data_OsC4(ClO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.17
_cell_length_b   6.17
_cell_length_c   11.82
_cell_angle_alpha   93.52
_cell_angle_beta   93.52
_cell_angle_gamma   114.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   OsC4(ClO2)2
_chemical_formula_sum   'Os2 C8 Cl4 O8'
_cell_volume   407.49
_cell_formula_units_Z   2
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
  Os  Os0  1  0.01  0.28  0.94  1.0
  Os  Os1  1  0.35  0.72  0.81  1.0
  C  C2  1  0.77  0.94  0.78  1.0
  C  C3  1  0.26  0.94  0.09  1.0
  C  C4  1  0.59  0.06  0.96  1.0
  C  C5  1  0.35  0.33  0.85  1.0
  C  C6  1  0.01  0.67  0.89  1.0
  C  C7  1  0.68  0.67  0.72  1.0
  C  C8  1  0.1  0.06  0.65  1.0
  C  C9  1  0.68  0.33  0.02  1.0
  Cl  Cl10  1  1.0  0.05  0.3  1.0
  Cl  Cl11  1  0.33  0.95  0.17  1.0
  Cl  Cl12  1  0.36  0.95  0.44  1.0
  Cl  Cl13  1  0.03  0.05  0.57  1.0
  O  O14  1  0.67  0.33  0.6  1.0
  O  O15  1  0.69  0.67  0.14  1.0
  O  O16  1  0.0  0.67  0.47  1.0
  O  O17  1  0.17  0.88  0.65  1.0
  O  O18  1  0.52  0.88  0.97  1.0
  O  O19  1  0.36  0.33  0.27  1.0
  O  O20  1  0.19  0.12  0.1  1.0
  O  O21  1  0.84  0.12  0.77  1.0

data_OsC4(ClO2)2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   6.17
_cell_length_b   6.17
_cell_length_c   11.82
_cell_angle_alpha   93.52
_cell_angle_beta   93.52
_cell_angle_gamma   114.24
_symmetry_Int_Tables_number   2
_chemical_formula_structural   OsC4(ClO2)2
_chemical_formula_sum   'Os2 C8 Cl4 O8'
_cell_volume   407.49
_cell_formula_units_Z   2
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
  Os  Os0  2  0.17  0.72  0.44  1.0
  C  C1  2  0.08  0.94  0.72  1.0
  C  C2  2  0.17  0.33  0.48  1.0
  C  C3  2  0.41  0.06  0.59  1.0
  C  C4  2  0.5  0.33  0.65  1.0
  Cl  Cl5  2  0.15  0.95  0.8  1.0
  Cl  Cl6  2  0.18  0.95  0.07  1.0
  O  O7  2  0.01  0.12  0.73  1.0
  O  O8  2  0.18  0.33  0.9  1.0
  O  O9  2  0.34  0.88  0.6  1.0
  O  O10  2  0.49  0.33  0.23  1.0

Os Os C C C C C C C C Cl Cl Cl Cl O O O O O O O O