data_CdPbF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.04
_cell_length_b   6.04
_cell_length_c   6.04
_cell_angle_alpha   55.97
_cell_angle_beta   55.97
_cell_angle_gamma   55.97
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdPbF6
_chemical_formula_sum   'Cd1 Pb1 F6'
_cell_volume   141.42
_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
  Pb  Pb1  1  0.0  0.0  0.62  1.0
  F  F2  1  0.68  0.58  0.83  1.0
  F  F3  1  0.29  0.79  0.83  1.0
  F  F4  1  0.03  0.62  0.83  1.0
  F  F5  1  0.97  0.38  0.4  1.0
  F  F6  1  0.71  0.21  0.4  1.0
  F  F7  1  0.32  0.42  0.4  1.0

data_CdPbF6
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.67
_cell_length_b   5.67
_cell_length_c   6.04
_cell_angle_alpha   62.02
_cell_angle_beta   62.02
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdPbF6
_chemical_formula_sum   'Cd1 Pb1 F6'
_cell_volume   141.42
_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
  Pb  Pb1  1  0.0  0.38  0.62  1.0
  F  F2  1  0.21  0.17  0.92  1.0
  F  F3  1  0.38  0.17  0.49  1.0
  F  F4  1  0.42  0.17  0.09  1.0
  F  F5  1  0.58  0.6  0.14  1.0
  F  F6  1  0.62  0.6  0.75  1.0
  F  F7  1  0.79  0.6  0.32  1.0

Cd Pb F F F F F F