data_Ce5Ge3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.9
_cell_length_b   8.9
_cell_length_c   6.22
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce5Ge3
_chemical_formula_sum   'Ce10 Ge6'
_cell_volume   426.79
_cell_formula_units_Z   2
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
  Ce  Ce0  1  0.45  0.57  0.11  1.0
  Ce  Ce1  1  0.0  0.14  0.0  1.0
  Ce  Ce2  1  0.0  0.14  0.11  1.0
  Ce  Ce3  1  0.45  0.57  0.0  1.0
  Ce  Ce4  1  0.73  0.66  0.66  1.0
  Ce  Ce5  1  0.37  0.0  0.55  1.0
  Ce  Ce6  1  0.27  0.66  0.55  1.0
  Ce  Ce7  1  0.18  0.05  0.66  1.0
  Ce  Ce8  1  0.53  0.0  0.66  1.0
  Ce  Ce9  1  0.82  0.05  0.55  1.0
  Ge  Ge10  1  0.31  0.93  0.66  1.0
  Ge  Ge11  1  0.52  0.0  0.55  1.0
  Ge  Ge12  1  0.69  0.93  0.55  1.0
  Ge  Ge13  1  0.76  0.78  0.66  1.0
  Ge  Ge14  1  0.38  0.0  0.66  1.0
  Ge  Ge15  1  0.24  0.78  0.55  1.0

data_Ce5Ge3
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.22
_cell_length_b   8.9
_cell_length_c   8.9
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce5Ge3
_chemical_formula_sum   'Ce10 Ge6'
_cell_volume   426.79
_cell_formula_units_Z   2
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
  Ce  Ce0  1  0.0  0.45  0.57  1.0
  Ce  Ce1  1  0.0  0.0  0.14  1.0
  Ce  Ce2  1  0.11  0.0  0.14  1.0
  Ce  Ce3  1  0.11  0.45  0.57  1.0
  Ce  Ce4  1  0.55  0.27  0.66  1.0
  Ce  Ce5  1  0.55  0.37  0.0  1.0
  Ce  Ce6  1  0.55  0.82  0.05  1.0
  Ce  Ce7  1  0.66  0.18  0.05  1.0
  Ce  Ce8  1  0.66  0.53  0.0  1.0
  Ce  Ce9  1  0.66  0.73  0.66  1.0
  Ge  Ge10  1  0.55  0.24  0.78  1.0
  Ge  Ge11  1  0.55  0.52  0.0  1.0
  Ge  Ge12  1  0.55  0.69  0.93  1.0
  Ge  Ge13  1  0.66  0.31  0.93  1.0
  Ge  Ge14  1  0.66  0.38  0.0  1.0
  Ge  Ge15  1  0.66  0.76  0.78  1.0

Ce Ce Ce Ce Ce Ce Ce Ce Ce Ce Ge Ge Ge Ge Ge Ge
Ce Ce Ce Ce Ce Ce Ce Ce Ce Ce Ge Ge Ge Ge Ge Ge 0 3 o o o 1 2 o o o 4 13 o o o 5 14 o o o 5 7 o o o 6 15 o o o 7 14 o o o 7 10 o - o 8 11 o o o 9 12 o - o 10 14 o + o 10 15 o o o 