# Supplementary Material (ESI) for Dalton Transactions # This journal is (c) The Royal Society of Chemistry 2010 data_global _journal_name_full 'Dalton Trans.' #TrackingRef '- Compound17.txt' #======================================================================= _journal_coden_Cambridge 0222 _publ_contact_author # Name and address of author ; Suess-Fink, Georg Institute of chemistry, University of Neuchatel, 2000 Neuchatel, Switzerland ; _publ_contact_author_phone '+41 032 7182500' _publ_contact_author_fax '+41 032 7182511' _publ_contact_author_email georg.suess-fink@unine.ch _publ_requested_coeditor_name ? _publ_requested_category ? _publ_contact_letter ; ; #_publ_requested_letter #; #; #======================================================================= # 2. PROCESSING SUMMARY (IUCr Office Use Only) _journal_date_recd_electronic ? _journal_date_to_coeditor ? _journal_date_from_coeditor ? _journal_date_accepted ? _journal_date_printers_first ? _journal_date_printers_final ? _journal_date_proofs_out ? _journal_date_proofs_in ? _journal_coeditor_name ? _journal_coeditor_code ? _journal_coeditor_notes ; ? ; _journal_techeditor_code ? _journal_techeditor_notes ; ? ; _journal_coden_ASTM ? _journal_year ? _journal_volume ? _journal_issue ? _journal_page_first ? _journal_page_last ? _journal_suppl_publ_number ? _journal_suppl_publ_pages ? #======================================================================= # 3. TITLE AND AUTHOR LIST _publ_section_title ; Dinuclear arene ruthenium complex cations containing three thiophenolato bridges: A new family of highly active anticancer agents ; # The loop structure below should contain the names and addresses of all # authors, in the required order of publication. Repeat as necessary. loop_ _publ_author_name _publ_author_address M.Gras ; Institut de Chimie, Universit\'e de Neuch\^atel, Case postale 158, CH-2009 Neuch\^atel, Switzerland ; B.Therrien ; Institut de Chimie, Universit\'e de Neuch\^atel, Case postale 158, CH-2009 Neuch\^atel, Switzerland ; G.Suess-Fink ; Institut de Chimie, Universit\'e de Neuch\^atel, Case postale 158, CH-2009 Neuch\^atel, Switzerland ; O.Zava ; Institut des Sciences et Ing\'enierie Chimiques, Ecole Polytechnique F\'ed\'erale de Lausanne, CH-1015 Lausanne, Switzerland ; P.J.Dyson ; Institut des Sciences et Ing\'enierie Chimiques, Ecole Polytechnique F\'ed\'erale de Lausanne, CH-1015 Lausanne, Switzerland ; #======================================================================= # 4. TEXT _publ_section_abstract ; ; _publ_section_comment ; ; _publ_section_exptl_prep ; ; _publ_section_exptl_refinement ; ; _publ_section_references ; Sheldrick, G. M. (1990). "SHELXS-97 Program for Crystal Structure Determination", Acta Cryst., A46, 467-473. Sheldrick, G. M. (1997). SHELXL-97. Univ. of G\"ottingen, G\"ottingen, Germany. Stoe & Cie (2000). IPDS Software. Stoe & Cie GmbH, Darmstadt, Germany. Walker, N. & Stuart, D. (1983). Acta Cryst. A39, 158-166. ; _publ_section_acknowledgements ; ; _publ_contact_author_name 'Suess-Fink, Georg' data_d:compound17 _database_code_depnum_ccdc_archive 'CCDC 771826' #TrackingRef '- Compound17.txt' _audit_creation_method SHELXL-97 _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_melting_point ? _chemical_formula_moiety 'C30 H27 Ru2 S3, F6 P' _chemical_formula_sum 'C30 H27 F6 P Ru2 S3' _chemical_formula_weight 830.81 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' F F 0.0171 0.0103 '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' P P 0.1023 0.0942 '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' _symmetry_cell_setting Monoclinic _symmetry_space_group_name_H-M 'C 2/c' _symmetry_space_group_name_Hall '-C 2yc' _symmetry_Int_Tables_number 15 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, y, -z+1/2' 'x+1/2, y+1/2, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y, z-1/2' '-x+1/2, -y+1/2, -z' 'x+1/2, -y+1/2, z-1/2' _cell_length_a 39.0178(15) _cell_length_b 10.4836(3) _cell_length_c 30.5653(13) _cell_angle_alpha 90.00 _cell_angle_beta 106.929(3) _cell_angle_gamma 90.00 _cell_volume 11960.9(8) _cell_formula_units_Z 16 _cell_measurement_temperature 173(2) _cell_measurement_reflns_used 8000 _cell_measurement_theta_min 2.40 _cell_measurement_theta_max 26.00 _exptl_crystal_description block _exptl_crystal_colour yellow _exptl_crystal_size_max 0.23 _exptl_crystal_size_mid 0.18 _exptl_crystal_size_min 0.15 _exptl_crystal_density_meas ? _exptl_crystal_density_diffrn 1.845 _exptl_crystal_density_method 'not measured' _exptl_crystal_F_000 6592 _exptl_absorpt_coefficient_mu 1.332 _exptl_absorpt_correction_type none _exptl_absorpt_correction_T_min ? _exptl_absorpt_correction_T_max ? _exptl_absorpt_process_details ? _exptl_special_details ; A crystal was mounted at 173K on a Stoe Image Plate Diffraction System (Stoe & Cie, 2000) using MoK\a graphite monochromated radiation. Image plate distance 70mm, \f oscillation scans 0 - 200\%, step \D\f = 0.8\%, 3 minutes per frame. ; _diffrn_ambient_temperature 173(2) _diffrn_radiation_wavelength 0.71073 _diffrn_radiation_type MoK\a _diffrn_radiation_source 'fine-focus sealed tube' _diffrn_radiation_monochromator graphite _diffrn_measurement_device_type 'STOE IPDS' _diffrn_measurement_method 'phi oscillation' _diffrn_detector_area_resol_mean 0.81\%A _diffrn_standards_number 0 _diffrn_standards_interval_count ? _diffrn_standards_interval_time 0 _diffrn_standards_decay_% 0 _diffrn_reflns_number 98418 _diffrn_reflns_av_R_equivalents 0.1253 _diffrn_reflns_av_sigmaI/netI 0.0876 _diffrn_reflns_limit_h_min -53 _diffrn_reflns_limit_h_max 53 _diffrn_reflns_limit_k_min -14 _diffrn_reflns_limit_k_max 14 _diffrn_reflns_limit_l_min -41 _diffrn_reflns_limit_l_max 41 _diffrn_reflns_theta_min 1.50 _diffrn_reflns_theta_max 29.28 _reflns_number_total 16075 _reflns_number_gt 11044 _reflns_threshold_expression >2sigma(I) _computing_data_collection 'EXPOSE (Stoe & Cie, 2000)' _computing_cell_refinement 'CELL (Stoe & Cie, 2000)' _computing_data_reduction 'INTEGRATE (Stoe & Cie, 2000)' _computing_structure_solution 'SHELXS-97 (Sheldrick, 1990)' _computing_structure_refinement 'SHELXL-97 (Sheldrick, 1997)' _computing_molecular_graphics 'ORTEP-32 (Farrugia, 1997)' _computing_publication_material 'SHELXL-97 (Sheldrick, 1997)' _refine_special_details ; Refinement of F^2^ against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F^2^, conventional R-factors R are based on F, with F set to zero for negative F^2^. The threshold expression of F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F^2^ are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger. ; _refine_ls_structure_factor_coef Fsqd _refine_ls_matrix_type full _refine_ls_weighting_scheme calc _refine_ls_weighting_details 'calc w=1/[\s^2^(Fo^2^)+(0.0167P)^2^+52.7472P] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _atom_sites_solution_hydrogens geom _refine_ls_hydrogen_treatment constr _refine_ls_extinction_method none _refine_ls_extinction_coef ? _refine_ls_number_reflns 16075 _refine_ls_number_parameters 757 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.1153 _refine_ls_R_factor_gt 0.0688 _refine_ls_wR_factor_ref 0.0892 _refine_ls_wR_factor_gt 0.0812 _refine_ls_goodness_of_fit_ref 1.116 _refine_ls_restrained_S_all 1.116 _refine_ls_shift/su_max 0.001 _refine_ls_shift/su_mean 0.000 