# Supplementary Material (ESI) for Dalton Transactions # This journal is (c) The Royal Society of Chemistry 2009 data_global _journal_name_full 'Dalton Trans.' _journal_coden_Cambridge 0222 _publ_contact_author_name 'Vladimir Arion' _publ_contact_author_email VLADIMIR.ARION@UNIVIE.AC.AT _publ_section_title ; nthesis, X-ray diff roliferative activi similarity to cispl ; loop_ _publ_author_name 'Vladimir Arion' 'Caroline Bartel' 'Sanja Grguric-Sipka' 'Michael Jakupec' 'Bernhard Keppler' ; J.M.Lazic ; 'Iryna N Stepanenko' # Attachment 'SAGRJL10.CIF' data_SAGRJL10 _database_code_depnum_ccdc_archive 'CCDC 707426' _audit_creation_method SHELXL-97 _chemical_name_systematic ; Bis(diammine)(hapto^6^-p-cymene)chlorido- ruthenium(II) hexafluorophosphate ; _chemical_name_common ;Bis(diammine)(hapto$6!-p-cymene)chlorido-ruthenium(ii) hexafluorophosphate ; _chemical_melting_point ? _chemical_formula_moiety 'C10 H20 Cl N2 Ru, F6 P' _chemical_formula_sum 'C10 H20 Cl F6 N2 P Ru' _chemical_formula_weight 449.77 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' N N 0.0061 0.0033 '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' P P 0.1023 0.0942 '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' _symmetry_cell_setting triclinic _symmetry_space_group_name_H-M P-1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, -z' _cell_length_a 8.0544(2) _cell_length_b 8.8166(2) _cell_length_c 11.2876(3) _cell_angle_alpha 87.861(2) _cell_angle_beta 88.256(2) _cell_angle_gamma 78.272(2) _cell_volume 784.07(3) _cell_formula_units_Z 2 _cell_measurement_temperature 100(2) _cell_measurement_reflns_used 1144 _cell_measurement_theta_min 1.90 _cell_measurement_theta_max 38.13 _exptl_crystal_description block _exptl_crystal_colour red _exptl_crystal_size_max 0.40 _exptl_crystal_size_mid 0.38 _exptl_crystal_size_min 0.38 _exptl_crystal_density_meas ? _exptl_crystal_density_diffrn 1.905 _exptl_crystal_density_method 'not measured' _exptl_crystal_F_000 448 _exptl_absorpt_coefficient_mu 1.327 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_correction_T_min 0.6188 _exptl_absorpt_correction_T_max 0.6324 _exptl_absorpt_process_details SADABS _exptl_special_details ; ? ; _diffrn_ambient_temperature 100(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 'Bruker APEXII' _diffrn_measurement_method 'w scan' _diffrn_detector_area_resol_mean ? _diffrn_standards_number ? _diffrn_standards_interval_count ? _diffrn_standards_interval_time ? _diffrn_standards_decay_% ? _diffrn_reflns_number 16677 _diffrn_reflns_av_R_equivalents 0.0323 _diffrn_reflns_av_sigmaI/netI 0.0297 _diffrn_reflns_limit_h_min -11 _diffrn_reflns_limit_h_max 11 _diffrn_reflns_limit_k_min -12 _diffrn_reflns_limit_k_max 12 _diffrn_reflns_limit_l_min -15 _diffrn_reflns_limit_l_max 15 _diffrn_reflns_theta_min 2.58 _diffrn_reflns_theta_max 30.08 _reflns_number_total 4586 _reflns_number_gt 4272 _reflns_threshold_expression >2sigma(I) _computing_data_collection ? _computing_cell_refinement ? _computing_data_reduction ? _computing_structure_solution 'SHELXS-97 (Sheldrick, 1990)' _computing_structure_refinement 'SHELXL-97 (Sheldrick, 1997)' _computing_molecular_graphics ? _computing_publication_material ? _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^)+(0.0317P)^2^+0.3223P] 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 4586 _refine_ls_number_parameters 191 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0261 _refine_ls_R_factor_gt 0.0237 _refine_ls_wR_factor_ref 0.0612 _refine_ls_wR_factor_gt 0.0601 _refine_ls_goodness_of_fit_ref 1.075 _refine_ls_restrained_S_all 1.075 _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 Ru1 Ru 0.406254(16) 0.293407(15) 0.314605(11) 0.00779(5) Uani 1 1 d . . . Cl1 Cl 0.61738(5) 0.28416(5) 0.46350(4) 0.01383(9) Uani 1 1 d . . . P1 P 0.90442(6) 0.67131(6) 0.22291(4) 0.01471(10) Uani 1 1 d . . . F1 F 1.0409(2) 0.57686(16) 0.13476(14) 0.0401(4) Uani 1 1 d . . . F2 F 0.90511(14) 0.51467(13) 0.30198(10) 0.0171(2) Uani 1 1 d . . . F3 F 0.7552(2) 0.6333(2) 0.14727(14) 0.0427(4) Uani 1 1 d . . . F4 F 0.7678(2) 0.76355(17) 0.31376(13) 0.0458(5) Uani 1 1 d . . . F5 F 0.90259(18) 0.82653(15) 0.14635(13) 0.0317(3) Uani 1 1 d . . . F6 F 1.0548(2) 0.70450(18) 0.30052(18) 0.0508(5) Uani 1 1 d . . . N1 N 0.4456(2) 0.52465(18) 0.27735(14) 0.0149(3) Uani 1 1 d . . . H1A H 0.3772 0.5693 0.2175 0.022 Uiso 1 1 calc R . . H1B H 0.5559 0.5209 0.2553 0.022 Uiso 1 1 calc R . . H1C H 0.4202 0.5816 0.3435 0.022 Uiso 1 1 calc R . . N2 N 0.2328(2) 0.40685(18) 0.44663(13) 0.0133(3) Uani 1 1 d . . . H2A H 0.1264 0.4305 0.4171 0.020 Uiso 1 1 calc R . . H2B H 0.2647 0.4955 0.4670 0.020 Uiso 1 1 calc R . . H2C H 0.2335 0.3428 0.5118 0.020 Uiso 1 1 calc R . . C1 C 0.2554(2) 0.1123(2) 0.30266(16) 0.0130(3) Uani 1 1 d . . . C2 C 0.4280(2) 0.0419(2) 0.31360(16) 0.0124(3) Uani 1 1 d . . . H2 H 0.4611 -0.0357 0.3737 0.015 Uiso 1 1 calc R . . C3 C 0.5541(2) 0.0862(2) 0.23504(15) 0.0108(3) Uani 1 1 d . . . H3 H 0.6699 0.0382 0.2446 0.013 Uiso 1 1 calc R . . C4 C 0.5102(2) 0.1992(2) 0.14400(15) 0.0100(3) Uani 1 1 d . . . C5 C 0.3350(2) 0.2713(2) 0.13380(15) 0.0119(3) Uani 1 1 d . . . H5 H 0.3020 0.3491 0.0737 0.014 Uiso 1 1 calc R . . C6 C 0.2105(2) 0.2287(2) 0.21155(16) 0.0125(3) Uani 1 1 d . . . H6 H 0.0950 0.2784 0.2031 0.015 Uiso 1 1 calc R . . C7 C 0.1229(3) 0.0724(2) 0.38787(19) 0.0199(4) Uani 1 1 d . . . H7A H 0.0779 -0.0134 0.3574 0.030 Uiso 1 1 calc R . . H7B H 0.0307 0.1630 0.3967 0.030 Uiso 1 1 calc R . . H7C H 0.1737 0.0415 0.4651 0.030 Uiso 1 1 calc R . . C8 C 0.6404(2) 0.2480(2) 0.05929(15) 0.0120(3) Uani 1 1 d . . . H8 H 0.5974 0.3589 0.0346 0.014 Uiso 1 1 calc R . . C9 C 0.8133(2) 0.2364(2) 0.11425(17) 0.0170(4) Uani 1 1 d . . . H9A H 0.8916 0.2695 0.0553 0.026 Uiso 1 1 calc R . . H9B H 0.8578 0.1288 0.1401 0.026 Uiso 1 1 calc R . . H9C H 0.8016 0.3033 0.1827 0.026 Uiso 1 1 calc R . . C10 C 0.6548(3) 0.1509(2) -0.05187(17) 0.0184(4) Uani 1 1 d . . . H10A H 0.7390 0.1814 -0.1073 0.028 Uiso 1 1 calc R . . H10B H 0.5445 0.1683 -0.0899 0.028 Uiso 1 1 calc R . . H10C H 0.6902 0.0408 -0.0294 0.028 Uiso 1 1 calc R . . 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 Ru1 0.00806(7) 0.00725(7) 0.00778(7) -0.00083(4) -0.00011(4) -0.00080(5) Cl1 0.01419(19) 0.01308(19) 0.01382(18) -0.00236(15) -0.00464(15) -0.00081(15) P1 0.0136(2) 0.0129(2) 0.0156(2) 0.00172(17) 0.00245(17) 0.00129(17) F1 0.0476(9) 0.0216(7) 0.0411(8) 0.0087(6) 0.0327(7) 0.0095(6) F2 0.0197(6) 0.0147(5) 0.0151(5) 0.0027(4) 0.0022(4) -0.0005(4) F3 0.0384(9) 0.0593(10) 0.0347(8) 0.0199(8) -0.0221(7) -0.0210(8) F4 0.0644(11) 0.0279(8) 0.0267(7) 0.0102(6) 0.0242(7) 0.0285(7) F5 0.0337(7) 0.0169(6) 0.0382(8) 0.0113(6) 0.0135(6) 0.0056(5) F6 0.0541(10) 0.0272(8) 0.0775(13) 0.0092(8) -0.0389(9) -0.0199(7) N1 0.0204(8) 0.0118(7) 0.0125(7) -0.0006(6) 0.0004(6) -0.0034(6) N2 0.0132(7) 0.0149(7) 0.0109(7) -0.0021(6) 0.0005(5) -0.0004(6) C1 0.0132(8) 0.0117(8) 0.0152(8) -0.0035(6) 0.0014(6) -0.0047(6) C2 0.0156(8) 0.0078(7) 0.0135(8) -0.0011(6) 0.0004(6) -0.0019(6) C3 0.0103(7) 0.0094(7) 0.0122(7) -0.0029(6) 0.0003(6) -0.0001(6) C4 0.0123(8) 0.0093(7) 0.0086(7) -0.0033(6) 0.0002(6) -0.0018(6) C5 0.0131(8) 0.0131(8) 0.0095(7) -0.0021(6) -0.0022(6) -0.0025(6) C6 0.0096(8) 0.0138(8) 0.0146(8) -0.0043(6) -0.0018(6) -0.0025(6) C7 0.0174(9) 0.0199(9) 0.0240(10) -0.0021(8) 0.0059(7) -0.0085(7) C8 0.0116(8) 0.0130(8) 0.0117(7) -0.0007(6) 0.0005(6) -0.0030(6) C9 0.0132(8) 0.0230(9) 0.0166(8) -0.0010(7) 0.0005(7) -0.0080(7) C10 0.0215(10) 0.0218(9) 0.0128(8) -0.0045(7) 0.0025(7) -0.0064(8) _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 Ru1 N2 2.1425(15) . ? Ru1 N1 2.1504(15) . ? Ru1 C5 2.1631(17) . ? Ru1 C6 2.1660(18) . ? Ru1 C3 2.1760(17) . ? Ru1 C2 2.1889(17) . ? Ru1 C4 2.1995(17) . ? Ru1 C1 2.2043(18) . ? Ru1 Cl1 2.4146(4) . ? P1 F1 1.5857(14) . ? P1 F5 1.5888(13) . ? P1 F3 1.5913(16) . ? P1 F6 1.5963(16) . ? P1 F4 1.5978(14) . ? P1 F2 1.6153(12) . ? N1 H1A 0.9100 . ? N1 H1B 0.9100 . ? N1 H1C 0.9100 . ? N2 H2A 0.9100 . ? N2 H2B 0.9100 . ? N2 H2C 0.9100 . ? C1 C2 1.410(2) . ? C1 C6 1.427(3) . ? C1 C7 1.501(3) . ? C2 C3 1.432(2) . ? C2 H2 0.9500 . ? C3 C4 1.406(2) . ? C3 H3 0.9500 . ? C4 C5 1.431(2) . ? C4 C8 1.514(2) . ? C5 C6 1.411(2) . ? C5 H5 0.9500 . ? C6 H6 0.9500 . ? C7 H7A 0.9800 . ? C7 H7B 0.9800 . ? C7 H7C 0.9800 . ? C8 C9 1.524(3) . ? C8 C10 1.534(3) . ? C8 H8 1.0000 . ? C9 H9A 0.9800 . ? C9 H9B 0.9800 . ? C9 H9C 0.9800 . ? C10 H10A 0.9800 . ? C10 H10B 0.9800 . ? C10 H10C 0.9800 . ? 