data_[Ge2Pd2Pt2]
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 [Pm]
_cell_length_a [3.9519]
_cell_length_b [3.8207]
_cell_length_c [6.3695]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.9183]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [GePdPt]
_chemical_formula_sum '[Ge2 Pd2 Pt2]'
_cell_volume [95.4728]
_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  1  0.2513  0.5000  0.3812  1.0
  Ge  Ge1  1  0.6369  0.0000  0.8432  1.0
  Pd  Pd2  1  0.1197  0.5000  0.7460  1.0
  Pd  Pd3  1  0.1898  0.0000  0.1025  1.0
  Pt  Pt4  1  0.6959  0.5000  0.1126  1.0
  Pt  Pt5  1  0.7252  0.0000  0.4714  1.0
]