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 C1 C 0.16062(16) 0.5355(7) 0.22250(18) 0.0393(16) Uani 1 1 d . . . H1 H 0.1370 0.5602 0.2090 0.047 Uiso 1 1 calc R . . C2 C 0.16822(15) 0.4096(6) 0.23833(17) 0.0320(13) Uani 1 1 d . . . H2 H 0.1497 0.3520 0.2362 0.038 Uiso 1 1 calc R . . C3 C 0.20352(16) 0.3720(5) 0.25705(16) 0.0302(13) Uani 1 1 d . . . H3 H 0.2087 0.2888 0.2675 0.036 Uiso 1 1 calc R . . C4 C 0.23150(15) 0.4587(6) 0.26033(16) 0.0308(13) Uani 1 1 d . . . H4 H 0.2551 0.4326 0.2726 0.037 Uiso 1 1 calc R . . C5 C 0.22402(17) 0.5827(6) 0.24541(18) 0.0359(15) Uani 1 1 d . . . H5 H 0.2427 0.6397 0.2476 0.043 Uiso 1 1 calc R . . C6 C 0.1884(2) 0.6237(6) 0.22696(18) 0.0416(17) Uani 1 1 d . . . H6 H 0.1833 0.7081 0.2179 0.050 Uiso 1 1 calc R . . C7 C 0.24175(14) 0.3740(5) 0.04351(16) 0.0221(11) Uani 1 1 d . . . H7 H 0.2665 0.3839 0.0533 0.027 Uiso 1 1 calc R . . C8 C 0.21931(15) 0.4795(5) 0.02633(16) 0.0254(12) Uani 1 1 d . . . H8 H 0.2294 0.5593 0.0249 0.030 Uiso 1 1 calc R . . C9 C 0.18214(14) 0.4646(5) 0.01143(16) 0.0264(12) Uani 1 1 d . . . H9 H 0.1675 0.5336 -0.0007 0.032 Uiso 1 1 calc R . . C10 C 0.16711(16) 0.3451(6) 0.01484(17) 0.0304(13) Uani 1 1 d . . . H10 H 0.1423 0.3364 0.0062 0.037 Uiso 1 1 calc R . . C11 C 0.18873(16) 0.2383(5) 0.03102(17) 0.0286(13) Uani 1 1 d . . . H11 H 0.1785 0.1586 0.0321 0.034 Uiso 1 1 calc R . . C12 C 0.22625(15) 0.2544(5) 0.04565(17) 0.0266(12) Uani 1 1 d . . . H12 H 0.2409 0.1846 0.0569 0.032 Uiso 1 1 calc R . . C13 C 0.20177(14) 0.1416(5) 0.15380(16) 0.0212(11) Uani 1 1 d . . . C14 C 0.17391(14) 0.1239(5) 0.17312(17) 0.0259(12) Uani 1 1 d . . . H14 H 0.1663 0.1914 0.1877 0.031 Uiso 1 1 calc R . . C15 C 0.15755(16) 0.0058(5) 0.17073(19) 0.0334(14) Uani 1 1 d . . . H15 H 0.1391 -0.0058 0.1840 0.040 Uiso 1 1 calc R . . C16 C 0.16836(17) -0.0944(6) 0.14891(18) 0.0381(15) Uani 1 1 d . . . H16 H 0.1570 -0.1731 0.1469 0.046 Uiso 1 1 calc R . . C17 C 0.19624(18) -0.0777(5) 0.12991(18) 0.0367(15) Uani 1 1 d . . . H17 H 0.2036 -0.1454 0.1152 0.044 Uiso 1 1 calc R . . C18 C 0.21301(16) 0.0389(5) 0.13275(17) 0.0299(12) Uani 1 1 d . . . H18 H 0.2320 0.0490 0.1205 0.036 Uiso 1 1 calc R . . C19 C 0.12527(13) 0.5407(5) 0.09952(15) 0.0198(10) Uani 1 1 d . . . C20 C 0.09513(14) 0.5472(6) 0.11523(18) 0.0297(12) Uani 1 1 d . . . H20 H 0.0907 0.4819 0.1334 0.036 Uiso 1 1 calc R . . C21 C 0.07197(15) 0.6487(6) 0.1042(2) 0.0362(14) Uani 1 1 d . . . H21 H 0.0524 0.6532 0.1157 0.043 Uiso 1 1 calc R . . C22 C 0.07775(15) 0.7446(6) 0.0759(2) 0.0349(14) Uani 1 1 d . . . H22 H 0.0619 0.8128 0.0680 0.042 Uiso 1 1 calc R . . C23 C 0.10721(14) 0.7388(5) 0.05924(18) 0.0278(12) Uani 1 1 d . . . H23 H 0.1111 0.8026 0.0401 0.033 Uiso 1 1 calc R . . C24 C 0.13105(14) 0.6369(5) 0.07142(16) 0.0226(11) Uani 1 1 d . . . H24 H 0.1510 0.6334 0.0606 0.027 Uiso 1 1 calc R . . C25 C 0.26529(12) 0.5988(5) 0.14987(15) 0.0209(10) Uani 1 1 d . . . C26 C 0.28941(14) 0.5364(5) 0.18593(18) 0.0265(12) Uani 1 1 d . . . H26 H 0.2816 0.4729 0.2020 0.032 Uiso 1 1 calc R . . C27 C 0.32559(15) 0.5704(6) 0.1978(2) 0.0336(14) Uani 1 1 d . . . H27 H 0.3420 0.5286 0.2217 0.040 Uiso 1 1 calc R . . C28 C 0.33712(15) 0.6660(6) 0.1741(2) 0.0356(15) Uani 1 1 d . . . H28 H 0.3611 0.6903 0.1827 0.043 Uiso 1 1 calc R . . C29 C 0.31286(16) 0.7249(6) 0.1377(2) 0.0372(15) Uani 1 1 d . . . H29 H 0.3207 0.7869 0.1212 0.045 Uiso 1 1 calc R . . C30 C 0.27685(15) 0.6926(6) 0.12565(17) 0.0290(13) Uani 1 1 d . . . H30 H 0.2606 0.7337 0.1014 0.035 Uiso 1 1 calc R . . C31 C 0.03017(17) 1.0854(6) 0.3674(2) 0.0429(16) Uani 1 1 d . . . H31 H 0.0066 1.1070 0.3651 0.052 Uiso 1 1 calc R . . C32 C 0.0561(2) 1.0946(6) 0.4096(3) 0.0531(18) Uani 1 1 d . . . H32 H 0.0495 1.1173 0.4355 0.064 Uiso 1 1 calc R . . C33 C 0.0909(2) 1.0703(6) 0.4128(3) 0.052(2) Uani 1 1 d . . . H33 H 0.1081 1.0812 0.4408 0.062 Uiso 1 1 calc R . . C34 C 0.10158(16) 1.0298(6) 0.3758(3) 0.0471(19) Uani 1 1 d . . . H34 H 0.1256 1.0120 0.3791 0.057 Uiso 1 1 calc R . . C35 C 0.0755(2) 1.0157(6) 0.3325(2) 0.0513(19) Uani 1 1 d . . . H35 H 0.0820 0.9883 0.3071 0.062 Uiso 1 1 calc R . . C36 C 0.03868(17) 1.0452(6) 0.3291(2) 0.0429(16) Uani 1 1 d . . . H36 H 0.0209 1.0371 0.3013 0.052 Uiso 1 1 calc R . . C37 C 0.07543(18) 0.4414(6) 0.4531(2) 0.0482(19) Uani 1 1 d . . . H37 H 0.0983 0.4396 0.4737 0.058 Uiso 1 1 calc R . . C38 C 0.0465(2) 0.4809(6) 0.4678(2) 0.0449(17) Uani 1 1 d . . . H38 H 0.0498 0.5056 0.4980 0.054 Uiso 1 1 calc R . . C39 C 0.01194(18) 0.4825(6) 0.4356(2) 0.0410(16) Uani 1 1 d . . . H39 H -0.0077 0.5084 0.4449 0.049 Uiso 1 1 calc R . . C40 C 0.00700(16) 0.4461(6) 0.3907(2) 0.0384(15) Uani 1 1 d . . . H40 H -0.0159 0.4469 0.3701 0.046 Uiso 1 1 calc R . . C41 C 0.03624(19) 0.4083(6) 0.3762(2) 0.0422(16) Uani 1 1 d . . . H41 H 0.0329 0.3859 0.3458 0.051 Uiso 1 1 calc R . . C42 C 0.07037(17) 0.4042(6) 0.4074(3) 0.0455(17) Uani 1 1 d . . . H42 H 0.0898 0.3769 0.3980 0.055 Uiso 1 1 calc R . . C43 C 0.12716(13) 0.6877(5) 0.38451(17) 0.0233(11) Uani 1 1 d . . . C44 C 0.15916(15) 0.7554(6) 0.39221(19) 0.0330(14) Uani 1 1 d . . . H44 H 0.1642 0.8227 0.4130 0.040 Uiso 1 1 calc R . . C45 C 0.18333(15) 0.7224(7) 0.3689(2) 0.0420(17) Uani 1 1 d . . . H45 H 0.2042 0.7698 0.3730 0.050 Uiso 1 1 calc R . . C46 C 0.17671(16) 0.6195(7) 0.33955(19) 0.0429(17) Uani 1 1 d . . . H46 H 0.1935 0.5958 0.3249 0.052 Uiso 1 1 calc R . . C47 C 0.14545(16) 0.5519(6) 0.33188(18) 0.0366(14) Uani 1 1 d . . . H47 H 0.1411 0.4826 0.3120 0.044 Uiso 1 1 calc R . . C48 C 0.12025(14) 0.5863(6) 0.35357(17) 0.0290(12) Uani 1 1 d . . . H48 H 0.0987 0.5419 0.3475 0.035 Uiso 1 1 calc R . . C49 C 0.04816(16) 0.8231(5) 0.48894(18) 0.0303(13) Uani 1 1 d . . . C50 C 0.02893(17) 0.7855(6) 0.5179(2) 0.0418(16) Uani 1 1 d . . . H50 H 0.0062 0.7507 0.5060 0.050 Uiso 1 1 calc R . . C51 C 0.04331(19) 0.7991(7) 0.5652(2) 0.052(2) Uani 1 1 d . . . H51 H 0.0302 0.7732 0.5846 0.062 Uiso 1 1 calc R . . C52 C 0.07667(19) 0.8506(7) 0.5828(2) 0.0473(18) Uani 1 1 d . . . H52 H 0.0864 0.8581 0.6143 0.057 Uiso 1 1 calc R . . C53 C 0.09606(17) 0.8918(6) 0.55413(19) 0.0390(14) Uani 1 1 d . . . H53 H 0.1186 0.9280 0.5664 0.047 Uiso 1 1 calc R . . C54 C 0.08201(15) 0.8791(5) 0.50713(18) 0.0303(13) Uani 1 1 d . . . H54 H 0.0949 0.9076 0.4878 0.036 Uiso 1 1 calc R . . C55 C -0.01371(14) 0.7319(6) 0.31383(17) 0.0275(12) Uani 1 1 d . . . C56 C -0.03054(16) 0.6322(6) 0.28622(18) 0.0364(15) Uani 1 1 d . . . H56 H -0.0176 0.5599 0.2832 0.044 Uiso 1 1 calc R . . C57 C -0.06673(17) 0.6404(7) 0.2630(2) 0.0443(17) Uani 1 1 d . . . H57 H -0.0781 0.5731 0.2447 0.053 Uiso 1 1 calc R . . C58 C -0.08586(17) 0.7475(7) 0.2671(2) 0.0497(19) Uani 1 1 d . . . H58 H -0.1100 0.7534 0.2508 0.060 Uiso 1 1 calc R . . C59 C -0.06955(17) 0.8453(7) 0.2950(2) 0.0468(18) Uani 1 1 d . . . H59 H -0.0827 0.9172 0.2979 0.056 Uiso 1 1 calc R . . C60 C -0.03331(16) 0.8376(6) 0.3190(2) 0.0365(14) Uani 1 1 d . . . H60 H -0.0223 0.9034 0.3385 0.044 Uiso 1 1 calc R . . F1 F 0.19640(9) -0.2365(3) 0.03646(10) 0.0339(8) Uani 1 1 d . . . F2 F 0.15972(8) -0.0661(3) 0.01450(12) 0.0373(8) Uani 1 1 d . . . F3 F 0.15642(9) -0.2314(3) -0.03401(11) 0.0377(8) Uani 1 1 d . . . F4 F 0.17922(9) -0.0405(3) -0.04740(11) 0.0428(9) Uani 1 1 d . . . F5 F 0.21921(8) -0.0474(3) 0.02322(11) 0.0365(8) Uani 1 1 d . . . F6 F 0.21530(9) -0.2121(3) -0.02625(11) 0.0379(8) Uani 