#------------------------------------------------------------------------------
#$Date: 2008-11-20 19:58:43 +0000 (Thu, 20 Nov 2008) $
#$Revision: 481 $
#$URL: svn://www.crystallography.net/cod/cif/2/2000517.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_2000517
_journal_name_full 'Acta Crystallographica Section C'
_journal_year  1992
_journal_volume 48
_journal_page_first  1779
_journal_page_last  1782
loop_
_publ_author_name
 'Herceg, M.'
 'Matkovic-Calogovic, D.'
_chemical_formula_sum  'C12 H24 Br4 Hg2 S6'
_chemical_formula_weight  1081.48
_symmetry_cell_setting  monoclinic
_symmetry_space_group_name_H-M  'P 21/n'
_symmetry_space_group_name_Hall  ?
_cell_length_a  11.756(3)
_cell_length_b  12.683(2)
_cell_length_c  8.448(2)
_cell_angle_alpha  90.
_cell_angle_beta  100.420(10)
_cell_angle_gamma  90.
_cell_volume  1238.8(5)
_cell_formula_units_Z  2
_exptl_crystal_density_diffrn  2.899
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  984
_exptl_absorpt_coefficient_mu  19.26
_diffrn_radiation_type  Mo
_diffrn_radiation_wavelength  0.71073
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
 Hg .33640(10)
    .51440(10)
       .34470(10)
          .0436(3)
 Br1 .1747(2) .4902(2) .5042(3) .0432(8)
 Br2 .5109(2) .6229(2) .3368(3) .0352(6)
 S1 .4263(4) .6769(4) -.2496(6) .038(2)
 C2 .3603(15) .5999(16) -.114(2)   .031(7)
 C3 .2500(17) .6524(16) -.080(2)   .039(8)
 S4 .1790(4) .5813(4) .0630(6) .028(2)
 C5 .1417(17) .4561(14) -.041(2)   .032(7)
 C6 .1388(16) .3665(16) .078(3)   .038(7)
 S7 .2828(4) .3291(4) .1982(6) .031(2)
 C8 .3624(16) .2962(18) .038(3)   .041(7)
 C9 .4777(16) .2411(15) .112(3)   .040(8)