data_CdAgPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.37
_cell_length_b   5.37
_cell_length_c   2.83
_cell_angle_alpha   100.46
_cell_angle_beta   100.46
_cell_angle_gamma   116.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdAgPt2
_chemical_formula_sum   'Cd1 Ag1 Pt2'
_cell_volume   68.45
_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
  Cd  Cd1  1  0.82  0.0  0.0  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Pt  Pt2  1  0.92  0.72  0.33  1.0
  Pt  Pt3  1  0.92  0.28  0.33  1.0

data_CdAgPt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.83
_cell_length_b   5.36
_cell_length_c   5.37
_cell_angle_alpha   117.11
_cell_angle_beta   100.46
_cell_angle_gamma   99.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdAgPt2
_chemical_formula_sum   'Cd1 Ag1 Pt2'
_cell_volume   68.45
_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
  Cd  Cd0  1  -0.0  0.0  0.82  1.0
  Ag  Ag1  1  0.0  0.0  0.0  1.0
  Pt  Pt2  1  0.05  0.72  0.63  1.0
  Pt  Pt3  1  0.61  0.28  0.2  1.0

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