#------------------------------------------------------------------------------
#$Date: 2009-11-16 01:43:51 +0000 (Mon, 16 Nov 2009) $
#$Revision: 853 $
#$URL: svn://www.crystallography.net/cod/cif/2/2005119.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_2005119
_journal_name_full               'Acta Crystallographica C'
_journal_volume                  52
_journal_year      1996
_journal_page_first     1629
_journal_page_last     1631
_publ_section_title
;
catena-Poly[cis-dicloro-trans-dimethyltin(IV)-\m-meso-
1,2-bis(phenylsulfinyl)ethane-O:O']
;
_chemical_formula_iupac     '[Sn Cl2(C H3)2 (C14 H14 O2 S2)]~n~'
_chemical_formula_moiety     'C16 H20 Cl2 O2 S2 Sn'
_chemical_formula_sum     'C16 H20 Cl2 O2 S2 Sn'
_chemical_formula_structural     '[Sn(CH~3~)~2~Cl~2~(C~6~H~5~SOCH~2~)~2~]~n~'
_chemical_formula_weight     498.03
_symmetry_cell_setting    'monoclinic'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_[local]_cod_cif_authors_sg_H-M  P21/c
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
_cell_length_a     16.445(2)
_cell_length_b     6.3075(6)
_cell_length_c     21.092(3)
_cell_angle_alpha     90.00
_cell_angle_beta     112.020(10)
_cell_angle_gamma     90.00
_cell_volume     2028.2(7)
_cell_formula_units_Z     4
_exptl_crystal_density_diffrn     1.631
_cell_measurement_temperature     293(2)
loop_
_atom_site_label
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Sn1 1  .25785(2)  .19297(4)  .019320(10)
                                        .03840(10)
Cl1 1  .40228(7)  .0193(2)  .07883(6)  .0552(3)
Cl2 1  .17348(8)  .0135(2)  .07984(7)  .0620(3)
O1 1  .3283(2)  .3846(6)  -.0440(2)  .0542(8)
S1 1  .39773(7)  .2832(2)  -.06527(5)  .0444(2)
C1 1  .3896(3)  .4170(8) -0.1417(2)  .0450(10)
C2 1  .4268(4)  .3290(10)
                        -0.1828(3)  .0660(10)
C3 1  .4191(4)  .4280(10)
                        -0.2434(3)  .084(2)
C4 1  .3745(5)  .6100(10)
                        -0.2621(3)  .085(2)
C5 1  .3378(5)  .6980(10)
                        -0.2211(3)  .097(2)
C6 1  .3434(4)  .6040(10)
                        -0.1608(3)  .078(2)
O2 1  .1278(2)  .3869(6)  -.0468(2)  .0544(8)
S2 1  .03389(7)  .3082(2)  -.07375(6)  .0456(2)
C7 1  -.0239(3)  .4923(8) -0.1403(2)  .0460(10)
C8 1  .0225(4)  .6531(8) -0.1547(2)  .0590(10)
C9 1  -.0213(4)  .7970(10)
                         -0.2057(3)  .074(2)
C10 1 -0.1085(5)  .7820(10)
                          -0.2403(3)  .085(2)
C11 1 -0.1535(4)  .6200(10)
                          -0.2247(4)  .101(3)
C12 1 -0.1123(3)  .4710(10)
                          -0.1758(3)  .077(2)
C13 1  .2191(3)  -.0200(9)  -.0635(3)  .0650(10)
C14 1  .2879(3)  .4639(7)  .0819(2)  .0500(10)
C15 1  .5009(3)  .3826(7)  -.0067(2)  .0424(9)
C16 1  -.0097(3)  .3862(7)  -.0104(2)  .0425(9)
H2 1  .4576  .202 -0.1704  .076
H3 1  .4450  .3678 -0.2714  .076
H4 1  .3691  .6757 -0.3030  .076
H5 1  .3078  .825 -0.2339  .076
H6 1  .3166  .6655 -0.1335  .076
H8 1  .0826  .6653 -0.1306  .076
H9 1  .0100  .9055 -0.2161  .076
H10 1 -0.1378  .8803 -0.2742  .076
H11 1 -0.2139  .6106 -0.2481  .076
H12 1 -0.1435  .3604 -0.1669  .076
H13A 1  .1590 -0.0866 -0.0627  .076
H13B 1  .2689 -0.1414 -0.0507  .076
H13C 1  .2077  .0409 -0.1140  .076
H14A 1  .2780  .3992  .1259  .076
H14B 1  .2476  .6034  .0642  .076
H14C 1  .3561  .5060  .0959  .076
H15A 1  .5169  .3068  .0363  .076
H15B 1  .5458  .3545 -0.0251  .076
H16A 1 -0.0727  .3647 -0.0286  .076
H16B 1  .0154  .2967  .0297  .076