data_2004785
_journal_name_full  'Acta Crystallographica'
_journal_year      1996
_journal_volume    'C52'
_journal_page_first     845
_journal_page_last     846
_publ_section_title
;
Bis(O-cyclohexyl dithiocarbonato)dimethyltin(IV)
;
_chemical_formula_iupac     '[Sn (C H3)2 (C7 H11 O S2)2]'
_chemical_formula_sum     'C16 H28 O2 S4 Sn'
_chemical_formula_weight     499.31
_symmetry_cell_setting    'Orthorhombic'
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z'
'x+1/2, -y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'x, -y-1/2, z'
'-x-1/2, y-1/2, z-1/2'
_symmetry_space_group_name_H-M     'P n m a'
_cell_length_a     10.2240(10)
_cell_length_b     21.514(2)
_cell_length_c     10.2300(10)
_cell_angle_alpha     90.00
_cell_angle_beta     90.00
_cell_angle_gamma     90.00
_cell_volume     2250.2(4)
_cell_formula_units_Z     4
_exptl_crystal_density_diffrn     1.474
_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  .20453(7)  .7500  .88278(7)  .0510(2)
S1 1  .3641(2)  .67059(10)  .9560(4)  .1009(11)
S2 1  .1299(2)  .61348(10)  .8358(3)  .0799(8)
O1 1  .3441(5)  .5559(2)  .9142(7)  .075(2)
C1 1  .205(4)  .7500  .6786(18)  .197(19)
H1A 1  .286(4)    .7500  .6327(18)  .080
C2 1  .0564(17)  .7500 1.0295(19)  .102(6)
H2A 1  -.0223(17)  .7500  .9783(19)  .080
C3 1  .2750(7)  .6074(3)  .9006(8)  .053(2)
C4 1  .2915(7)  .4961(3)  .8712(8)  .056(2)
H4 1  .2292(7)  .5027(3)  .8024(8)  .080
C5 1  .2269(10)  .4652(4)  .9820(9)  .079(3)
H5A 1  .1527(10)  .4894(4) 1.0087(9)  .080
H5B 1  .2865(10)  .4628(4) 1.0543(9)  .080
C6 1  .1823(10)  .4009(4)  .9432(13)  .103(4)
H6A 1  .1119(10)  .4042(4)  .8815(13)  .080
H6B 1  .1493(10)  .3802(4) 1.0195(13)  .080
C7 1  .2876(9)  .3624(4)  .8935(11)  .085(3)
H7A 1  .2501(9)  .3253(4)  .8572(11)  .080
H7B 1  .3472(9)  .3502(4)  .9613(11)  .080
C8 1  .3552(11)  .3943(4)  .7824(10)  .091(3)
H8A 1  .3013(11)  .3963(4)  .7057(10)  .080
H8B 1  .4312(11)  .3701(4)  .7607(10)  .080
C9 1  .4022(9)  .4584(4)  .8210(9)  .074(2)
H9A 1  .4382(9)  .4779(4)  .7447(9)  .080
H9B 1  .4696(9)  .4564(4)  .8862(9)  .080
H1B 1  .166(12)    .720(5)    .656(11)    .12(5)
H2B 1  .029(8)    .707(3)   1.065(7)    .07(3)