data_Cd3Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.87
_cell_length_b   4.91
_cell_length_c   5.29
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3Os
_chemical_formula_sum   'Cd3 Os1'
_cell_volume   74.54
_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  0.43  0.0  0.09  1.0
  Cd  Cd1  1  0.0  0.0  0.63  1.0
  Cd  Cd2  1  0.0  0.46  0.36  1.0
  Os  Os3  1  0.43  0.46  0.73  1.0

data_Cd3Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   4.91
_cell_length_c   5.29
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3Os
_chemical_formula_sum   'Cd3 Os1'
_cell_volume   74.54
_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  0.0  0.0  0.63  1.0
  Cd  Cd1  1  0.0  0.46  0.36  1.0
  Cd  Cd2  1  0.43  0.0  0.09  1.0
  Os  Os3  1  0.43  0.46  0.73  1.0

Cd Cd Cd Os
OsCd3 crystallizes in the triclinic P1 space group. Os(1) is bonded in a 3-coordinate geometry to two equivalent Cd(1), two equivalent Cd(3), and four equivalent Cd(2) atoms. There is one shorter (2.94 Å) and one longer (3.29 Å) Os(1)-Cd(1) bond length. There is one shorter (2.30 Å) and one longer (2.52 Å) Os(1)-Cd(3) bond length. There are a spread of Os(1)-Cd(2) bond distances ranging from 2.61-3.17 Å. There are three inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 12-coordinate geometry to two equivalent Os(1), two equivalent Cd(1), four equivalent Cd(2), and four equivalent Cd(3) atoms. Both Cd(1)-Cd(1) bond lengths are 2.87 Å. There are a spread of Cd(1)-Cd(2) bond distances ranging from 2.73-3.29 Å. There are a spread of Cd(1)-Cd(3) bond distances ranging from 2.94-3.45 Å. In the second Cd site, Cd(2) is bonded in a 12-coordinate geometry to four equivalent Os(1), two equivalent Cd(2), two equivalent Cd(3), and four equivalent Cd(1) atoms. Both Cd(2)-Cd(2) bond lengths are 2.87 Å. There is one shorter (2.65 Å) and one longer (3.03 Å) Cd(2)-Cd(3) bond length. In the third Cd site, Cd(3) is bonded in a 2-coordinate geometry to two equivalent Os(1), two equivalent Cd(2), and four equivalent Cd(1) atoms.