data_[Ti8Ge4Pd8Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [10.6150]
_cell_length_b [4.3238]
_cell_length_c [10.6637]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4951]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Ti2GePd2Pb]
_chemical_formula_sum '[Ti8 Ge4 Pd8 Pb4]'
_cell_volume [461.3717]
_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
[
  Ti  Ti0  1  0.0038  0.0000  0.2504  1
  Ti  Ti1  1  0.1289  0.5000  0.6166  1
  Ti  Ti2  1  0.2519  0.0000  0.0118  1
  Ti  Ti3  1  0.3701  0.5000  0.3704  1
  Ti  Ti4  1  0.5043  0.0000  0.7509  1
  Ti  Ti5  1  0.6209  0.5000  0.1242  1
  Ti  Ti6  1  0.7418  0.0000  0.4923  1
  Ti  Ti7  1  0.8802  0.5000  0.8883  1
  Ge  Ge8  1  0.1258  0.5000  0.1272  1
  Ge  Ge9  1  0.2487  0.0000  0.4941  1
  Ge  Ge10  1  0.4970  0.0000  0.2483  1
  Ge  Ge11  1  0.7530  0.0000  0.0025  1
  Pd  Pd12  1  0.0038  0.0000  0.0152  1
  Pd  Pd13  1  0.1331  0.5000  0.3722  1
  Pd  Pd14  1  0.2526  0.0000  0.7340  1
  Pd  Pd15  1  0.3729  0.5000  0.1345  1
  Pd  Pd16  1  0.4876  0.0000  0.4869  1
  Pd  Pd17  1  0.6379  0.5000  0.8881  1
  Pd  Pd18  1  0.7360  0.0000  0.2373  1
  Pd  Pd19  1  0.8744  0.5000  0.6237  1
  Pb  Pb20  1  0.0042  0.0000  0.7565  1
  Pb  Pb21  1  0.3747  0.5000  0.8774  1
  Pb  Pb22  1  0.6223  0.5000  0.6264  1
  Pb  Pb23  1  0.8743  0.5000  0.3708  1
]