data_BaAgOs4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.44
_cell_length_b   5.44
_cell_length_c   5.44
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaAgOs4
_chemical_formula_sum   'Ba1 Ag1 Os4'
_cell_volume   113.99
_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  0.92  0.92  0.92  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.88  0.88  0.82  1.0
  Os  Os3  1  0.88  0.82  0.88  1.0
  Os  Os4  1  0.82  0.88  0.88  1.0
  Os  Os5  1  0.82  0.82  0.82  1.0

data_BaAgOs4
_symmetry_space_group_name_H-M   R3m
_cell_length_a   5.44
_cell_length_b   5.44
_cell_length_c   13.33
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   BaAgOs4
_chemical_formula_sum   'Ba3 Ag3 Os12'
_cell_volume   341.98
_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
  Ba  Ba0  3  0.0  0.0  0.08  1.0
  Ag  Ag1  3  0.0  0.0  0.0  1.0
  Os  Os2  9  0.04  0.02  0.14  1.0
  Os  Os3  3  0.0  0.0  0.18  1.0

Ba Ag Os Os Os Os
BaOs4Ag is Copper structured and crystallizes in the trigonal R3m space group. The structure is zero-dimensional and consists of three BaOs4Ag clusters. Ba(1) is bonded in a distorted rectangular see-saw-like geometry to three equivalent Os(1) and one Ag(1) atom. All Ba(1)-Os(1) bond lengths are 0.89 Å. The Ba(1)-Ag(1) bond length is 1.01 Å. There are two inequivalent Os sites. In the first Os site, Os(2) is bonded in a 3-coordinate geometry to three equivalent Os(1) atoms. All Os(2)-Os(1) bond lengths are 0.59 Å. In the second Os site, Os(1) is bonded in a 4-coordinate geometry to one Ba(1), one Os(2), and two equivalent Os(1) atoms. Both Os(1)-Os(1) bond lengths are 0.34 Å. Ag(1) is bonded in a single-bond geometry to one Ba(1) atom.