#------------------------------------------------------------------------------
#$Date: 2016-03-25 11:37:32 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179799 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/95/7009559.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_7009559
loop_
_publ_author_name
'Clot, Olivier'
'Wolf, Michael O.'
'Yap, Glenn P. A.'
'Patrick, Brian O.'
_publ_section_title
;
 Synthesis and reactivity of ruthenium(II) complexes containing
 hemilabile phosphine--thiophene ligands
;
_journal_issue                   16
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              2729
_journal_paper_doi               10.1039/b001898h
_journal_year                    2000
_chemical_formula_sum            'C50 H35 Cl5 O P2 Ru S6'
_chemical_formula_weight         1184.40
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 105.325(9)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.069(7)
_cell_length_b                   12.857(7)
_cell_length_c                   24.092(7)
_cell_measurement_reflns_used    'reflections from 60 data frames'
_cell_measurement_temperature    238(2)
_cell_measurement_theta_max      28.29
_cell_measurement_theta_min      1.47
_cell_volume                     5099(4)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      238(2)
_diffrn_measured_fraction_theta_full 0.794
_diffrn_measured_fraction_theta_max 0.794
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1875
_diffrn_reflns_av_sigmaI/netI    0.2717
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            15072
_diffrn_reflns_theta_full        20.81
_diffrn_reflns_theta_max         20.81
_diffrn_reflns_theta_min         1.81
_diffrn_standards_decay_%        <1
_diffrn_standards_number         '50 standard frames at start and end'
_exptl_absorpt_coefficient_mu    0.916
_exptl_absorpt_correction_T_max  0.928076
_exptl_absorpt_correction_T_min  0.538896
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Blessing,R., Acta Cryst. (1995) A51 33-38.'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.543
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2392
_exptl_crystal_size_max          0.1
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.05
_refine_diff_density_max         0.539
_refine_diff_density_min         -0.742
_refine_diff_density_rms         0.101
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.066
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     532
_refine_ls_number_reflns         4244
_refine_ls_number_restraints     543
_refine_ls_restrained_S_all      1.022
_refine_ls_R_factor_all          0.1242
_refine_ls_R_factor_gt           0.0621
_refine_ls_shift/su_max          0.018
_refine_ls_shift/su_mean         0.005
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0700P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1369
_refine_ls_wR_factor_ref         0.1584
_reflns_number_gt                2354
_reflns_number_total             4244
_reflns_threshold_expression     2sigma(I)
_cod_data_source_file            b001898h.txt
_cod_data_source_block           '[RuCl2(dppterth)2(CO)]'
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7009559
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ru Ru 0.27895(7) 0.80289(8) 0.05687(4) 0.0325(4) Uani 1 1 d U . .
Cl1 Cl 0.4166(2) 0.8453(3) 0.11417(13) 0.0453(10) Uani 1 1 d U . .
Cl2 Cl 0.2077(2) 0.8849(2) 0.11786(13) 0.0423(10) Uani 1 1 d U . .
O1 O 0.1192(6) 0.7327(7) -0.0130(4) 0.065(3) Uani 1 1 d U . .
P1 P 0.2941(2) 0.6538(3) 0.11639(14) 0.0379(10) Uani 1 1 d U . .
P2 P 0.2700(2) 0.9662(3) 0.00727(14) 0.0372(10) Uani 1 1 d U B .
S1 S 0.3459(2) 0.7214(3) -0.00438(14) 0.0463(11) Uani 1 1 d U . .
S2 S 0.4883(2) 0.4799(3) 0.07846(16) 0.0519(11) Uani 1 1 d U . .
S3 S 0.6008(4) 0.4519(4) 0.2577(2) 0.121(3) Uani 0.888(11) 1 d PU A 1
S3' S 0.595(5) 0.337(5) 0.186(3) 0.121(3) Uani 0.11 1 d PU A 2
S4 S 0.4516(4) 1.1049(6) 0.2457(2) 0.106(3) Uani 0.832(11) 1 d PU B 1
S4' S 0.401(3) 1.284(4) 0.2366(15) 0.106(3) Uani 0.17 1 d PU B 2
S5 S 0.3799(2) 1.2527(3) 0.08668(16) 0.0559(12) Uani 1 1 d U B .
S6 S 0.4136(4) 1.2245(5) -0.0500(3) 0.073(2) Uani 0.679(10) 1 d PU B 1
S6' S 0.2425(16) 1.254(2) -0.0665(9) 0.073(2) Uani 0.32 1 d PU B 2
C1 C 0.1808(9) 0.7607(10) 0.0133(6) 0.043(3) Uani 1 1 d U . .
