data_K2CdAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.01
_cell_length_b   7.01
_cell_length_c   5.85
_cell_angle_alpha   113.14
_cell_angle_beta   113.14
_cell_angle_gamma   35.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2CdAg
_chemical_formula_sum   'K2 Cd1 Ag1'
_cell_volume   150.85
_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  K2  1  0.22  0.0  0.12  1.0
  K  K3  1  0.23  0.0  0.82  1.0
  Cd  Cd1  1  0.99  0.0  0.56  1.0
  Ag  Ag0  1  0.0  0.0  0.49  1.0

data_K2CdAg
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.23
_cell_length_b   5.85
_cell_length_c   7.01
_cell_angle_alpha   113.14
_cell_angle_beta   107.56
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2CdAg
_chemical_formula_sum   'K2 Cd1 Ag1'
_cell_volume   150.85
_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  0.0  0.12  0.22  1.0
  K  K1  1  0.0  0.82  0.23  1.0
  Cd  Cd2  1  0.0  0.56  0.99  1.0
  Ag  Ag3  1  0.0  0.49  0.0  1.0

K K Cd Ag
K K Cd Ag 0 1 o o - 1 3 o o o 1 2 - o o 2 3 + o o 