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 N2 Ru1 N1 82.70(6) . . ? N2 Ru1 C5 122.96(6) . . ? N1 Ru1 C5 91.67(6) . . ? N2 Ru1 C6 94.40(6) . . ? N1 Ru1 C6 114.52(6) . . ? C5 Ru1 C6 38.05(7) . . ? N2 Ru1 C3 151.88(6) . . ? N1 Ru1 C3 124.60(6) . . ? C5 Ru1 C3 68.07(7) . . ? C6 Ru1 C3 80.78(7) . . ? N2 Ru1 C2 114.30(6) . . ? N1 Ru1 C2 162.90(7) . . ? C5 Ru1 C2 80.71(7) . . ? C6 Ru1 C2 67.92(7) . . ? C3 Ru1 C2 38.30(6) . . ? N2 Ru1 C4 161.26(6) . . ? N1 Ru1 C4 95.92(6) . . ? C5 Ru1 C4 38.30(6) . . ? C6 Ru1 C4 69.06(7) . . ? C3 Ru1 C4 37.47(6) . . ? C2 Ru1 C4 68.65(6) . . ? N2 Ru1 C1 90.44(6) . . ? N1 Ru1 C1 151.37(7) . . ? C5 Ru1 C1 68.88(7) . . ? C6 Ru1 C1 38.09(7) . . ? C3 Ru1 C1 68.65(7) . . ? C2 Ru1 C1 37.44(7) . . ? C4 Ru1 C1 81.83(7) . . ? N2 Ru1 Cl1 84.68(4) . . ? N1 Ru1 Cl1 84.60(4) . . ? C5 Ru1 Cl1 151.48(5) . . ? C6 Ru1 Cl1 160.63(5) . . ? C3 Ru1 Cl1 90.91(5) . . ? C2 Ru1 Cl1 94.78(5) . . ? C4 Ru1 Cl1 113.87(5) . . ? C1 Ru1 Cl1 122.55(5) . . ? F1 P1 F5 90.91(7) . . ? F1 P1 F3 90.37(10) . . ? F5 P1 F3 90.83(8) . . ? F1 P1 F6 89.31(11) . . ? F5 P1 F6 90.80(9) . . ? F3 P1 F6 178.35(9) . . ? F1 P1 F4 178.79(8) . . ? F5 P1 F4 90.25(7) . . ? F3 P1 F4 89.94(10) . . ? F6 P1 F4 90.35(11) . . ? F1 P1 F2 89.73(7) . . ? F5 P1 F2 179.34(7) . . ? F3 P1 F2 89.31(7) . . ? F6 P1 F2 89.06(8) . . ? F4 P1 F2 89.11(7) . . ? Ru1 N1 H1A 109.5 . . ? Ru1 N1 H1B 109.5 . . ? H1A N1 H1B 109.5 . . ? Ru1 N1 H1C 109.5 . . ? H1A N1 H1C 109.5 . . ? H1B N1 H1C 109.5 . . ? Ru1 N2 H2A 109.5 . . ? Ru1 N2 H2B 109.5 . . ? H2A N2 H2B 109.5 . . ? Ru1 N2 H2C 109.5 . . ? H2A N2 H2C 109.5 . . ? H2B N2 H2C 109.5 . . ? C2 C1 C6 118.10(16) . . ? C2 C1 C7 121.28(17) . . ? C6 C1 C7 120.54(16) . . ? C2 C1 Ru1 70.69(10) . . ? C6 C1 Ru1 69.50(10) . . ? C7 C1 Ru1 128.85(13) . . ? C1 C2 C3 120.71(16) . . ? C1 C2 Ru1 71.88(10) . . ? C3 C2 Ru1 70.36(10) . . ? C1 C2 H2 119.6 . . ? C3 C2 H2 119.6 . . ? Ru1 C2 H2 130.9 . . ? C4 C3 C2 121.39(16) . . ? C4 C3 Ru1 72.17(10) . . ? C2 C3 Ru1 71.34(10) . . ? C4 C3 H3 119.3 . . ? C2 C3 H3 119.3 . . ? Ru1 C3 H3 129.8 . . ? C3 C4 C5 117.74(15) . . ? C3 C4 C8 122.62(15) . . ? C5 C4 C8 119.63(15) . . ? C3 C4 Ru1 70.36(10) . . ? C5 C4 Ru1 69.48(10) . . ? C8 C4 Ru1 130.69(12) . . ? C6 C5 C4 121.03(16) . . ? C6 C5 Ru1 71.08(10) . . ? C4 C5 Ru1 72.22(10) . . ? C6 C5 H5 119.5 . . ? C4 C5 H5 119.5 . . ? Ru1 C5 H5 129.8 . . ? C5 C6 C1 121.01(16) . . ? C5 C6 Ru1 70.86(10) . . ? C1 C6 Ru1 72.41(10) . . ? C5 C6 H6 119.5 . . ? C1 C6 H6 119.5 . . ? Ru1 C6 H6 129.8 . . ? C1 C7 H7A 109.5 . . ? C1 C7 H7B 109.5 . . ? H7A C7 H7B 109.5 . . ? C1 C7 H7C 109.5 . . ? H7A C7 H7C 109.5 . . ? H7B C7 H7C 109.5 . . ? C4 C8 C9 113.39(15) . . ? C4 C8 C10 108.77(15) . . ? C9 C8 C10 111.05(15) . . ? C4 C8 H8 107.8 . . ? C9 C8 H8 107.8 . . ? C10 C8 H8 107.8 . . ? C8 C9 H9A 109.5 . . ? C8 C9 H9B 109.5 . . ? H9A C9 H9B 109.5 . . ? C8 C9 H9C 109.5 . . ? H9A C9 H9C 109.5 . . ? H9B C9 H9C 109.5 . . ? C8 C10 H10A 109.5 . . ? C8 C10 H10B 109.5 . . ? H10A C10 H10B 109.5 . . ? C8 C10 H10C 109.5 . . ? H10A C10 H10C 109.5 . . ? H10B C10 H10C 109.5 . . ? 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 N2 Ru1 C1 C2 -131.82(11) . . . . ? N1 Ru1 C1 C2 152.72(13) . . . . ? C5 Ru1 C1 C2 102.71(11) . . . . ? C6 Ru1 C1 C2 131.60(15) . . . . ? C3 Ru1 C1 C2 28.90(10) . . . . ? C4 Ru1 C1 C2 65.32(11) . . . . ? Cl1 Ru1 C1 C2 -47.85(12) . . . . ? N2 Ru1 C1 C6 96.58(10) . . . . ? N1 Ru1 C1 C6 21.11(18) . . . . ? C5 Ru1 C1 C6 -28.89(10) . . . . ? C3 Ru1 C1 C6 -102.70(11) . . . . ? C2 Ru1 C1 C6 -131.60(15) . . . . ? C4 Ru1 C1 C6 -66.28(10) . . . . ? Cl1 Ru1 C1 C6 -179.45(8) . . . . ? N2 Ru1 C1 C7 -16.72(17) . . . . ? N1 Ru1 C1 C7 -92.2(2) . . . . ? C5 Ru1 C1 C7 -142.19(18) . . . . ? C6 Ru1 C1 C7 -113.3(2) . . . . ? C3 Ru1 C1 C7 144.01(18) . . . . ? C2 Ru1 C1 C7 115.1(2) . . . . ? C4 Ru1 C1 C7 -179.58(18) . . . . ? Cl1 Ru1 C1 C7 67.25(18) . . . . ? C6 C1 C2 C3 -0.2(3) . . . . ? C7 C1 C2 C3 -177.10(17) . . . . ? Ru1 C1 C2 C3 -52.72(15) . . . . ? C6 C1 C2 Ru1 52.56(15) . . . . ? C7 C1 C2 Ru1 -124.39(17) . . . . ? N2 Ru1 C2 C1 54.85(12) . . . . ? N1 Ru1 C2 C1 -131.7(2) . . . . ? C5 Ru1 C2 C1 -67.23(11) . . . . ? C6 Ru1 C2 C1 -29.86(10) . . . . ? C3 Ru1 C2 C1 -133.42(15) . . . . ? C4 Ru1 C2 C1 -105.05(11) . . . . ? Cl1 Ru1 C2 C1 141.16(10) . . . . ? N2 Ru1 C2 C3 -171.73(10) . . . . ? N1 Ru1 C2 C3 1.7(3) . . . . ? C5 Ru1 C2 C3 66.20(10) . . . . ? C6 Ru1 C2 C3 103.57(11) . . . . ? C4 Ru1 C2 C3 28.37(10) . . . . ? C1 Ru1 C2 C3 133.42(15) . . . . ? Cl1 Ru1 C2 C3 -85.42(10) . . . . ? C1 C2 C3 C4 -0.8(3) . . . . ? Ru1 C2 C3 C4 -54.22(15) . . . . ? C1 C2 C3 Ru1 53.40(15) . . . . ? N2 Ru1 C3 C4 149.48(13) . . . . ? N1 Ru1 C3 C4 -46.05(12) . . . . ? C5 Ru1 C3 C4 30.08(10) . . . . ? C6 Ru1 C3 C4 67.46(11) . . . . ? C2 Ru1 C3 C4 133.32(15) . . . . ? C1 Ru1 C3 C4 105.03(11) . . . . ? Cl1 Ru1 C3 C4 -130.12(10) . . . . ? N2 Ru1 C3 C2 16.15(19) . . . . ? N1 Ru1 C3 C2 -179.38(10) . . . . ? C5 Ru1 C3 C2 -103.25(11) . . . . ? C6 Ru1 C3 C2 -65.87(11) . . . . ? C4 Ru1 C3 C2 -133.32(15) . . . . ? C1 Ru1 C3 C2 -28.30(10) . . . . ? Cl1 Ru1 C3 C2 96.55(10) . . . . ? C2 C3 C4 C5 1.3(3) . . . . ? Ru1 C3 C4 C5 -52.54(14) . . . . ? C2 C3 C4 C8 -179.76(16) . . . . ? Ru1 C3 C4 C8 126.40(16) . . . . ? C2 C3 C4 Ru1 53.84(15) . . . . ? N2 Ru1 C4 C3 -131.84(18) . . . . ? N1 Ru1 C4 C3 143.43(10) . . . . ? C5 Ru1 C4 C3 -131.40(15) . . . . ? C6 Ru1 C4 C3 -102.54(11) . . . . ? C2 Ru1 C4 C3 -28.96(10) . . . . ? C1 Ru1 C4 C3 -65.33(11) . . . . ? Cl1 Ru1 C4 C3 56.73(11) . . . . ? N2 Ru1 C4 C5 -0.4(2) . . . . ? N1 Ru1 C4 C5 -85.17(11) . . . . ? C6 Ru1 C4 C5 28.85(10) . . . . ? C3 Ru1 C4 C5 131.40(15) . . . . ? C2 Ru1 C4 C5 102.44(11) . . . . ? C1 Ru1 C4 C5 66.06(11) . . . . ? Cl1 Ru1 C4 C5 -171.87(9) . . . . ? N2 Ru1 C4 C8 111.5(2) . . . . ? N1 Ru1 C4 C8 26.82(16) . . . . ? C5 Ru1 C4 C8 111.99(19) . . . . ? C6 Ru1 C4 C8 140.84(17) . . . . ? C3 Ru1 C4 C8 -116.6(2) . . . . ? C2 Ru1 C4 C8 -145.57(17) . . . . ? C1 Ru1 C4 C8 178.05(16) . . . . ? Cl1 Ru1 C4 C8 -59.89(16) . . . . ? C3 C4 C5 C6 -0.9(3) . . . . ? C8 C4 C5 C6 -179.84(16) . . . . ? Ru1 C4 C5 C6 -53.83(15) . . . . ? C3 C4 C5 Ru1 52.96(14) . . . . ? C8 C4 C5 Ru1 -126.01(15) . . . . ? N2 Ru1 C5 C6 -47.16(13) . . . . ? N1 Ru1 C5 C6 -129.53(11) . . . . ? C3 Ru1 C5 C6 103.54(11) . . . . ? C2 Ru1 C5 C6 65.86(11) . . . . ? C4 Ru1 C5 C6 133.01(15) . . . . ? C1 Ru1 C5 C6 28.92(10) . . . . ? Cl1 Ru1 C5 C6 148.72(9) . . . . ? N2 Ru1 C5 C4 179.83(9) . . . . ? N1 Ru1 C5 C4 97.45(10) . . . . ? C6 Ru1 C5 C4 -133.01(15) . . . . ? C3 Ru1 C5 C4 -29.47(10) . . . . ? C2 Ru1 C5 C4 -67.16(10) . . . . ? C1 Ru1 C5 C4 -104.09(11) . . . . ? Cl1 Ru1 C5 C4 15.71(17) . . . . ? C4 C5 C6 C1 -0.1(3) . . . . ? Ru1 C5 C6 C1 -54.42(16) . . . . ? C4 C5 C6 Ru1 54.35(15) . . . . ? C2 C1 C6 C5 0.6(3) . . . . ? C7 C1 C6 C5 177.56(17) . . . . ? Ru1 C1 C6 C5 53.71(15) . . . . ? C2 C1 C6 Ru1 -53.13(15) . . . . ? C7 C1 C6 Ru1 123.84(17) . . . . ? N2 Ru1 C6 C5 141.90(10) . . . . ? N1 Ru1 C6 C5 57.92(12) . . . . ? C3 Ru1 C6 C5 -66.01(11) . . . . ? C2 Ru1 C6 C5 -103.63(11) . . . . ? C4 Ru1 C6 C5 -29.03(10) . . . . ? C1 Ru1 C6 C5 -133.01(15) . . . . ? Cl1 Ru1 C6 C5 -131.62(13) . . . . ? N2 Ru1 C6 C1 -85.09(10) . . . . ? N1 Ru1 C6 C1 -169.06(10) . . . . ? C5 Ru1 C6 C1 133.01(15) . . . . ? C3 Ru1 C6 C1 67.00(11) . . . . ? C2 Ru1 C6 C1 29.38(10) . . . . ? C4 Ru1 C6 C1 103.99(11) . . . . ? Cl1 Ru1 C6 C1 1.4(2) . . . . ? C3 C4 C8 C9 -30.7(2) . . . . ? C5 C4 C8 C9 148.26(17) . . . . ? Ru1 C4 C8 C9 60.7(2) . . . . ? C3 C4 C8 C10 93.4(2) . . . . ? C5 C4 C8 C10 -87.7(2) . . . . ? Ru1 C4 C8 C10 -175.22(13) . . . . ? _diffrn_measured_fraction_theta_max 0.997 _diffrn_reflns_theta_full 30.08 _diffrn_measured_fraction_theta_full 0.997 _refine_diff_density_max 0.535 _refine_diff_density_min -0.865 _refine_diff_density_rms 0.102 # Attachment 'IRST435.CIF' data_IRST435 _database_code_depnum_ccdc_archive 'CCDC 707427' _audit_creation_method SHELXL-97 _chemical_name_systematic ; Tris(mu~2~-methoxido)-bis(hapto^6^-p-cymene)- di-osmium(II) hexafluorophosphate ; _chemical_name_common ;Tris(mu!2$-methoxido)-bis(hapto$6!