1 1 d . . . F7 F 0.07874(13) 0.2994(5) 0.27037(16) 0.0831(16) Uani 1 1 d . . . F8 F 0.04639(12) 0.1297(4) 0.23733(14) 0.0639(12) Uani 1 1 d . . . F9 F 0.02850(11) 0.3251(4) 0.21356(17) 0.0720(14) Uani 1 1 d . . . F10 F 0.10028(10) 0.1694(4) 0.22717(17) 0.0778(15) Uani 1 1 d . . . F11 F 0.08114(13) 0.3658(5) 0.2020(2) 0.0999(19) Uani 1 1 d . . . F12 F 0.05022(12) 0.1897(6) 0.17004(13) 0.0847(17) Uani 1 1 d . . . S1 S 0.22522(3) 0.28991(12) 0.15632(4) 0.0180(2) Uani 1 1 d . . . S2 S 0.15408(3) 0.40538(13) 0.11702(4) 0.0186(2) Uani 1 1 d . . . S3 S 0.21780(3) 0.57008(11) 0.13301(4) 0.0165(2) Uani 1 1 d . . . S4 S 0.09849(3) 0.73207(12) 0.41834(4) 0.0192(3) Uani 1 1 d . . . S5 S 0.02734(4) 0.79914(13) 0.42889(4) 0.0241(3) Uani 1 1 d . . . S6 S 0.03390(3) 0.71908(13) 0.33860(4) 0.0238(3) Uani 1 1 d . . . P1 P 0.18794(4) -0.13920(13) -0.00563(5) 0.0230(3) Uani 1 1 d . . . P2 P 0.06444(4) 0.24637(16) 0.22009(5) 0.0348(4) Uani 1 1 d . . . Ru1 Ru 0.197954(10) 0.45685(4) 0.188475(12) 0.01517(8) Uani 1 1 d . . . Ru2 Ru 0.201922(10) 0.39214(4) 0.082474(12) 0.01425(8) Uani 1 1 d . . . Ru3 Ru 0.059039(10) 0.90189(4) 0.382909(13) 0.02035(9) Uani 1 1 d . . . Ru4 Ru 0.047674(10) 0.59696(4) 0.408142(13) 0.01916(9) Uani 1 1 d . . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 C1 0.034(3) 0.062(5) 0.022(3) -0.013(3) 0.009(2) 0.021(3) C2 0.036(3) 0.041(4) 0.024(3) -0.009(3) 0.018(2) -0.008(3) C3 0.052(4) 0.028(3) 0.015(2) 0.002(2) 0.016(2) 0.006(3) C4 0.030(3) 0.043(4) 0.015(2) -0.005(2) -0.001(2) 0.003(3) C5 0.045(4) 0.040(4) 0.025(3) -0.014(3) 0.015(3) -0.021(3) C6 0.083(5) 0.023(3) 0.022(3) -0.005(2) 0.021(3) 0.013(3) C7 0.021(3) 0.025(3) 0.022(2) -0.002(2) 0.010(2) 0.004(2) C8 0.035(3) 0.025(3) 0.020(2) -0.002(2) 0.014(2) -0.002(2) C9 0.033(3) 0.032(3) 0.012(2) -0.001(2) 0.004(2) 0.009(3) C10 0.030(3) 0.039(3) 0.017(2) -0.011(2) -0.001(2) -0.007(3) C11 0.049(4) 0.020(3) 0.022(3) -0.007(2) 0.019(3) -0.012(3) C12 0.042(3) 0.020(3) 0.022(3) 0.002(2) 0.016(2) 0.011(2) C13 0.027(3) 0.018(3) 0.014(2) -0.0018(18) -0.001(2) 0.000(2) C14 0.035(3) 0.016(3) 0.027(3) -0.002(2) 0.010(2) 0.000(2) C15 0.033(3) 0.029(3) 0.035(3) 0.006(3) 0.006(3) -0.007(3) C16 0.059(4) 0.020(3) 0.028(3) 0.006(3) 0.000(3) -0.011(3) C17 0.071(5) 0.015(3) 0.020(3) 0.002(2) 0.008(3) 0.009(3) C18 0.044(3) 0.024(3) 0.022(3) 0.002(2) 0.010(2) 0.006(3) C19 0.017(2) 0.021(3) 0.018(2) -0.004(2) 0.0012(19) 0.002(2) C20 0.027(3) 0.033(3) 0.030(3) 0.005(2) 0.010(2) 0.002(3) C21 0.020(3) 0.042(4) 0.050(4) -0.002(3) 0.015(3) 0.007(3) C22 0.024(3) 0.032(3) 0.046(4) -0.003(3) 0.007(3) 0.013(3) C23 0.029(3) 0.023(3) 0.028(3) 0.000(2) 0.003(2) 0.004(2) C24 0.021(3) 0.023(3) 0.023(2) -0.001(2) 0.005(2) 0.003(2) C25 0.018(2) 0.025(3) 0.019(2) -0.010(2) 0.0051(18) -0.002(2) C26 0.023(3) 0.022(3) 0.032(3) -0.005(2) 0.005(2) -0.002(2) C27 0.024(3) 0.039(4) 0.035(3) -0.013(3) 0.003(2) 0.003(3) C28 0.014(3) 0.056(4) 0.038(3) -0.022(3) 0.010(2) -0.007(3) C29 0.032(3) 0.049(4) 0.036(3) -0.013(3) 0.019(3) -0.016(3) C30 0.027(3) 0.041(4) 0.021(3) -0.004(2) 0.009(2) -0.011(3) C31 0.032(3) 0.025(3) 0.067(4) 0.013(3) 0.005(3) 0.003(3) C32 0.068(5) 0.027(4) 0.059(4) -0.005(3) 0.011(4) -0.006(4) C33 0.051(5) 0.029(4) 0.059(4) 0.008(3) -0.010(4) -0.023(3) C34 0.024(3) 0.040(4) 0.073(5) 0.036(4) 0.008(3) -0.007(3) C35 0.060(5) 0.047(4) 0.053(4) 0.027(3) 0.026(4) -0.002(4) C36 0.038(4) 0.042(4) 0.043(4) 0.024(3) 0.002(3) -0.007(3) C37 0.041(4) 0.028(4) 0.060(4) 0.024(3) -0.010(3) -0.010(3) C38 0.067(5) 0.034(4) 0.031(3) 0.015(3) 0.010(3) -0.018(3) C39 0.043(4) 0.026(3) 0.060(4) 0.015(3) 0.024(3) -0.007(3) C40 0.033(3) 0.023(3) 0.051(4) 0.007(3) -0.001(3) -0.013(3) C41 0.072(5) 0.014(3) 0.040(3) -0.002(3) 0.016(3) -0.012(3) C42 0.039(4) 0.019(3) 0.080(5) 0.015(3) 0.019(4) 0.010(3) C43 0.020(3) 0.028(3) 0.021(2) 0.005(2) 0.006(2) 0.007(2) C44 0.025(3) 0.045(4) 0.029(3) -0.008(3) 0.007(2) -0.004(3) C45 0.018(3) 0.075(5) 0.034(3) -0.003(3) 0.009(3) -0.004(3) C46 0.028(3) 0.072(5) 0.029(3) -0.006(3) 0.008(3) 0.010(3) C47 0.036(3) 0.050(4) 0.022(3) -0.007(3) 0.004(2) 0.006(3) C48 0.023(3) 0.035(3) 0.025(3) -0.002(2) 0.003(2) 0.002(2) C49 0.038(3) 0.031(3) 0.026(3) -0.006(2) 0.016(3) -0.007(3) C50 0.043(4) 0.055(4) 0.031(3) -0.008(3) 0.017(3) -0.023(3) C51 0.064(5) 0.071(5) 0.032(3) -0.009(3) 0.030(3) -0.031(4) C52 0.064(5) 0.055(4) 0.023(3) -0.012(3) 0.014(3) -0.020(4) C53 0.042(4) 0.041(4) 0.032(3) -0.005(3) 0.008(3) -0.009(3) C54 0.035(3) 0.033(3) 0.027(3) -0.006(2) 0.016(2) -0.002(3) C55 0.024(3) 0.038(3) 0.018(2) 0.004(2) 0.002(2) -0.005(2) C56 0.037(4) 0.042(4) 0.026(3) 0.003(3) 0.003(3) -0.011(3) C57 0.035(4) 0.061(5) 0.028(3) 0.005(3) -0.004(3) -0.021(3) C58 0.023(3) 0.063(5) 0.053(4) 0.028(4) -0.006(3) -0.009(3) C59 0.025(3) 0.044(4) 0.070(5) 0.015(4) 0.013(3) -0.001(3) C60 0.030(3) 0.034(4) 0.043(3) 0.005(3) 0.007(3) -0.009(3) F1 0.050(2) 0.0275(18) 0.0256(16) 0.0075(13) 0.0133(15) 0.0052(15) F2 0.0334(19) 0.032(2) 0.054(2) -0.0024(16) 0.0243(16) 0.0046(15) F3 0.0333(19) 0.0301(19) 0.044(2) -0.0058(15) 0.0016(15) 0.0010(15) F4 0.042(2) 0.042(2) 0.042(2) 0.0220(17) 0.0086(16) 0.0067(17) F5 0.0312(18) 0.0341(19) 0.0416(19) -0.0025(16) 0.0067(15) -0.0042(15) F6 0.0352(19) 0.050(2) 0.0319(18) -0.0018(16) 0.0148(15) 0.0139(16) F7 0.080(3) 0.079(3) 0.067(3) -0.029(3) -0.016(3) 0.012(3) F8 0.091(3) 0.051(3) 0.059(3) 0.012(2) 0.038(2) -0.012(2) F9 0.041(2) 0.074(3) 0.101(4) 0.033(3) 0.020(2) 0.017(2) F10 0.032(2) 0.070(3) 0.112(4) -0.029(3) -0.009(2) 0.014(2) F11 0.078(4) 0.071(4) 0.172(6) 0.044(4) 0.070(4) -0.010(3) F12 0.057(3) 0.167(5) 0.027(2) -0.010(3) 0.007(2) -0.021(3) S1 0.0200(6) 0.0174(6) 0.0167(5) -0.0014(5) 0.0055(5) 0.0010(5) S2 0.0175(6) 0.0191(6) 0.0192(5) -0.0015(5) 0.0052(4) -0.0016(5) S3 0.0178(6) 0.0150(7) 0.0169(5) -0.0022(4) 0.0054(5) -0.0011(5) S4 0.0172(6) 0.0230(7) 0.0165(5) 0.0009(5) 0.0035(5) -0.0010(5) S5 0.0229(7) 0.0277(7) 0.0233(6) -0.0007(5) 0.0094(5) -0.0026(6) S6 0.0211(7) 0.0302(8) 0.0189(6) 0.0012(5) 0.0039(5) -0.0029(6) P1 0.0234(7) 0.0206(7) 0.0252(7) 0.0033(5) 0.0075(6) 0.0039(5) P2 0.0262(8) 0.0431(10) 0.0301(8) 0.0113(7) 0.0001(6) -0.0029(7) Ru1 0.0175(2) 0.0156(2) 0.01326(16) -0.00188(15) 0.00571(14) 0.00004(16) Ru2 0.01602(19) 0.01366(19) 0.01314(16) -0.00198(15) 0.00434(14) -0.00031(17) Ru3 0.0151(2) 0.0195(2) 0.0243(2) 0.00743(18) 0.00240(16) -0.00211(18) Ru4 0.0192(2) 0.0177(2) 0.01927(18) 0.00228(17) 0.00357(15) -0.00345(18) _geom_special_details ; All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes. ; 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 C1 C6 1.400(9) . ? C1 C2 1.407(9) . ? C1 Ru1 2.183(5) . ? C1 H1 0.9300 . ? C2 C3 1.386(8) . ? C2 Ru1 2.223(5) . ? C2 H2 0.9300 . ? C3 C4 1.401(8) . ? C3 Ru1 2.229(5) . ? C3 H3 0.9300 . ? C4 C5 1.381(8) . ? C4 Ru1 2.205(5) . ? C4 H4 0.9300 . ? C5 C6 1.408(9) . ? C5 Ru1 2.185(5) . ? C5 H5 0.9300 . ? C6 Ru1 2.201(5) . ? C6 H6 0.9300 . ? C7 C12 1.403(7) . ? C7 C8 1.413(7) . ? C7 Ru2 2.224(5) . ? C7 H7 0.9300 . ? C8 C9 1.396(7) . ? C8 Ru2 2.219(5) . ? C8 H8 0.9300 . ? C9 C10 1.400(8) . ? C9 Ru2 2.216(5) . ? C9 H9 0.9300 . ? C10 C11 1.402(8) . ? C10 Ru2 2.174(5) . ? C10 H10 0.9300 . ? C11 C12 1.411(8) . ? C11 Ru2 2.206(5) . ? C11 H11 0.9300 . ? C12 Ru2 2.208(5) . ? C12 H12 0.9300 . ? C13 C18 1.389(7) . ? C13 C14 1.392(7) . ? C13 S1 1.795(5) . ? C14 C15 1.385(7) . ? C14 