data_KLiCdMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17
_cell_length_b   5.17
_cell_length_c   5.17
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KLiCdMo
_chemical_formula_sum   'K1 Li1 Cd1 Mo1'
_cell_volume   97.69
_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  K1  1  0.83  0.83  0.83  1.0
  Li  Li2  1  0.0  0.0  0.0  1.0
  Cd  Cd0  1  0.48  0.48  0.48  1.0
  Mo  Mo3  1  0.66  0.66  0.66  1.0

data_KLiCdMo
_symmetry_space_group_name_H-M   R3m
_cell_length_a   5.17
_cell_length_b   5.17
_cell_length_c   12.66
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   KLiCdMo
_chemical_formula_sum   'K3 Li3 Cd3 Mo3'
_cell_volume   293.08
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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  3  0.0  0.0  0.17  1.0
  Li  Li1  3  0.0  0.0  0.0  1.0
  Cd  Cd2  3  0.0  0.0  0.52  1.0
  Mo  Mo3  3  0.0  0.0  0.34  1.0

K Li Cd Mo
KLiMoCd crystallizes in the trigonal R3m space group. K(1) is bonded in a 5-coordinate geometry to one Li(1), one Mo(1), and three equivalent Cd(1) atoms. The K(1)-Li(1) bond length is 2.18 Å. The K(1)-Mo(1) bond length is 2.18 Å. All K(1)-Cd(1) bond lengths are 2.99 Å. Li(1) is bonded to one K(1) and three equivalent Mo(1) atoms to form LiKMo3 trigonal pyramids that share  a cornercorner with one Mo(1)KLi3Cd trigonal bipyramid, corners with six equivalent Li(1)KMo3 trigonal pyramids, and edges with three equivalent Cd(1)K3Mo trigonal pyramids. All Li(1)-Mo(1) bond lengths are 2.99 Å. Mo(1) is bonded to one K(1), three equivalent Li(1), and one Cd(1) atom to form distorted MoKLi3Cd trigonal bipyramids that share corners with six equivalent Mo(1)KLi3Cd trigonal bipyramids,  a cornercorner with one Li(1)KMo3 trigonal pyramid, and corners with three equivalent Cd(1)K3Mo trigonal pyramids. The Mo(1)-Cd(1) bond length is 2.18 Å. Cd(1) is bonded to three equivalent K(1) and one Mo(1) atom to form distorted CdK3Mo trigonal pyramids that share corners with three equivalent Mo(1)KLi3Cd trigonal bipyramids, corners with six equivalent Cd(1)K3Mo trigonal pyramids, and edges with three equivalent Li(1)KMo3 trigonal pyramids.