data_CrGePb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.08
_cell_length_b   6.08
_cell_length_c   5.29
_cell_angle_alpha   109.9
_cell_angle_beta   109.9
_cell_angle_gamma   31.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrGePb2
_chemical_formula_sum   'Cr1 Ge1 Pb2'
_cell_volume   96.06
_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
  Cr  Cr0  1  0.59  0.0  0.45  1.0
  Ge  Ge1  1  0.74  0.0  0.29  1.0
  Pb  Pb2  1  0.11  0.0  0.15  1.0
  Pb  Pb3  1  0.31  0.0  0.53  1.0

data_CrGePb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.32
_cell_length_b   5.29
_cell_length_c   6.08
_cell_angle_alpha   109.9
_cell_angle_beta   105.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrGePb2
_chemical_formula_sum   'Cr1 Ge1 Pb2'
_cell_volume   96.06
_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
  Cr  Cr0  1  0.0  0.45  0.59  1.0
  Ge  Ge1  1  0.0  0.29  0.74  1.0
  Pb  Pb2  1  0.0  0.15  0.11  1.0
  Pb  Pb3  1  0.0  0.53  0.31  1.0

Cr Ge Pb Pb
Cr Ge Pb Pb 0 1 o o o 0 3 o o o 2 3 o o o 