data_LiSbP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.61
_cell_length_b   4.61
_cell_length_c   7.64
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiSbP
_chemical_formula_sum   'Li2 Sb2 P2'
_cell_volume   140.42
_cell_formula_units_Z   2
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  0.82  1.0
  Li  Li1  1  0.0  0.0  0.0  1.0
  Sb  Sb4  1  0.0  0.66  0.73  1.0
  Sb  Sb5  1  0.3  0.33  0.91  1.0
  P  P2  1  0.3  0.33  0.73  1.0
  P  P3  1  0.0  0.66  0.91  1.0

data_LiSbP
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.61
_cell_length_b   4.61
_cell_length_c   7.64
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiSbP
_chemical_formula_sum   'Li2 Sb2 P2'
_cell_volume   140.42
_cell_formula_units_Z   2
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
  Li  Li1  1  0.0  0.0  0.82  1.0
  Sb  Sb2  1  0.0  0.66  0.73  1.0
  Sb  Sb3  1  0.3  0.33  0.91  1.0
  P  P4  1  0.0  0.66  0.91  1.0
  P  P5  1  0.3  0.33  0.73  1.0

Li Li Sb Sb P P
Li Li Sb Sb P P 0 2 o - o 0 5 o - o 0 4 o o o 0 1 o o + 0 3 o o o 1 3 o o - 2 5 o o o 3 4 o o o 
LiSbP is Indium-like structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one LiSbP cluster. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a 5-coordinate geometry to one Li(2), one Sb(1), one Sb(2), one P(1), and one P(2) atom. The Li(1)-Li(2) bond length is 1.37 Å. The Li(1)-Sb(1) bond length is 1.71 Å. The Li(1)-Sb(2) bond length is 1.61 Å. The Li(1)-P(1) bond length is 1.61 Å. The Li(1)-P(2) bond length is 1.71 Å. In the second Li site, Li(2) is bonded in a 3-coordinate geometry to one Li(1), one Sb(2), and one P(2) atom. The Li(2)-Sb(2) bond length is 1.61 Å. The Li(2)-P(2) bond length is 1.71 Å. There are two inequivalent Sb sites. In the first Sb site, Sb(1) is bonded in a 2-coordinate geometry to one Li(1) and one P(2) atom. The Sb(1)-P(2) bond length is 1.37 Å. In the second Sb site, Sb(2) is bonded in a 3-coordinate geometry to one Li(1), one Li(2), and one P(1) atom. The Sb(2)-P(1) bond length is 1.37 Å. There are two inequivalent P sites. In the first P site, P(1) is bonded in a 2-coordinate geometry to one Li(1) and one Sb(2) atom. In the second P site, P(2) is bonded in a 3-coordinate geometry to one Li(1), one Li(2), and one Sb(1) atom.