C2 C 0.2902(8) 0.6995(12) -0.0732(5) 0.058(4) Uani 1 1 d U . .
H2A H 0.2640 0.7516 -0.0989 0.070 Uiso 1 1 calc R . .
C3 C 0.2888(9) 0.5970(12) -0.0861(6) 0.065(4) Uani 1 1 d U . .
H3A H 0.2631 0.5693 -0.1225 0.079 Uiso 1 1 calc R . .
C4 C 0.3318(8) 0.5343(11) -0.0371(6) 0.058(4) Uani 1 1 d U . .
H4A H 0.3381 0.4618 -0.0389 0.070 Uiso 1 1 calc R . .
C5 C 0.3611(8) 0.5894(10) 0.0101(5) 0.041(3) Uani 1 1 d U . .
C6 C 0.4034(8) 0.5563(10) 0.0656(6) 0.043(3) Uani 1 1 d U . .
C7 C 0.3847(8) 0.5793(9) 0.1169(5) 0.043(3) Uani 1 1 d U . .
C8 C 0.4397(8) 0.5348(10) 0.1650(6) 0.048(4) Uani 1 1 d U . .
H8A H 0.4369 0.5448 0.2031 0.057 Uiso 1 1 calc R . .
C9 C 0.4966(9) 0.4766(11) 0.1507(6) 0.050(4) Uani 1 1 d U A .
C10 C 0.5600(8) 0.4136(11) 0.1874(6) 0.058(4) Uani 1 1 d U . .
C11 C 0.5908(16) 0.3116(17) 0.1727(11) 0.121(3) Uani 1 1 d U A .
H11A H 0.5760 0.2750 0.1377 0.146 Uiso 1 1 calc R . .
C12 C 0.6509(9) 0.2825(13) 0.2273(8) 0.099(6) Uani 1 1 d U . .
H12A H 0.6821 0.2216 0.2302 0.118 Uiso 1 1 calc R A .
C13 C 0.6585(12) 0.3451(13) 0.2710(9) 0.138(8) Uani 1 1 d U A .
H13A H 0.6938 0.3312 0.3074 0.166 Uiso 1 1 calc R C 1
C14 C 0.2846(6) 0.5870(6) 0.2246(4) 0.076(4) Uani 1 1 d GU . .
H14A H 0.2649 0.5246 0.2057 0.092 Uiso 1 1 calc R . .
C15 C 0.2944(6) 0.5962(8) 0.2836(4) 0.087(5) Uani 1 1 d GU . .
H15A H 0.2813 0.5400 0.3045 0.104 Uiso 1 1 calc R . .
C16 C 0.3235(6) 0.6884(9) 0.3116(3) 0.096(6) Uani 1 1 d GU . .
H16A H 0.3302 0.6946 0.3515 0.116 Uiso 1 1 calc R . .
C17 C 0.3429(6) 0.7714(7) 0.2807(4) 0.082(5) Uani 1 1 d GU . .
H17A H 0.3626 0.8338 0.2997 0.098 Uiso 1 1 calc R . .
C18 C 0.3330(6) 0.7622(6) 0.2218(4) 0.060(4) Uani 1 1 d GU . .
H18A H 0.3461 0.8184 0.2009 0.072 Uiso 1 1 calc R . .
C19 C 0.3039(5) 0.6700(7) 0.1937(3) 0.051(4) Uani 1 1 d GU . .
C20 C 0.1337(7) 0.5938(6) 0.0971(4) 0.067(4) Uani 1 1 d GU . .
H20A H 0.1257 0.6608 0.1103 0.081 Uiso 1 1 calc R . .
C21 C 0.0684(5) 0.5257(9) 0.0801(4) 0.083(5) Uani 1 1 d GU . .
H21A H 0.0163 0.5467 0.0817 0.099 Uiso 1 1 calc R . .
C22 C 0.0803(6) 0.4267(8) 0.0606(4) 0.080(5) Uani 1 1 d GU . .
H22A H 0.0362 0.3806 0.0491 0.096 Uiso 1 1 calc R . .
C23 C 0.1573(7) 0.3956(6) 0.0583(4) 0.079(5) Uani 1 1 d GU . .
H23A H 0.1653 0.3286 0.0451 0.095 Uiso 1 1 calc R . .
C24 C 0.2226(5) 0.4637(7) 0.0753(4) 0.059(4) Uani 1 1 d GU . .
H24A H 0.2747 0.4427 0.0737 0.071 Uiso 1 1 calc R . .
C25 C 0.2107(5) 0.5628(7) 0.0948(4) 0.044(3) Uani 1 1 d GU . .