H14 0.9300 . ? C15 C16 1.375(8) . ? C15 H15 0.9300 . ? C16 C17 1.385(9) . ? C16 H16 0.9300 . ? C17 C18 1.378(8) . ? C17 H17 0.9300 . ? C18 H18 0.9300 . ? C19 C24 1.385(7) . ? C19 C20 1.395(7) . ? C19 S2 1.793(5) . ? C20 C21 1.373(8) . ? C20 H20 0.9300 . ? C21 C22 1.388(8) . ? C21 H21 0.9300 . ? C22 C23 1.387(8) . ? C22 H22 0.9300 . ? C23 C24 1.394(7) . ? C23 H23 0.9300 . ? C24 H24 0.9300 . ? C25 C30 1.383(7) . ? C25 C26 1.387(7) . ? C25 S3 1.798(5) . ? C26 C27 1.398(7) . ? C26 H26 0.9300 . ? C27 C28 1.385(8) . ? C27 H27 0.9300 . ? C28 C29 1.379(9) . ? C28 H28 0.9300 . ? C29 C30 1.387(7) . ? C29 H29 0.9300 . ? C30 H30 0.9300 . ? C31 C36 1.373(9) . ? C31 C32 1.391(9) . ? C31 Ru3 2.210(6) . ? C31 H31 0.9300 . ? C32 C33 1.358(10) . ? C32 Ru3 2.195(7) . ? C32 H32 0.9300 . ? C33 C34 1.382(10) . ? C33 Ru3 2.198(6) . ? C33 H33 0.9300 . ? C34 C35 1.421(9) . ? C34 Ru3 2.194(6) . ? C34 H34 0.9300 . ? C35 C36 1.445(9) . ? C35 Ru3 2.189(6) . ? C35 H35 0.9300 . ? C36 Ru3 2.198(6) . ? C36 H36 0.9300 . ? C37 C38 1.394(10) . ? C37 C42 1.409(10) . ? C37 Ru4 2.204(6) . ? C37 H37 0.9300 . ? C38 C39 1.418(9) . ? C38 Ru4 2.204(6) . ? C38 H38 0.9300 . ? C39 C40 1.383(9) . ? C39 Ru4 2.185(6) . ? C39 H39 0.9300 . ? C40 C41 1.397(9) . ? C40 Ru4 2.193(6) . ? C40 H40 0.9300 . ? C41 C42 1.394(9) . ? C41 Ru4 2.193(6) . ? C41 H41 0.9300 . ? C42 Ru4 2.210(6) . ? C42 H42 0.9300 . ? C43 C48 1.396(7) . ? C43 C44 1.396(7) . ? C43 S4 1.792(5) . ? C44 C45 1.381(8) . ? C44 H44 0.9300 . ? C45 C46 1.379(9) . ? C45 H45 0.9300 . ? C46 C47 1.371(9) . ? C46 H46 0.9300 . ? C47 C48 1.384(7) . ? C47 H47 0.9300 . ? C48 H48 0.9300 . ? C49 C50 1.375(7) . ? C49 C54 1.404(8) . ? C49 S5 1.796(6) . ? C50 C51 1.396(8) . ? C50 H50 0.9300 . ? C51 C52 1.367(9) . ? C51 H51 0.9300 . ? C52 C53 1.382(8) . ? C52 H52 0.9300 . ? C53 C54 1.387(7) . ? C53 H53 0.9300 . ? C54 H54 0.9300 . ? C55 C60 1.382(8) . ? C55 C56 1.383(8) . ? C55 S6 1.795(5) . ? C56 C57 1.386(8) . ? C56 H56 0.9300 . ? C57 C58 1.374(10) . ? C57 H57 0.9300 . ? C58 C59 1.367(10) . ? C58 H58 0.9300 . ? C59 C60 1.393(8) . ? C59 H59 0.9300 . ? C60 H60 0.9300 . ? F1 P1 1.599(3) . ? F2 P1 1.604(3) . ? F3 P1 1.605(3) . ? F4 P1 1.601(3) . ? F5 P1 1.602(3) . ? F6 P1 1.585(3) . ? F7 P2 1.576(4) . ? F8 P2 1.576(4) . ? F9 P2 1.589(4) . ? F10 P2 1.574(4) . ? F11 P2 1.583(4) . ? F12 P2 1.583(4) . ? S1 Ru1 2.4019(13) . ? S1 Ru2 2.4239(12) . ? S2 Ru2 2.4014(12) . ? S2 Ru1 2.4112(12) . ? S3 Ru1 2.3764(12) . ? S3 Ru2 2.3858(12) . ? S4 Ru4 2.3823(13) . ? S4 Ru3 2.3961(13) . ? S5 Ru3 2.3828(13) . ? S5 Ru4 2.4119(14) . ? S6 Ru3 2.3866(14) . ? S6 Ru4 2.4043(13) . ? 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 C6 C1 C2 120.5(5) . . ? C6 C1 Ru1 72.1(3) . . ? C2 C1 Ru1 72.9(3) . . ? C6 C1 H1 119.8 . . ? C2 C1 H1 119.8 . . ? Ru1 C1 H1 127.3 . . ? C3 C2 C1 119.6(6) . . ? C3 C2 Ru1 72.1(3) . . ? C1 C2 Ru1 69.8(3) . . ? C3 C2 H2 120.2 . . ? C1 C2 H2 120.2 . . ? Ru1 C2 H2 130.4 . . ? C2 C3 C4 120.3(5) . . ? C2 C3 Ru1 71.6(3) . . ? C4 C3 Ru1 70.7(3) . . ? C2 C3 H3 119.8 . . ? C4 C3 H3 119.8 . . ? Ru1 C3 H3 130.5 . . ? C5 C4 C3 120.1(5) . . ? C5 C4 Ru1 70.9(3) . . ? C3 C4 Ru1 72.5(3) . . ? C5 C4 H4 119.9 . . ? C3 C4 H4 119.9 . . ? Ru1 C4 H4 129.0 . . ? C4 C5 C6 120.6(6) . . ? C4 C5 Ru1 72.5(3) . . ? C6 C5 Ru1 71.9(3) . . ? C4 C5 H5 119.7 . . ? C6 C5 H5 119.7 . . ? Ru1 C5 H5 128.1 . . ? C1 C6 C5 118.9(6) . . ? C1 C6 Ru1 70.7(3) . . ? C5 C6 Ru1 70.7(3) . . ? C1 C6 H6 120.6 . . ? C5 C6 H6 120.6 . . ? Ru1 C6 H6 130.6 . . ? C12 C7 C8 119.2(5) . . ? C12 C7 Ru2 70.9(3) . . ? C8 C7 Ru2 71.2(3) . . ? C12 C7 H7 120.4 . . ? C8 C7 H7 120.4 . . ? Ru2 C7 H7 129.8 . . ? C9 C8 C7 120.4(5) . . ? C9 C8 Ru2 71.6(3) . . ? C7 C8 Ru2 71.7(3) . . ? C9 C8 H8 119.8 . . ? C7 C8 H8 119.8 . . ? Ru2 C8 H8 129.4 . . ? C8 C9 C10 119.6(5) . . ? C8 C9 Ru2 71.7(3) . . ? C10 C9 Ru2 69.8(3) . . ? C8 C9 H9 120.2 . . ? C10 C9 H9 120.2 . . ? Ru2 C9 H9 130.9 . . ? C9 C10 C11 121.2(5) . . ? C9 C10 Ru2 73.1(3) . . ? C11 C10 Ru2 72.6(3) . . ? C9 C10 H10 119.4 . . ? C11 C10 H10 119.4 . . ? Ru2 C10 H10 127.0 . . ? C10 C11 C12 118.6(5) . . ? C10 C11 Ru2 70.1(3) . . ? C12 C11 Ru2 71.4(3) . . ? C10 C11 H11 120.7 . . ? C12 C11 H11 120.7 . . ? Ru2 C11 H11 130.2 . . ? C7 C12 C11 120.9(5) . . ? C7 C12 Ru2 72.2(3) . . ? C11 C12 Ru2 71.3(3) . . ? C7 C12 H12 119.6 . . ? C11 C12 H12 119.6 . . ? Ru2 C12 H12 129.5 . . ? C18 C13 C14 119.0(5) . . ? C18 C13 S1 117.7(4) . . ? C14 C13 S1 123.3(4) . . ? C15 C14 C13 120.1(5) . . ? C15 C14 H14 120.0 . . ? C13 C14 H14 120.0 . . ? C16 C15 C14 120.5(6) . . ? C16 C15 H15 119.8 . . ? C14 C15 H15 119.8 . . ? C15 C16 C17 119.7(5) . . ? C15 C16 H16 120.1 . . ? C17 C16 H16 120.1 . . ? C18 C17 C16 120.2(5) . . ? C18 C17 H17 119.9 . . ? C16 C17 H17 119.9 . . ? C17 C18 C13 120.6(5) . . ? C17 C18 H18 119.7 . . ? C13 C18 H18 119.7 . . ? C24 C19 C20 118.9(5) . . ? C24 C19 S2 124.1(4) . . ? C20 C19 S2 117.0(4) . . ? C21 C20 C19 120.9(5) . . ? C21 C20 H20 119.5 . . ? C19 C20 H20 119.5 . . ? C20 C21 C22 120.0(5) . . ? C20 C21 H21 120.0 . . ? C22 C21 H21 120.0 . . ? C23 C22 C21 120.0(5) . . ? C23 C22 H22 120.0 . . ? C21 C22 H22 120.0 . . ? C22 C23 C24 119.7(5) . . ? C22 C23 H23 120.1 . . ? C24 C23 H23 120.1 . . ? C19 C24 C23 120.5(5) . . ? C19 C24 H24 119.8 . . ? C23 C24 H24 119.8 . . ? C30 C25 C26 120.6(5) . . ? C30 C25 S3 115.8(4) . . ? C26 C25 S3 123.6(4) . . ? C25 C26 C27 119.1(5) . . ? C25 C26 H26 120.5 . . ? C27 C26 H26 120.5 . . ? C28 C27 C26 120.4(5) . . ? C28 C27 H27 119.8 . . ? C26 C27 H27 119.8 . . ? C29 C28 C27 119.6(5) . . ? C29 C28 H28 120.2 . . ? C27 C28 H28 120.2 . . ? C28 C29 C30 120.7(6) . . ? C28 C29 H29 119.7 . . ? C30 C29 H29 119.7 . . ? C25 C30 C29 119.6(5) . . ? C25 C30 H30 120.2 . . ? C29 C30 H30 120.2 . . ? C36 C31 C32 121.4(6) . . ? C36 C31 Ru3 71.4(4) . . ? C32 C31 Ru3 71.0(4) . . ? C36 C31 H31 119.3 . . ? C32 C31 H31 119.3 . . ? Ru3 C31 H31 131.2 . . ? C33 C32 C31 119.7(7) . . ? C33 C32 Ru3 72.1(4) . . ? C31 C32 Ru3 72.2(4) . . ? C33 C32 H32 120.2 . . ? C31 C32 H32 120.2 . . ? Ru3 C32 H32 127.5 . . ? C32 C33 C34 122.2(7) . . ? C32 C33 Ru3 71.8(4) . . ? C34 C33 Ru3 71.5(4) . . ? C32 C33 H33 118.9 . . ? C34 C33 H33 118.9 . . ? Ru3 C33 H33 130.6 . . ? C33 C34 C35 119.3(6) . . ? C33 C34 Ru3 71.8(4) . . ? C35 C34 Ru3 70.9(3) . . ? C33 C34 H34 120.4 . . ? C35 C34 H34 120.4 . . ? Ru3 C34 H34 129.2 . . ? C34 C35 C36 118.1(7) . . ? C34 C35 Ru3 71.3(3) . . ? C36 C35 Ru3 71.1(3) . . ? C34 C35 H35 120.9 . . ? C36 C35 H35 120.9 . . ? Ru3 C35 H35 128.8 . . ? C31 C36 C35 119.2(6) . . ? C31 C36 Ru3 72.3(3) . . ? C35 C36 Ru3 70.4(3) . . ? C31 C36 H36 120.4 . . ? C35 C36 H36 120.4 . . ? Ru3 C36 H36 129.1 . . ? C38 C37 C42 120.6(6) . . ? C38 C37 Ru4 71.6(4) . . ? C42 C37 Ru4 71.6(3) . . ? C38 C37 H37 119.7 . . ? C42 C37 H37 119.7 . . ? Ru4 C37 H37 129.6 . . ? C37 C38 C39 118.4(6) . . ? C37 C38 Ru4 71.5(3) . . ? C39 C38 Ru4 70.4(3) . . ? C37 C38 H38 120.8 . . ? C39 C38 H38 120.8 . . ? Ru4 C38 H38 129.5 . . ? C40 C39 C38 121.0(6) . . ? C40 C39 Ru4 71.9(3) . . ? C38 C39 Ru4 71.9(3) . . ? C40 C39 H39 119.5 . . ? C38 C39 H39 119.5 . . ? Ru4 C39 H39 129.1 . . ? C39 C40 C41 120.2(6) . . ? C39 C40 Ru4 71.2(3) . . ? C41 C40 Ru4 71.4(3) . . ? C39 C40 H40 119.9 . . ? C41 C40 H40 119.9 . . ? Ru4 C40 H40 129.9 . . ? C42 C41 C40 119.9(6) . . ? C42 C41 Ru4 72.2(4) . . ? C40 C41 Ru4 71.4(3) . . ? C42 C41 H41 120.1 . . ? C40 C41 H41 120.1 . . ? Ru4 C41 H41 128.6 . . ? C41 C42 C37 119.9(6) . . ? C41 C42 Ru4 70.9(3) . . ? C37 C42 Ru4 71.1(4) . . ? C41 C42 H42 120.0 . . ? C37 C42 H42 120.0 . . ? Ru4 C42 H42 130.5 . . ? C48 C43 C44 119.2(5) . . ? C48 C43 S4 124.0(4) . . ? C44 C43 S4 116.6(4) . . ? C45 C44 C43 119.8(6) . . ? C45 C44 H44 120.1 . . ? C43 C44 H44 120.1 . . ? C46 C45 C44 120.4(6) . . ? C46 C45 H45 119.8 . . ? C44 C45 H45 119.8 . . ? C47 C46 C45 120.3(6) . . ? C47 C46 H46 119.8 . . ? C45 C46 H46 119.8 . . ? C46 C47 C48 120.3(6) . . ? C46 C47 H47 119.9 . . ? C48 C47 H47 119.9 . . ? C47 C48 C43 119.9(5) . . ? C47 C48 H48 120.0 . . ? C43 C48 H48 120.0 . . ? C50 C49 C54 119.5(5) . . ? C50 C49 S5 116.7(4) . . ? C54 C49 S5 123.8(4) . . ? C49 C50 C51 120.4(6) . . ? C49 C50 H50 119.8 . . ? C51 C50 H50 119.8 . . ? C52 C51 C50 119.9(6) . . ? C52 C51 H51 120.1 . . ? C50 C51 H51 120.1 . . ? C51 C52 C53 120.5(6) . . ? C51 C52 H52 119.7 . . ? C53 C52 H52 119.7 . . ? C52 C53 C54 120.2(6) . . ? C52 C53 H53 119.9 . . ? C54 C53 H53 119.9 . . ? C53 C54 C49 119.5(5) . . ? C53 C54 H54 120.2 . . ? C49 C54 H54 120.2 . . ? C60 C55 C56 119.7(5) . . ? C60 C55 S6 123.4(4) . . ? C56 C55 S6 116.8(5) . . ? C55 C56 C57 119.8(6) . . ? C55 C56 H56 120.1 . . ? C57 C56 H56 120.1 . . ? C58 C57 C56 120.3(6) . . ? C58 C57 H57 119.9 . . ? C56 C57 H57 119.9 . . ? C59 C58 C57 120.2(6) . . ? C59 C58 H58 119.9 . . ? C57 C58 H58 119.9 . . ? C58 C59 C60 120.2(7) . . ? C58 C59 H59 119.9 . . ? C60 C59 H59 119.9 . . ? C55 C60 C59 119.8(6) . . ? C55 C60 H60 120.1 . . ? C59 C60 H60 120.1 . . ? C13 S1 Ru1 111.59(17) . . ? C13 S1 Ru2 107.15(16) . . ? Ru1 S1 Ru2 88.17(4) . . ? C19 S2 Ru2 114.50(17) . . ? C19 S2 Ru1 108.14(16) . . ? Ru2 S2 Ru1 88.48(4) . . ? C25 S3 Ru1 113.69(17) . . ? C25 S3 Ru2 111.61(16) . . ? Ru1 S3 Ru2 89.67(4) . . ? C43 S4 Ru4 113.93(18) . . ? C43 S4 Ru3 111.05(17) . . ? Ru4 S4 Ru3 88.96(4) . . ? C49 S5 Ru3 112.43(19) . . ? C49 S5 Ru4 107.8(2) . . ? Ru3 S5 Ru4 88.58(4) . . ? C55 S6 Ru3 112.5(2) . . ? C55 S6 Ru4 110.50(17) . . ? Ru3 S6 Ru4 88.67(4) . . ? F6 P1 F1 90.42(18) . . ? F6 P1 F4 90.34(19) . . ? F1 P1 F4 179.2(2) . . ? F6 P1 F5 90.88(19) . . ? F1 P1 F5 89.72(18) . . ? F4 P1 F5 90.08(19) . . ? F6 P1 F2 179.0(2) . . ? F1 P1 F2 90.01(18) . . ? F4 P1 F2 89.24(19) . . ? F5 P1 F2 89.99(18) . . ? F6 P1 F3 89.64(19) . . ? F1 P1 F3 89.81(18) . . ? F4 P1 F3 90.38(19) . . ? F5 P1 F3 179.3(2) . . ? F2 P1 F3 89.50(18) . . ? F10 P2 F7 89.9(3) . . ? F10 P2 F8 91.2(3) . . ? F7 P2 F8 90.8(3) . . ? F10 P2 F11 90.8(3) . . ? F7 P2 F11 89.7(3) . . ? F8 P2 F11 177.9(3) . . ? F10 P2 F12 89.3(3) . . ? F7 P2 F12 178.6(3) . . ? F8 P2 F12 88.1(3) . . ? F11 P2 F12 91.4(3) . . ? F10 P2 F9 179.2(3) . . ? F7 P2 F9 89.3(3) . . ? F8 P2 F9 88.9(2) . . ? F11 P2 F9 89.0(3) . . ? F12 P2 F9 91.5(3) . . ? C1 Ru1 C5 67.2(2) . . ? C1 Ru1 C6 37.2(2) . . ? C5 Ru1 C6 37.5(2) . . ? C1 Ru1 C4 78.9(2) . . ? C5 Ru1 C4 36.7(2) . . ? C6 Ru1 C4 66.7(2) . . ? C1 Ru1 C2 37.2(2) . . ? C5 Ru1 C2 78.7(2) . . ? C6 Ru1 C2 66.8(2) . . ? C4 Ru1 C2 66.2(2) . . ? C1 Ru1 C3 66.3(2) . . ? C5 Ru1 C3 66.2(2) . . ? C6 Ru1 C3 78.4(2) . . ? C4 Ru1 C3 36.8(2) . . ? C2 Ru1 C3 36.3(2) . . ? C1 Ru1 S3 123.54(19) . . ? C5 Ru1 S3 95.38(15) . . ? C6 Ru1 S3 97.23(16) . . ? C4 Ru1 S3 118.95(16) . . ? C2 Ru1 S3 160.69(17) . . ? C3 Ru1 S3 155.17(16) . . ? C1 Ru1 S1 155.0(2) . . ? C5 Ru1 S1 127.37(17) . . ? C6 Ru1 S1 164.3(2) . . ? C4 Ru1 S1 102.04(15) . . ? C2 Ru1 S1 119.98(16) . . ? C3 Ru1 S1 99.23(14) . . ? S3 Ru1 S1 78.28(4) . . ? C1 Ru1 S2 96.88(16) . . ? C5 Ru1 S2 154.12(18) . . ? C6 Ru1 S2 118.40(18) . . ? C4 Ru1 S2 164.35(16) . . ? C2 Ru1 S2 101.33(15) . . ? C3 Ru1 S2 127.71(16) . . ? S3 Ru1 S2 76.02(4) . . ? S1 Ru1 S2 75.44(4) . . ? C10 Ru2 C11 37.3(2) . . ? C10 Ru2 C12 67.0(2) . . ? C11 Ru2 C12 37.3(2) . . ? C10 Ru2 C9 37.2(2) . . ? C11 Ru2 C9 67.0(2) . . ? C12 Ru2 C9 78.67(19) . . ? C10 Ru2 C8 66.7(2) . . ? C11 Ru2 C8 79.09(19) . . ? C12 Ru2 C8 66.55(19) . . ? C9 Ru2 C8 36.71(19) . . ? C10 Ru2 C7 79.2(2) . . ? C11 Ru2 C7 67.1(2) . . ? C12 Ru2 C7 36.89(19) . . ? C9 Ru2 C7 66.60(19) . . ? C8 Ru2 C7 37.09(18) . . ? C10 Ru2 S3 139.95(16) . . ? C11 Ru2 S3 174.69(14) . . ? C12 Ru2 S3 140.56(15) . . ? C9 Ru2 S3 108.48(15) . . ? C8 Ru2 S3 95.61(14) . . ? C7 Ru2 S3 108.85(14) . . ? C10 Ru2 S2 94.64(16) . . ? C11 Ru2 S2 107.81(15) . . ? C12 Ru2 S2 140.04(15) . . ? C9 Ru2 S2 108.52(14) . . ? C8 Ru2 S2 140.20(14) . . ? C7 Ru2 S2 173.79(14) . . ? S3 Ru2 S2 76.04(4) . . ? C10 Ru2 S1 138.27(16) . . ? C11 Ru2 S1 106.68(15) . . ? C12 Ru2 S1 94.88(14) . . ? C9 Ru2 S1 173.28(15) . . ? C8 Ru2 S1 141.87(14) . . ? C7 Ru2 S1 109.26(13) . . ? S3 Ru2 S1 77.67(4) . . ? S2 Ru2 S1 75.21(4) . . ? C35 Ru3 C34 37.8(2) . . ? C35 Ru3 C32 79.5(3) . . ? C34 Ru3 C32 66.3(3) . . ? C35 Ru3 C36 38.5(2) . . ? C34 Ru3 C36 68.1(2) . . ? C32 Ru3 C36 66.5(3) . . ? C35 Ru3 C33 66.9(3) . . ? C34 Ru3 C33 36.7(3) . . ? C32 Ru3 C33 36.0(3) . . ? C36 Ru3 C33 78.4(2) . . ? C35 Ru3 C31 67.1(3) . . ? C34 Ru3 C31 78.4(2) . . ? C32 Ru3 C31 36.8(2) . . ? C36 Ru3 C31 36.3(2) . . ? C33 Ru3 C31 65.2(2) . . ? C35 Ru3 S5 166.2(2) . . ? C34 Ru3 S5 150.8(2) . . ? C32 Ru3 S5 96.0(2) . . ? C36 Ru3 S5 127.86(18) . . ? C33 Ru3 S5 116.5(2) . . ? C31 Ru3 S5 101.56(18) . . ? C35 Ru3 S6 101.2(2) . . ? C34 Ru3 S6 129.2(2) . . ? C32 Ru3 S6 153.2(2) . . ? C36 Ru3 S6 97.18(19) . . ? C33 Ru3 S6 165.9(2) . . ? C31 Ru3 S6 118.54(17) . . ? S5 Ru3 S6 76.90(5) . . ? C35 Ru3 S4 116.2(2) . . ? C34 Ru3 S4 95.40(17) . . ? C32 Ru3 S4 127.8(2) . . ? C36 Ru3 S4 152.94(19) . . ? C33 Ru3 S4 101.41(19) . . ? C31 Ru3 S4 164.59(18) . . ? S5 Ru3 S4 76.89(5) . . ? S6 Ru3 S4 76.33(5) . . ? C39 Ru4 C40 36.8(2) . . ? C39 Ru4 C41 66.8(2) . . ? C40 Ru4 C41 37.1(2) . . ? C39 Ru4 C37 66.8(2) . . ? C40 Ru4 C37 78.9(2) . . ? C41 Ru4 C37 67.0(3) . . ? C39 Ru4 C38 37.7(2) . . ? C40 Ru4 C38 67.3(2) . . ? C41 Ru4 C38 79.6(2) . . ? C37 Ru4 C38 36.9(3) . . ? C39 Ru4 C42 78.7(2) . . ? C40 Ru4 C42 66.5(2) . . ? C41 Ru4 C42 36.9(2) . . ? C37 Ru4 C42 37.2(3) . . ? C38 Ru4 C42 67.0(3) . . ? C39 Ru4 S4 151.21(18) . . ? C40 Ru4 S4 167.50(19) . . ? C41 Ru4 S4 130.40(19) . . ? C37 Ru4 S4 96.86(17) . . ? C38 Ru4 S4 115.93(18) . . ? C42 Ru4 S4 102.96(17) . . ? C39 Ru4 S6 128.99(18) . . ? C40 Ru4 S6 102.10(16) . . ? C41 Ru4 S6 97.04(16) . . ? C37 Ru4 S6 152.7(2) . . ? C38 Ru4 S6 166.49(19) . . ? C42 Ru4 S6 117.70(19) . . ? S4 Ru4 S6 76.25(4) . . ? C39 Ru4 S5 94.93(18) . . ? C40 Ru4 S5 115.29(18) . . ? C41 Ru4 S5 150.42(19) . . ? C37 Ru4 S5 128.8(2) . . ? C38 Ru4 S5 100.4(2) . . ? C42 Ru4 S5 166.0(2) . . ? S4 Ru4 S5 76.59(5) . . ? S6 Ru4 S5 76.02(5) . . ? loop_ _geom_torsion_atom_site_label_1 _geom_torsion_atom_site_label_2 _geom_torsion_atom_site_label_3 _geom_torsion_atom_site_label_4 _geom_torsion _geom_torsion_site_symmetry_1 _geom_torsion_site_symmetry_2 _geom_torsion_site_symmetry_3 _geom_torsion_site_symmetry_4 _geom_torsion_publ_flag C6 C1 C2 C3 -2.2(7) . . . . ? Ru1 C1 C2 C3 54.2(4) . . . . ? C6 C1 C2 Ru1 -56.3(4) . . . . ? C1 C2 C3 C4 0.1(7) . . . . ? Ru1 C2 C3 C4 53.3(4) . . . . ? C1 C2 C3 Ru1 -53.1(4) . . . . ? C2 C3 C4 C5 0.8(7) . . . . ? Ru1 C3 C4 C5 54.5(4) . . . . ? C2 C3 C4 Ru1 -53.7(4) . . . . ? C3 C4 C5 C6 0.3(8) . . . . ? Ru1 C4 C5 C6 55.6(5) . . . . ? C3 C4 C5 Ru1 -55.3(4) . . . . ? C2 C1 C6 C5 3.2(8) . . . . ? Ru1 C1 C6 C5 -53.6(4) . . . . ? C2 C1 C6 Ru1 56.8(4) . . . . ? C4 C5 C6 C1 -2.2(8) . . . . ? Ru1 