data_LiTe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.0
_cell_length_b   4.06
_cell_length_c   5.69
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTe2P
_chemical_formula_sum   'Li1 Te2 P1'
_cell_volume   92.33
_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  0.0  1.0
  Te  Te2  1  1.0  0.03  0.0  1.0
  Te  Te3  1  1.0  0.0  0.84  1.0
  P  P1  1  0.0  0.03  0.84  1.0

data_LiTe2P
_symmetry_space_group_name_H-M   Pm
_cell_length_a   4.06
_cell_length_b   4.0
_cell_length_c   5.69
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   LiTe2P
_chemical_formula_sum   'Li1 Te2 P1'
_cell_volume   92.33
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.0  1.0
  Te  Te1  1  0.0  0.0  0.84  1.0
  Te  Te2  1  0.03  0.0  0.0  1.0
  P  P3  1  0.03  0.0  0.84  1.0

Li Te Te P
Li Te Te P 0 1 - o o 2 3 + o o 
LiPTe2 is Indium-like structured and crystallizes in the monoclinic Pm space group. The structure is zero-dimensional and consists of one LiPTe2 cluster. Li(1) is bonded in a single-bond geometry to one Te(1) and one Te(2) atom. The Li(1)-Te(1) bond length is 0.12 Å. The Li(1)-Te(2) bond length is 0.89 Å. P(1) is bonded in a single-bond geometry to one Te(2) atom. The P(1)-Te(2) bond length is 0.12 Å. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a single-bond geometry to one Li(1) atom. In the second Te site, Te(2) is bonded in an L-shaped geometry to one Li(1) and one P(1) atom.