data_CdCo4Tc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.81
_cell_length_b   4.81
_cell_length_c   4.81
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdCo4Tc
_chemical_formula_sum   'Cd1 Co4 Tc1'
_cell_volume   78.64
_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
  Cd  Cd0  1  0.1  0.1  0.1  1.0
  Co  Co1  1  0.25  0.55  0.25  1.0
  Co  Co2  1  0.55  0.25  0.25  1.0
  Co  Co3  1  0.55  0.55  0.55  1.0
  Co  Co4  1  0.25  0.25  0.55  1.0
  Tc  Tc5  1  0.0  0.0  0.0  1.0

data_CdCo4Tc
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.81
_cell_length_b   4.81
_cell_length_c   11.78
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   CdCo4Tc
_chemical_formula_sum   'Cd3 Co12 Tc3'
_cell_volume   235.93
_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
  Cd  Cd0  3  0.0  0.0  0.9  1.0
  Co  Co1  9  0.1  0.2  0.65  1.0
  Co  Co2  3  0.0  0.0  0.45  1.0
  Tc  Tc3  3  0.0  0.0  0.0  1.0

Cd Co Co Co Co Tc
TcCo4Cd crystallizes in the trigonal R3m space group. Tc(1) is bonded in a single-bond geometry to three equivalent Co(1), three equivalent Co(2), and one Cd(1) atom. All Tc(1)-Co(1) bond lengths are 1.97 Å. All Tc(1)-Co(2) bond lengths are 3.11 Å. The Tc(1)-Cd(1) bond length is 1.19 Å. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 4-coordinate geometry to one Tc(1), two equivalent Co(1), three equivalent Co(2), and one Cd(1) atom. Both Co(1)-Co(1) bond lengths are 1.42 Å. There is one shorter (2.45 Å) and two longer (2.95 Å) Co(1)-Co(2) bond lengths. The Co(1)-Cd(1) bond length is 2.19 Å. In the second Co site, Co(2) is bonded in a 15-coordinate geometry to three equivalent Tc(1), nine equivalent Co(1), and three equivalent Cd(1) atoms. All Co(2)-Cd(1) bond lengths are 3.08 Å. Cd(1) is bonded in a single-bond geometry to one Tc(1), three equivalent Co(1), and three equivalent Co(2) atoms.