C5 C6 C1 53.6(4) . . . . ? C4 C5 C6 Ru1 -55.8(5) . . . . ? C12 C7 C8 C9 -0.3(7) . . . . ? Ru2 C7 C8 C9 -54.5(4) . . . . ? C12 C7 C8 Ru2 54.2(4) . . . . ? C7 C8 C9 C10 1.8(7) . . . . ? Ru2 C8 C9 C10 -52.7(4) . . . . ? C7 C8 C9 Ru2 54.5(4) . . . . ? C8 C9 C10 C11 -3.0(7) . . . . ? Ru2 C9 C10 C11 -56.6(4) . . . . ? C8 C9 C10 Ru2 53.6(4) . . . . ? C9 C10 C11 C12 2.5(7) . . . . ? Ru2 C10 C11 C12 -54.3(4) . . . . ? C9 C10 C11 Ru2 56.8(4) . . . . ? C8 C7 C12 C11 -0.2(7) . . . . ? Ru2 C7 C12 C11 54.2(4) . . . . ? C8 C7 C12 Ru2 -54.3(4) . . . . ? C10 C11 C12 C7 -0.9(7) . . . . ? Ru2 C11 C12 C7 -54.6(4) . . . . ? C10 C11 C12 Ru2 53.7(4) . . . . ? C18 C13 C14 C15 -0.8(8) . . . . ? S1 C13 C14 C15 -178.6(4) . . . . ? C13 C14 C15 C16 -0.7(8) . . . . ? C14 C15 C16 C17 1.2(8) . . . . ? C15 C16 C17 C18 -0.2(8) . . . . ? C16 C17 C18 C13 -1.3(8) . . . . ? C14 C13 C18 C17 1.7(8) . . . . ? S1 C13 C18 C17 179.7(4) . . . . ? C24 C19 C20 C21 -1.8(8) . . . . ? S2 C19 C20 C21 178.8(4) . . . . ? C19 C20 C21 C22 2.1(9) . . . . ? C20 C21 C22 C23 -1.0(9) . . . . ? C21 C22 C23 C24 -0.5(8) . . . . ? C20 C19 C24 C23 0.3(7) . . . . ? S2 C19 C24 C23 179.7(4) . . . . ? C22 C23 C24 C19 0.8(8) . . . . ? C30 C25 C26 C27 0.6(8) . . . . ? S3 C25 C26 C27 -176.7(4) . . . . ? C25 C26 C27 C28 0.7(8) . . . . ? C26 C27 C28 C29 -2.1(8) . . . . ? C27 C28 C29 C30 2.3(9) . . . . ? C26 C25 C30 C29 -0.4(8) . . . . ? S3 C25 C30 C29 177.1(4) . . . . ? C28 C29 C30 C25 -1.1(8) . . . . ? C36 C31 C32 C33 3.7(10) . . . . ? Ru3 C31 C32 C33 56.4(6) . . . . ? C36 C31 C32 Ru3 -52.7(6) . . . . ? C31 C32 C33 C34 -3.4(10) . . . . ? Ru3 C32 C33 C34 53.0(6) . . . . ? C31 C32 C33 Ru3 -56.4(6) . . . . ? C32 C33 C34 C35 1.4(10) . . . . ? Ru3 C33 C34 C35 54.6(5) . . . . ? C32 C33 C34 Ru3 -53.2(6) . . . . ? C33 C34 C35 C36 0.3(9) . . . . ? Ru3 C34 C35 C36 55.3(5) . . . . ? C33 C34 C35 Ru3 -55.1(5) . . . . ? C32 C31 C36 C35 -2.0(9) . . . . ? Ru3 C31 C36 C35 -54.5(5) . . . . ? C32 C31 C36 Ru3 52.5(6) . . . . ? C34 C35 C36 C31 0.0(9) . . . . ? Ru3 C35 C36 C31 55.4(5) . . . . ? C34 C35 C36 Ru3 -55.4(5) . . . . ? C42 C37 C38 C39 0.1(9) . . . . ? Ru4 C37 C38 C39 54.4(5) . . . . ? C42 C37 C38 Ru4 -54.3(5) . . . . ? C37 C38 C39 C40 -0.2(9) . . . . ? Ru4 C38 C39 C40 54.8(5) . . . . ? C37 C38 C39 Ru4 -54.9(5) . . . . ? C38 C39 C40 C41 -0.7(9) . . . . ? Ru4 C39 C40 C41 54.1(5) . . . . ? C38 C39 C40 Ru4 -54.7(5) . . . . ? C39 C40 C41 C42 1.6(9) . . . . ? Ru4 C40 C41 C42 55.6(5) . . . . ? C39 C40 C41 Ru4 -54.0(5) . . . . ? C40 C41 C42 C37 -1.7(9) . . . . ? Ru4 C41 C42 C37 53.6(5) . . . . ? C40 C41 C42 Ru4 -55.2(5) . . . . ? C38 C37 C42 C41 0.9(9) . . . . ? Ru4 C37 C42 C41 -53.4(5) . . . . ? C38 C37 C42 Ru4 54.3(5) . . . . ? C48 C43 C44 C45 0.6(8) . . . . ? S4 C43 C44 C45 177.0(5) . . . . ? C43 C44 C45 C46 -2.8(9) . . . . ? C44 C45 C46 C47 2.5(10) . . . . ? C45 C46 C47 C48 0.0(9) . . . . ? C46 C47 C48 C43 -2.1(9) . . . . ? C44 C43 C48 C47 1.8(8) . . . . ? S4 C43 C48 C47 -174.3(4) . . . . ? C54 C49 C50 C51 -2.0(10) . . . . ? S5 C49 C50 C51 179.2(6) . . . . ? C49 C50 C51 C52 0.3(11) . . . . ? C50 C51 C52 C53 1.3(12) . . . . ? C51 C52 C53 C54 -1.0(11) . . . . ? C52 C53 C54 C49 -0.7(10) . . . . ? C50 C49 C54 C53 2.2(9) . . . . ? S5 C49 C54 C53 -179.0(5) . . . . ? C60 C55 C56 C57 1.6(8) . . . . ? S6 C55 C56 C57 -174.8(4) . . . . ? C55 C56 C57 C58 0.5(9) . . . . ? C56 C57 C58 C59 -1.7(10) . . . . ? C57 C58 C59 C60 0.8(10) . . . . ? C56 C55 C60 C59 -2.6(8) . . . . ? S6 C55 C60 C59 173.6(5) . . . . ? C58 C59 C60 C55 1.4(9) . . . . ? C18 C13 S1 Ru1 175.2(3) . . . . ? C14 C13 S1 Ru1 -6.9(5) . . . . ? C18 C13 S1 Ru2 80.3(4) . . . . ? C14 C13 S1 Ru2 -101.9(4) . . . . ? C24 C19 S2 Ru2 -5.1(5) . . . . ? C20 C19 S2 Ru2 174.3(3) . . . . ? C24 C19 S2 Ru1 91.7(4) . . . . ? C20 C19 S2 Ru1 -88.9(4) . . . . ? C30 C25 S3 Ru1 -162.7(3) . . . . ? C26 C25 S3 Ru1 14.8(5) . . . . ? C30 C25 S3 Ru2 97.7(4) . . . . ? C26 C25 S3 Ru2 -84.8(4) . . . . ? C48 C43 S4 Ru4 2.2(5) . . . . ? C44 C43 S4 Ru4 -174.0(4) . . . . ? C48 C43 S4 Ru3 -96.4(4) . . . . ? C44 C43 S4 Ru3 87.4(4) . . . . ? C50 C49 S5 Ru3 169.8(4) . . . . ? C54 C49 S5 Ru3 -9.1(6) . . . . ? C50 C49 S5 Ru4 -94.2(5) . . . . ? C54 C49 S5 Ru4 86.9(5) . . . . ? C60 C55 S6 Ru3 1.6(5) . . . . ? C56 C55 S6 Ru3 177.9(4) . . . . ? C60 C55 S6 Ru4 98.9(5) . . . . ? C56 C55 S6 Ru4 -84.8(4) . . . . ? C6 C1 Ru1 C5 29.5(3) . . . . ? C2 C1 Ru1 C5 -101.5(4) . . . . ? C2 C1 Ru1 C6 -131.1(5) . . . . ? C6 C1 Ru1 C4 66.0(4) . . . . ? C2 C1 Ru1 C4 -65.1(3) . . . . ? C6 C1 Ru1 C2 131.1(5) . . . . ? C6 C1 Ru1 C3 102.4(4) . . . . ? C2 C1 Ru1 C3 -28.6(3) . . . . ? C6 C1 Ru1 S3 -51.5(4) . . . . ? C2 C1 Ru1 S3 177.5(3) . . . . ? C6 C1 Ru1 S1 160.7(3) . . . . ? C2 C1 Ru1 S1 29.6(6) . . . . ? C6 C1 Ru1 S2 -129.3(3) . . . . ? C2 C1 Ru1 S2 99.7(3) . . . . ? C4 C5 Ru1 C1 102.3(4) . . . . ? C6 C5 Ru1 C1 -29.4(4) . . . . ? C4 C5 Ru1 C6 131.7(5) . . . . ? C6 C5 Ru1 C4 -131.7(5) . . . . ? C4 C5 Ru1 C2 65.1(4) . . . . ? C6 C5 Ru1 C2 -66.6(4) . . . . ? C4 C5 Ru1 C3 29.2(3) . . . . ? C6 C5 Ru1 C3 -102.4(4) . . . . ? C4 C5 Ru1 S3 -133.4(3) . . . . ? C6 C5 Ru1 S3 94.9(3) . . . . ? C4 C5 Ru1 S1 -54.1(4) . . . . ? C6 C5 Ru1 S1 174.2(3) . . . . ? C4 C5 Ru1 S2 157.8(3) . . . . ? C6 C5 Ru1 S2 26.1(6) . . . . ? C5 C6 Ru1 C1 131.7(5) . . . . ? C1 C6 Ru1 C5 -131.7(5) . . . . ? C1 C6 Ru1 C4 -102.6(4) . . . . ? C5 C6 Ru1 C4 29.0(3) . . . . ? C1 C6 Ru1 C2 -29.8(3) . . . . ? C5 C6 Ru1 C2 101.9(4) . . . . ? C1 C6 Ru1 C3 -65.9(4) . . . . ? C5 C6 Ru1 C3 65.8(4) . . . . ? C1 C6 Ru1 S3 138.9(3) . . . . ? C5 C6 Ru1 S3 -89.4(3) . . . . ? C1 C6 Ru1 S1 -148.9(5) . . . . ? C5 C6 Ru1 S1 -17.2(8) . . . . ? C1 C6 Ru1 S2 60.9(4) . . . . ? C5 C6 Ru1 S2 -167.4(3) . . . . ? C5 C4 Ru1 C1 -66.6(4) . . . . ? C3 C4 Ru1 C1 65.2(4) . . . . ? C3 C4 Ru1 C5 131.8(5) . . . . ? C5 C4 Ru1 C6 -29.6(4) . . . . ? C3 C4 Ru1 C6 102.2(4) . . . . ? C5 C4 Ru1 C2 -103.5(4) . . . . ? C3 C4 Ru1 C2 28.3(3) . . . . ? C5 C4 Ru1 C3 -131.8(5) . . . . ? C5 C4 Ru1 S3 55.7(4) . . . . ? C3 C4 Ru1 S3 -172.5(3) . . . . ? C5 C4 Ru1 S1 138.8(3) . . . . ? C3 C4 Ru1 S1 -89.4(3) . . . . ? C5 C4 Ru1 S2 -142.2(5) . . . . ? C3 C4 Ru1 S2 -10.4(8) . . . . ? C3 C2 Ru1 C1 -132.2(5) . . . . ? C3 C2 Ru1 C5 -65.0(4) . . . . ? C1 C2 Ru1 C5 67.1(4) . . . . ? C3 C2 Ru1 C6 -102.4(4) . . . . ? C1 C2 Ru1 C6 29.8(3) . . . . ? C3 C2 Ru1 C4 -28.7(3) . . . . ? C1 C2 Ru1 C4 103.4(4) . . . . ? C1 C2 Ru1 C3 132.2(5) . . . . ? C3 C2 Ru1 S3 -138.6(4) . . . . ? C1 C2 Ru1 S3 -6.4(7) . . . . ? C3 C2 Ru1 S1 61.8(4) . . . . ? C1 C2 Ru1 S1 -166.1(3) . . . . ? C3 C2 Ru1 S2 141.4(3) . . . . ? C1 C2 Ru1 S2 -86.5(3) . . . . ? C2 C3 Ru1 C1 29.3(4) . . . . ? C4 C3 Ru1 C1 -103.5(4) . . . . ? C2 C3 Ru1 C5 103.7(4) . . . . ? C4 C3 Ru1 C5 -29.1(3) . . . . ? C2 C3 Ru1 C6 66.4(4) . . . . ? C4 C3 Ru1 C6 -66.4(4) . . . . ? C2 C3 Ru1 C4 132.8(5) . . . . ? C4 C3 Ru1 C2 -132.8(5) . . . . ? C2 C3 Ru1 S3 148.6(3) . . . . ? C4 C3 Ru1 S3 15.8(6) . . . . ? C2 C3 Ru1 S1 -129.4(3) . . . . ? C4 C3 Ru1 S1 97.8(3) . . . . ? C2 C3 Ru1 S2 -50.7(4) . . . . ? C4 C3 Ru1 S2 176.5(3) . . . . ? C25 S3 Ru1 C1 117.6(3) . . . . ? Ru2 S3 Ru1 C1 -128.9(2) . . . . ? C25 S3 Ru1 C5 51.4(3) . . . . ? Ru2 S3 Ru1 C5 164.93(18) . . . . ? C25 S3 Ru1 C6 89.0(3) . . . . ? Ru2 S3 Ru1 C6 -157.42(19) . . . . ? C25 S3 Ru1 C4 21.7(3) . . . . ? Ru2 S3 Ru1 C4 135.24(18) . . . . ? C25 S3 Ru1 C2 122.2(5) . . . . ? Ru2 S3 Ru1 C2 -124.2(4) . . . . ? C25 S3 Ru1 C3 11.0(4) . . . . ? Ru2 S3 Ru1 C3 124.5(3) . . . . ? C25 S3 Ru1 S1 -75.72(18) . . . . ? Ru2 S3 Ru1 S1 37.84(4) . . . . ? C25 S3 Ru1 S2 -153.42(18) . . . . ? Ru2 S3 Ru1 S2 -39.87(4) . . . . ? C13 S1 Ru1 C1 8.2(4) . . . . ? Ru2 S1 Ru1 C1 115.9(4) . . . . ? C13 S1 Ru1 C5 127.3(3) . . . . ? Ru2 S1 Ru1 C5 -125.0(2) . . . . ? C13 S1 Ru1 C6 140.3(6) . . . . ? Ru2 S1 Ru1 C6 -111.9(6) . . . . ? C13 S1 Ru1 C4 97.6(2) . . . . ? Ru2 S1 Ru1 C4 -154.63(16) . . . . ? C13 S1 Ru1 C2 28.3(2) . . . . ? Ru2 S1 Ru1 C2 136.09(17) . . . . ? C13 S1 Ru1 C3 60.2(2) . . . . ? Ru2 S1 Ru1 C3 167.97(16) . . . . ? C13 S1 Ru1 S3 -144.90(17) . . . . ? Ru2 S1 Ru1 S3 -37.16(4) . . . . ? C13 S1 Ru1 S2 -66.50(17) . . . . ? Ru2 S1 Ru1 S2 41.25(4) . . . . ? C19 S2 Ru1 C1 47.2(3) . . . . ? Ru2 S2 Ru1 C1 162.5(2) . . . . ? C19 S2 Ru1 C5 -2.7(4) . . . . ? Ru2 S2 Ru1 C5 112.6(3) . . . . ? C19 S2 Ru1 C6 15.0(3) . . . . ? Ru2 S2 Ru1 C6 130.3(2) . . . . ? C19 S2 Ru1 C4 120.3(6) . . . . ? Ru2 S2 Ru1 C4 -124.3(6) . . . . ? C19 S2 Ru1 C2 84.6(2) . . . . ? Ru2 S2 Ru1 C2 -160.03(17) . . . . ? C19 S2 Ru1 C3 112.5(2) . . . . ? Ru2 S2 Ru1 C3 -132.21(18) . . . . ? C19 S2 Ru1 S3 -75.76(18) . . . . ? Ru2 S2 Ru1 S3 39.57(4) . . . . ? C19 S2 Ru1 S1 -157.04(18) . . . . ? Ru2 S2 Ru1 S1 -41.71(4) . . . . ? C9 C10 Ru2 C11 -131.6(5) . . . . ? C9 C10 Ru2 C12 -101.9(4) . . . . ? C11 C10 Ru2 C12 29.7(3) . . . . ? C11 C10 Ru2 C9 131.6(5) . . . . ? C9 C10 Ru2 C8 -28.7(3) . . . . ? C11 C10 Ru2 C8 102.9(4) . . . . ? C9 C10 Ru2 C7 -65.4(3) . . . . ? C11 C10 Ru2 C7 66.2(3) . . . . ? C9 C10 Ru2 S3 41.1(4) . . . . ? C11 C10 Ru2 S3 172.7(2) . . . . ? C9 C10 Ru2 S2 114.9(3) . . . . ? C11 C10 Ru2 S2 -113.5(3) . . . . ? C9 C10 Ru2 S1 -172.2(2) . . . . ? C11 C10 Ru2 S1 -40.6(4) . . . . ? C12 C11 Ru2 C10 131.2(5) . . . . ? C10 C11 Ru2 C12 -131.2(5) . . . . ? C10 C11 Ru2 C9 -29.4(3) . . . . ? C12 C11 Ru2 C9 101.8(3) . . . . ? C10 C11 Ru2 C8 -65.8(3) . . . . ? C12 C11 Ru2 C8 65.4(3) . . . . ? C10 C11 Ru2 C7 -102.6(4) . . . . ? C12 C11 Ru2 C7 28.6(3) . . . . ? C10 C11 Ru2 S2 73.7(3) . . . . ? C12 C11 Ru2 S2 -155.1(3) . . . . ? C10 C11 Ru2 S1 153.1(3) . . . . ? C12 C11 Ru2 S1 -75.7(3) . . . . ? C7 C12 Ru2 C10 103.0(3) . . . . ? C11 C12 Ru2 C10 -29.7(3) . . . . ? C7 C12 Ru2 C11 132.7(5) . . . . ? C7 C12 Ru2 C9 65.9(3) . . . . ? C11 C12 Ru2 C9 -66.8(3) . . . . ? C7 C12 Ru2 C8 29.5(3) . . . . ? C11 C12 Ru2 C8 -103.3(3) . . . . ? C11 C12 Ru2 C7 -132.7(5) . . . . ? C7 C12 Ru2 S3 -39.5(4) . . . . ? C11 C12 Ru2 S3 -172.2(2) . . . . ? C7 C12 Ru2 S2 171.3(2) . . . . ? C11 C12 Ru2 S2 38.6(4) . . . . ? C7 C12 Ru2 S1 -116.0(3) . . . . ? C11 C12 Ru2 S1 111.3(3) . . . . ? C8 C9 Ru2 C10 -132.5(5) . . . . ? C8 C9 Ru2 C11 -103.0(3) . . . . ? C10 C9 Ru2 C11 29.5(3) . . . . ? C8 C9 Ru2 C12 -65.8(3) . . . . ? C10 C9 Ru2 C12 66.7(3) . . . . ? C10 C9 Ru2 C8 132.5(5) . . . . ? C8 C9 Ru2 C7 -29.1(3) . . . . ? C10 C9 Ru2 C7 103.4(4) . . . . ? C8 C9 Ru2 S3 74.0(3) . . . . ? C10 C9 Ru2 S3 -153.5(3) . . . . ? C8 C9 Ru2 S2 155.0(3) . . . . ? C10 C9 Ru2 S2 -72.5(3) . . . . ? C9 C8 Ru2 C10 29.0(3) . . . . ? C7 C8 Ru2 C10 -103.2(3) . . . . ? C9 C8 Ru2 C11 66.0(3) . . . . ? C7 C8 Ru2 C11 -66.2(3) . . . . ? C9 C8 Ru2 C12 102.9(4) . . . . ? C7 C8 Ru2 C12 -29.3(3) . . . . ? C7 C8 Ru2 C9 -132.2(5) . . . . ? C9 C8 Ru2 C7 132.2(5) . . . . ? C9 C8 Ru2 S3 -113.7(3) . . . . ? C7 C8 Ru2 S3 114.1(3) . . . . ? C9 C8 Ru2 S2 -38.8(4) . . . . ? C7 C8 Ru2 S2 -171.0(2) . . . . ? C9 C8 Ru2 S1 169.2(2) . . . . ? C7 C8 Ru2 S1 36.9(4) . . . . ? C12 C7 Ru2 C10 -65.9(3) . . . . ? C8 C7 Ru2 C10 65.6(3) . . . . ? C12 C7 Ru2 C11 -28.9(3) . . . . ? C8 C7 Ru2 C11 102.6(3) . . . . ? C8 C7 Ru2 C12 131.5(5) . . . . ? C12 C7 Ru2 C9 -102.7(3) . . . . ? C8 C7 Ru2 C9 28.8(3) . . . . ? C12 C7 Ru2 C8 -131.5(5) . . . . ? C12 C7 Ru2 S3 154.7(3) . . . . ? C8 C7 Ru2 S3 -73.7(3) . . . . ? C12 C7 Ru2 S1 71.6(3) . . . . ? C8 C7 Ru2 S1 -156.8(3) . . . . ? C25 S3 Ru2 C10 -124.1(3) . . . . ? Ru1 S3 Ru2 C10 120.5(2) . . . . ? C25 S3 Ru2 C12 -4.7(3) . . . . ? Ru1 S3 Ru2 C12 -120.2(2) . . . . ? C25 S3 Ru2 C9 -99.3(2) . . . . ? Ru1 S3 Ru2 C9 145.24(15) . . . . ? C25 S3 Ru2 C8 -64.0(2) . . . . ? Ru1 S3 Ru2 C8 -179.50(14) . . . . ? C25 S3 Ru2 C7 -28.5(2) . . . . ? Ru1 S3 Ru2 C7 -143.93(14) . . . . ? C25 S3 Ru2 S2 155.52(19) . . . . ? Ru1 S3 Ru2 S2 40.06(4) . . . . ? C25 S3 Ru2 S1 77.92(19) . . . . ? Ru1 S3 Ru2 S1 -37.53(4) . . . . ? C19 S2 Ru2 C10 -70.6(2) . . . . ? Ru1 S2 Ru2 C10 -179.85(16) . . . . ? C19 S2 Ru2 C11 -106.3(2) . . . . ? Ru1 S2 Ru2 C11 144.42(16) . . . . ? C19 S2 Ru2 C12 -129.7(3) . . . . ? Ru1 S2 Ru2 C12 121.1(2) . . . . ? C19 S2 Ru2 C9 -35.3(2) . . . . ? Ru1 S2 Ru2 C9 -144.53(16) . . . . ? C19 S2 Ru2 C8 -12.0(3) . . . . ? Ru1 S2 Ru2 C8 -121.3(2) . . . . ? C19 S2 Ru2 S3 69.89(17) . . . . ? Ru1 S2 Ru2 S3 -39.38(4) . . . . ? C19 S2 Ru2 S1 150.58(18) . . . . ? Ru1 S2 Ru2 S1 41.30(4) . . . . ? C13 S1 Ru2 C10 -9.6(3) . . . . ? Ru1 S1 Ru2 C10 -121.7(2) . . . . ? C13 S1 Ru2 C11 -34.0(2) . . . . ? Ru1 S1 Ru2 C11 -146.05(16) . . . . ? C13 S1 Ru2 C12 -70.1(2) . . . . ? Ru1 S1 Ru2 C12 177.87(15) . . . . ? C13 S1 Ru2 C8 -127.5(3) . . . . ? Ru1 S1 Ru2 C8 120.4(2) . . . . ? C13 S1 Ru2 C7 -105.0(2) . . . . ? Ru1 S1 Ru2 C7 142.99(14) . . . . ? C13 S1 Ru2 S3 149.14(18) . . . . ? Ru1 S1 Ru2 S3 37.09(4) . . . . ? C13 S1 Ru2 S2 70.55(18) . . . . ? Ru1 S1 Ru2 S2 -41.50(4) . . . . ? C36 C35 Ru3 C34 -129.9(7) . . . . ? C34 C35 Ru3 C32 64.6(4) . . . . ? C36 C35 Ru3 C32 -65.3(4) . . . . ? C34 C35 Ru3 C36 129.9(7) . . . . ? C34 C35 Ru3 C33 29.2(4) . . . . ? C36 C35 Ru3 C33 -100.7(5) . . . . ? C34 C35 Ru3 C31 100.9(5) . . . . ? C36 C35 Ru3 C31 -29.0(4) . . . . ? C34 C35 Ru3 S5 136.5(8) . . . . ? C36 C35 Ru3 S5 6.6(12) . . . . ? C34 C35 Ru3 S6 -142.6(4) . . . . ? C36 C35 Ru3 S6 87.4(4) . . . . ? C34 C35 Ru3 S4 -62.5(5) . . . . ? C36 C35 Ru3 S4 167.6(3) . . . . ? C33 C34 Ru3 C35 131.2(6) . . . . ? C33 C34 Ru3 C32 27.2(4) . . . . ? C35 C34 Ru3 C32 -104.0(5) . . . . ? C33 C34 Ru3 C36 100.3(4) . . . . ? C35 C34 Ru3 C36 -30.9(4) . . . . ? C35 C34 Ru3 C33 -131.2(6) . . . . ? C33 C34 Ru3 C31 63.8(4) . . . . ? C35 C34 Ru3 C31 -67.4(4) . . . . ? C33 C34 Ru3 S5 -29.2(6) . . . . ? C35 C34 Ru3 S5 -160.4(4) . . . . ? C33 C34 Ru3 S6 -178.6(3) . . . . ? C35 C34 Ru3 S6 50.2(5) . . . . ? C33 C34 Ru3 S4 -101.9(4) . . . . ? C35 C34 Ru3 S4 126.9(4) . . . . ? C33 C32 Ru3 C35 -65.0(5) . . . . ? C31 C32 Ru3 C35 65.5(4) . . . . ? C33 C32 Ru3 C34 -27.7(4) . . . . ? C31 C32 Ru3 C34 102.8(5) . . . . ? C33 C32 Ru3 C36 -103.0(5) . . . . ? C31 C32 Ru3 C36 27.5(4) . . . . ? C31 C32 Ru3 C33 130.5(7) . . . . ? C33 C32 Ru3 C31 -130.5(7) . . . . ? C33 C32 Ru3 S5 128.2(4) . . . . ? C31 C32 Ru3 S5 -101.3(4) . . . . ? C33 C32 Ru3 S6 -159.2(4) . . . . ? C31 C32 Ru3 S6 -28.6(7) . . . . ? C33 C32 Ru3 S4 50.1(5) . . . . ? C31 C32 Ru3 S4 -179.3(3) . . . . ? C31 C36 Ru3 C35 -131.0(6) . . . . ? C31 C36 Ru3 C34 -100.6(4) . . . . ? C35 C36 Ru3 C34 30.5(4) . . . . ? C31 C36 Ru3 C32 -27.9(4) . . . . ? C35 C36 Ru3 C32 103.1(5) . . . . ? C31 C36 Ru3 C33 -63.7(4) . . . . ? C35 C36 Ru3 C33 67.3(5) . . . . ? C35 C36 Ru3 C31 131.0(6) . . . . ? C31 C36 Ru3 S5 51.0(4) . . . . ? C35 C36 Ru3 S5 -178.0(3) . . . . ? C31 C36 Ru3 S6 129.9(4) . . . . ? C35 C36 Ru3 S6 -99.0(4) . . . . ? C31 C36 Ru3 S4 -156.1(3) . . . . ? C35 C36 Ru3 S4 -25.1(7) . . . . ? C32 C33 Ru3 C35 104.4(5) . . . . ? C34 C33 Ru3 