data_KLiCd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.91
_cell_length_b   6.91
_cell_length_c   6.91
_cell_angle_alpha   150.65
_cell_angle_beta   143.85
_cell_angle_gamma   47.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KLiCd
_chemical_formula_sum   'K1 Li1 Cd1'
_cell_volume   95.09
_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  0.0  0.0  0.3  1.0
  Li  Li2  1  0.0  0.0  0.75  1.0
  Cd  Cd0  1  0.0  0.0  0.62  1.0

data_KLiCd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.5
_cell_length_b   4.29
_cell_length_c   6.91
_cell_angle_alpha   108.08
_cell_angle_beta   104.68
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KLiCd
_chemical_formula_sum   'K1 Li1 Cd1'
_cell_volume   95.09
_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  0.7  0.7  0.7  1.0
  Li  Li1  1  0.25  0.25  0.25  1.0
  Cd  Cd2  1  0.38  0.38  0.38  1.0

K Li Cd
K Li Cd 0 2 o o o 1 2 o o o 