C26 C 0.4633(13) 1.1883(18) 0.2995(7) 0.122(6) Uani 1 1 d U . .
H26A H 0.4936 1.1744 0.3374 0.147 Uiso 1 1 calc R B 1
C27 C 0.4257(13) 1.2756(17) 0.2831(8) 0.120(6) Uani 1 1 d U B .
H27A H 0.4274 1.3281 0.3106 0.143 Uiso 1 1 calc R . .
C28 C 0.3793(14) 1.295(2) 0.2214(8) 0.106(3) Uani 1 1 d U . .
H28A H 0.3487 1.3519 0.2030 0.127 Uiso 1 1 calc R B .
C29 C 0.4001(9) 1.1879(14) 0.1990(6) 0.073(4) Uani 1 1 d U B .
C30 C 0.3677(7) 1.1650(10) 0.1366(5) 0.042(3) Uani 1 1 d U . .
C31 C 0.3370(7) 1.0754(10) 0.1127(5) 0.041(3) Uani 1 1 d U B .
H31A H 0.3283 1.0175 0.1342 0.050 Uiso 1 1 calc R . .
C32 C 0.3181(7) 1.0755(9) 0.0500(5) 0.038(3) Uani 1 1 d U . .
C33 C 0.3357(8) 1.1691(10) 0.0298(5) 0.044(3) Uani 1 1 d U B .
C34 C 0.3353(9) 1.2106(10) -0.0263(5) 0.050(3) Uani 1 1 d U . .
C35 C 0.2593(18) 1.254(2) -0.0766(10) 0.073(2) Uani 1 1 d U B .
H35A H 0.2044 1.2532 -0.0761 0.088 Uiso 1 1 calc R . .
C36 C 0.2885(11) 1.2929(12) -0.1189(6) 0.078(5) Uani 1 1 d U . .
H36A H 0.2567 1.3260 -0.1520 0.093 Uiso 1 1 calc R B .
C37 C 0.3708(11) 1.2775(11) -0.1075(6) 0.073(4) Uani 1 1 d U B .
H37A H 0.3999 1.2984 -0.1337 0.088 Uiso 1 1 calc R D 1
C38 C 0.1374(6) 1.0935(7) 0.0024(4) 0.074(4) Uani 1 1 d GU B .
H38A H 0.1719 1.1289 0.0336 0.088 Uiso 1 1 calc R . .
C39 C 0.0572(7) 1.1251(7) -0.0188(5) 0.089(5) Uani 1 1 d GU . .
H39A H 0.0374 1.1819 -0.0020 0.106 Uiso 1 1 calc R . .
C40 C 0.0062(4) 1.0728(9) -0.0649(5) 0.092(6) Uani 1 1 d GU . .
H40A H -0.0480 1.0942 -0.0793 0.110 Uiso 1 1 calc R . .
C41 C 0.0355(6) 0.9889(9) -0.0898(4) 0.086(5) Uani 1 1 d GU . .
H41A H 0.0011 0.9535 -0.1210 0.104 Uiso 1 1 calc R . .
C42 C 0.1158(7) 0.9573(7) -0.0686(4) 0.065(4) Uani 1 1 d GU B .
H42A H 0.1356 0.9006 -0.0854 0.078 Uiso 1 1 calc R . .
C43 C 0.1667(4) 1.0096(8) -0.0225(4) 0.050(3) Uani 1 1 d GU . .
C44 C 0.2803(4) 0.9857(7) -0.1087(3) 0.051(4) Uani 1 1 d GU B .
H44A H 0.2246 1.0020 -0.1194 0.061 Uiso 1 1 calc R . .
C45 C 0.3233(5) 0.9813(7) -0.1502(2) 0.056(4) Uani 1 1 d GU . .
H45A H 0.2968 0.9947 -0.1890 0.067 Uiso 1 1 calc R . .
C46 C 0.4056(5) 0.9572(7) -0.1344(3) 0.061(4) Uani 1 1 d GU . .
H46A H 0.4348 0.9542 -0.1624 0.073 Uiso 1 1 calc R . .
C47 C 0.4449(4) 0.9374(6) -0.0770(4) 0.042(3) Uani 1 1 d GU . .
H47A H 0.5005 0.9211 -0.0663 0.051 Uiso 1 1 calc R . .
C48 C 0.4018(5) 0.9417(6) -0.0355(2) 0.032(3) Uani 1 1 d GU B .
H48A H 0.4283 0.9284 0.0033 0.039 Uiso 1 1 calc R . .
C49 C 0.3195(5) 0.9659(6) -0.0513(3) 0.033(3) Uani 1 1 d GU . .
