data_In24C5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.24
_cell_length_b   10.24
_cell_length_c   10.24
_cell_angle_alpha   109.47
_cell_angle_beta   109.47
_cell_angle_gamma   109.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In24C5
_chemical_formula_sum   'In24 C5'
_cell_volume   826.73
_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
  In  In5  1  0.17  0.43  0.17  1.0
  In  In6  1  0.74  0.51  0.74  1.0
  In  In7  1  0.17  0.4  0.83  1.0
  In  In8  1  0.83  0.4  0.17  1.0
  In  In9  1  0.17  0.17  0.43  1.0
  In  In10  1  0.74  0.74  0.51  1.0
  In  In11  1  0.83  0.17  0.4  1.0
  In  In12  1  0.17  0.83  0.4  1.0
  In  In13  1  0.43  0.17  0.17  1.0
  In  In14  1  0.51  0.74  0.74  1.0
  In  In15  1  0.4  0.83  0.17  1.0
  In  In16  1  0.4  0.17  0.83  1.0
  In  In17  1  0.23  0.53  0.23  1.0
  In  In18  1  0.68  0.45  0.68  1.0
  In  In19  1  0.32  0.38  0.68  1.0
  In  In20  1  0.68  0.38  0.32  1.0
  In  In21  1  0.23  0.23  0.53  1.0
  In  In22  1  0.68  0.68  0.45  1.0
  In  In23  1  0.68  0.32  0.38  1.0
  In  In24  1  0.32  0.68  0.38  1.0
  In  In25  1  0.53  0.23  0.23  1.0
  In  In26  1  0.45  0.68  0.68  1.0
  In  In27  1  0.38  0.68  0.32  1.0
  In  In28  1  0.38  0.32  0.68  1.0
  C  C0  1  0.9  0.9  0.9  1.0
  C  C1  1  0.01  0.99  0.01  1.0
  C  C2  1  0.99  0.01  0.01  1.0
  C  C3  1  0.01  0.01  0.99  1.0
  C  C4  1  0.0  0.0  0.0  1.0

data_In24C5
_symmetry_space_group_name_H-M   R3m
_cell_length_a   16.72
_cell_length_b   16.72
_cell_length_c   10.24
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   In24C5
_chemical_formula_sum   'In72 C15'
_cell_volume   2480.2
_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
  In  In0  18  0.03  0.4  0.8  1.0
  In  In1  18  0.2  0.45  0.13  1.0
  In  In2  9  0.08  0.15  0.67  1.0
  In  In3  9  0.08  0.15  0.6  1.0
  In  In4  9  0.17  0.09  0.25  1.0
  In  In5  9  0.2  0.1  0.33  1.0
  C  C6  9  0.01  0.01  0.0  1.0
  C  C7  3  0.0  0.0  0.0  1.0
  C  C8  3  0.0  0.0  0.9  1.0

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