data_CdPt3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97
_cell_length_b   4.97
_cell_length_c   4.93
_cell_angle_alpha   99.58
_cell_angle_beta   99.58
_cell_angle_gamma   33.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdPt3
_chemical_formula_sum   'Cd1 Pt3'
_cell_volume   66.12
_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  0.0  1.0
  Pt  Pt1  1  0.73  0.0  0.61  1.0
  Pt  Pt2  1  0.33  0.0  0.43  1.0
  Pt  Pt3  1  0.93  0.0  0.25  1.0

data_CdPt3
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.86
_cell_length_b   4.93
_cell_length_c   4.97
_cell_angle_alpha   99.58
_cell_angle_beta   106.75
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdPt3
_chemical_formula_sum   'Cd1 Pt3'
_cell_volume   66.12
_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  0.0  1.0
  Pt  Pt1  1  0.0  0.25  0.93  1.0
  Pt  Pt2  1  0.0  0.43  0.33  1.0
  Pt  Pt3  1  0.0  0.61  0.73  1.0

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