C50 C 0.9439(12) 0.3308(19) 0.2265(9) 0.140(6) Uani 1 1 d U . .
H50A H 0.9943 0.3483 0.2563 0.168 Uiso 1 1 calc R . .
Cl3 Cl 0.9248(8) 0.2005(8) 0.2182(5) 0.361(7) Uani 1 1 d U . .
Cl4 Cl 0.8651(6) 0.3780(11) 0.2376(4) 0.347(7) Uani 1 1 d U . .
Cl5 Cl 0.9473(5) 0.3583(9) 0.1577(4) 0.277(5) Uani 1 1 d U . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C1 Ru S1 91.8(5) . . ?
C1 Ru P1 92.6(4) . . ?
S1 Ru P1 91.48(12) . . ?
C1 Ru Cl2 86.9(5) . . ?
S1 Ru Cl2 178.68(13) . . ?
P1 Ru Cl2 88.66(12) . . ?
C1 Ru P2 92.7(4) . . ?
S1 Ru P2 93.16(12) . . ?
P1 Ru P2 172.89(13) . . ?
Cl2 Ru P2 86.82(12) . . ?
C1 Ru Cl1 175.0(4) . . ?
S1 Ru Cl1 84.23(13) . . ?
P1 Ru Cl1 84.49(12) . . ?
Cl2 Ru Cl1 97.09(12) . . ?
P2 Ru Cl1 90.61(12) . . ?
C25 P1 C7 105.3(5) . . ?
C25 P1 C19 102.6(4) . . ?
C7 P1 C19 101.8(5) . . ?
C25 P1 Ru 113.4(3) . . ?
C7 P1 Ru 112.8(4) . . ?
C19 P1 Ru 119.2(3) . . ?
C43 P2 C32 103.6(5) . . ?
C43 P2 C49 107.2(4) . . ?
C32 P2 C49 102.1(5) . . ?
C43 P2 Ru 113.2(3) . . ?
C32 P2 Ru 115.9(4) . . ?
C49 P2 Ru 113.7(3) . . ?
C2 S1 C5 92.9(7) . . ?
C2 S1 Ru 116.6(5) . . ?
C5 S1 Ru 112.5(4) . . ?
C6 S2 C9 92.2(7) . . ?
C13 S3 C10 91.1(9) . . ?
C29 S4 C26 92.8(10) . . ?
C30 S5 C33 92.2(6) . . ?
C37 S6 C34 97.3(9) . . ?
O1 C1 Ru 178.4(13) . . ?
C3 C2 S1 110.8(11) . . ?
C2 C3 C4 112.3(13) . . ?
C5 C4 C3 113.3(13) . . ?
C4 C5 C6 129.6(13) . . ?
C4 C5 S1 110.4(11) . . ?
C6 C5 S1 119.9(10) . . ?
C7 C6 C5 126.9(12) . . ?
C7 C6 S2 110.1(10) . . ?
C5 C6 S2 123.0(10) . . ?
C6 C7 C8 112.8(12) . . ?
C6 C7 P1 120.2(10) . . ?
C8 C7 P1 127.0(10) . . ?
C9 C8 C7 112.8(13) . . ?
C8 C9 C10 129.0(13) . . ?
C8 C9 S2 112.1(11) . . ?
C10 C9 S2 119.0(11) . . ?
C9 C10 C11 126.8(14) . . ?
C9 C10 S3 118.9(11) . . ?
C11 C10 S3 114.1(13) . . ?
C12 C11 C10 102.4(15) . . ?
C13 C12 C11 117.3(16) . . ?
C12 C13 S3 115.1(13) . . ?
C15 C14 C19 120.0 . . ?
C16 C15 C14 120.0 . . ?
C17 C16 C15 120.0 . . ?
C16 C17 C18 120.0 . . ?
C19 C18 C17 120.0 . . ?
C18 C19 C14 120.0 . . ?
C18 C19 P1 120.9(5) . . ?
C14 C19 P1 119.0(5) . . ?
C21 C20 C25 120.0 . . ?
C20 C21 C22 120.0 . . ?
C23 C22 C21 120.0 . . ?
C22 C23 C24 120.0 . . ?
C23 C24 C25 120.0 . . ?
C24 C25 C20 120.0 . . ?
C24 C25 P1 121.1(6) . . ?
C20 C25 P1 118.9(6) . . ?
C27 C26 S4 112.0(15) . . ?
C26 C27 C28 122(2) . . ?
C29 C28 C27 95.0(17) . . ?
C28 C29 C30 118.0(14) . . ?
C28 C29 S4 118.1(11) . . ?
C30 C29 S4 123.8(13) . . ?
