data_Co24Ge5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.6
_cell_length_b   7.6
_cell_length_c   7.6
_cell_angle_alpha   109.47
_cell_angle_beta   109.47
_cell_angle_gamma   109.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co24Ge5
_chemical_formula_sum   'Co24 Ge5'
_cell_volume   337.58
_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
  Co  Co0  1  0.8  0.28  0.2  1.0
  Co  Co1  1  0.2  0.28  0.8  1.0
  Co  Co2  1  0.8  0.5  0.8  1.0
  Co  Co3  1  0.58  0.11  0.58  1.0
  Co  Co4  1  0.8  0.2  0.28  1.0
  Co  Co5  1  0.2  0.8  0.28  1.0
  Co  Co6  1  0.58  0.58  0.11  1.0
  Co  Co7  1  0.8  0.8  0.5  1.0
  Co  Co8  1  0.11  0.58  0.58  1.0
  Co  Co9  1  0.5  0.8  0.8  1.0
  Co  Co10  1  0.28  0.8  0.2  1.0
  Co  Co11  1  0.28  0.2  0.8  1.0
  Co  Co12  1  0.77  0.02  0.23  1.0
  Co  Co13  1  0.23  0.02  0.77  1.0
  Co  Co14  1  0.16  0.37  0.16  1.0
  Co  Co15  1  0.23  0.76  0.23  1.0
  Co  Co16  1  0.77  0.23  0.02  1.0
  Co  Co17  1  0.23  0.77  0.02  1.0
  Co  Co18  1  0.23  0.23  0.76  1.0
  Co  Co19  1  0.16  0.16  0.37  1.0
  Co  Co20  1  0.76  0.23  0.23  1.0
  Co  Co21  1  0.37  0.16  0.16  1.0
  Co  Co22  1  0.02  0.77  0.23  1.0
  Co  Co23  1  0.02  0.23  0.77  1.0
  Ge  Ge24  1  0.34  0.66  0.66  1.0
  Ge  Ge25  1  0.66  0.66  0.34  1.0
  Ge  Ge26  1  0.72  0.72  0.72  1.0
  Ge  Ge27  1  0.66  0.34  0.66  1.0
  Ge  Ge28  1  0.0  0.0  0.0  1.0

data_Co24Ge5
_symmetry_space_group_name_H-M   R3m
_cell_length_a   12.41
_cell_length_b   12.41
_cell_length_c   7.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   Co24Ge5
_chemical_formula_sum   'Co72 Ge15'
_cell_volume   1012.74
_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
  Co  Co0  18  0.01  0.24  0.01  1.0
  Co  Co1  18  0.04  0.48  0.76  1.0
  Co  Co2  9  0.02  0.51  0.09  1.0
  Co  Co3  9  0.02  0.51  0.74  1.0
  Co  Co4  9  0.1  0.9  0.7  1.0
  Co  Co5  9  0.14  0.07  0.23  1.0
  Ge  Ge6  9  0.11  0.22  0.55  1.0
  Ge  Ge7  3  0.0  0.0  -0.0  1.0
  Ge  Ge8  3  0.0  0.0  0.72  1.0

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