  0.3674  1.0
  Cd  Cd2  1  0.3167  0.5199  0.9607  1.0
  H  H3  1  0.0082  0.3330  0.2275  1.0
  Ru  Ru4  1  0.0776  0.0007  0.0380  1.0
  H  H5  1  0.3265  0.1480  0.4264  1.0
  H  H6  1  0.3913  0.1252  0.9610  1.0
  H  H7  1  0.7901  0.7939  0.1106  1.0
  H  H8  1  0.8125  0.9641  0.7203  1.0
  H  H9  1  0.9808  0.6278  0.7252  1.0
]