C35 -30.1(4) . . . . ? C32 C33 Ru3 C34 134.6(6) . . . . ? C34 C33 Ru3 C32 -134.6(6) . . . . ? C32 C33 Ru3 C36 65.8(5) . . . . ? C34 C33 Ru3 C36 -68.7(4) . . . . ? C32 C33 Ru3 C31 30.1(4) . . . . ? C34 C33 Ru3 C31 -104.5(4) . . . . ? C32 C33 Ru3 S5 -60.9(5) . . . . ? C34 C33 Ru3 S5 164.6(3) . . . . ? C32 C33 Ru3 S6 138.9(7) . . . . ? C34 C33 Ru3 S6 4.4(10) . . . . ? C32 C33 Ru3 S4 -141.8(4) . . . . ? C34 C33 Ru3 S4 83.7(4) . . . . ? C36 C31 Ru3 C35 30.6(4) . . . . ? C32 C31 Ru3 C35 -103.6(5) . . . . ? C36 C31 Ru3 C34 68.6(4) . . . . ? C32 C31 Ru3 C34 -65.7(5) . . . . ? C36 C31 Ru3 C32 134.2(6) . . . . ? C32 C31 Ru3 C36 -134.2(6) . . . . ? C36 C31 Ru3 C33 104.8(4) . . . . ? C32 C31 Ru3 C33 -29.5(4) . . . . ? C36 C31 Ru3 S5 -141.2(4) . . . . ? C32 C31 Ru3 S5 84.5(4) . . . . ? C36 C31 Ru3 S6 -60.0(4) . . . . ? C32 C31 Ru3 S6 165.8(4) . . . . ? C36 C31 Ru3 S4 136.2(6) . . . . ? C32 C31 Ru3 S4 1.9(9) . . . . ? C49 S5 Ru3 C35 -127.7(9) . . . . ? Ru4 S5 Ru3 C35 123.6(9) . . . . ? C49 S5 Ru3 C34 -7.6(4) . . . . ? Ru4 S5 Ru3 C34 -116.3(4) . . . . ? C49 S5 Ru3 C32 -57.7(3) . . . . ? Ru4 S5 Ru3 C32 -166.4(2) . . . . ? C49 S5 Ru3 C36 -122.5(3) . . . . ? Ru4 S5 Ru3 C36 128.8(2) . . . . ? C49 S5 Ru3 C33 -26.6(3) . . . . ? Ru4 S5 Ru3 C33 -135.3(2) . . . . ? C49 S5 Ru3 C31 -94.5(3) . . . . ? Ru4 S5 Ru3 C31 156.73(18) . . . . ? C49 S5 Ru3 S6 148.5(2) . . . . ? Ru4 S5 Ru3 S6 39.79(4) . . . . ? C49 S5 Ru3 S4 69.8(2) . . . . ? Ru4 S5 Ru3 S4 -38.96(4) . . . . ? C55 S6 Ru3 C35 -94.3(3) . . . . ? Ru4 S6 Ru3 C35 154.0(2) . . . . ? C55 S6 Ru3 C34 -123.0(3) . . . . ? Ru4 S6 Ru3 C34 125.3(2) . . . . ? C55 S6 Ru3 C32 -5.4(5) . . . . ? Ru4 S6 Ru3 C32 -117.0(4) . . . . ? C55 S6 Ru3 C36 -55.5(3) . . . . ? Ru4 S6 Ru3 C36 -167.23(18) . . . . ? C55 S6 Ru3 C33 -126.4(8) . . . . ? Ru4 S6 Ru3 C33 121.9(8) . . . . ? C55 S6 Ru3 C31 -24.4(3) . . . . ? Ru4 S6 Ru3 C31 -136.1(2) . . . . ? C55 S6 Ru3 S5 71.75(19) . . . . ? Ru4 S6 Ru3 S5 -39.94(4) . . . . ? C55 S6 Ru3 S4 151.20(19) . . . . ? Ru4 S6 Ru3 S4 39.51(4) . . . . ? C43 S4 Ru3 C35 -20.6(3) . . . . ? Ru4 S4 Ru3 C35 -135.9(2) . . . . ? C43 S4 Ru3 C34 -53.7(3) . . . . ? Ru4 S4 Ru3 C34 -169.0(2) . . . . ? C43 S4 Ru3 C32 -117.7(3) . . . . ? Ru4 S4 Ru3 C32 126.9(3) . . . . ? C43 S4 Ru3 C36 -3.5(4) . . . . ? Ru4 S4 Ru3 C36 -118.8(4) . . . . ? C43 S4 Ru3 C33 -90.3(3) . . . . ? Ru4 S4 Ru3 C33 154.4(2) . . . . ? C43 S4 Ru3 C31 -119.2(7) . . . . ? Ru4 S4 Ru3 C31 125.5(7) . . . . ? C43 S4 Ru3 S5 154.9(2) . . . . ? Ru4 S4 Ru3 S5 39.53(4) . . . . ? C43 S4 Ru3 S6 75.39(19) . . . . ? Ru4 S4 Ru3 S6 -39.94(4) . . . . ? C38 C39 Ru4 C40 132.5(6) . . . . ? C40 C39 Ru4 C41 -29.0(4) . . . . ? C38 C39 Ru4 C41 103.5(4) . . . . ? C40 C39 Ru4 C37 -102.8(4) . . . . ? C38 C39 Ru4 C37 29.7(4) . . . . ? C40 C39 Ru4 C38 -132.5(6) . . . . ? C40 C39 Ru4 C42 -65.7(4) . . . . ? C38 C39 Ru4 C42 66.8(4) . . . . ? C40 C39 Ru4 S4 -162.2(3) . . . . ? C38 C39 Ru4 S4 -29.6(6) . . . . ? C40 C39 Ru4 S6 50.9(4) . . . . ? C38 C39 Ru4 S6 -176.6(3) . . . . ? C40 C39 Ru4 S5 126.9(4) . . . . ? C38 C39 Ru4 S5 -100.6(4) . . . . ? C41 C40 Ru4 C39 -132.4(6) . . . . ? C39 C40 Ru4 C41 132.4(6) . . . . ? C39 C40 Ru4 C37 66.0(4) . . . . ? C41 C40 Ru4 C37 -66.4(4) . . . . ? C39 C40 Ru4 C38 29.2(4) . . . . ? C41 C40 Ru4 C38 -103.2(4) . . . . ? C39 C40 Ru4 C42 102.9(4) . . . . ? C41 C40 Ru4 C42 -29.5(4) . . . . ? C39 C40 Ru4 S4 137.0(7) . . . . ? C41 C40 Ru4 S4 4.6(10) . . . . ? C39 C40 Ru4 S6 -141.9(3) . . . . ? C41 C40 Ru4 S6 85.7(4) . . . . ? C39 C40 Ru4 S5 -61.8(4) . . . . ? C41 C40 Ru4 S5 165.8(3) . . . . ? C42 C41 Ru4 C39 -102.5(4) . . . . ? C40 C41 Ru4 C39 28.8(4) . . . . ? C42 C41 Ru4 C40 -131.3(6) . . . . ? C42 C41 Ru4 C37 -29.0(4) . . . . ? C40 C41 Ru4 C37 102.3(4) . . . . ? C42 C41 Ru4 C38 -65.3(4) . . . . ? C40 C41 Ru4 C38 66.0(4) . . . . ? C40 C41 Ru4 C42 131.3(6) . . . . ? C42 C41 Ru4 S4 50.0(4) . . . . ? C40 C41 Ru4 S4 -178.7(3) . . . . ? C42 C41 Ru4 S6 128.0(4) . . . . ? C40 C41 Ru4 S6 -100.8(3) . . . . ? C42 C41 Ru4 S5 -158.0(3) . . . . ? C40 C41 Ru4 S5 -26.7(6) . . . . ? C38 C37 Ru4 C39 -30.3(4) . . . . ? C42 C37 Ru4 C39 102.2(4) . . . . ? C38 C37 Ru4 C40 -66.9(4) . . . . ? C42 C37 Ru4 C40 65.7(4) . . . . ? C38 C37 Ru4 C41 -103.8(4) . . . . ? C42 C37 Ru4 C41 28.7(4) . . . . ? C42 C37 Ru4 C38 132.6(6) . . . . ? C38 C37 Ru4 C42 -132.6(6) . . . . ? C38 C37 Ru4 S4 125.0(4) . . . . ? C42 C37 Ru4 S4 -102.4(4) . . . . ? C38 C37 Ru4 S6 -161.8(3) . . . . ? C42 C37 Ru4 S6 -29.2(6) . . . . ? C38 C37 Ru4 S5 46.7(4) . . . . ? C42 C37 Ru4 S5 179.3(3) . . . . ? C37 C38 Ru4 C39 130.6(6) . . . . ? C37 C38 Ru4 C40 102.0(4) . . . . ? C39 C38 Ru4 C40 -28.6(4) . . . . ? C37 C38 Ru4 C41 65.3(4) . . . . ? C39 C38 Ru4 C41 -65.3(4) . . . . ? C39 C38 Ru4 C37 -130.6(6) . . . . ? C37 C38 Ru4 C42 29.0(4) . . . . ? C39 C38 Ru4 C42 -101.7(4) . . . . ? C37 C38 Ru4 S4 -64.7(4) . . . . ? C39 C38 Ru4 S4 164.6(3) . . . . ? C37 C38 Ru4 S6 142.1(7) . . . . ? C39 C38 Ru4 S6 11.4(11) . . . . ? C37 C38 Ru4 S5 -144.8(4) . . . . ? C39 C38 Ru4 S5 84.6(4) . . . . ? C41 C42 Ru4 C39 66.2(4) . . . . ? C37 C42 Ru4 C39 -66.3(4) . . . . ? C41 C42 Ru4 C40 29.6(4) . . . . ? C37 C42 Ru4 C40 -102.9(4) . . . . ? C37 C42 Ru4 C41 -132.6(6) . . . . ? C41 C42 Ru4 C37 132.6(6) . . . . ? C41 C42 Ru4 C38 103.9(4) . . . . ? C37 C42 Ru4 C38 -28.7(4) . . . . ? C41 C42 Ru4 S4 -143.2(3) . . . . ? C37 C42 Ru4 S4 84.2(4) . . . . ? C41 C42 Ru4 S6 -62.1(4) . . . . ? C37 C42 Ru4 S6 165.3(3) . . . . ? C41 C42 Ru4 S5 130.3(7) . . . . ? C37 C42 Ru4 S5 -2.3(10) . . . . ? C43 S4 Ru4 C39 132.8(4) . . . . ? Ru3 S4 Ru4 C39 -114.5(4) . . . . ? C43 S4 Ru4 C40 10.9(8) . . . . ? Ru3 S4 Ru4 C40 123.5(8) . . . . ? C43 S4 Ru4 C41 14.5(3) . . . . ? Ru3 S4 Ru4 C41 127.2(2) . . . . ? C43 S4 Ru4 C37 80.0(3) . . . . ? Ru3 S4 Ru4 C37 -167.3(2) . . . . ? C43 S4 Ru4 C38 113.2(3) . . . . ? Ru3 S4 Ru4 C38 -134.2(2) . . . . ? C43 S4 Ru4 C42 42.7(3) . . . . ? Ru3 S4 Ru4 C42 155.4(2) . . . . ? C43 S4 Ru4 S6 -73.04(18) . . . . ? Ru3 S4 Ru4 S6 39.60(4) . . . . ? C43 S4 Ru4 S5 -151.66(18) . . . . ? Ru3 S4 Ru4 S5 -39.02(4) . . . . ? C55 S6 Ru4 C39 10.9(3) . . . . ? Ru3 S6 Ru4 C39 124.5(2) . . . . ? C55 S6 Ru4 C40 39.3(3) . . . . ? Ru3 S6 Ru4 C40 152.92(19) . . . . ? C55 S6 Ru4 C41 76.6(3) . . . . ? Ru3 S6 Ru4 C41 -169.74(19) . . . . ? C55 S6 Ru4 C37 128.5(4) . . . . ? Ru3 S6 Ru4 C37 -117.9(4) . . . . ? C55 S6 Ru4 C38 1.9(8) . . . . ? Ru3 S6 Ru4 C38 115.5(8) . . . . ? C55 S6 Ru4 C42 109.0(3) . . . . ? Ru3 S6 Ru4 C42 -137.40(19) . . . . ? C55 S6 Ru4 S4 -153.4(2) . . . . ? Ru3 S6 Ru4 S4 -39.79(4) . . . . ? C55 S6 Ru4 S5 -74.1(2) . . . . ? Ru3 S6 Ru4 S5 39.54(4) . . . . ? C49 S5 Ru4 C39 78.2(3) . . . . ? Ru3 S5 Ru4 C39 -168.62(18) . . . . ? C49 S5 Ru4 C40 110.3(3) . . . . ? Ru3 S5 Ru4 C40 -136.59(18) . . . . ? C49 S5 Ru4 C41 127.8(4) . . . . ? Ru3 S5 Ru4 C41 -119.1(3) . . . . ? C49 S5 Ru4 C37 14.2(3) . . . . ? Ru3 S5 Ru4 C37 127.3(2) . . . . ? C49 S5 Ru4 C38 40.6(3) . . . . ? Ru3 S5 Ru4 C38 153.71(18) . . . . ? C49 S5 Ru4 C42 16.0(7) . . . . ? Ru3 S5 Ru4 C42 129.1(7) . . . . ? C49 S5 Ru4 S4 -73.85(19) . . . . ? Ru3 S5 Ru4 S4 39.29(4) . . . . ? C49 S5 Ru4 S6 -152.8(2) . . . . ? Ru3 S5 Ru4 S6 -39.62(4) . . . . ? _diffrn_measured_fraction_theta_max 0.984 _diffrn_reflns_theta_full 29.28 _diffrn_measured_fraction_theta_full 0.984 _refine_diff_density_max 1.149 _refine_diff_density_min -1.232 _refine_diff_density_rms 0.145