data_Ge2PbAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56
_cell_length_b   4.56
_cell_length_c   6.02
_cell_angle_alpha   106.06
_cell_angle_beta   106.06
_cell_angle_gamma   50.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2PbAu
_chemical_formula_sum   'Ge2 Pb1 Au1'
_cell_volume   92.03
_cell_formula_units_Z   1
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  Ge1  1  0.99  0.0  0.03  1.0
  Ge  Ge2  1  0.68  0.0  0.75  1.0
  Pb  Pb3  1  0.21  0.0  0.74  1.0
  Au  Au0  1  0.73  0.0  0.08  1.0

data_Ge2PbAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.89
_cell_length_b   4.56
_cell_length_c   6.02
_cell_angle_alpha   106.06
_cell_angle_beta   90.0
_cell_angle_gamma   115.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2PbAu
_chemical_formula_sum   'Ge2 Pb1 Au1'
_cell_volume   92.03
_cell_formula_units_Z   1
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  0.0  0.01  0.97  1.0
  Ge  Ge1  1  0.0  0.32  0.25  1.0
  Pb  Pb2  1  0.0  0.79  0.26  1.0
  Au  Au3  1  0.0  0.27  0.92  1.0

Ge Ge Pb Au