data_[Cd2Cu2H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Cu  1.9000  1.3500  0.8200
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [2.9286]
_cell_length_b [2.9411]
_cell_length_c [11.9936]
_cell_angle_alpha [88.5767]
_cell_angle_beta [89.4901]
_cell_angle_gamma [89.5405]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CdCuH]
_chemical_formula_sum '[Cd2 Cu2 H2]'
_cell_volume [103.2644]
_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
[
  Cd  Cd0  2  0.2578  0.2718  0.7860  1.0
  Cu  Cu1  2  0.2478  0.2443  0.0585  1.0
  H  H2  2  0.0175  0.0178  0.4691  1.0
]