data_[Zn4H4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1372]
_cell_length_b [5.0344]
_cell_length_c [7.9955]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.9909]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [ZnHPd3]
_chemical_formula_sum '[Zn4 H4 Pd12]'
_cell_volume [255.9970]
_cell_formula_units_Z [4]
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
[
  Zn  Zn0  4  0.4008  0.6790  0.8850  1
  Pd  Pd1  4  0.0632  0.0860  0.3593  1
  H  H2  4  0.0657  0.2401  0.6448  1
  Pd  Pd3  4  0.1993  0.5882  0.5346  1
  Pd  Pd4  4  0.3557  0.1542  0.7715  1
]