data_[Ge2P2Pt12Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  P  2.1900  1.0000  0.5500
  Pt  2.2800  1.3500  0.8050
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [6.6151]
_cell_length_b [8.4342]
_cell_length_c [7.1035]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [GeP(Pt3Pb)2]
_chemical_formula_sum '[Ge2 P2 Pt12 Pb4]'
_cell_volume [396.3297]
_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  0.5000  0.7376  1.0
  P  P1  2  0.0000  0.0000  0.7444  1.0
  Pt  Pt2  4  0.0000  0.2410  0.9076  1.0
  Pt  Pt3  4  0.2112  0.5000  0.4465  1.0
  Pt  Pt4  4  0.2141  0.5000  0.0441  1.0
  Pb  Pb5  4  0.0000  0.2114  0.3079  1.0
]