data_Ba2CdAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.56
_cell_length_b   6.56
_cell_length_c   5.84
_cell_angle_alpha   104.59
_cell_angle_beta   104.59
_cell_angle_gamma   36.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2CdAg
_chemical_formula_sum   'Ba2 Cd1 Ag1'
_cell_volume   144.26
_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
  Ba  Ba1  1  0.16  0.0  0.42  1.0
  Ba  Ba2  1  0.83  0.0  0.83  1.0
  Cd  Cd3  1  0.17  0.0  0.01  1.0
  Ag  Ag0  1  0.22  0.0  0.18  1.0

data_Ba2CdAg
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.11
_cell_length_b   5.84
_cell_length_c   6.56
_cell_angle_alpha   104.59
_cell_angle_beta   108.25
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2CdAg
_chemical_formula_sum   'Ba2 Cd1 Ag1'
_cell_volume   144.26
_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
  Ba  Ba0  1  0.0  0.42  0.16  1.0
  Ba  Ba1  1  0.0  0.83  0.83  1.0
  Cd  Cd2  1  0.0  0.01  0.17  1.0
  Ag  Ag3  1  0.0  0.18  0.22  1.0

Ba Ba Cd Ag
Ba Ba Cd Ag 0 3 o o o 1 2 + o + 2 3 o o o 
Ba2AgCd crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one Ba2AgCd cluster. There are two inequivalent Ba sites. In the first Ba site, Ba(1) is bonded in a single-bond geometry to one Ag(1) atom. The Ba(1)-Ag(1) bond length is 1.55 Å. In the second Ba site, Ba(2) is bonded in a single-bond geometry to one Cd(1) atom. The Ba(2)-Cd(1) bond length is 2.19 Å. Ag(1) is bonded in a bent 150 degrees geometry to one Ba(1) and one Cd(1) atom. The Ag(1)-Cd(1) bond length is 0.97 Å. Cd(1) is bonded in a distorted bent 120 degrees geometry to one Ba(2) and one Ag(1) atom.