#------------------------------------------------------------------------------
#$Date: 2008-01-26 17:25:03 +0000 (Sat, 26 Jan 2008) $
#$Revision: 20 $
#$URL: svn://www.crystallography.net/cod/cif/2/2003462.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_2003462
_journal_name_full    'Acta Crystallographica'
_journal_year         1995
_journal_volume    	C51
_journal_page_first    	824
_journal_page_last    	825
_publ_section_title
;
Tetrachloropentakis(dimethyl sulfoxide)diruthenium(II)
;
_chemical_formula_sum    	'C10 H30 Cl4 O5 Ru2 S5'
_chemical_formula_weight    	734.6
loop_
    _symmetry_equiv_pos_as_xyz
    'x,y,z'
    '1/2+x,1/2-y,1/2+z'
    '-x,-y,-z'
    '1/2-x,1/2+y,1/2-z'
_symmetry_space_group_name_H-M    	'P 21/n'
_cell_length_a    	11.095(7)
_cell_length_b    	15.692(8)
_cell_length_c    	15.173(7)
_cell_angle_alpha    	90
_cell_angle_beta    	109.83(4)
_cell_angle_gamma    	90
_cell_volume    	2485(2)
_cell_formula_units_Z    	4
_exptl_crystal_density_diffrn    	1.963
_exptl_crystal_density_meas    	?
_diffrn_radiation_type    	'MoK\a'
_diffrn_radiation_wavelength    	0.71073
_cell_measurement_reflns_used    	35
_cell_measurement_theta_min    	8
_cell_measurement_theta_max    	16
_exptl_absorpt_coefficient_mu    	2.084
_cell_measurement_temperature    	295
_exptl_crystal_description    	'parallelepiped'
_exptl_crystal_size_max    	0.33
_exptl_crystal_size_mid    	0.24
_exptl_crystal_size_min    	0.18
_exptl_crystal_size_rad    	?
_exptl_crystal_colour    	'red'
_chemical_compound_source    	'synthesis'
_diffrn_measurement_device    	'Siemens R3m/V'
_diffrn_measurement_method    	'\w'
_exptl_absorpt_correction_type    	'empirical'
_exptl_absorpt_correction_T_min    	0.89
_exptl_absorpt_correction_T_max    	1.00
_diffrn_reflns_number    	5045
_reflns_number_total    	4278
_reflns_number_observed    	3016
_reflns_observed_criterion    	F>6\s(F)
_diffrn_reflns_av_R_equivalents    	0.0430
_diffrn_reflns_theta_max    	25
_diffrn_reflns_limit_h_min    	-13
_diffrn_reflns_limit_h_max    	12
_diffrn_reflns_limit_k_min    	0
_diffrn_reflns_limit_k_max    	18
_diffrn_reflns_limit_l_min    	0
_diffrn_reflns_limit_l_max    	18
_diffrn_standards_number    	2
_diffrn_standards_interval_count    	98
_diffrn_standards_interval_time    	?
_diffrn_standards_decay_%    	3
_refine_ls_structure_factor_coef    	F
_refine_ls_R_factor_obs    	0.0548
_refine_ls_wR_factor_obs    	0.0631
_refine_ls_goodness_of_fit_obs    	2.08
_refine_ls_number_reflns    	3016
_refine_ls_number_parameters    	235
_refine_ls_hydrogen_treatment    	'noref'
_refine_ls_weighting_scheme    	'1/[\s^2^(F)+0.0001F^2^]'
_refine_ls_shift/esd_max    	0.005
_refine_diff_density_max    	0.72
_refine_diff_density_min    	-0.79
_refine_ls_extinction_method    	'none'
_refine_ls_extinction_coef    	?
_atom_type_scat_source    	'SHELXTL-Plus (Sheldrick, 1990)'
loop_
    _atom_site_label
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_U_iso_or_equiv
    Ru(1) 1.1315(1) .1159(1) .3002(1) .028(1)
    Ru(2) .8836(1) -.0082(1) .2250(1) .027(1)
    Cl(1) 1.2465(3) .1669(2) .2029(2) .047(1)
    Cl(2) 1.0001(2) .0506(2) .3805(2) .032(1)
    Cl(3) 1.1010(2) -.0256(2) .2215(2) .034(1)
    Cl(4) .9191(2) .1376(2) .1774(2) .037(1)
    S(1) 1.1268(3) .2441(2) .3630(2) .035(1)
    S(2) 1.3171(2) .0757(2) .4064(2) .035(1)
    S(3) .7985(3) -.0597(2) .0768(2) .036(1)
    S(4) .6848(2) .0261(2) .2261(2) .036(1)
    S(5) .8849(3) -.1382(2) .2920(2) .034(1)
    O(1) 1.2232(8) .2675(5) .4535(6) .058(3)
    O(2) 1.3137(8) .0351(6) .4927(5) .050(3)
    O(3) .6631(7) -.0845(6) .0427(6) .054(3)
    O(4) .5945(7) -.0428(5) .2260(6) .048(3)
    O(5) .8319(9) -.2122(5) .2319(5) .051(3)
    C(1) 1.1260(14) .3264(8) .2825(11) .060(6)
    C(2) .9776(12) .2634(8) .3756(9) .048(5)
    C(3) 1.4380(11) .1551(9) .4377(9) .052(5)
    C(4) 1.3958(11) .0011(8) .3554(8) .047(4)
    C(5) .8183(13) .0145(8) -.0061(8) .049(4)
    C(6) .8880(13) -.1479(8) .0556(9) .051(5)
    C(7) .6027(11) .0946(8) .1328(10) .055(5)
    C(8) .6925(11) .0935(7) .3220(9) .048(5)
    C(9) 1.0454(12) -.1670(8) .3611(10) .056(5)
    C(10) .8147(13) -.1362(7) .3811(8) .049(5)
    H(1A) 1.1239 .3807 .3111 .080
    H(1B) 1.2016 .3226 .2654 .080
    H(1C) 1.0515 .3204 .2274 .080
    H(2A) .9779 .3188 .4026 .080
    H(2B) .9120 .2611 .3151 .080
    H(2C) .9613 .2209 .4156 .080
    H(3A) 1.5139 .1323 .4834 .080
    H(3B) 1.4571 .1726 .3832 .080
    H(3C) 1.4087 .2033 .4637 .080
    H(4A) 1.4757 -.0164 .4008 .080
    H(4B) 1.3415 -.0477 .3343 .080
    H(4C) 1.4114 .0273 .3031 .080
    H(5A) .7819 -.0083 -.0683 .080
    H(5B) .7763 .0670 -.0019 .080
    H(5C) .9081 .0247 .0075 .080
    H(6A) .8491 -.1677 -.0076 .080
    H(6B) .9740 -.1296 .0650 .080
    H(6C) .8895 -.1934 .0983 .080
    H(7A) .5195 .1077 .1355 .080
    H(7B) .6507 .1464 .1375 .080
    H(7C) .5935 .0670 .0744 .080
    H(8A) .6072 .1067 .3203 .080
    H(8B) .7378 .0647 .3795 .080
    H(8C) .7365 .1453 .3181 .080
    H(9A) 1.0458 -.2217 .3893 .080
    H(9B) 1.0976 -.1690 .3220 .080
    H(9C) 1.0789 -.1249 .4092 .080
    H(10A) .8178 -.1924 .4069 .080
    H(10B) .8619 -.0976 .4295 .080
    H(10C) .7272 -.1178 .3555 .080