data_SnPClO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.02
_cell_length_b   5.64
_cell_length_c   10.3
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnPClO2
_chemical_formula_sum   'Sn4 P4 Cl4 O8'
_cell_volume   465.8
_cell_formula_units_Z   4
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
  Sn  Sn0  1  0.87  0.41  0.73  1.0
  Sn  Sn1  1  0.88  0.41  0.72  1.0
  Sn  Sn2  1  0.15  0.23  0.57  1.0
  Sn  Sn3  1  0.14  0.23  0.58  1.0
  P  P4  1  0.37  0.23  0.58  1.0
  P  P5  1  0.38  0.23  0.88  1.0
  P  P6  1  0.65  0.41  0.73  1.0
  P  P7  1  0.64  0.41  0.42  1.0
  Cl  Cl8  1  0.68  0.41  0.05  1.0
  Cl  Cl9  1  0.67  0.41  0.41  1.0
  Cl  Cl10  1  0.34  0.23  0.26  1.0
  Cl  Cl11  1  0.35  0.23  0.9  1.0
  O  O12  1  0.03  0.5  0.37  1.0
  O  O13  1  0.04  0.96  0.09  1.0
  O  O14  1  0.99  0.68  0.93  1.0
  O  O15  1  0.98  0.14  0.22  1.0
  O  O16  1  0.99  0.14  0.93  1.0
  O  O17  1  0.98  0.68  0.22  1.0
  O  O18  1  0.03  0.96  0.37  1.0
  O  O19  1  0.04  0.5  0.09  1.0

data_SnPClO2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   5.64
_cell_length_b   8.02
_cell_length_c   10.3
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   SnPClO2
_chemical_formula_sum   'Sn4 P4 Cl4 O8'
_cell_volume   465.8
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Sn  Sn0  2  0.41  0.63  0.93  1.0
  Sn  Sn1  2  0.41  0.64  0.92  1.0
  P  P2  2  0.41  0.86  0.92  1.0
  P  P3  2  0.41  0.87  0.23  1.0
  Cl  Cl4  2  0.41  0.83  0.6  1.0
  Cl  Cl5  2  0.41  0.84  0.24  1.0
  O  O6  2  0.14  0.52  0.72  1.0
  O  O7  2  0.14  0.53  0.43  1.0
  O  O8  2  0.32  0.48  0.28  1.0
  O  O9  2  0.32  0.47  0.57  1.0

Sn Sn Sn Sn P P P P Cl Cl Cl Cl O O O O O O O O