-p-cymene)-di-osmium(ii) hexafluorophosphate ; _chemical_melting_point ? _chemical_formula_moiety 'C23 H37 O3 Os2, F6 P' _chemical_formula_sum 'C23 H37 F6 O3 Os2 P' _chemical_formula_weight 886.90 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' F F 0.0171 0.0103 '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' Os Os -1.2165 7.6030 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' _symmetry_cell_setting orthorhombic _symmetry_space_group_name_H-M P212121 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x+1/2, -y, z+1/2' '-x, y+1/2, -z+1/2' 'x+1/2, -y+1/2, -z' _cell_length_a 11.2483(3) _cell_length_b 13.6694(4) _cell_length_c 34.2630(9) _cell_angle_alpha 90.00 _cell_angle_beta 90.00 _cell_angle_gamma 90.00 _cell_volume 5268.2(3) _cell_formula_units_Z 8 _cell_measurement_temperature 100(2) _cell_measurement_reflns_used 4820 _cell_measurement_theta_min 2.32 _cell_measurement_theta_max 33.05 _exptl_crystal_description block _exptl_crystal_colour yellow _exptl_crystal_size_max 0.38 _exptl_crystal_size_mid 0.28 _exptl_crystal_size_min 0.22 _exptl_crystal_density_meas ? _exptl_crystal_density_diffrn 2.236 _exptl_crystal_density_method 'not measured' _exptl_crystal_F_000 3360 _exptl_absorpt_coefficient_mu 9.765 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_correction_T_min 0.1188 _exptl_absorpt_correction_T_max 0.2225 _exptl_absorpt_process_details SADABS _exptl_special_details ; ? ; _diffrn_ambient_temperature 100(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 'Bruker APEXII' _diffrn_measurement_method 'w scan' _diffrn_detector_area_resol_mean ? _diffrn_standards_number ? _diffrn_standards_interval_count ? _diffrn_standards_interval_time ? _diffrn_standards_decay_% ? _diffrn_reflns_number 140298 _diffrn_reflns_av_R_equivalents 0.0601 _diffrn_reflns_av_sigmaI/netI 0.0316 _diffrn_reflns_limit_h_min -15 _diffrn_reflns_limit_h_max 15 _diffrn_reflns_limit_k_min -19 _diffrn_reflns_limit_k_max 19 _diffrn_reflns_limit_l_min -48 _diffrn_reflns_limit_l_max 48 _diffrn_reflns_theta_min 1.91 _diffrn_reflns_theta_max 30.12 _reflns_number_total 15486 _reflns_number_gt 14769 _reflns_threshold_expression >2sigma(I) _computing_data_collection ? _computing_cell_refinement ? _computing_data_reduction ? _computing_structure_solution 'SHELXS-97 (Sheldrick, 1990)' _computing_structure_refinement 'SHELXL-97 (Sheldrick, 1997)' _computing_molecular_graphics ? _computing_publication_material ? _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^)+(0.0263P)^2^+4.3440P] 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_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881' _refine_ls_abs_structure_Flack 0.006(5) _refine_ls_number_reflns 15486 _refine_ls_number_parameters 641 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0251 _refine_ls_R_factor_gt 0.0228 _refine_ls_wR_factor_ref 0.0489 _refine_ls_wR_factor_gt 0.0483 _refine_ls_goodness_of_fit_ref 0.993 _refine_ls_restrained_S_all 0.993 _refine_ls_shift/su_max 0.005 _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 Os1 Os 0.424454(13) -0.021897(12) 0.881442(4) 0.00935(3) Uani 1 1 d . . . Os2 Os 0.278346(13) 0.167811(12) 0.876485(5) 0.00988(3) Uani 1 1 d . . . P1 P 0.68734(10) 0.03795(10) 0.72882(3) 0.0193(2) Uani 1 1 d . . . F1 F 0.6043(3) -0.0481(3) 0.74521(11) 0.0474(9) Uani 1 1 d . . . F2 F 0.6406(4) 0.0178(3) 0.68591(9) 0.0506(10) Uani 1 1 d . . . F3 F 0.7690(3) 0.1247(3) 0.71304(13) 0.0548(11) Uani 1 1 d . . . F4 F 0.7311(4) 0.0567(3) 0.77202(9) 0.0519(10) Uani 1 1 d . . . F5 F 0.7917(3) -0.0398(3) 0.72208(10) 0.0402(8) Uani 1 1 d . . . F6 F 0.5818(3) 0.1150(3) 0.73485(10) 0.0400(8) Uani 1 1 d . . . O1 O 0.4402(3) 0.1225(2) 0.90105(9) 0.0144(6) Uani 1 1 d . . . O2 O 0.2557(3) 0.0256(2) 0.89610(9) 0.0181(7) Uani 1 1 d . . . O3 O 0.3609(3) 0.0709(2) 0.83861(8) 0.0140(6) Uani 1 1 d . . . C1 C 0.6109(4) -0.0592(3) 0.87863(14) 0.0167(8) Uani 1 1 d . . . C2 C 0.5657(4) -0.0815(3) 0.91712(13) 0.0159(8) Uani 1 1 d . . . H2 H 0.6052 -0.0563 0.9395 0.019 Uiso 1 1 calc R . . C3 C 0.4637(4) -0.1401(3) 0.92172(13) 0.0147(8) Uani 1 1 d . . . H3 H 0.4356 -0.1540 0.9473 0.018 Uiso 1 1 calc R . . C4 C 0.4012(3) -0.1792(3) 0.88864(12) 0.0117(8) Uani 1 1 d . . . C5 C 0.4486(3) -0.1606(3) 0.85108(12) 0.0114(8) Uani 1 1 d . . . H5 H 0.4113 -0.1882 0.8288 0.014 Uiso 1 1 calc R . . C6 C 0.5514(4) -0.1010(3) 0.84628(12) 0.0150(8) Uani 1 1 d . . . H6 H 0.5808 -0.0890 0.8207 0.018 Uiso 1 1 calc R . . C7 C 0.7116(4) 0.0129(4) 0.87368(14) 0.0214(9) Uani 1 1 d . . . H7A H 0.7876 -0.0205 0.8779 0.032 Uiso 1 1 calc R . . H7B H 0.7029 0.0660 0.8927 0.032 Uiso 1 1 calc R . . H7C H 0.7096 0.0399 0.8472 0.032 Uiso 1 1 calc R . . C8 C 0.2881(4) -0.2359(3) 0.89539(13) 0.0161(9) Uani 1 1 d . . . H8 H 0.2511 -0.2115 0.9201 0.019 Uiso 1 1 calc R . . C9 C 0.1969(4) -0.2245(4) 0.86246(14) 0.0234(10) Uani 1 1 d . . . H9A H 0.1256 -0.2626 0.8687 0.035 Uiso 1 1 calc R . . H9B H 0.2313 -0.2483 0.8379 0.035 Uiso 1 1 calc R . . H9C H 0.1756 -0.1553 0.8597 0.035 Uiso 1 1 calc R . . C10 C 0.3189(4) -0.3445(3) 0.90104(14) 0.0224(10) Uani 1 1 d . . . H10A H 0.2459 -0.3818 0.9056 0.034 Uiso 1 1 calc R . . H10B H 0.3719 -0.3517 0.9236 0.034 Uiso 1 1 calc R . . H10C H 0.3587 -0.3692 0.8776 0.034 Uiso 1 1 calc R . . C11 C 0.3064(4) 0.3254(3) 0.88216(13) 0.0162(8) Uani 1 1 d . . . C12 C 0.2269(4) 0.2927(3) 0.91179(12) 0.0150(8) Uani 1 1 d . . . H12 H 0.2429 0.3078 0.9383 0.018 Uiso 1 1 calc R . . C13 C 0.1248(4) 0.2381(3) 0.90201(12) 0.0137(8) Uani 1 1 d . . . H13 H 0.0728 0.2172 0.9222 0.016 Uiso 1 1 calc R . . C14 C 0.0974(3) 0.2132(3) 0.86234(12) 0.0108(8) Uani 1 1 d . . . C15 C 0.1771(4) 0.2470(3) 0.83336(13) 0.0144(8) Uani 1 1 d . . . H15 H 0.1615 0.2319 0.8068 0.017 Uiso 1 1 calc R . . C16 C 0.2799(4) 0.3030(3) 0.84289(12) 0.0144(8) Uani 1 1 d . . . H16 H 0.3310 0.3254 0.8227 0.017 Uiso 1 1 calc R . . C17 C 0.4205(4) 0.3783(4) 0.89201(14) 0.0230(10) Uani 1 1 d . . . H17A H 0.4851 0.3530 0.8757 0.035 Uiso 1 1 calc R . . H17B H 0.4398 0.3677 0.9196 0.035 Uiso 1 1 calc R . . H17C H 0.4105 0.4485 0.8872 0.035 Uiso 1 1 calc R . . C18 C -0.0095(4) 0.1512(3) 0.85236(13) 0.0154(9) Uani 1 1 d . . . H18 H -0.0479 0.1295 0.8772 0.019 Uiso 1 1 calc R . . C19 C -0.0985(4) 0.2154(3) 0.82979(15) 0.0225(10) Uani 1 1 d . . . H19A H -0.1176 0.2736 0.8453 0.034 Uiso 1 1 calc R . . H19B H -0.1713 0.1780 0.8248 0.034 Uiso 1 1 calc R . . H19C H -0.0632 0.2354 0.8049 0.034 Uiso 1 1 calc R . . C20 C 0.0211(4) 0.0615(3) 0.82860(14) 0.0191(9) Uani 1 1 d . . . H20A H -0.0515 0.0242 0.8232 0.029 Uiso 1 1 calc R . . H20B H 0.0770 0.0206 0.8432 0.029 Uiso 1 1 calc R . . H20C H 0.0576 0.0817 0.8039 0.029 Uiso 1 1 calc R . . C21 C 0.4678(4) 0.1405(4) 0.94110(14) 0.0217(10) Uani 1 1 d . . . H21A H 0.4129 0.1036 0.9577 0.033 Uiso 1 1 calc R . . H21B H 0.4600 0.2106 0.9466 0.033 Uiso 1 1 calc R . . H21C H 0.5496 0.1196 0.9464 0.033 Uiso 1 1 calc R . . C22 C 0.1745(4) -0.0095(4) 0.92412(13) 0.0198(9) Uani 1 1 d . . . H22A H 0.2171 -0.0252 0.9483 0.030 Uiso 1 1 calc R . . H22B H 0.1354 -0.0685 0.9141 0.030 Uiso 1 1 calc R . . H22C H 0.1145 0.0408 0.9294 0.030 Uiso 1 1 calc R . . C23 C 0.4337(4) 0.1061(4) 0.80733(13) 0.0214(10) Uani 1 1 d . . . H23A H 0.5012 0.1426 0.8181 0.032 Uiso 1 1 calc R . . H23B H 0.3867 0.1491 0.7905 0.032 Uiso 1 1 calc R . . H23C H 0.4632 0.0505 0.7921 0.032 Uiso 1 1 calc R . . Os3 Os 0.868647(13) 0.571074(12) 0.920316(5) 0.01140(3) Uani 1 1 d . . . Os4 Os 0.841911(14) 0.609870(13) 0.832141(5) 0.01261(3) Uani 1 1 d . . . P2 P 0.85525(10) 0.00699(10) 0.99142(4) 0.0216(3) Uani 1 1 d . . . F7 F 0.7863(3) -0.0963(2) 0.98891(11) 0.0427(9) Uani 1 1 d . . . F8 F 0.9097(3) -0.0144(4) 0.94969(11) 0.0660(13) Uani 1 1 d . . . F9 F 0.9222(3) 0.1082(3) 0.99439(13) 0.0577(11) Uani 1 1 d . . . F10 F 0.7990(3) 0.0238(3) 1.03370(9) 0.0394(8) Uani 1 1 d . . . F11 F 0.9672(3) -0.0460(3) 1.01087(13) 0.0574(12) Uani 1 1 d . . . F12 F 0.7422(3) 0.0591(3) 0.97252(10) 0.0397(8) Uani 1 1 d . . . O4 O 0.8982(3) 0.6871(2) 0.88192(9) 0.0156(6) Uani 1 1 d . . . O5 O 0.9336(3) 0.5154(2) 0.86856(8) 0.0164(6) Uani 1 1 d . . . O6 O 0.7351(2) 0.5657(2) 0.87827(9) 0.0166(6) Uani 1 1 d . . . C24 C 0.9601(4) 0.6303(4) 0.97162(12) 0.0163(9) Uani 1 1 d . . . C25 C 1.0053(4) 0.5356(4) 0.96332(12) 0.0180(9) Uani 1 1 d . . . H25 H 1.0888 0.5263 0.9612 0.022 Uiso 1 1 calc R . . C26 C 0.9280(4) 0.4545(3) 0.95813(12) 0.0167(9) Uani 1 1 d . . . H26 H 0.9607 0.3923 0.9520 0.020 Uiso 1 1 calc R . . C27 C 0.8020(4) 0.4644(4) 0.96193(12) 0.0185(9) Uani 1 1 d . . . C28 C 0.7580(4) 0.5593(4) 0.97187(12) 0.0174(9) Uani 1 1 d . . . H28 H 0.6750 0.5678 0.9757 0.021 Uiso 1 1 calc R . . C29 C 0.8339(4) 0.6405(3) 0.97609(12) 0.0151(8) Uani 1 1 d . . . H29 H 0.8012 0.7029 0.9820 0.018 Uiso 1 1 calc R . . C30 C 1.0413(4) 0.7166(4) 0.97480(14) 0.0235(10) Uani 1 1 d . . . H30A H 1.0756 0.7190 1.0011 0.035 Uiso 1 1 calc R . . H30B H 0.9963 0.7767 0.9699 0.035 Uiso 1 1 calc R . . H30C H 1.1053 0.7106 0.9555 0.035 Uiso 1 1 calc R . . C31 C 0.7178(4) 0.3797(4) 0.95451(12) 0.0189(9) Uani 1 1 d . . . H31 H 0.6372 0.4081 0.9496 0.023 Uiso 1 1 calc R . . C32 C 0.7511(5) 0.3185(4) 0.91886(14) 0.0321(12) Uani 1 1 d . . . H32A H 0.6935 0.2653 0.9157 0.048 Uiso 1 1 calc R . . H32B H 0.8308 0.2909 0.9225 0.048 Uiso 1 1 calc R . . H32C H 0.7504 0.3599 0.8955 0.048 Uiso 1 1 calc R . . C33 C 0.7085(5) 0.3156(4) 0.99114(13) 0.0254(11) Uani 1 1 d . . . H33A H 0.6538 0.2612 0.9861 0.038 Uiso 1 1 calc R . . H33B H 0.6786 0.3549 1.0129 0.038 Uiso 1 1 calc R . . H33C H 0.7872 0.2896 0.9977 0.038 Uiso 1 1 calc R . . C34 C 0.8600(5) 0.7271(4) 0.78881(13) 0.0245(10) Uani 1 1 d . . . C35 C 0.9474(5) 0.6553(4) 0.78224(13) 0.0245(11) Uani 1 1 d . . . H35 H 1.0286 0.6738 0.7805 0.029 Uiso 1 1 calc R . . C36 C 0.9150(4) 0.5556(4) 0.77821(12) 0.0227(10) Uani 1 1 d . . . H36 H 0.9752 0.5083 0.7736 0.027 Uiso 1 1 calc R . . C37 C 0.7948(4) 0.5248(4) 0.78086(12) 0.0177(9) Uani 1 1 d . . . C38 C 0.7078(4) 0.5967(3) 0.78725(12) 0.0184(9) Uani 1 1 d . . . H38 H 0.6268 0.5778 0.7891 0.022 Uiso 1 1 calc R . . C39 C 0.7384(5) 0.6972(3) 0.79093(13) 0.0213(10) Uani 1 1 d . . . H39 H 0.6779 0.7447 0.7948 0.026 Uiso 1 1 calc R . . C40 C 0.8967(6) 0.8321(4) 0.79385(17) 0.0401(15) Uani 1 1 d . . . H40A H 0.9762 0.8348 0.8055 0.060 Uiso 1 1 calc R . . H40B H 0.8400 0.8654 0.8110 0.060 Uiso 1 1 calc R . . H40C H 0.8978 0.8645 0.7683 0.060 Uiso 1 1 calc R . . C41 C 0.7667(5) 0.4158(3) 0.77814(13) 0.0226(10) Uani 1 1 d . . . H41 H 0.8386 0.3794 0.7873 0.027 Uiso 1 1 calc R . . C42 C 0.7466(8) 0.3886(5) 0.73526(16) 0.057(2) Uani 1 1 d . . . H42A H 0.8162 0.4077 0.7199 0.086 Uiso 1 1 calc R . . H42B H 0.6762 0.4229 0.7254 0.086 Uiso 1 1 calc R . . H42C H 0.7345 0.3178 0.7331 0.086 Uiso 1 1 calc R . . C43 C 0.6638(5) 0.3853(4) 0.80385(18) 0.0349(13) Uani 1 1 d . . . H43A H 0.6502 0.3148 0.8010 0.052 Uiso 1 1 calc R . . H43B H 0.5921 0.4210 0.7960 0.052 Uiso 1 1 calc R . . H43C H 0.6825 0.4003 0.8311 0.052 Uiso 1 1 calc R . . C44 C 0.8634(5) 0.7847(4) 0.89075(13) 0.0226(10) Uani 1 1 d . . . H44A H 0.7788 0.7933 0.8847 0.034 Uiso 1 1 calc R . . H44B H 0.9105 0.8305 0.8751 0.034 Uiso 1 1 calc R . . H44C H 0.8769 0.7977 0.9185 0.034 Uiso 1 1 calc R . . C45 C 1.0534(4) 0.4879(4) 0.86244(14) 0.0199(9) Uani 1 1 d . . . H45A H 1.1026 0.5467 0.8598 0.030 Uiso 1 1 calc R . . H45B H 1.0593 0.4487 0.8386 0.030 Uiso 1 1 calc R . . H45C H 1.0813 0.4492 0.8847 0.030 Uiso 1 1 calc R . . C46 C 0.6177(4) 0.5985(4) 0.88428(14) 0.0215(9) Uani 1 1 d . . . H46A H 0.6183 0.6691 0.8893 0.032 Uiso 1 1 calc R . . H46B H 0.5832 0.5643 0.9067 0.032 Uiso 1 1 calc R . . H46C H 0.5701 0.5850 0.8610 0.032 Uiso 1 1 calc R . . 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 Os1 0.00889(6) 0.01017(7) 0.00899(7) 0.00046(6) 0.00121(5) 0.00135(6) Os2 0.00971(6) 0.00948(7) 0.01044(7) 0.00069(6) 0.00081(6) 0.00127(6) P1 0.0189(5) 0.0254(7) 0.0136(5) -0.0012(5) 0.0028(4) -0.0037(5) F1 0.047(2) 0.038(2) 0.057(2) 0.0163(18) 0.0032(18) -0.0176(17) F2 0.081(3) 0.053(2) 0.0178(15) -0.0099(15) -0.0186(17) 0.015(2) F3 0.041(2) 0.045(2) 0.078(3) 0.015(2) 0.016(2) -0.0195(18) F4 0.067(2) 0.062(3) 0.0259(17) -0.0173(17) -0.0195(18) 0.008(2) F5 0.0382(18) 0.049(2) 0.0332(17) 0.0046(16) 0.0092(14) 0.0174(16) F6 0.0342(17) 0.044(2) 0.0422(19) 0.0045(16) 0.0115(15) 0.0142(17) O1 0.0130(14) 0.0133(15) 0.0170(14) -0.0039(12) -0.0040(11) 0.0058(12) O2 0.0117(13) 0.0141(16) 0.0287(17) 0.0110(13) 0.0103(12) 0.0025(12) O3 0.0166(14) 0.0168(15) 0.0084(13) 0.0027(11) 0.0003(11) 0.0026(13) C1 0.0138(17) 0.013(2) 0.023(2) 0.0026(18) 0.0029(17) 0.0035(15) C2 0.0169(19) 0.011(2) 0.020(2) -0.0007(17) -0.0012(17) 0.0037(16) C3 0.0145(18) 0.018(2) 0.0115(18) 0.0006(16) 0.0003(16) 0.0041(16) C4 0.0113(18) 0.011(2) 0.0130(18) 0.0004(15) -0.0017(14) 0.0046(15) C5 0.0117(18) 0.0106(19) 0.0119(18) -0.0037(15) 0.0014(14) 0.0017(15) C6 0.0155(19) 0.016(2) 0.0134(19) 0.0014(16) 0.0064(15) 0.0067(16) C7 0.0151(19) 0.024(2) 0.026(2) -0.001(2) 0.0034(18) -0.0027(18) C8 0.019(2) 0.011(2) 0.018(2) 0.0027(16) 0.0023(17) 0.0033(17) C9 0.020(2) 0.022(3) 0.028(3) 0.001(2) 0.0013(19) -0.0012(19) C10 0.024(2) 0.014(2) 0.029(2) 0.0025(19) 0.0026(19) 0.0018(19) C11 0.0152(18) 0.012(2) 0.022(2) 0.0021(18) -0.0048(17) -0.0018(15) C12 0.0183(19) 0.0109(19) 0.016(2) 0.0005(16) -0.0001(17) 0.0029(17) C13 0.0163(19) 0.012(2) 0.0127(19) 0.0008(15) 0.0003(16) 0.0057(16) C14 0.0081(17) 0.0105(19) 0.0137(18) -0.0024(15) 0.0000(14) 0.0041(14) C15 0.0178(19) 0.0082(19) 0.017(2) 0.0026(16) -0.0007(17) 0.0032(15) C16 0.0160(19) 0.011(2) 0.017(2) 0.0045(15) 0.0030(17) 0.0000(17) C17 0.017(2) 0.024(3) 0.028(2) -0.001(2) -0.0024(19) -0.006(2) C18 0.0109(18) 0.019(2) 0.017(2) -0.0021(17) -0.0022(15) 0.0012(17) C19 0.020(2) 0.015(2) 0.033(3) 0.002(2) -0.005(2) 0.0067(17) C20 0.020(2) 0.016(2) 0.022(2) -0.0045(18) 0.0002(18) 0.0028(17) C21 0.023(2) 0.020(2) 0.022(2) -0.0054(19) -0.0052(19) 0.0042(18) C22 0.0166(19) 0.020(2) 0.023(2) 0.0038(19) 0.0101(18) 0.0022(17) C23 0.027(2) 0.024(2) 0.014(2) 0.0066(18) 0.0099(18) 0.009(2) Os3 0.00915(6) 0.01593(8) 0.00911(7) 0.00008(6) 0.00055(6) 0.00239(6) Os4 0.01320(7) 0.01472(8) 0.00991(7) 0.00075(6) -0.00163(6) 0.00429(6) P2 0.0113(5) 0.0293(7) 0.0243(6) -0.0051(5) -0.0020(4) -0.0009(5) F7 0.0331(17) 0.0270(18) 0.068(2) -0.0145(17) -0.0087(17) -0.0032(14) F8 0.038(2) 0.121(4) 0.039(2) -0.023(2) 0.0196(17) -0.012(2) F9 0.0407(19) 0.043(2) 0.090(3) 0.021(2) -0.022(2) -0.0247(18) F10 0.0398(18) 0.053(2) 0.0256(15) -0.0114(16) -0.0034(14) 0.0020(17) F11 0.0246(16) 0.058(3) 0.089(3) -0.022(2) -0.0282(19) 