data_LiCo2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.3
_cell_length_b   3.3
_cell_length_c   5.54
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCo2Te
_chemical_formula_sum   'Li1 Co2 Te1'
_cell_volume   60.42
_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  Li2  1  0.0  0.0  0.64  1.0
  Co  Co0  1  0.0  0.0  0.16  1.0
  Co  Co1  1  0.65  0.65  0.26  1.0
  Te  Te3  1  0.65  0.65  0.24  1.0

data_LiCo2Te
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.67
_cell_length_b   4.67
_cell_length_c   5.54
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LiCo2Te
_chemical_formula_sum   'Li2 Co4 Te2'
_cell_volume   120.84
_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  0.64  1.0
  Co  Co1  2  0.0  0.0  0.16  1.0
  Co  Co2  2  0.15  0.5  0.26  1.0
  Te  Te3  2  0.15  0.5  0.24  1.0

Li Co Co Te
Li Co Co Te 0 3 - - o 0 3 - o o 0 3 o - o 0 2 - - o 0 2 - o o 0 2 o - o 0 0 + o o 0 0 o + o 0 1 o o o 0 1 o o + 1 3 - - o 1 2 - - o 2 3 o o o 
LiCo2Te crystallizes in the monoclinic Cm space group. Li(1) is bonded in a 3-coordinate geometry to one Co(2) and two equivalent Co(1) atoms. The Li(1)-Co(2) bond length is 2.66 Å. There is one shorter (2.69 Å) and one longer (2.85 Å) Li(1)-Co(1) bond length. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 5-coordinate geometry to two equivalent Li(1) and three equivalent Te(1) atoms. There is one shorter (1.69 Å) and two longer (2.48 Å) Co(1)-Te(1) bond lengths. In the second Co site, Co(2) is bonded in a single-bond geometry to one Li(1) and one Te(1) atom. The Co(2)-Te(1) bond length is 0.12 Å. Te(1) is bonded in a single-bond geometry to one Co(2) and three equivalent Co(1) atoms.