data_Cr2CdAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07
_cell_length_b   5.07
_cell_length_c   4.57
_cell_angle_alpha   100.58
_cell_angle_beta   100.58
_cell_angle_gamma   32.16
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2CdAg
_chemical_formula_sum   'Cr2 Cd1 Ag1'
_cell_volume   61.37
_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
  Cr  Cr2  1  0.08  0.0  0.06  1.0
  Cr  Cr3  1  0.79  0.0  0.42  1.0
  Cd  Cd1  1  0.43  0.0  0.24  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0

data_Cr2CdAg
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   4.57
_cell_length_c   5.07
_cell_angle_alpha   100.58
_cell_angle_beta   106.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2CdAg
_chemical_formula_sum   'Cr2 Cd1 Ag1'
_cell_volume   61.37
_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
  Cr  Cr0  1  0.0  0.06  0.08  1.0
  Cr  Cr1  1  0.0  0.42  0.79  1.0
  Cd  Cd2  1  0.0  0.24  0.43  1.0
  Ag  Ag3  1  0.0  0.0  0.0  1.0

Cr Cr Cd Ag
Cr Cr Cd Ag 0 3 o o o 0 2 o o o 1 2 o o o 