0.0173(17) F12 0.0295(16) 0.037(2) 0.052(2) 0.0104(16) -0.0217(16) 0.0001(14) O4 0.0207(15) 0.0138(15) 0.0124(14) -0.0013(12) -0.0009(12) 0.0010(12) O5 0.0137(13) 0.0236(17) 0.0117(13) 0.0027(12) 0.0019(11) 0.0084(13) O6 0.0102(12) 0.0247(16) 0.0149(14) 0.0030(13) 0.0021(12) 0.0027(12) C24 0.0129(18) 0.024(3) 0.0120(19) 0.0001(17) 0.0024(15) -0.0008(17) C25 0.0117(18) 0.030(3) 0.0124(19) 0.0033(18) -0.0031(15) 0.0022(18) C26 0.0177(19) 0.020(2) 0.0125(19) 0.0077(16) -0.0021(17) 0.0039(18) C27 0.017(2) 0.027(3) 0.0115(19) 0.0029(18) 0.0019(16) 0.0010(18) C28 0.0119(18) 0.025(2) 0.0153(19) -0.0020(18) 0.0001(16) -0.0031(17) C29 0.0135(18) 0.021(2) 0.0105(18) -0.0032(16) 0.0037(15) -0.0017(16) C30 0.021(2) 0.028(3) 0.021(2) -0.002(2) -0.0030(18) -0.0121(19) C31 0.023(2) 0.020(2) 0.0138(19) -0.0015(17) -0.0004(17) -0.0047(19) C32 0.049(3) 0.030(3) 0.017(2) -0.004(2) 0.002(2) -0.008(2) C33 0.038(3) 0.022(3) 0.016(2) 0.0036(18) 0.001(2) -0.008(2) C34 0.036(3) 0.023(3) 0.014(2) 0.0039(18) -0.001(2) -0.004(2) C35 0.029(2) 0.033(3) 0.012(2) 0.007(2) -0.0013(18) 0.000(2) C36 0.025(2) 0.033(3) 0.0097(19) 0.0039(18) 0.0000(18) 0.012(2) C37 0.026(2) 0.018(2) 0.0090(18) -0.0004(17) -0.0040(16) 0.0067(19) C38 0.023(2) 0.018(2) 0.014(2) 0.0028(17) -0.0099(17) 0.0001(18) C39 0.032(3) 0.015(2) 0.017(2) 0.0010(17) -0.0092(19) 0.0100(19) C40 0.065(4) 0.022(3) 0.033(3) 0.006(2) -0.008(3) -0.005(3) C41 0.036(3) 0.014(2) 0.018(2) -0.0005(17) -0.004(2) 0.006(2) C42 0.125(7) 0.022(3) 0.024(3) -0.004(2) -0.015(4) 0.003(4) C43 0.035(3) 0.024(3) 0.046(3) -0.004(3) -0.010(3) -0.004(2) C44 0.028(2) 0.021(2) 0.018(2) 0.0008(18) 0.0072(19) -0.002(2) C45 0.0144(19) 0.021(2) 0.024(2) 0.0032(19) 0.0023(17) 0.0127(18) C46 0.0159(19) 0.027(3) 0.021(2) 0.0000(19) -0.0009(17) 0.0004(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 Os1 O3 2.068(3) . ? Os1 O2 2.069(3) . ? Os1 O1 2.093(3) . ? Os1 C6 2.159(4) . ? Os1 C1 2.160(4) . ? Os1 C2 2.164(4) . ? Os1 C3 2.170(4) . ? Os1 C5 2.180(4) . ? Os1 C4 2.180(4) . ? Os1 Os2 3.0748(2) . ? Os2 O2 2.072(3) . ? Os2 O3 2.073(3) . ? Os2 O1 2.099(3) . ? Os2 C15 2.157(4) . ? Os2 C13 2.161(4) . ? Os2 C12 2.171(4) . ? Os2 C16 2.177(4) . ? Os2 C14 2.182(4) . ? Os2 C11 2.185(4) . ? P1 F4 1.581(3) . ? P1 F2 1.586(3) . ? P1 F3 1.594(4) . ? P1 F6 1.600(3) . ? P1 F5 1.601(3) . ? P1 F1 1.603(4) . ? O1 C21 1.428(5) . ? O2 C22 1.409(5) . ? O3 C23 1.432(5) . ? C1 C6 1.415(6) . ? C1 C2 1.445(6) . ? C1 C7 1.511(6) . ? C2 C3 1.408(6) . ? C2 H2 0.9500 . ? C3 C4 1.437(6) . ? C3 H3 0.9500 . ? C4 C5 1.416(6) . ? C4 C8 1.508(6) . ? C5 C6 1.424(6) . ? C5 H5 0.9500 . ? C6 H6 0.9500 . ? C7 H7A 0.9800 . ? C7 H7B 0.9800 . ? C7 H7C 0.9800 . ? C8 C9 1.533(6) . ? C8 C10 1.537(6) . ? C8 H8 1.0000 . ? C9 H9A 0.9800 . ? C9 H9B 0.9800 . ? C9 H9C 0.9800 . ? C10 H10A 0.9800 . ? C10 H10B 0.9800 . ? C10 H10C 0.9800 . ? C11 C16 1.412(6) . ? C11 C12 1.424(6) . ? C11 C17 1.512(6) . ? C12 C13 1.411(6) . ? C12 H12 0.9500 . ? C13 C14 1.434(5) . ? C13 H13 0.9500 . ? C14 C15 1.415(6) . ? C14 C18 1.511(6) . ? C15 C16 1.425(6) . ? C15 H15 0.9500 . ? C16 H16 0.9500 . ? C17 H17A 0.9800 . ? C17 H17B 0.9800 . ? C17 H17C 0.9800 . ? C18 C20 1.511(6) . ? C18 C19 1.539(6) . ? C18 H18 1.0000 . ? C19 H19A 0.9800 . ? C19 H19B 0.9800 . ? C19 H19C 0.9800 . ? C20 H20A 0.9800 . ? C20 H20B 0.9800 . ? C20 H20C 0.9800 . ? C21 H21A 0.9800 . ? C21 H21B 0.9800 . ? C21 H21C 0.9800 . ? C22 H22A 0.9800 . ? C22 H22B 0.9800 . ? C22 H22C 0.9800 . ? C23 H23A 0.9800 . ? C23 H23B 0.9800 . ? C23 H23C 0.9800 . ? Os3 O5 2.064(3) . ? Os3 O6 2.083(3) . ? Os3 O4 2.087(3) . ? Os3 C26 2.160(4) . ? Os3 C28 2.167(4) . ? Os3 C29 2.169(4) . ? Os3 C27 2.173(5) . ? Os3 C25 2.184(4) . ? Os3 C24 2.192(4) . ? Os3 Os4 3.0820(2) . ? Os4 O5 2.071(3) . ? Os4 O6 2.075(3) . ? Os4 O4 2.103(3) . ? Os4 C36 2.154(5) . ? Os4 C38 2.162(4) . ? Os4 C35 2.172(5) . ? Os4 C37 2.173(4) . ? Os4 C39 2.185(4) . ? Os4 C34 2.194(5) . ? P2 F9 1.578(4) . ? P2 F8 1.583(4) . ? P2 F12 1.595(3) . ? P2 F10 1.597(3) . ? P2 F11 1.598(4) . ? P2 F7 1.613(4) . ? O4 C44 1.423(6) . ? O5 C45 1.415(5) . ? O6 C46 1.410(5) . ? C24 C25 1.420(7) . ? C24 C29 1.434(6) . ? C24 C30 1.495(6) . ? C25 C26 1.420(7) . ? C25 H25 0.9500 . ? C26 C27 1.429(6) . ? C26 H26 0.9500 . ? C27 C28 1.430(7) . ? C27 C31 1.516(7) . ? C28 C29 1.409(6) . ? C28 H28 0.9500 . ? C29 H29 0.9500 . ? C30 H30A 0.9800 . ? C30 H30B 0.9800 . ? C30 H30C 0.9800 . ? C31 C32 1.528(6) . ? C31 C33 1.535(6) . ? C31 H31 1.0000 . ? C32 H32A 0.9800 . ? C32 H32B 0.9800 . ? C32 H32C 0.9800 . ? C33 H33A 0.9800 . ? C33 H33B 0.9800 . ? C33 H33C 0.9800 . ? C34 C35 1.407(7) . ? C34 C39 1.429(7) . ? C34 C40 1.503(8) . ? C35 C36 1.418(8) . ? C35 H35 0.9500 . ? C36 C37 1.419(7) . ? C36 H36 0.9500 . ? C37 C38 1.404(6) . ? C37 C41 1.526(7) . ? C38 C39 1.422(7) . ? C38 H38 0.9500 . ? C39 H39 0.9500 . ? C40 H40A 0.9800 . ? C40 H40B 0.9800 . ? C40 H40C 0.9800 . ? C41 C43 1.513(8) . ? C41 C42 1.532(7) . ? C41 H41 1.0000 . ? C42 H42A 0.9800 . ? C42 H42B 0.9800 . ? C42 H42C 0.9800 . ? C43 H43A 0.9800 . ? C43 H43B 0.9800 . ? C43 H43C 0.9800 . ? C44 H44A 0.9800 . ? C44 H44B 0.9800 . ? C44 H44C 0.9800 . ? C45 H45A 0.9800 . ? C45 H45B 0.9800 . ? C45 H45C 0.9800 . ? C46 H46A 0.9800 . ? C46 H46B 0.9800 . ? C46 H46C 0.9800 . ? 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 O3 Os1 O2 70.25(11) . . ? O3 Os1 O1 71.22(12) . . ? O2 Os1 O1 72.75(12) . . ? O3 Os1 C6 98.06(14) . . ? O2 Os1 C6 154.15(15) . . ? O1 Os1 C6 126.56(15) . . ? O3 Os1 C1 116.68(15) . . ? O2 Os1 C1 167.40(16) . . ? O1 Os1 C1 98.91(14) . . ? C6 Os1 C1 38.26(17) . . ? O3 Os1 C2 152.36(14) . . ? O2 Os1 C2 130.92(15) . . ? O1 Os1 C2 96.40(14) . . ? C6 Os1 C2 68.96(16) . . ? C1 Os1 C2 39.06(17) . . ? O3 Os1 C3 168.14(15) . . ? O2 Os1 C3 105.44(14) . . ? O1 Os1 C3 118.73(14) . . ? C6 Os1 C3 81.22(16) . . ? C1 Os1 C3 69.81(16) . . ? C2 Os1 C3 37.91(16) . . ? O3 Os1 C5 103.78(14) . . ? O2 Os1 C5 120.22(14) . . ? O1 Os1 C5 164.41(13) . . ? C6 Os1 C5 38.32(16) . . ? C1 Os1 C5 69.67(16) . . ? C2 Os1 C5 81.42(16) . . ? C3 Os1 C5 68.33(16) . . ? O3 Os1 C4 130.11(14) . . ? O2 Os1 C4 99.92(14) . . ? O1 Os1 C4 154.72(14) . . ? C6 Os1 C4 69.41(16) . . ? C1 Os1 C4 83.60(15) . . ? C2 Os1 C4 69.69(16) . . ? C3 Os1 C4 38.58(15) . . ? C5 Os1 C4 37.90(15) . . ? O3 Os1 Os2 42.13(8) . . ? O2 Os1 Os2 42.10(9) . . ? O1 Os1 Os2 42.89(8) . . ? C6 Os1 Os2 138.18(12) . . ? C1 Os1 Os2 135.68(12) . . ? C2 Os1 Os2 137.82(12) . . ? C3 Os1 Os2 140.51(11) . . ? C5 Os1 Os2 140.70(11) . . ? C4 Os1 Os2 140.72(10) . . ? O2 Os2 O3 70.07(12) . . ? O2 Os2 O1 72.56(12) . . ? O3 Os2 O1 71.00(11) . . ? O2 Os2 C15 128.89(15) . . ? O3 Os2 C15 97.36(14) . . ? O1 Os2 C15 151.72(15) . . ? O2 Os2 C13 100.78(14) . . ? O3 Os2 C13 153.48(14) . . ? O1 Os2 C13 131.45(14) . . ? C15 Os2 C13 68.42(16) . . ? O2 Os2 C12 121.60(15) . . ? O3 Os2 C12 166.00(14) . . ? O1 Os2 C12 103.85(14) . . ? C15 Os2 C12 81.16(16) . . ? C13 Os2 C12 38.02(16) . . ? O2 Os2 C16 165.59(15) . . ? O3 Os2 C16 101.97(14) . . ? O1 Os2 C16 117.07(15) . . ? C15 Os2 C16 38.39(16) . . ? C13 Os2 C16 81.00(16) . . ? C12 Os2 C16 68.24(16) . . ? O2 Os2 C14 102.94(14) . . ? O3 Os2 C14 117.39(13) . . ? O1 Os2 C14 169.06(13) . . ? C15 Os2 C14 38.06(15) . . ? C13 Os2 C14 38.56(15) . . ? C12 Os2 C14 69.62(16) . . ? C16 Os2 C14 69.45(16) . . ? O2 Os2 C11 155.95(15) . . ? O3 Os2 C11 128.36(15) . . ? O1 Os2 C11 97.45(14) . . ? C15 Os2 C11 69.06(16) . . ? C13 Os2 C11 68.99(17) . . ? C12 Os2 C11 38.16(16) . . ? C16 Os2 C11 37.76(16) . . ? C14 Os2 C11 82.77(15) . . ? O2 Os2 Os1 42.00(8) . . ? O3 Os2 Os1 41.99(8) . . ? O1 Os2 Os1 42.75(9) . . ? C15 Os2 Os1 138.02(12) . . ? C13 Os2 Os1 141.22(11) . . ? C12 Os2 Os1 140.79(11) . . ? C16 Os2 Os1 137.78(11) . . ? C14 Os2 Os1 138.64(11) . . ? C11 Os2 Os1 138.52(11) . . ? F4 P1 F2 178.6(2) . . ? F4 P1 F3 