data_Cd3Pt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.53
_cell_length_b   5.53
_cell_length_c   8.52
_cell_angle_alpha   60.53
_cell_angle_beta   39.74
_cell_angle_gamma   79.73
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3Pt2
_chemical_formula_sum   'Cd6 Pt4'
_cell_volume   184.36
_cell_formula_units_Z   2
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  0.25  0.46  0.29  1.0
  Cd  Cd1  1  0.38  0.59  0.29  1.0
  Cd  Cd2  1  0.66  0.11  0.65  1.0
  Cd  Cd3  1  0.79  0.97  0.65  1.0
  Cd  Cd4  1  0.81  0.02  0.04  1.0
  Cd  Cd5  1  0.41  0.51  0.95  1.0
  Pt  Pt6  1  0.62  0.67  0.37  1.0
  Pt  Pt7  1  0.01  0.37  0.37  1.0
  Pt  Pt8  1  0.03  0.86  0.0  1.0
  Pt  Pt9  1  0.6  0.19  0.0  1.0

data_Cd3Pt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.45
_cell_length_b   5.53
_cell_length_c   7.53
_cell_angle_alpha   79.73
_cell_angle_beta   68.79
_cell_angle_gamma   60.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3Pt2
_chemical_formula_sum   'Cd6 Pt4'
_cell_volume   184.36
_cell_formula_units_Z   2
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  0.19  0.94  0.85  1.0
  Cd  Cd1  1  0.21  0.38  0.44  1.0
  Cd  Cd2  1  0.34  0.24  0.31  1.0
  Cd  Cd3  1  0.59  0.54  0.36  1.0
  Cd  Cd4  1  0.62  0.12  0.67  1.0
  Cd  Cd5  1  0.75  0.25  0.54  1.0
  Pt  Pt6  1  0.38  0.96  0.99  1.0
  Pt  Pt7  1  0.4  0.81  0.61  1.0
  Pt  Pt8  1  0.97  0.13  0.03  1.0
  Pt  Pt9  1  0.99  0.26  0.38  1.0

Cd Cd Cd Cd Cd Cd Pt Pt Pt Pt
Cd Cd Cd Cd Cd Cd Pt Pt Pt Pt 0 7 o o o 0 1 o o o 0 5 o o - 2 3 o - o 2 7 + o o 4 6 o - o 4 9 o o o 4 8 + - o 5 7 o o + 5 9 o o + 6 8 + o o 