data_Cd3P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64
_cell_length_b   5.64
_cell_length_c   5.64
_cell_angle_alpha   116.43
_cell_angle_beta   116.43
_cell_angle_gamma   116.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3P
_chemical_formula_sum   'Cd3 P1'
_cell_volume   85.77
_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  0.4  0.62  0.08  1.0
  Cd  Cd1  1  0.6  0.62  0.08  1.0
  Cd  Cd2  1  0.0  0.77  0.08  1.0
  P  P3  1  0.0  0.0  0.0  1.0

data_Cd3P
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.24
_cell_length_b   5.64
_cell_length_c   5.64
_cell_angle_alpha   116.43
_cell_angle_beta   101.03
_cell_angle_gamma   101.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd3P
_chemical_formula_sum   'Cd3 P1'
_cell_volume   85.77
_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  0.08  0.08  0.31  1.0
  Cd  Cd1  1  0.08  0.68  0.46  1.0
  Cd  Cd2  1  0.08  0.47  0.46  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Cd Cd Cd P
Cd Cd Cd P 0 1 o o o 2 3 o + o 