data_[Cu2Ge8Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [7.5272]
_cell_length_b [7.8106]
_cell_length_c [5.5819]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [CuGe4Pd5]
_chemical_formula_sum '[Cu2 Ge8 Pd10]'
_cell_volume [328.1697]
_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
[
  Cu  Cu0  2  0.0000  0.0000  0.0218  1
  Ge  Ge1  4  0.0000  0.3349  0.0555  1
  Ge  Ge2  4  0.1814  0.0000  0.3876  1
  Pd  Pd3  8  0.1990  0.2053  0.7415  1
  Pd  Pd4  2  0.0000  0.5000  0.4676  1
]