data_[Bi4Te2H4Pd14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  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 [5.8826]
_cell_length_b [5.8832]
_cell_length_c [11.5965]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5498]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Bi2TeH2Pd7]
_chemical_formula_sum '[Bi4 Te2 H4 Pd14]'
_cell_volume [388.4635]
_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
[
  Bi  Bi0  4  0.1962  0.0000  0.3902  1.0
  Te  Te1  2  0.0000  0.0000  0.0000  1.0
  Pd  Pd2  8  0.1558  0.2502  0.8181  1.0
  H  H3  4  0.0647  0.5000  0.1766  1.0
  Pd  Pd4  4  0.1812  0.5000  0.3563  1.0
  Pd  Pd5  2  0.0000  0.5000  0.0000  1.0
]