data_InCo4Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.8
_cell_length_b   4.8
_cell_length_c   4.8
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InCo4Ru
_chemical_formula_sum   'In1 Co4 Ru1'
_cell_volume   78.29
_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  In4  1  0.09  0.09  0.09  1.0
  Co  Co0  1  0.24  0.24  0.55  1.0
  Co  Co1  1  0.24  0.55  0.24  1.0
  Co  Co2  1  0.55  0.24  0.24  1.0
  Co  Co3  1  0.55  0.55  0.55  1.0
  Ru  Ru5  1  0.0  0.0  0.0  1.0

data_InCo4Ru
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.8
_cell_length_b   4.8
_cell_length_c   11.76
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   InCo4Ru
_chemical_formula_sum   'In3 Co12 Ru3'
_cell_volume   234.86
_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+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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  3  0.0  0.0  0.91  1.0
  Co  Co1  9  0.1  0.2  0.65  1.0
  Co  Co2  3  0.0  0.0  0.45  1.0
  Ru  Ru3  3  0.0  0.0  0.0  1.0

In Co Co Co Co Ru
In Co Co Co Co Ru 0 5 o o o 0 4 o o - 0 4 o - o 0 4 - o o 1 3 o o o 1 2 o o o 1 4 o o o 1 4 o - o 1 4 - o o 2 3 o o o 2 4 o o o 2 4 o o - 2 4 - o o 3 4 o o o 3 4 o o - 3 4 o - o 4 5 o + + 4 5 + o + 4 5 + + o 
RuCo4In crystallizes in the trigonal R3m space group. Ru(1) is bonded in a single-bond geometry to three equivalent Co(1), three equivalent Co(2), and one In(1) atom. All Ru(1)-Co(1) bond lengths are 1.94 Å. All Ru(1)-Co(2) bond lengths are 3.11 Å. The Ru(1)-In(1) bond length is 1.09 Å. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 3-coordinate geometry to one Ru(1), two equivalent Co(1), and three equivalent Co(2) atoms. Both Co(1)-Co(1) bond lengths are 1.45 Å. There is one shorter (2.51 Å) and two longer (2.91 Å) Co(1)-Co(2) bond lengths. In the second Co site, Co(2) is bonded in a 15-coordinate geometry to three equivalent Ru(1), nine equivalent Co(1), and three equivalent In(1) atoms. All Co(2)-In(1) bond lengths are 3.11 Å. In(1) is bonded in a single-bond geometry to one Ru(1) and three equivalent Co(2) atoms.