data_Cr5Ge24
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.88
_cell_length_b   8.88
_cell_length_c   8.88
_cell_angle_alpha   109.47
_cell_angle_beta   109.47
_cell_angle_gamma   109.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr5Ge24
_chemical_formula_sum   'Cr5 Ge24'
_cell_volume   539.51
_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  0.48  0.52  0.48  1.0
  Cr  Cr1  1  0.52  0.48  0.48  1.0
  Cr  Cr2  1  0.48  0.48  0.52  1.0
  Cr  Cr3  1  0.64  0.64  0.64  1.0
  Cr  Cr4  1  0.0  0.0  0.0  1.0
  Ge  Ge5  1  0.91  0.09  0.79  1.0
  Ge  Ge6  1  0.09  0.91  0.79  1.0
  Ge  Ge7  1  0.91  0.91  0.46  1.0
  Ge  Ge8  1  0.22  0.22  0.34  1.0
  Ge  Ge9  1  0.91  0.46  0.91  1.0
  Ge  Ge10  1  0.22  0.34  0.22  1.0
  Ge  Ge11  1  0.09  0.79  0.91  1.0
  Ge  Ge12  1  0.91  0.79  0.09  1.0
  Ge  Ge13  1  0.79  0.09  0.91  1.0
  Ge  Ge14  1  0.79  0.91  0.09  1.0
  Ge  Ge15  1  0.34  0.22  0.22  1.0
  Ge  Ge16  1  0.46  0.91  0.91  1.0
  Ge  Ge17  1  0.58  0.42  0.7  1.0
  Ge  Ge18  1  0.42  0.58  0.7  1.0
  Ge  Ge19  1  0.7  0.7  0.43  1.0
  Ge  Ge20  1  0.42  0.42  0.56  1.0
  Ge  Ge21  1  0.7  0.43  0.7  1.0
  Ge  Ge22  1  0.42  0.56  0.42  1.0
  Ge  Ge23  1  0.42  0.7  0.58  1.0
  Ge  Ge24  1  0.58  0.7  0.42  1.0
  Ge  Ge25  1  0.7  0.42  0.58  1.0
  Ge  Ge26  1  0.7  0.58  0.42  1.0
  Ge  Ge27  1  0.56  0.42  0.42  1.0
  Ge  Ge28  1  0.43  0.7  0.7  1.0

data_Cr5Ge24
_symmetry_space_group_name_H-M   R3m
_cell_length_a   14.51
_cell_length_b   14.51
_cell_length_c   8.88
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   Cr5Ge24
_chemical_formula_sum   'Cr15 Ge72'
_cell_volume   1618.52
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+2/3, y+1/3, z+1/3'
  8  '-y+2/3, x-y+1/3, z+1/3'
  9  '-x+y+2/3, -x+1/3, z+1/3'
  10  '-y+2/3, -x+1/3, z+1/3'
  11  '-x+y+2/3, y+1/3, z+1/3'
  12  'x+2/3, x-y+1/3, z+1/3'
  13  'x+1/3, y+2/3, z+2/3'
  14  '-y+1/3, x-y+2/3, z+2/3'
  15  '-x+y+1/3, -x+2/3, z+2/3'
  16  '-y+1/3, -x+2/3, z+2/3'
  17  '-x+y+1/3, y+2/3, z+2/3'
  18  'x+1/3, x-y+2/3, z+2/3'
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  9  0.02  0.01  0.49  1.0
  Cr  Cr1  3  0.0  0.0  0.0  1.0
  Cr  Cr2  3  0.0  0.0  0.64  1.0
  Ge  Ge3  18  0.01  0.14  0.57  1.0
  Ge  Ge4  18  0.16  0.02  0.93  1.0
  Ge  Ge5  9  0.04  0.52  0.43  1.0
  Ge  Ge6  9  0.08  0.04  0.26  1.0
  Ge  Ge7  9  0.09  0.04  0.47  1.0
  Ge  Ge8  9  0.09  0.18  0.61  1.0

Cr Cr Cr Cr Cr Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge
Cr Cr Cr Cr Cr Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge Ge 0 2 o o o 0 1 o o o 0 3 o o o 0 22 o o o 1 2 o o o 1 3 o o o 1 27 o o o 2 3 o o o 2 20 o o o 4 14 - - o 4 13 - o - 4 5 - o - 4 11 o - - 4 6 o - - 4 12 - - o 4 15 o o o 4 10 o o o 4 8 o o o 5 13 o o o 6 11 o o o 7 19 o o o 8 10 o o o 8 15 o o o 8 20 o o o 9 21 o o o 10 15 o o o 10 22 o o o 12 14 o o o 15 27 o o o 16 28 o o o 17 21 o o o 18 28 o o o 19 24 o o o 19 26 o o o 21 25 o o o 23 28 o o o 