data_TiGePb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.77
_cell_length_b   5.77
_cell_length_c   5.37
_cell_angle_alpha   102.37
_cell_angle_beta   102.37
_cell_angle_gamma   32.28
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiGePb2
_chemical_formula_sum   'Ti1 Ge1 Pb2'
_cell_volume   92.96
_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
  Ti  Ti3  1  0.09  0.0  0.66  1.0
  Ge  Ge0  1  0.63  0.0  0.82  1.0
  Pb  Pb1  1  0.85  0.0  0.17  1.0
  Pb  Pb2  1  0.13  0.0  0.45  1.0

data_TiGePb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.21
_cell_length_b   5.37
_cell_length_c   5.77
_cell_angle_alpha   102.37
_cell_angle_beta   106.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiGePb2
_chemical_formula_sum   'Ti1 Ge1 Pb2'
_cell_volume   92.96
_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
  Ti  Ti0  1  0.0  0.66  0.09  1.0
  Ge  Ge1  1  0.0  0.82  0.63  1.0
  Pb  Pb2  1  0.0  0.17  0.85  1.0
  Pb  Pb3  1  0.0  0.45  0.13  1.0

Ti Ge Pb Pb