data_Na6Cd(SnS3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.91
_cell_length_b   8.91
_cell_length_c   6.66
_cell_angle_alpha   97.21
_cell_angle_beta   97.21
_cell_angle_gamma   80.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na6Cd(SnS3)4
_chemical_formula_sum   'Na6 Cd1 Sn4 S12'
_cell_volume   514.96
_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
  Na  Na0  1  0.33  0.15  0.91  1.0
  Na  Na1  1  0.13  0.15  0.66  1.0
  Na  Na2  1  0.33  0.85  0.91  1.0
  Na  Na3  1  0.13  0.85  0.66  1.0
  Na  Na4  1  0.86  0.0  0.66  1.0
  Na  Na5  1  0.6  0.0  0.91  1.0
  Cd  Cd6  1  0.0  0.0  0.0  1.0
  Sn  Sn7  1  0.78  0.14  0.0  1.0
  Sn  Sn8  1  0.23  0.77  0.28  1.0
  Sn  Sn9  1  0.23  0.23  0.28  1.0
  Sn  Sn10  1  0.78  0.86  0.0  1.0
  S  S11  1  0.02  0.0  0.54  1.0
  S  S12  1  0.31  0.0  0.87  1.0
  S  S13  1  0.15  0.0  0.69  1.0
  S  S14  1  0.44  0.0  0.02  1.0
  S  S15  1  0.57  0.91  0.25  1.0
  S  S16  1  0.14  0.76  0.91  1.0
  S  S17  1  0.14  0.24  0.91  1.0
  S  S18  1  0.57  0.09  0.25  1.0
  S  S19  1  0.32  0.24  0.65  1.0
  S  S20  1  0.89  0.09  0.32  1.0
  S  S21  1  0.89  0.91  0.32  1.0
  S  S22  1  0.32  0.76  0.65  1.0

data_Na6Cd(SnS3)4
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.66
_cell_length_b   8.91
_cell_length_c   8.91
_cell_angle_alpha   80.92
_cell_angle_beta   82.79
_cell_angle_gamma   82.79
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na6Cd(SnS3)4
_chemical_formula_sum   'Na6 Cd1 Sn4 S12'
_cell_volume   514.96
_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
  Na  Na0  1  0.66  0.14  0.0  1.0
  Na  Na1  1  0.66  0.87  0.15  1.0
  Na  Na2  1  0.66  0.87  0.85  1.0
  Na  Na3  1  0.91  0.67  0.15  1.0
  Na  Na4  1  0.91  0.67  0.85  1.0
  Na  Na5  1  0.91  0.4  0.0  1.0
  Cd  Cd6  1  0.0  0.0  0.0  1.0
  Sn  Sn7  1  0.0  0.22  0.14  1.0
  Sn  Sn8  1  0.0  0.22  0.86  1.0
  Sn  Sn9  1  0.28  0.77  0.23  1.0
  Sn  Sn10  1  0.28  0.77  0.77  1.0
  S  S11  1  0.02  0.56  0.0  1.0
  S  S12  1  0.25  0.43  0.09  1.0
  S  S13  1  0.25  0.43  0.91  1.0
  S  S14  1  0.32  0.11  0.09  1.0
  S  S15  1  0.32  0.11  0.91  1.0
  S  S16  1  0.54  0.98  0.0  1.0
  S  S17  1  0.65  0.68  0.24  1.0
  S  S18  1  0.65  0.68  0.76  1.0
  S  S19  1  0.69  0.85  0.0  1.0
  S  S20  1  0.87  0.69  0.0  1.0
  S  S21  1  0.91  0.86  0.24  1.0
  S  S22  1  0.91  0.86  0.76  1.0

Na Na Na Na Na Na Cd Sn Sn Sn Sn S S S S S S S S S S S S