91.0(2) . . ? F2 P1 F3 90.4(2) . . ? F4 P1 F6 90.2(2) . . ? F2 P1 F6 89.3(2) . . ? F3 P1 F6 89.0(2) . . ? F4 P1 F5 90.8(2) . . ? F2 P1 F5 89.7(2) . . ? F3 P1 F5 91.3(2) . . ? F6 P1 F5 178.9(2) . . ? F4 P1 F1 88.4(2) . . ? F2 P1 F1 90.2(2) . . ? F3 P1 F1 179.1(2) . . ? F6 P1 F1 90.3(2) . . ? F5 P1 F1 89.4(2) . . ? C21 O1 Os1 119.3(3) . . ? C21 O1 Os2 121.6(3) . . ? Os1 O1 Os2 94.36(12) . . ? C22 O2 Os1 130.8(3) . . ? C22 O2 Os2 128.3(3) . . ? Os1 O2 Os2 95.90(12) . . ? C23 O3 Os1 122.6(3) . . ? C23 O3 Os2 120.7(3) . . ? Os1 O3 Os2 95.88(11) . . ? C6 C1 C2 117.6(4) . . ? C6 C1 C7 122.0(4) . . ? C2 C1 C7 120.2(4) . . ? C6 C1 Os1 70.8(2) . . ? C2 C1 Os1 70.6(2) . . ? C7 C1 Os1 125.4(3) . . ? C3 C2 C1 120.6(4) . . ? C3 C2 Os1 71.3(2) . . ? C1 C2 Os1 70.3(2) . . ? C3 C2 H2 119.7 . . ? C1 C2 H2 119.7 . . ? Os1 C2 H2 131.5 . . ? C2 C3 C4 121.5(4) . . ? C2 C3 Os1 70.8(2) . . ? C4 C3 Os1 71.1(2) . . ? C2 C3 H3 119.3 . . ? C4 C3 H3 119.3 . . ? Os1 C3 H3 131.9 . . ? C5 C4 C3 117.8(4) . . ? C5 C4 C8 123.3(4) . . ? C3 C4 C8 118.9(4) . . ? C5 C4 Os1 71.0(2) . . ? C3 C4 Os1 70.3(2) . . ? C8 C4 Os1 128.7(3) . . ? C4 C5 C6 120.9(4) . . ? C4 C5 Os1 71.1(2) . . ? C6 C5 Os1 70.0(2) . . ? C4 C5 H5 119.6 . . ? C6 C5 H5 119.6 . . ? Os1 C5 H5 132.4 . . ? C1 C6 C5 121.6(4) . . ? C1 C6 Os1 70.9(2) . . ? C5 C6 Os1 71.6(2) . . ? C1 C6 H6 119.2 . . ? C5 C6 H6 119.2 . . ? Os1 C6 H6 131.2 . . ? C1 C7 H7A 109.5 . . ? C1 C7 H7B 109.5 . . ? H7A C7 H7B 109.5 . . ? C1 C7 H7C 109.5 . . ? H7A C7 H7C 109.5 . . ? H7B C7 H7C 109.5 . . ? C4 C8 C9 113.5(4) . . ? C4 C8 C10 109.0(4) . . ? C9 C8 C10 110.0(4) . . ? C4 C8 H8 108.0 . . ? C9 C8 H8 108.0 . . ? C10 C8 H8 108.0 . . ? C8 C9 H9A 109.5 . . ? C8 C9 H9B 109.5 . . ? H9A C9 H9B 109.5 . . ? C8 C9 H9C 109.5 . . ? H9A C9 H9C 109.5 . . ? H9B C9 H9C 109.5 . . ? C8 C10 H10A 109.5 . . ? C8 C10 H10B 109.5 . . ? H10A C10 H10B 109.5 . . ? C8 C10 H10C 109.5 . . ? H10A C10 H10C 109.5 . . ? H10B C10 H10C 109.5 . . ? C16 C11 C12 118.7(4) . . ? C16 C11 C17 119.7(4) . . ? C12 C11 C17 121.6(4) . . ? C16 C11 Os2 70.8(2) . . ? C12 C11 Os2 70.4(2) . . ? C17 C11 Os2 127.9(3) . . ? C13 C12 C11 120.5(4) . . ? C13 C12 Os2 70.6(2) . . ? C11 C12 Os2 71.5(3) . . ? C13 C12 H12 119.7 . . ? C11 C12 H12 119.7 . . ? Os2 C12 H12 130.9 . . ? C12 C13 C14 121.7(4) . . ? C12 C13 Os2 71.3(2) . . ? C14 C13 Os2 71.5(2) . . ? C12 C13 H13 119.2 . . ? C14 C13 H13 119.2 . . ? Os2 C13 H13 130.8 . . ? C15 C14 C13 116.9(4) . . ? C15 C14 C18 121.9(4) . . ? C13 C14 C18 121.2(4) . . ? C15 C14 Os2 70.0(2) . . ? C13 C14 Os2 69.9(2) . . ? C18 C14 Os2 129.3(3) . . ? C14 C15 C16 121.9(4) . . ? C14 C15 Os2 71.9(2) . . ? C16 C15 Os2 71.6(2) . . ? C14 C15 H15 119.0 . . ? C16 C15 H15 119.0 . . ? Os2 C15 H15 130.2 . . ? C11 C16 C15 120.4(4) . . ? C11 C16 Os2 71.4(2) . . ? C15 C16 Os2 70.0(2) . . ? C11 C16 H16 119.8 . . ? C15 C16 H16 119.8 . . ? Os2 C16 H16 131.6 . . ? C11 C17 H17A 109.5 . . ? C11 C17 H17B 109.5 . . ? H17A C17 H17B 109.5 . . ? C11 C17 H17C 109.5 . . ? H17A C17 H17C 109.5 . . ? H17B C17 H17C 109.5 . . ? C20 C18 C14 113.3(4) . . ? C20 C18 C19 109.8(4) . . ? C14 C18 C19 108.1(4) . . ? C20 C18 H18 108.5 . . ? C14 C18 H18 108.5 . . ? C19 C18 H18 108.5 . . ? C18 C19 H19A 109.5 . . ? C18 C19 H19B 109.5 . . ? H19A C19 H19B 109.5 . . ? C18 C19 H19C 109.5 . . ? H19A C19 H19C 109.5 . . ? H19B C19 H19C 109.5 . . ? C18 C20 H20A 109.5 . . ? C18 C20 H20B 109.5 . . ? H20A C20 H20B 109.5 . . ? C18 C20 H20C 109.5 . . ? H20A C20 H20C 109.5 . . ? H20B C20 H20C 109.5 . . ? O1 C21 H21A 109.5 . . ? O1 C21 H21B 109.5 . . ? H21A C21 H21B 109.5 . . ? O1 C21 H21C 109.5 . . ? H21A C21 H21C 109.5 . . ? H21B C21 H21C 109.5 . . ? O2 C22 H22A 109.5 . . ? O2 C22 H22B 109.5 . . ? H22A C22 H22B 109.5 . . ? O2 C22 H22C 109.5 . . ? H22A C22 H22C 109.5 . . ? H22B C22 H22C 109.5 . . ? O3 C23 H23A 109.5 . . ? O3 C23 H23B 109.5 . . ? H23A C23 H23B 109.5 . . ? O3 C23 H23C 109.5 . . ? H23A C23 H23C 109.5 . . ? H23B C23 H23C 109.5 . . ? O5 Os3 O6 69.38(11) . . ? O5 Os3 O4 71.48(12) . . ? O6 Os3 O4 72.87(12) . . ? O5 Os3 C26 97.69(15) . . ? O6 Os3 C26 127.74(16) . . ? O4 Os3 C26 152.83(15) . . ? O5 Os3 C28 151.21(16) . . ? O6 Os3 C28 98.44(14) . . ? O4 Os3 C28 131.43(15) . . ? C26 Os3 C28 68.51(17) . . ? O5 Os3 C29 169.19(14) . . ? O6 Os3 C29 119.67(14) . . ? O4 Os3 C29 104.56(15) . . ? C26 Os3 C29 81.38(17) . . ? C28 Os3 C29 37.92(16) . . ? O5 Os3 C27 116.00(16) . . ? O6 Os3 C27 100.46(15) . . ? O4 Os3 C27 168.09(15) . . ? C26 Os3 C27 38.52(16) . . ? C28 Os3 C27 38.47(18) . . ? C29 Os3 C27 69.74(17) . . ? O5 Os3 C25 104.39(14) . . ? O6 Os3 C25 165.15(16) . . ? O4 Os3 C25 118.82(15) . . ? C26 Os3 C25 38.16(18) . . ? C28 Os3 C25 80.68(16) . . ? C29 Os3 C25 68.26(17) . . ? C27 Os3 C25 69.57(17) . . ? O5 Os3 C24 131.25(14) . . ? O6 Os3 C24 155.00(15) . . ? O4 Os3 C24 98.63(15) . . ? C26 Os3 C24 69.30(18) . . ? C28 Os3 C24 69.12(16) . . ? C29 Os3 C24 38.39(16) . . ? C27 Os3 C24 83.33(17) . . ? C25 Os3 C24 37.88(18) . . ? O5 Os3 Os4 41.89(8) . . ? O6 Os3 Os4 42.06(8) . . ? O4 Os3 Os4 42.86(8) . . ? C26 Os3 Os4 138.17(12) . . ? C28 Os3 Os4 139.09(11) . . ? C29 Os3 Os4 140.42(12) . . ? C27 Os3 Os4 136.47(12) . . ? C25 Os3 Os4 140.19(11) . . ? C24 Os3 Os4 140.20(12) . . ? O5 Os4 O6 69.39(11) . . ? O5 Os4 O4 71.01(12) . . ? O6 Os4 O4 72.69(12) . . ? O5 Os4 C36 96.43(15) . . ? O6 Os4 C36 140.73(17) . . ? O4 Os4 C36 138.90(16) . . ? O5 Os4 C38 136.41(15) . . ? O6 Os4 C38 96.53(15) . . ? O4 Os4 C38 145.96(15) . . ? C36 Os4 C38 68.12(18) . . ? O5 Os4 C35 112.38(16) . . ? O6 Os4 C35 177.60(16) . . ? O4 Os4 C35 109.30(17) . . ? C36 Os4 C35 38.3(2) . . ? C38 Os4 C35 81.07(18) . . ? O5 Os4 C37 105.95(15) . . ? O6 Os4 C37 108.61(16) . . ? O4 Os4 C37 176.21(15) . . ? C36 Os4 C37 38.29(19) . . ? C38 Os4 C37 37.80(17) . . ? C35 Os4 C37 69.50(19) . . ? O5 Os4 C39 174.55(16) . . ? O6 Os4 C39 110.04(16) . . ? O4 Os4 C39 114.20(15) . . ? C36 Os4 C39 80.63(18) . . ? C38 Os4 C39 38.20(17) . . ? C35 Os4 C39 68.03(19) . . ? C37 Os4 C39 68.91(17) . . ? O5 Os4 C34 144.80(17) . . ? O6 Os4 C34 141.39(17) . . ? O4 Os4 C34 98.87(16) . . ? C36 Os4 C34 68.64(19) . . ? C38 Os4 C34 69.15(18) . . ? C35 Os4 C34 37.6(2) . . ? C37 Os4 C34 82.33(18) . . ? C39 Os4 C34 38.1(2) . . ? O5 Os4 Os3 41.71(8) . . ? O6 Os4 Os3 42.26(8) . . ? O4 Os4 Os3 42.45(8) . . ? C36 Os4 Os3 138.10(12) . . ? C38 Os4 Os3 138.70(13) . . ? C35 Os4 Os3 140.14(13) . . ? C37 Os4 Os3 136.42(12) . . ? C39 Os4 Os3 141.21(13) . . ? C34 Os4 Os3 141.25(13) . . ? F9 P2 F8 92.0(3) . . ? F9 P2 F12 90.9(2) . . ? F8 P2 F12 91.4(2) . . ? F9 P2 F10 90.3(2) . . ? F8 P2 F10 177.6(3) . . ? F12 P2 F10 89.34(19) . . ? F9 P2 F11 89.7(2) . . ? F8 P2 F11 89.3(3) . . ? F12 P2 F11 179.1(2) . . ? F10 P2 F11 89.9(2) . . ? F9 P2 F7 179.3(2) . . ? F8 P2 F7 88.6(2) . . ? F12 P2 F7 89.21(18) . . ? F10 P2 F7 89.1(2) . . ? F11 P2 F7 90.2(2) . . ? C44 O4 Os3 122.3(3) . . ? C44 O4 Os4 124.1(3) . . ? Os3 O4 Os4 94.70(12) . . ? C45 O5 Os3 124.2(3) . . ? C45 O5 Os4 123.4(3) . . ? Os3 O5 Os4 96.40(12) . . ? C46 O6 Os4 124.1(3) . . ? C46 O6 Os3 124.3(3) . . ? Os4 O6 Os3 95.68(11) . . ? C25 C24 C29 117.7(4) . . ? C25 C24 C30 121.0(4) . . ? C29 C24 C30 121.3(4) . . ? C25 C24 Os3 70.8(2) . . ? C29 C24 Os3 70.0(2) . . ? C30 C24 Os3 129.5(3) . . ? C26 C25 C24 121.2(4) . . ? C26 C25 Os3 70.0(2) . . ? C24 C25 Os3 71.3(2) . . ? C26 C25 H25 119.4 . . ? C24 C25 H25 119.4 . . ? Os3 C25 H25 132.4 . . ? C25 C26 C27 121.5(4) . . ? C25 C26 Os3 71.9(2) . . ? C27 C26 Os3 71.2(3) . . ? C25 C26 H26 119.3 . . ? C27 C26 H26 119.3 . . ? Os3 C26 H26 130.4 . . ? C26 C27 C28 116.8(4) . . ? C26 C27 C31 122.1(4) . . ? C28 C27 C31 121.0(4) . . ? C26 C27 Os3 70.2(3) . . ? C28 C27 Os3 70.5(3) . . ? C31 C27 Os3 128.1(3) . . ? C29 C28 C27 122.0(4) . . ? C29 C28 Os3 71.1(2) . . ? C27 C28 Os3 71.0(2) . . ? C29 C28 H28 119.0 . . ? C27 C28 H28 