data_InGe2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.5
_cell_length_b   5.5
_cell_length_c   3.36
_cell_angle_alpha   92.89
_cell_angle_beta   92.89
_cell_angle_gamma   104.56
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InGe2Pb
_chemical_formula_sum   'In1 Ge2 Pb1'
_cell_volume   98.21
_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
  In  In2  1  0.0  0.0  0.0  1.0
  Ge  Ge0  1  0.54  0.18  0.68  1.0
  Ge  Ge1  1  0.54  0.82  0.68  1.0
  Pb  Pb3  1  0.37  0.0  0.0  1.0

data_InGe2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   5.5
_cell_length_c   5.5
_cell_angle_alpha   104.56
_cell_angle_beta   92.89
_cell_angle_gamma   92.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InGe2Pb
_chemical_formula_sum   'In1 Ge2 Pb1'
_cell_volume   98.21
_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
  In  In0  1  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.68  0.54  0.18  1.0
  Ge  Ge2  1  0.68  0.54  0.82  1.0
  Pb  Pb3  1  0.0  0.37  0.0  1.0

In Ge Ge Pb