data_Cd2Ge
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98
_cell_length_b   6.73
_cell_length_c   3.91
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2Ge
_chemical_formula_sum   'Cd4 Ge2'
_cell_volume   157.36
_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
  Cd  Cd0  1  0.27  0.32  0.0  1.0
  Cd  Cd1  1  0.71  0.4  0.0  1.0
  Cd  Cd2  1  0.26  0.76  0.96  1.0
  Cd  Cd3  1  0.72  0.96  0.96  1.0
  Ge  Ge4  1  0.0  0.0  0.0  1.0
  Ge  Ge5  1  0.99  0.36  0.96  1.0

data_Cd2Ge
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.91
_cell_length_b   5.98
_cell_length_c   6.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2Ge
_chemical_formula_sum   'Cd4 Ge2'
_cell_volume   157.36
_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
  Cd  Cd0  1  0.0  0.27  0.32  1.0
  Cd  Cd1  1  0.0  0.71  0.4  1.0
  Cd  Cd2  1  0.96  0.26  0.76  1.0
  Cd  Cd3  1  0.96  0.72  0.96  1.0
  Ge  Ge4  1  0.0  0.0  0.0  1.0
  Ge  Ge5  1  0.96  0.99  0.36  1.0

Cd Cd Cd Cd Ge Ge