data_[Ge4Sb4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.7438]
_cell_length_b [6.7859]
_cell_length_c [5.7695]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.5250]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [GeSbPd2]
_chemical_formula_sum '[Ge4 Sb4 Pd8]'
_cell_volume [303.0718]
_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
[
  Ge  Ge0  4  0.3831  0.0679  0.6884  1.0
  Sb  Sb1  4  0.1283  0.5891  0.7807  1.0
  Pd  Pd2  4  0.1575  0.2201  0.9801  1.0
  Pd  Pd3  4  0.3962  0.6947  0.4994  1.0
]