data_[Li4Mn2Cd2H12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mn  1.5500  1.4000  0.6483
  Cd  1.6900  1.5500  1.0900
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [4.7746]
_cell_length_b [8.4744]
_cell_length_c [5.1195]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.6491]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Li2MnCdH6]
_chemical_formula_sum '[Li4 Mn2 Cd2 H12]'
_cell_volume [206.4636]
_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
[
  Li  Li0  2  0.0000  0.0277  0.0000  1.0
  Li  Li1  2  0.0000  0.3632  0.5000  1.0
  Mn  Mn2  2  0.0000  0.3622  0.0000  1.0
  Cd  Cd3  2  0.0000  0.6936  0.0000  1.0
  H  H4  4  0.0427  0.2232  0.7940  1.0
  H  H5  4  0.1653  0.4723  0.7993  1.0
  H  H6  4  0.2464  0.4146  0.2197  1.0
]