data_Cd2CoMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.8
_cell_length_b   2.8
_cell_length_c   8.42
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2CoMo
_chemical_formula_sum   'Cd2 Co1 Mo1'
_cell_volume   65.79
_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  0.4  0.4  0.51  1.0
  Cd  Cd1  1  0.4  0.4  0.91  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Mo  Mo3  1  0.0  0.0  0.21  1.0

data_Cd2CoMo
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.95
_cell_length_b   3.95
_cell_length_c   8.42
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Cd2CoMo
_chemical_formula_sum   'Cd4 Co2 Mo2'
_cell_volume   131.57
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.4  0.0  0.51  1.0
  Cd  Cd1  2  0.4  0.0  0.91  1.0
  Co  Co2  2  0.0  0.0  0.0  1.0
  Mo  Mo3  2  0.0  0.0  0.21  1.0

Cd Cd Co Mo
MoCoCd2 crystallizes in the monoclinic Cm space group. Mo(1) is bonded in a single-bond geometry to one Co(1) and four equivalent Cd(1) atoms. The Mo(1)-Co(1) bond length is 1.77 Å. There are a spread of Mo(1)-Cd(1) bond distances ranging from 2.97-3.47 Å. Co(1) is bonded in a 5-coordinate geometry to one Mo(1) and four equivalent Cd(2) atoms. There are a spread of Co(1)-Cd(2) bond distances ranging from 1.74-2.50 Å. There are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 9-coordinate geometry to four equivalent Mo(1), one Cd(2), and four equivalent Cd(1) atoms. The Cd(1)-Cd(2) bond length is 3.37 Å. All Cd(1)-Cd(1) bond lengths are 2.80 Å. In the second Cd site, Cd(2) is bonded in a 4-coordinate geometry to four equivalent Co(1) and one Cd(1) atom.