data_CdInGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.89
_cell_length_b   7.68
_cell_length_c   3.17
_cell_angle_alpha   82.11
_cell_angle_beta   74.46
_cell_angle_gamma   23.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdInGe
_chemical_formula_sum   'Cd1 In1 Ge1'
_cell_volume   70.53
_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
  Cd  Cd0  1  0.83  0.59  0.11  1.0
  In  In2  1  0.83  0.59  0.91  1.0
  Ge  Ge1  1  0.83  0.59  0.89  1.0

data_CdInGe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.66
_cell_length_b   14.91
_cell_length_c   3.17
_cell_angle_alpha   90.0
_cell_angle_beta   125.23
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   CdInGe
_chemical_formula_sum   'Cd2 In2 Ge2'
_cell_volume   141.06
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.11  0.0  0.94  1.0
  In  In1  2  0.41  0.5  0.74  1.0
  Ge  Ge2  2  0.39  0.5  0.72  1.0

Cd In Ge
Cd In Ge 0 2 o o - 0 1 o o - 1 2 o o o 