data_Cd3C5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.55
_cell_length_b   7.55
_cell_length_c   2.66
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   121.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3C5
_chemical_formula_sum   'Cd3 C5'
_cell_volume   129.81
_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  Cd5  1  0.71  0.0  0.0  1.0
  Cd  Cd6  1  0.71  0.92  0.33  1.0
  Cd  Cd7  1  0.71  0.08  0.33  1.0
  C  C0  1  0.0  0.0  0.0  1.0
  C  C1  1  0.86  0.29  0.0  1.0
  C  C2  1  0.86  0.71  0.0  1.0
  C  C3  1  0.76  0.0  0.33  1.0
  C  C4  1  0.66  0.0  0.33  1.0

data_Cd3C5
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.66
_cell_length_b   7.43
_cell_length_c   7.55
_cell_angle_alpha   119.45
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3C5
_chemical_formula_sum   'Cd3 C5'
_cell_volume   129.81
_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  0.71  1.0
  Cd  Cd1  1  0.33  0.08  0.8  1.0
  Cd  Cd2  1  0.33  0.92  0.63  1.0
  C  C3  1  0.0  0.0  0.0  1.0
  C  C4  1  0.0  0.71  0.57  1.0
  C  C5  1  0.0  0.29  0.15  1.0
  C  C6  1  0.33  0.0  0.66  1.0
  C  C7  1  0.33  0.0  0.76  1.0

Cd Cd Cd C C C C C
Cd Cd Cd C C C C C 0 7 o o o 0 2 o o o 0 1 o - o 0 6 o o o 0 3 + o o 0 4 o o o 1 6 o + o 1 3 + + o 2 7 o o o 2 4 o o o 3 6 - o o 3 5 - - o 