119.0 . . ? Os3 C28 H28 132.0 . . ? C28 C29 C24 120.8(4) . . ? C28 C29 Os3 71.0(2) . . ? C24 C29 Os3 71.7(2) . . ? C28 C29 H29 119.6 . . ? C24 C29 H29 119.6 . . ? Os3 C29 H29 130.5 . . ? C24 C30 H30A 109.5 . . ? C24 C30 H30B 109.5 . . ? H30A C30 H30B 109.5 . . ? C24 C30 H30C 109.5 . . ? H30A C30 H30C 109.5 . . ? H30B C30 H30C 109.5 . . ? C27 C31 C32 113.5(4) . . ? C27 C31 C33 110.0(4) . . ? C32 C31 C33 110.9(4) . . ? C27 C31 H31 107.4 . . ? C32 C31 H31 107.4 . . ? C33 C31 H31 107.4 . . ? C31 C32 H32A 109.5 . . ? C31 C32 H32B 109.5 . . ? H32A C32 H32B 109.5 . . ? C31 C32 H32C 109.5 . . ? H32A C32 H32C 109.5 . . ? H32B C32 H32C 109.5 . . ? C31 C33 H33A 109.5 . . ? C31 C33 H33B 109.5 . . ? H33A C33 H33B 109.5 . . ? C31 C33 H33C 109.5 . . ? H33A C33 H33C 109.5 . . ? H33B C33 H33C 109.5 . . ? C35 C34 C39 118.5(5) . . ? C35 C34 C40 119.5(5) . . ? C39 C34 C40 122.0(5) . . ? C35 C34 Os4 70.3(3) . . ? C39 C34 Os4 70.6(3) . . ? C40 C34 Os4 130.2(4) . . ? C34 C35 C36 120.4(5) . . ? C34 C35 Os4 72.1(3) . . ? C36 C35 Os4 70.2(3) . . ? C34 C35 H35 119.8 . . ? C36 C35 H35 119.8 . . ? Os4 C35 H35 130.6 . . ? C35 C36 C37 121.6(4) . . ? C35 C36 Os4 71.5(3) . . ? C37 C36 Os4 71.6(3) . . ? C35 C36 H36 119.2 . . ? C37 C36 H36 119.2 . . ? Os4 C36 H36 130.4 . . ? C38 C37 C36 117.8(4) . . ? C38 C37 C41 123.3(4) . . ? C36 C37 C41 118.9(4) . . ? C38 C37 Os4 70.7(3) . . ? C36 C37 Os4 70.2(3) . . ? C41 C37 Os4 128.5(3) . . ? C37 C38 C39 121.4(4) . . ? C37 C38 Os4 71.5(2) . . ? C39 C38 Os4 71.8(3) . . ? C37 C38 H38 119.3 . . ? C39 C38 H38 119.3 . . ? Os4 C38 H38 130.1 . . ? C38 C39 C34 120.2(4) . . ? C38 C39 Os4 70.0(2) . . ? C34 C39 Os4 71.3(3) . . ? C38 C39 H39 119.9 . . ? C34 C39 H39 119.9 . . ? Os4 C39 H39 131.7 . . ? C34 C40 H40A 109.5 . . ? C34 C40 H40B 109.5 . . ? H40A C40 H40B 109.5 . . ? C34 C40 H40C 109.5 . . ? H40A C40 H40C 109.5 . . ? H40B C40 H40C 109.5 . . ? C43 C41 C37 113.1(4) . . ? C43 C41 C42 112.2(5) . . ? C37 C41 C42 109.0(4) . . ? C43 C41 H41 107.4 . . ? C37 C41 H41 107.4 . . ? C42 C41 H41 107.4 . . ? C41 C42 H42A 109.5 . . ? C41 C42 H42B 109.5 . . ? H42A C42 H42B 109.5 . . ? C41 C42 H42C 109.5 . . ? H42A C42 H42C 109.5 . . ? H42B C42 H42C 109.5 . . ? C41 C43 H43A 109.5 . . ? C41 C43 H43B 109.5 . . ? H43A C43 H43B 109.5 . . ? C41 C43 H43C 109.5 . . ? H43A C43 H43C 109.5 . . ? H43B C43 H43C 109.5 . . ? O4 C44 H44A 109.5 . . ? O4 C44 H44B 109.5 . . ? H44A C44 H44B 109.5 . . ? O4 C44 H44C 109.5 . . ? H44A C44 H44C 109.5 . . ? H44B C44 H44C 109.5 . . ? O5 C45 H45A 109.5 . . ? O5 C45 H45B 109.5 . . ? H45A C45 H45B 109.5 . . ? O5 C45 H45C 109.5 . . ? H45A C45 H45C 109.5 . . ? H45B C45 H45C 109.5 . . ? O6 C46 H46A 109.5 . . ? O6 C46 H46B 109.5 . . ? H46A C46 H46B 109.5 . . ? O6 C46 H46C 109.5 . . ? H46A C46 H46C 109.5 . . ? H46B C46 H46C 109.5 . . ? 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 O3 Os1 Os2 O2 118.19(19) . . . . ? O1 Os1 Os2 O2 -122.79(19) . . . . ? C6 Os1 Os2 O2 140.9(2) . . . . ? C1 Os1 Os2 O2 -161.8(2) . . . . ? C2 Os1 Os2 O2 -103.5(2) . . . . ? C3 Os1 Os2 O2 -44.1(2) . . . . ? C5 Os1 Os2 O2 80.4(2) . . . . ? C4 Os1 Os2 O2 18.7(2) . . . . ? O2 Os1 Os2 O3 -118.19(19) . . . . ? O1 Os1 Os2 O3 119.02(18) . . . . ? C6 Os1 Os2 O3 22.7(2) . . . . ? C1 Os1 Os2 O3 80.0(2) . . . . ? C2 Os1 Os2 O3 138.3(2) . . . . ? C3 Os1 Os2 O3 -162.3(2) . . . . ? C5 Os1 Os2 O3 -37.8(2) . . . . ? C4 Os1 Os2 O3 -99.5(2) . . . . ? O3 Os1 Os2 O1 -119.02(17) . . . . ? O2 Os1 Os2 O1 122.79(19) . . . . ? C6 Os1 Os2 O1 -96.3(2) . . . . ? C1 Os1 Os2 O1 -39.0(2) . . . . ? C2 Os1 Os2 O1 19.3(2) . . . . ? C3 Os1 Os2 O1 78.7(2) . . . . ? C5 Os1 Os2 O1 -156.8(2) . . . . ? C4 Os1 Os2 O1 141.5(2) . . . . ? O3 Os1 Os2 C15 18.5(2) . . . . ? O2 Os1 Os2 C15 -99.7(2) . . . . ? O1 Os1 Os2 C15 137.5(2) . . . . ? C6 Os1 Os2 C15 41.2(2) . . . . ? C1 Os1 Os2 C15 98.5(3) . . . . ? C2 Os1 Os2 C15 156.8(2) . . . . ? C3 Os1 Os2 C15 -143.8(2) . . . . ? C5 Os1 Os2 C15 -19.3(2) . . . . ? C4 Os1 Os2 C15 -81.0(2) . . . . ? O3 Os1 Os2 C13 138.8(2) . . . . ? O2 Os1 Os2 C13 20.6(2) . . . . ? O1 Os1 Os2 C13 -102.2(2) . . . . ? C6 Os1 Os2 C13 161.5(3) . . . . ? C1 Os1 Os2 C13 -141.2(3) . . . . ? C2 Os1 Os2 C13 -82.9(3) . . . . ? C3 Os1 Os2 C13 -23.4(3) . . . . ? C5 Os1 Os2 C13 101.0(2) . . . . ? C4 Os1 Os2 C13 39.3(2) . . . . ? O3 Os1 Os2 C12 -158.8(2) . . . . ? O2 Os1 Os2 C12 83.0(2) . . . . ? O1 Os1 Os2 C12 -39.8(2) . . . . ? C6 Os1 Os2 C12 -136.1(3) . . . . ? C1 Os1 Os2 C12 -78.9(3) . . . . ? C2 Os1 Os2 C12 -20.5(3) . . . . ? C3 Os1 Os2 C12 38.9(3) . . . . ? C5 Os1 Os2 C12 163.4(2) . . . . ? C4 Os1 Os2 C12 101.7(3) . . . . ? O3 Os1 Os2 C16 -40.3(2) . . . . ? O2 Os1 Os2 C16 -158.4(2) . . . . ? O1 Os1 Os2 C16 78.8(2) . . . . ? C6 Os1 Os2 C16 -17.5(3) . . . . ? C1 Os1 Os2 C16 39.7(3) . . . . ? C2 Os1 Os2 C16 98.0(2) . . . . ? C3 Os1 Os2 C16 157.5(2) . . . . ? C5 Os1 Os2 C16 -78.1(2) . . . . ? C4 Os1 Os2 C16 -139.8(2) . . . . ? O3 Os1 Os2 C14 77.2(2) . . . . ? O2 Os1 Os2 C14 -41.0(2) . . . . ? O1 Os1 Os2 C14 -163.8(2) . . . . ? C6 Os1 Os2 C14 99.9(2) . . . . ? C1 Os1 Os2 C14 157.2(2) . . . . ? C2 Os1 Os2 C14 -144.5(2) . . . . ? C3 Os1 Os2 C14 -85.0(2) . . . . ? C5 Os1 Os2 C14 39.4(2) . . . . ? C4 Os1 Os2 C14 -22.3(2) . . . . ? O3 Os1 Os2 C11 -98.3(2) . . . . ? O2 Os1 Os2 C11 143.5(2) . . . . ? O1 Os1 Os2 C11 20.8(2) . . . . ? C6 Os1 Os2 C11 -75.5(3) . . . . ? C1 Os1 Os2 C11 -18.3(3) . . . . ? C2 Os1 Os2 C11 40.0(3) . . . . ? C3 Os1 Os2 C11 99.5(3) . . . . ? C5 Os1 Os2 C11 -136.1(2) . . . . ? C4 Os1 Os2 C11 162.2(2) . . . . ? O3 Os1 O1 C21 168.4(3) . . . . ? O2 Os1 O1 C21 94.0(3) . . . . ? C6 Os1 O1 C21 -105.5(3) . . . . ? C1 Os1 O1 C21 -76.3(3) . . . . ? C2 Os1 O1 C21 -37.0(3) . . . . ? C3 Os1 O1 C21 -4.5(3) . . . . ? C5 Os1 O1 C21 -118.0(5) . . . . ? C4 Os1 O1 C21 17.6(5) . . . . ? Os2 Os1 O1 C21 130.1(3) . . . . ? O3 Os1 O1 Os2 38.28(11) . . . . ? O2 Os1 O1 Os2 -36.17(11) . . . . ? C6 Os1 O1 Os2 124.39(16) . . . . ? C1 Os1 O1 Os2 153.54(15) . . . . ? C2 Os1 O1 Os2 -167.11(14) . . . . ? C3 Os1 O1 Os2 -134.66(14) . . . . ? C5 Os1 O1 Os2 111.9(5) . . . . ? C4 Os1 O1 Os2 -112.6(3) . . . . ? O2 Os2 O1 C21 -92.3(3) . . . . ? O3 Os2 O1 C21 -166.7(4) . . . . ? C15 Os2 O1 C21 124.0(4) . . . . ? C13 Os2 O1 C21 -3.3(4) . . . . ? C12 Os2 O1 C21 26.9(4) . . . . ? C16 Os2 O1 C21 99.3(3) . . . . ? C14 Os2 O1 C21 -25.2(9) . . . . ? C11 Os2 O1 C21 65.2(3) . . . . ? Os1 Os2 O1 C21 -128.5(4) . . . . ? O2 Os2 O1 Os1 36.14(12) . . . . ? O3 Os2 O1 Os1 -38.22(11) . . . . ? C15 Os2 O1 Os1 -107.5(3) . . . . ? C13 Os2 O1 Os1 125.22(17) . . . . ? C12 Os2 O1 Os1 155.36(14) . . . . ? C16 Os2 O1 Os1 -132.26(15) . . . . ? C14 Os2 O1 Os1 103.3(7) . . . . ? C11 Os2 O1 Os1 -166.31(15) . . . . ? O3 Os1 O2 C22 165.2(4) . . . . ? O1 Os1 O2 C22 -119.0(4) . . . . ? C6 Os1 O2 C22 98.8(5) . . . . ? C1 Os1 O2 C22 -69.3(8) . . . . ? C2 Os1 O2 C22 -35.6(5) . . . . ? C3 Os1 O2 C22 -3.2(4) . . . . ? C5 Os1 O2 C22 70.4(4) . . . . ? C4 Os1 O2 C22 36.0(4) . . . . ? Os2 Os1 O2 C22 -155.9(4) . . . . ? O3 Os1 O2 Os2 -38.91(12) . . . . ? O1 Os1 O2 Os2 36.81(12) . . . . ? C6 Os1 O2 Os2 -105.4(3) . . . . ? C1 Os1 O2 Os2 86.6(7) . . . . ? C2 Os1 O2 Os2 120.23(17) . . . . ? C3 Os1 O2 Os2 152.69(14) . . . . ? C5 Os1 O2 Os2 -133.72(15) . . . . ? C4 Os1 O2 Os2 -168.12(14) . . . . ? O3 Os2 O2 C22 -164.4(4) . . . . ? O1 Os2 O2 C22 120.0(4) . . . . ? C15 Os2 O2 C22 -81.2(4) . . . . ? C13 Os2 O2 C22 -10.3(4) . . . . ? C12 Os2 O2 C22 24.2(4) . . . . ? C16 Os2 O2 C22 -106.1(6) . . . . ? C14 Os2 O2 C22 -49.7(4) . . . . ? C11 Os2 O2 C22 51.7(5) . . . . ? Os1 Os2 O2 C22 156.7(4) . . . . ? O3 Os2 O2 Os1 38.84(11) . . . . ? O1 Os2 O2 Os1 -36.74(12) . . . . ? C15 Os2 O2 Os1 122.10(17) . . . . ? C13 Os2 O2 Os1 -167.02(14) . . . . ? C12 Os2 O2 Os1 -132.55(16) . . . . ? C16 Os2 O2 Os1 97.2(6) . . . . ? C14 Os2 O2 Os1 153.60(14) . . . . ? C11 