data_Hf2AgOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.22
_cell_length_b   3.22
_cell_length_c   7.17
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2AgOs
_chemical_formula_sum   'Hf2 Ag1 Os1'
_cell_volume   74.48
_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
  Hf  Hf1  1  0.61  0.61  0.95  1.0
  Hf  Hf2  1  0.61  0.61  0.23  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.0  0.59  1.0

data_Hf2AgOs
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.56
_cell_length_b   4.56
_cell_length_c   7.17
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Hf2AgOs
_chemical_formula_sum   'Hf4 Ag2 Os2'
_cell_volume   148.96
_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
  Hf  Hf0  2  0.11  0.5  0.23  1.0
  Hf  Hf1  2  0.11  0.5  0.95  1.0
  Ag  Ag2  2  0.0  0.0  0.0  1.0
  Os  Os3  2  0.0  0.0  0.59  1.0

Hf Hf Ag Os
Hf2OsAg crystallizes in the monoclinic Cm space group. There are two inequivalent Hf sites. In the first Hf site, Hf(1) is bonded in a 1-coordinate geometry to one Hf(2), four equivalent Os(1), and one Ag(1) atom. The Hf(1)-Hf(2) bond length is 2.01 Å. There are a spread of Hf(1)-Os(1) bond distances ranging from 3.13-3.80 Å. The Hf(1)-Ag(1) bond length is 1.81 Å. In the second Hf site, Hf(2) is bonded in a 13-coordinate geometry to one Hf(1), four equivalent Hf(2), four equivalent Os(1), and four equivalent Ag(1) atoms. All Hf(2)-Hf(2) bond lengths are 3.22 Å. There are a spread of Hf(2)-Os(1) bond distances ranging from 3.13-3.80 Å. There are a spread of Hf(2)-Ag(1) bond distances ranging from 2.40-3.22 Å. Os(1) is bonded in a 13-coordinate geometry to four equivalent Hf(1), four equivalent Hf(2), four equivalent Os(1), and one Ag(1) atom. All Os(1)-Os(1) bond lengths are 3.22 Å. The Os(1)-Ag(1) bond length is 2.97 Å. Ag(1) is bonded in a 1-coordinate geometry to one Hf(1), four equivalent Hf(2), and one Os(1) atom.