data_LiRe2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.06
_cell_length_b   5.06
_cell_length_c   5.06
_cell_angle_alpha   145.87
_cell_angle_beta   128.5
_cell_angle_gamma   63.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiRe2Os
_chemical_formula_sum   'Li1 Re2 Os1'
_cell_volume   56.38
_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
  Li  Li0  1  0.0  0.0  0.33  1.0
  Re  Re2  1  0.0  0.0  0.01  1.0
  Re  Re3  1  0.49  0.0  0.12  1.0
  Os  Os1  1  0.0  0.2  0.17  1.0

data_LiRe2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.97
_cell_length_b   4.4
_cell_length_c   5.06
_cell_angle_alpha   115.75
_cell_angle_beta   107.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiRe2Os
_chemical_formula_sum   'Li1 Re2 Os1'
_cell_volume   56.38
_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
  Li  Li0  1  0.0  0.33  0.33  1.0
  Re  Re1  1  0.0  0.01  0.01  1.0
  Re  Re2  1  0.0  0.12  0.63  1.0
  Os  Os3  1  0.8  0.97  0.97  1.0

Li Re Re Os
LiRe2Os crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one LiRe2Os cluster. Li(1) is bonded in a 3-coordinate geometry to one Re(1), one Re(2), and one Os(1) atom. The Li(1)-Re(1) bond length is 1.60 Å. The Li(1)-Re(2) bond length is 2.11 Å. The Li(1)-Os(1) bond length is 1.71 Å. There are two inequivalent Re sites. In the first Re site, Re(1) is bonded in a distorted single-bond geometry to one Li(1) and one Os(1) atom. The Re(1)-Os(1) bond length is 0.57 Å. In the second Re site, Re(2) is bonded in a distorted single-bond geometry to one Li(1) atom. Os(1) is bonded in a single-bond geometry to one Li(1) and one Re(1) atom.