data_KLiSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69
_cell_length_b   4.69
_cell_length_c   5.03
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KLiSb2
_chemical_formula_sum   'K1 Li1 Sb2'
_cell_volume   110.75
_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
  K  K0  1  0.35  0.35  0.0  1.0
  Li  Li1  1  0.0  0.0  0.0  1.0
  Sb  Sb2  1  0.0  0.35  0.52  1.0
  Sb  Sb3  1  0.35  0.0  0.52  1.0

data_KLiSb2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.63
_cell_length_b   6.63
_cell_length_c   5.03
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   KLiSb2
_chemical_formula_sum   'K2 Li2 Sb4'
_cell_volume   221.51
_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
  K  K0  2  0.35  0.0  -0.0  1.0
  Li  Li1  2  0.0  0.0  0.0  1.0
  Sb  Sb2  4  0.17  0.17  0.52  1.0

K Li Sb Sb
K Li Sb Sb 0 1 o o o 2 3 o o o 
KLiSb2 crystallizes in the monoclinic Cm space group. K(1) is bonded in a 5-coordinate geometry to three equivalent Li(1) and four equivalent Sb(1) atoms. There is one shorter (2.29 Å) and two longer (3.47 Å) K(1)-Li(1) bond lengths. There are two shorter (2.92 Å) and two longer (3.06 Å) K(1)-Sb(1) bond lengths. Li(1) is bonded in a 7-coordinate geometry to three equivalent K(1) and four equivalent Sb(1) atoms. There are two shorter (2.92 Å) and two longer (3.06 Å) Li(1)-Sb(1) bond lengths. Sb(1) is bonded in a 5-coordinate geometry to two equivalent K(1), two equivalent Li(1), and one Sb(1) atom. The Sb(1)-Sb(1) bond length is 2.29 Å.