data_CdCoB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.53
_cell_length_b   4.53
_cell_length_c   4.53
_cell_angle_alpha   136.99
_cell_angle_beta   136.99
_cell_angle_gamma   62.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdCoB2
_chemical_formula_sum   'Cd1 Co1 B2'
_cell_volume   42.7
_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  Cd2  1  0.66  0.0  0.94  1.0
  Co  Co3  1  0.0  0.0  0.87  1.0
  B  B0  1  0.0  0.66  0.94  1.0
  B  B1  1  0.0  0.0  0.0  1.0

data_CdCoB2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.32
_cell_length_b   3.32
_cell_length_c   4.53
_cell_angle_alpha   111.5
_cell_angle_beta   111.5
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdCoB2
_chemical_formula_sum   'Cd1 Co1 B2'
_cell_volume   42.7
_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  0.06  0.0  0.72  1.0
  Co  Co1  1  0.13  0.0  0.13  1.0
  B  B2  1  0.0  0.0  0.0  1.0
  B  B3  1  0.72  0.66  0.72  1.0

Cd Co B B
CoCdB2 crystallizes in the triclinic P1 space group. Co(1) is bonded in a single-bond geometry to one B(1) and one B(2) atom. The Co(1)-B(1) bond length is 2.79 Å. The Co(1)-B(2) bond length is 0.58 Å. Cd(1) is bonded in a 1-coordinate geometry to one B(2) and three equivalent B(1) atoms. The Cd(1)-B(2) bond length is 1.34 Å. There is one shorter (1.60 Å) and two longer (2.47 Å) Cd(1)-B(1) bond lengths. There are two inequivalent B sites. In the first B site, B(1) is bonded in a 5-coordinate geometry to one Co(1), three equivalent Cd(1), and one B(2) atom. The B(1)-B(2) bond length is 1.34 Å. In the second B site, B(2) is bonded in a 3-coordinate geometry to one Co(1), one Cd(1), and one B(1) atom.