C31 C30 C29 127.5(13) . . ?
C31 C30 S5 112.0(10) . . ?
C29 C30 S5 120.0(10) . . ?
C30 C31 C32 113.7(12) . . ?
C33 C32 C31 111.2(11) . . ?
C33 C32 P2 126.4(10) . . ?
C31 C32 P2 122.2(9) . . ?
C32 C33 C34 135.3(12) . . ?
C32 C33 S5 110.7(10) . . ?
C34 C33 S5 113.5(9) . . ?
C33 C34 S6 125.2(11) . . ?
C33 C34 C35 128.8(13) . . ?
S6 C34 C35 106.0(11) . . ?
C36 C35 C34 108(2) . . ?
C37 C36 C35 111(2) . . ?
C36 C37 S6 117.3(12) . . ?
C39 C38 C43 120.0 . . ?
C40 C39 C38 120.0 . . ?
C39 C40 C41 120.0 . . ?
C42 C41 C40 120.0 . . ?
C43 C42 C41 120.0 . . ?
C42 C43 C38 120.0 . . ?
C42 C43 P2 120.4(7) . . ?
C38 C43 P2 119.5(7) . . ?
C45 C44 C49 120.0 . . ?
C44 C45 C46 120.0 . . ?
C47 C46 C45 120.0 . . ?
C46 C47 C48 120.0 . . ?
C49 C48 C47 120.0 . . ?
C48 C49 C44 120.0 . . ?
C48 C49 P2 115.4(5) . . ?
C44 C49 P2 124.6(5) . . ?
Cl4 C50 Cl5 109.7(15) . . ?
Cl4 C50 Cl3 104.8(13) . . ?
Cl5 C50 Cl3 98.3(12) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ru C1 1.810(15) . ?
Ru S1 2.340(4) . ?
Ru P1 2.367(4) . ?
Ru Cl2 2.386(3) . ?
Ru P2 2.401(4) . ?
Ru Cl1 2.452(4) . ?
O1 C1 1.133(13) . ?
P1 C25 1.810(8) . ?
P1 C7 1.816(13) . ?
P1 C19 1.839(7) . ?
P2 C43 1.808(8) . ?
P2 C32 1.806(13) . ?
P2 C49 1.827(7) . ?
S1 C2 1.703(13) . ?
S1 C5 1.738(13) . ?
S2 C6 1.709(13) . ?
S2 C9 1.709(13) . ?
S3 C13 1.669(17) . ?
S3 C10 1.723(14) . ?
S4 C29 1.630(17) . ?
S4 C26 1.653(19) . ?
S5 C30 1.702(13) . ?
S5 C33 1.748(13) . ?
S6 C37 1.545(16) . ?
S6 C34 1.595(15) . ?
C2 C3 1.353(17) . ?
C3 C4 1.457(17) . ?
C4 C5 1.321(15) . ?
C5 C6 1.406(15) . ?
C6 C7 1.388(15) . ?
C7 C8 1.406(15) . ?
C8 C9 1.342(16) . ?
C9 C10 1.450(17) . ?
C10 C11 1.49(3) . ?
C11 C12 1.49(3) . ?
C12 C13 1.31(2) . ?
C14 C15 1.3900 . ?
C14 C19 1.3900 . ?
C15 C16 1.3900 . ?
C16 C17 1.3900 . ?
C17 C18 1.3900 . ?
C18 C19 1.3900 . ?
C20 C21 1.3900 . ?
C20 C25 1.3900 . ?
C21 C22 1.3900 . ?
C22 C23 1.3900 . ?
C23 C24 1.3900 . ?
C24 C25 1.3900 . ?
C26 C27 1.30(2) . ?
C27 C28 1.51(3) . ?
C28 C29 1.55(3) . ?
C29 C30 1.486(17) . ?
C30 C31 1.332(15) . ?
C31 C32 1.457(15) . ?
C32 C33 1.362(15) . ?
C33 C34 1.452(16) . ?
C34 C35 1.62(3) . ?
C35 C36 1.34(2) . ?
C36 C37 1.372(18) . ?
C38 C39 1.3900 . ?
C38 C43 1.3900 . ?
C39 C40 1.3900 . ?
C40 C41 1.3900 . ?
C41 C42 1.3900 . ?
C42 C43 1.3900 . ?
C44 C45 1.3900 . ?
C44 C49 1.3900 . ?
C45 C46 1.3900 . ?
C46 C47 1.3900 . ?
C47 C48 1.3900 . ?
C48 C49 1.3900 . ?
C50 Cl4 1.56(2) . ?
C50 Cl5 1.71(2) . ?
C50 Cl3 1.71(2) . ?
