data_[Te4H2Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.8543]
_cell_length_b [4.4683]
_cell_length_c [5.1952]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.9777]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Te2HPd8]
_chemical_formula_sum '[Te4 H2 Pd16]'
_cell_volume [367.9862]
_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
[
  Te  Te0  4  0.1277  0.0000  0.3478  1.0
  Pd  Pd1  4  0.0359  0.0000  0.7628  1.0
  Pd  Pd2  4  0.1063  0.5000  0.0479  1.0
  Pd  Pd3  4  0.1948  0.5000  0.5578  1.0
  Pd  Pd4  4  0.2100  0.0000  0.9029  1.0
  H  H5  2  0.0000  0.5000  0.0000  1.0
]