data_LiReMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.73
_cell_length_b   2.73
_cell_length_c   7.18
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiReMo
_chemical_formula_sum   'Li1 Re1 Mo1'
_cell_volume   46.51
_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  0.13  1.0
  Re  Re2  1  0.37  0.79  0.75  1.0
  Mo  Mo1  1  0.0  0.58  0.47  1.0

data_LiReMo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   2.73
_cell_length_c   7.18
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiReMo
_chemical_formula_sum   'Li1 Re1 Mo1'
_cell_volume   46.51
_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  0.13  1.0
  Re  Re1  1  0.37  0.79  0.75  1.0
  Mo  Mo2  1  -0.0  0.58  0.47  1.0

Li Re Mo
LiMoRe crystallizes in the triclinic P1 space group. Li(1) is bonded in a 11-coordinate geometry to six equivalent Li(1), two equivalent Mo(1), and three equivalent Re(1) atoms. All Li(1)-Li(1) bond lengths are 2.73 Å. There is one shorter (2.70 Å) and one longer (2.91 Å) Li(1)-Mo(1) bond length. There are a spread of Li(1)-Re(1) bond distances ranging from 3.05-3.30 Å. Mo(1) is bonded in a 3-coordinate geometry to two equivalent Li(1) and one Re(1) atom. The Mo(1)-Re(1) bond length is 2.21 Å. Re(1) is bonded in a 1-coordinate geometry to three equivalent Li(1) and one Mo(1) atom.