data_[Ge4Pd6Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [3.7840]
_cell_length_b [7.6390]
_cell_length_c [6.4786]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [Ge2Pd3Pt]
_chemical_formula_sum '[Ge4 Pd6 Pt2]'
_cell_volume [187.2717]
_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
[
  Ge  Ge0  2  0.0000  0.3745  0.2555  1
  Ge  Ge1  2  0.5000  0.1251  0.7484  1
  Pd  Pd2  2  0.0000  0.0830  0.4619  1
  Pd  Pd3  2  0.0000  0.3226  0.8645  1
  Pd  Pd4  2  0.5000  0.1789  0.1366  1
  Pt  Pt5  2  0.5000  0.4045  0.5331  1
]