#------------------------------------------------------------------------------
#$Date: 2008-01-26 13:05:32 +0000 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: svn://www.crystallography.net/cod/cif/2/2000465.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_2000465
_journal_name_full  'Acta Cryst.'
_journal_year  1992
_journal_volume  C48
_journal_page_first  2025
_journal_page_last  2026
loop_
_publ_author_name
 'Ng, S.W.'
 'Kumar Das, V.G.'
_chemical_formula_sum  'C25 H21 N1 O2 S1 Sn1'
_chemical_formula_weight  518.21
_symmetry_cell_setting  monoclinic
_symmetry_space_group_name_H-M  'P 21/a'
_symmetry_space_group_name_Hall  ?
_cell_length_a  16.525(2)
_cell_length_b  15.386(2)
_cell_length_c  19.751(2)
_cell_angle_alpha  90.
_cell_angle_beta  113.820(10)
_cell_angle_gamma  90.
_cell_volume  4594.0(10)
_cell_formula_units_Z  8
_exptl_crystal_density_diffrn  1.498
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  2080
_exptl_absorpt_coefficient_mu  1.222
_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
 Sn1a .20143(2) .22048(3) .95893(2)
 S1a -.05549(9) .43860(10)
       .86046(9)
 O1a .0791(2) .2898(3) .9036(2)
 O2a .0928(3) .2877(3) .7967(2)
 N1a .1627(3) .6392(3) .9599(3)
 C1a .1647(3) .1063(4) .8932(3)
 C2a .0769(4) .0837(5) .8566(3)
 C3a .0514(5) .0096(5) .8147(4)
 C4a .1133(5) -.0421(5) .8056(4)
 C5a .1998(5) -.0213(5) .8391(3)
 C6a .2261(4) .0518(4) .8835(3)
 C7a .2845(3) .3124(4) .9393(3)
 C8a .3007(4) .3066(4) .8753(3)
 C9a .3497(4) .3677(5) .8591(3)
 C10a .3852(4) .4363(5) .9060(4)
 C11a .3709(4) .4431(5) .9691(4)
 C12a .3213(4) .3813(4) .9860(3)
 C13a .1742(4) .2255(4) 1.0558(3)
 C14a .2337(5) .2552(5) 1.1224(3)
 C15a .2118(6) .2590(5) 1.1825(4)
 C16a .1327(5) .2303(6) 1.1789(4)
 C17a .0749(5) .1998(6) 1.1136(4)
 C18a .0931(4) .1975(5) 1.0517(4)
 C19a .0558(4) .3109(4) .8363(3)
 C20a -.0247(4) .3703(4) .8026(3)
 C21a .0299(3) .5147(4) .8949(3)
 C22a .1081(3) .5124(4) .8850(3)
 C23a .1706(4) .5748(4) .9175(3)
 C24a .0871(4) .6410(4) .9694(3)
 C25a .0206(4) .5814(4) .9381(3)
 Sn1b .73378(2) .20656(3) .53764(2)
 S1b .57503(9) .42660(10)
         .63542(8)
 O1b .6663(2) .2786(3) .5921(2)
 O2b .7850(2) .2785(3) .6988(2)
 N1b .7041(3) .6221(4) .5379(3)
 C1b .7577(4) .0966(4) .6084(3)
 C2b .7053(4) .0843(4) .6469(3)
 C3b .7181(6) .0138(5) .6927(4)
 C4b .7827(6) -.0439(5) .7013(5)
 C5b .8354(6) -.0317(5) .6651(5)
 C6b .8235(5) .0377(4) .6189(4)
 C7b .8340(3) .2995(4) .5529(3)
 C8b .9137(3) .2961(4) .6134(3)
 C9b .9776(4) .3576(5) .6239(3)
 C10b .9627(4) .4247(5) .5741(4)
 C11b .8856(4) .4294(5) .5150(4)
 C12b .8218(4) .3663(5) .5033(4)
 C13b .6134(4) .2077(4) .4396(3)
 C14b .6089(5) .2161(7) .3691(4)
 C15b .5294(5) .2084(8) .3085(4)
 C16b .4541(5) .1937(7) .3170(4)
 C17b .4566(4) .1856(6) .3847(4)
 C18b .5355(4) .1932(5) .4458(3)
 C19b .7096(3) .3004(4) .6604(3)
 C20b .6614(4) .3568(4) .6946(3)
 C21b .6297(4) .5012(4) .6024(3)
 C22b .7176(4) .4943(5) .6116(3)
 C23b .7494(4) .5555(5) .5786(4)
 C24b .6204(4) .6293(4) .5315(3)
 C25b .5821(4) .5716(4) .5627(3)
 H1a .033 .121 .860
 H2a -.009 -.007 .793
 H3a .095 -.092 .775
 H4a .243 -.058 .833
 H5a .287 .066 .908
 H6a .277 .259 .843
 H7a .359 .363 .815
 H8a .420 .479 .895
 H9a .396 .491 1.002
 H10a .312 .386 1.030
 H11a .291 .272 1.126
 H12a .253 .283 1.228
 H13a .119 .232 1.221
 H14a .019 .179 1.111
 H15a .051 .177 1.006
 H16a -.014 .407 .769
 H17a -.074 .334 .777
 H18a .118 .467 .856
 H19a .223 .573 .909
 H20a .079 .686 .999
 H21a -.032 .586 .946
 H1b .660 .126 .641
 H2b .681 .006 .718
 H3b .791 -.093 .733
 H4b .881 -.073 .672
 H5b .861 .046 .594
 H6b .924 .250 .648
 H7b 1.033 .354 .666
 H8b 1.007 .468 .582
 H9b .875 .476 .481
 H10b .768 .368 .460
 H11b .662 .227 .362
 H12b .528 .214 .260
 H13b .400 .189 .275
 H14b .404 .175 .391
 H15b .536 .188 .494
 H16b .636 .319 .719
 H17b .705 .393 .730
 H18b .754 .448 .640
 H19b .809 .551 .585
 H20b .586 .677 .504
 H21b .523 .580 .557