data_[Sr8Ge20Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [10.5184]
_cell_length_b [12.4767]
_cell_length_c [6.2121]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Sr2Ge5Pd3]
_chemical_formula_sum '[Sr8 Ge20 Pd12]'
_cell_volume [815.2475]
_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
[
  Sr  Sr0  8  0.2354  0.3692  0.5000  1.0
  Ge  Ge1  8  0.0000  0.2291  0.2500  1.0
  Ge  Ge2  8  0.1508  0.1071  0.5000  1.0
  Ge  Ge3  4  0.0000  0.5000  0.2500  1.0
  Pd  Pd4  8  0.1121  0.3633  0.0000  1.0
  Pd  Pd5  4  0.0000  0.0000  0.2500  1.0
]