data_LiGeMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.78
_cell_length_b   3.78
_cell_length_c   4.11
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiGeMo2
_chemical_formula_sum   'Li1 Ge1 Mo2'
_cell_volume   58.65
_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  Li1  1  0.0  0.0  0.0  1.0
  Ge  Ge0  1  0.89  0.89  0.0  1.0
  Mo  Mo2  1  0.0  0.89  0.06  1.0
  Mo  Mo3  1  0.89  0.0  0.06  1.0

data_LiGeMo2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.34
_cell_length_b   5.34
_cell_length_c   4.11
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LiGeMo2
_chemical_formula_sum   'Li2 Ge2 Mo4'
_cell_volume   117.31
_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
  Li  Li0  2  0.0  0.0  0.0  1.0
  Ge  Ge1  2  0.39  0.5  0.0  1.0
  Mo  Mo2  4  0.44  0.44  0.06  1.0

Li Ge Mo Mo
Li Ge Mo Mo 0 3 - o o 0 2 o - o 1 2 + o o 1 3 o + o 
LiMo2Ge is alpha Po structured and crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two LiMo2Ge clusters. Li(1) is bonded in a 2-coordinate geometry to two equivalent Mo(1) and one Ge(1) atom. Both Li(1)-Mo(1) bond lengths are 0.48 Å. The Li(1)-Ge(1) bond length is 0.60 Å. Mo(1) is bonded in a 2-coordinate geometry to one Li(1) and one Ge(1) atom. The Mo(1)-Ge(1) bond length is 0.48 Å. Ge(1) is bonded in a 3-coordinate geometry to one Li(1) and two equivalent Mo(1) atoms.