data_[Cd1Hg2H1Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Hg  2.0000  1.5000  1.2450
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.1827]
_cell_length_b [5.0013]
_cell_length_c [8.6519]
_cell_angle_alpha [74.4153]
_cell_angle_beta [89.7670]
_cell_angle_gamma [65.2926]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CdHg2HPd6]
_chemical_formula_sum '[Cd1 Hg2 H1 Pd6]'
_cell_volume [157.1594]
_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  0.4913  0.0023  0.4902  1.0
  Hg  Hg1  1  0.1729  0.6386  0.7201  1.0
  Hg  Hg2  1  0.8057  0.3712  0.2612  1.0
  H  H3  1  0.0796  0.9894  0.1011  1.0
  Pd  Pd4  1  0.1507  0.6837  0.3794  1.0
  Pd  Pd5  1  0.1561  0.6662  0.0410  1.0
  Pd  Pd6  1  0.4881  0.0172  0.1530  1.0
  Pd  Pd7  1  0.5009  0.9816  0.8238  1.0
  Pd  Pd8  1  0.8289  0.3243  0.9330  1.0
  Pd  Pd9  1  0.8317  0.3204  0.6013  1.0
]