data_Ge5Ir4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.68
_cell_length_b   7.68
_cell_length_c   5.67
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge5Ir4
_chemical_formula_sum   'Ge10 Ir8'
_cell_volume   289.46
_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
  Ge  Ge0  1  0.79  0.84  0.25  1.0
  Ge  Ge1  1  0.09  0.0  0.25  1.0
  Ge  Ge2  1  0.95  0.81  0.25  1.0
  Ge  Ge3  1  0.05  0.81  0.42  1.0
  Ge  Ge4  1  0.58  0.0  0.42  1.0
  Ge  Ge5  1  0.21  0.84  0.42  1.0
  Ge  Ge6  1  0.0  0.43  0.84  1.0
  Ge  Ge7  1  0.84  0.22  0.0  1.0
  Ge  Ge8  1  0.84  0.22  0.84  1.0
  Ge  Ge9  1  0.0  0.43  0.0  1.0
  Ir  Ir10  1  0.0  0.0  0.84  1.0
  Ir  Ir11  1  0.0  0.0  0.0  1.0
  Ir  Ir12  1  0.59  0.75  0.25  1.0
  Ir  Ir13  1  0.5  0.0  0.25  1.0
  Ir  Ir14  1  0.75  0.89  0.25  1.0
  Ir  Ir15  1  0.25  0.89  0.42  1.0
  Ir  Ir16  1  0.18  0.0  0.42  1.0
  Ir  Ir17  1  0.41  0.75  0.42  1.0

data_Ge5Ir4
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.67
_cell_length_b   7.68
_cell_length_c   7.68
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge5Ir4
_chemical_formula_sum   'Ge10 Ir8'
_cell_volume   289.46
_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
  Ge  Ge0  1  -0.0  0.84  0.22  1.0
  Ge  Ge1  1  -0.0  0.0  0.43  1.0
  Ge  Ge2  1  0.25  0.09  0.0  1.0
  Ge  Ge3  1  0.25  0.79  0.84  1.0
  Ge  Ge4  1  0.25  0.95  0.81  1.0
  Ge  Ge5  1  0.42  0.05  0.81  1.0
  Ge  Ge6  1  0.42  0.21  0.84  1.0
  Ge  Ge7  1  0.42  0.58  0.0  1.0
  Ge  Ge8  1  0.84  0.0  0.43  1.0
  Ge  Ge9  1  0.84  0.84  0.22  1.0
  Ir  Ir10  1  0.0  0.0  0.0  1.0
  Ir  Ir11  1  0.25  0.5  0.0  1.0
  Ir  Ir12  1  0.25  0.59  0.75  1.0
  Ir  Ir13  1  0.25  0.75  0.89  1.0
  Ir  Ir14  1  0.42  0.18  0.0  1.0
  Ir  Ir15  1  0.42  0.25  0.89  1.0
  Ir  Ir16  1  0.42  0.41  0.75  1.0
  Ir  Ir17  1  0.84  0.0  0.0  1.0

Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ir Ir Ir Ir Ir Ir Ir Ir
Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ir Ir Ir Ir Ir Ir Ir Ir 0 14 o o o 0 2 o o o 0 12 o o o 1 2 - - o 1 16 o o o 2 3 + o o 3 16 o + o 3 15 o o o 3 5 o o o 4 13 o o o 4 17 o - o 5 15 o o o 5 16 o + o 5 17 o o o 6 9 o o + 7 8 o o - 10 11 o o + 12 14 o o o 12 17 o o o 13 17 o - o 15 16 o + o 15 17 o o o 