Os2 O2 Os1 -105.0(3) . . . . ? O2 Os1 O3 C23 171.4(4) . . . . ? O1 Os1 O3 C23 93.5(3) . . . . ? C6 Os1 O3 C23 -32.4(3) . . . . ? C1 Os1 O3 C23 2.8(4) . . . . ? C2 Os1 O3 C23 26.8(5) . . . . ? C3 Os1 O3 C23 -118.1(7) . . . . ? C5 Os1 O3 C23 -71.1(3) . . . . ? C4 Os1 O3 C23 -102.3(3) . . . . ? Os2 Os1 O3 C23 132.5(4) . . . . ? O2 Os1 O3 Os2 38.89(12) . . . . ? O1 Os1 O3 Os2 -38.95(11) . . . . ? C6 Os1 O3 Os2 -164.92(15) . . . . ? C1 Os1 O3 Os2 -129.65(15) . . . . ? C2 Os1 O3 Os2 -105.7(3) . . . . ? C3 Os1 O3 Os2 109.4(7) . . . . ? C5 Os1 O3 Os2 156.44(13) . . . . ? C4 Os1 O3 Os2 125.27(16) . . . . ? O2 Os2 O3 C23 -172.6(3) . . . . ? O1 Os2 O3 C23 -94.8(3) . . . . ? C15 Os2 O3 C23 58.6(3) . . . . ? C13 Os2 O3 C23 113.7(4) . . . . ? C12 Os2 O3 C23 -24.4(7) . . . . ? C16 Os2 O3 C23 19.9(3) . . . . ? C14 Os2 O3 C23 92.8(3) . . . . ? C11 Os2 O3 C23 -10.4(4) . . . . ? Os1 Os2 O3 C23 -133.7(3) . . . . ? O2 Os2 O3 Os1 -38.86(12) . . . . ? O1 Os2 O3 Os1 38.88(12) . . . . ? C15 Os2 O3 Os1 -167.65(14) . . . . ? C13 Os2 O3 Os1 -112.5(3) . . . . ? C12 Os2 O3 Os1 109.4(6) . . . . ? C16 Os2 O3 Os1 153.65(14) . . . . ? C14 Os2 O3 Os1 -133.47(14) . . . . ? C11 Os2 O3 Os1 123.29(16) . . . . ? O3 Os1 C1 C6 -67.4(3) . . . . ? O2 Os1 C1 C6 171.6(6) . . . . ? O1 Os1 C1 C6 -140.8(2) . . . . ? C2 Os1 C1 C6 130.0(4) . . . . ? C3 Os1 C1 C6 101.7(3) . . . . ? C5 Os1 C1 C6 28.2(2) . . . . ? C4 Os1 C1 C6 64.6(3) . . . . ? Os2 Os1 C1 C6 -115.1(2) . . . . ? O3 Os1 C1 C2 162.6(2) . . . . ? O2 Os1 C1 C2 41.6(8) . . . . ? O1 Os1 C1 C2 89.2(3) . . . . ? C6 Os1 C1 C2 -130.0(4) . . . . ? C3 Os1 C1 C2 -28.2(2) . . . . ? C5 Os1 C1 C2 -101.8(3) . . . . ? C4 Os1 C1 C2 -65.4(3) . . . . ? Os2 Os1 C1 C2 114.9(2) . . . . ? O3 Os1 C1 C7 48.7(4) . . . . ? O2 Os1 C1 C7 -72.2(8) . . . . ? O1 Os1 C1 C7 -24.7(4) . . . . ? C6 Os1 C1 C7 116.2(5) . . . . ? C2 Os1 C1 C7 -113.9(5) . . . . ? C3 Os1 C1 C7 -142.1(4) . . . . ? C5 Os1 C1 C7 144.4(4) . . . . ? C4 Os1 C1 C7 -179.3(4) . . . . ? Os2 Os1 C1 C7 1.1(5) . . . . ? C6 C1 C2 C3 -2.1(6) . . . . ? C7 C1 C2 C3 173.0(4) . . . . ? Os1 C1 C2 C3 52.7(4) . . . . ? C6 C1 C2 Os1 -54.7(3) . . . . ? C7 C1 C2 Os1 120.3(4) . . . . ? O3 Os1 C2 C3 -168.9(3) . . . . ? O2 Os1 C2 C3 57.3(3) . . . . ? O1 Os1 C2 C3 130.0(3) . . . . ? C6 Os1 C2 C3 -103.2(3) . . . . ? C1 Os1 C2 C3 -133.7(4) . . . . ? C5 Os1 C2 C3 -65.5(3) . . . . ? C4 Os1 C2 C3 -28.2(2) . . . . ? Os2 Os1 C2 C3 117.0(2) . . . . ? O3 Os1 C2 C1 -35.2(4) . . . . ? O2 Os1 C2 C1 -168.9(2) . . . . ? O1 Os1 C2 C1 -96.3(3) . . . . ? C6 Os1 C2 C1 30.5(3) . . . . ? C3 Os1 C2 C1 133.7(4) . . . . ? C5 Os1 C2 C1 68.2(3) . . . . ? C4 Os1 C2 C1 105.5(3) . . . . ? Os2 Os1 C2 C1 -109.3(2) . . . . ? C1 C2 C3 C4 -0.2(6) . . . . ? Os1 C2 C3 C4 52.0(4) . . . . ? C1 C2 C3 Os1 -52.2(4) . . . . ? O3 Os1 C3 C2 154.3(6) . . . . ? O2 Os1 C3 C2 -138.7(2) . . . . ? O1 Os1 C3 C2 -60.2(3) . . . . ? C6 Os1 C3 C2 66.9(3) . . . . ? C1 Os1 C3 C2 29.0(3) . . . . ? C5 Os1 C3 C2 104.4(3) . . . . ? C4 Os1 C3 C2 134.7(4) . . . . ? Os2 Os1 C3 C2 -109.8(2) . . . . ? O3 Os1 C3 C4 19.6(8) . . . . ? O2 Os1 C3 C4 86.6(2) . . . . ? O1 Os1 C3 C4 165.1(2) . . . . ? C6 Os1 C3 C4 -67.9(2) . . . . ? C1 Os1 C3 C4 -105.7(3) . . . . ? C2 Os1 C3 C4 -134.7(4) . . . . ? C5 Os1 C3 C4 -30.3(2) . . . . ? Os2 Os1 C3 C4 115.5(2) . . . . ? C2 C3 C4 C5 2.8(6) . . . . ? Os1 C3 C4 C5 54.7(3) . . . . ? C2 C3 C4 C8 -176.0(4) . . . . ? Os1 C3 C4 C8 -124.1(4) . . . . ? C2 C3 C4 Os1 -51.9(4) . . . . ? O3 Os1 C4 C5 54.9(3) . . . . ? O2 Os1 C4 C5 127.4(2) . . . . ? O1 Os1 C4 C5 -162.2(3) . . . . ? C6 Os1 C4 C5 -28.2(2) . . . . ? C1 Os1 C4 C5 -64.8(2) . . . . ? C2 Os1 C4 C5 -102.5(3) . . . . ? C3 Os1 C4 C5 -130.2(3) . . . . ? Os2 Os1 C4 C5 114.8(2) . . . . ? O3 Os1 C4 C3 -174.8(2) . . . . ? O2 Os1 C4 C3 -102.4(2) . . . . ? O1 Os1 C4 C3 -31.9(4) . . . . ? C6 Os1 C4 C3 102.1(3) . . . . ? C1 Os1 C4 C3 65.4(3) . . . . ? C2 Os1 C4 C3 27.7(2) . . . . ? C5 Os1 C4 C3 130.2(3) . . . . ? Os2 Os1 C4 C3 -115.0(2) . . . . ? O3 Os1 C4 C8 -63.0(4) . . . . ? O2 Os1 C4 C8 9.4(4) . . . . ? O1 Os1 C4 C8 79.9(5) . . . . ? C6 Os1 C4 C8 -146.1(4) . . . . ? C1 Os1 C4 C8 177.2(4) . . . . ? C2 Os1 C4 C8 139.5(4) . . . . ? C3 Os1 C4 C8 111.8(5) . . . . ? C5 Os1 C4 C8 -118.0(5) . . . . ? Os2 Os1 C4 C8 -3.2(5) . . . . ? C3 C4 C5 C6 -3.0(6) . . . . ? C8 C4 C5 C6 175.7(4) . . . . ? Os1 C4 C5 C6 51.3(4) . . . . ? C3 C4 C5 Os1 -54.3(3) . . . . ? C8 C4 C5 Os1 124.4(4) . . . . ? O3 Os1 C5 C4 -139.9(2) . . . . ? O2 Os1 C5 C4 -64.9(3) . . . . ? O1 Os1 C5 C4 150.9(4) . . . . ? C6 Os1 C5 C4 134.6(4) . . . . ? C1 Os1 C5 C4 106.4(3) . . . . ? C2 Os1 C5 C4 67.8(2) . . . . ? C3 Os1 C5 C4 30.8(2) . . . . ? Os2 Os1 C5 C4 -114.8(2) . . . . ? O3 Os1 C5 C6 85.5(2) . . . . ? O2 Os1 C5 C6 160.5(2) . . . . ? O1 Os1 C5 C6 16.3(6) . . . . ? C1 Os1 C5 C6 -28.2(2) . . . . ? C2 Os1 C5 C6 -66.8(2) . . . . ? C3 Os1 C5 C6 -103.8(3) . . . . ? C4 Os1 C5 C6 -134.6(4) . . . . ? Os2 Os1 C5 C6 110.6(2) . . . . ? C2 C1 C6 C5 1.8(6) . . . . ? C7 C1 C6 C5 -173.2(4) . . . . ? Os1 C1 C6 C5 -52.8(4) . . . . ? C2 C1 C6 Os1 54.6(3) . . . . ? C7 C1 C6 Os1 -120.4(4) . . . . ? C4 C5 C6 C1 0.8(6) . . . . ? Os1 C5 C6 C1 52.5(4) . . . . ? C4 C5 C6 Os1 -51.7(4) . . . . ? O3 Os1 C6 C1 123.6(3) . . . . ? O2 Os1 C6 C1 -175.8(3) . . . . ? O1 Os1 C6 C1 51.0(3) . . . . ? C2 Os1 C6 C1 -31.1(3) . . . . ? C3 Os1 C6 C1 -68.4(3) . . . . ? C5 Os1 C6 C1 -134.4(4) . . . . ? C4 Os1 C6 C1 -106.5(3) . . . . ? Os2 Os1 C6 C1 108.4(2) . . . . ? O3 Os1 C6 C5 -102.1(2) . . . . ? O2 Os1 C6 C5 -41.4(4) . . . . ? O1 Os1 C6 C5 -174.6(2) . . . . ? C1 Os1 C6 C5 134.4(4) . . . . ? C2 Os1 C6 C5 103.2(3) . . . . ? C3 Os1 C6 C5 66.0(2) . . . . ? C4 Os1 C6 C5 27.9(2) . . . . ? Os2 Os1 C6 C5 -117.2(2) . . . . ? C5 C4 C8 C9 -31.2(6) . . . . ? C3 C4 C8 C9 147.5(4) . . . . ? Os1 C4 C8 C9 60.4(5) . . . . ? C5 C4 C8 C10 91.8(5) . . . . ? C3 C4 C8 C10 -89.5(5) . . . . ? Os1 C4 C8 C10 -176.6(3) . . . . ? O2 Os2 C11 C16 -171.2(3) . . . . ? O3 Os2 C11 C16 53.9(3) . . . . ? O1 Os2 C11 C16 125.5(2) . . . . ? C15 Os2 C11 C16 -28.8(2) . . . . ? C13 Os2 C11 C16 -102.8(3) . . . . ? C12 Os2 C11 C16 -131.6(4) . . . . ? C14 Os2 C11 C16 -65.5(3) . . . . ? Os1 Os2 C11 C16 111.4(2) . . . . ? O2 Os2 C11 C12 -39.6(4) . . . . ? O3 Os2 C11 C12 -174.6(2) . . . . ? O1 Os2 C11 C12 -103.0(2) . . . . ? C15 Os2 C11 C12 102.8(3) . . . . ? C13 Os2 C11 C12 28.7(2) . . . . ? C16 Os2 C11 C12 131.6(4) . . . . ? C14 Os2 C11 C12 66.0(3) . . . . ? Os1 Os2 C11 C12 -117.0(2) . . . . ? O2 Os2 C11 C17 75.7(6) . . . . ? O3 Os2 C11 C17 -59.3(5) . . . . ? O1 Os2 C11 C17 12.3(4) . . . . ? C15 Os2 C11 C17 -142.0(4) . . . . ? C13 Os2 C11 C17 144.0(4) . . . . ? C12 Os2 C11 C17 115.3(5) . . . . ? C16 Os2 C11 C17 -113.2(5) . . . . ? C14 Os2 C11 C17 -178.7(4) . . . . ? Os1 Os2 C11 C17 -1.7(5) . . . . ? C16 C11 C12 C13 0.8(6) . . . . ? C17 C11 C12 C13 -176.0(4) . . . . ? Os2 C11 C12 C13 -52.9(4) . . . . ? C16 C11 C12 Os2 53.6(4) . . . . ? C17 C11 C12 Os2 -123.1(4) . . . . ? O2 Os2 C12 C13 -64.5(3) . . . . ? O3 Os2 C12 C13 151.0(5) . . . . ? O1 Os2 C12 C13 -142.3(2) . . . . ? C15 Os2 C12 C13 66.1(3) . . . . ? C16 Os2 C12 C13 103.7(3) . . . . ? C14 Os2 C12 C13 28.5(2) . . . . ? C11 Os2 C12 C13 133.3(4) . . . . ? Os1 Os2 C12 C13 -115.7(2) . . . . ? O2 Os2 C12 C11 162.2(2) . . . . ? O3 Os2 C12 C11 17.8(7) . . . . ? O1 Os2 C12 C11 84.4(3) . . . . ? C15 Os2 C12 C11 -67.2(3) . . . . ? C13 Os2 C12 C11 -133.3(4) . . . . ? C16 Os2 C12 C11 -29.6(2) . . . . ? C14 Os2 C12 C11 -104.8(3) . . . . ? Os1 Os2 C12 C11 111.0(2) . . . . ? C11 C12 C13 C14 0.3(6) . . . . ? Os2 C12 C13 C14 -53.0(4) . . . . ? C11 C12 C13 Os2 53.3(4) . . . . ? O2 Os2 C13 C12 128.5(2) . . . . ? O3 Os2 C13 C12 -164.8(3) . . . . ? O1 Os2 C13 C12 52.3(3) . . . . ? C15 Os2 C13 C12 -103.8(3) . . . . ? C16 Os2 C13 C12 -66.0(3) . . . . ? C14 Os2 C13 C12 -134.2(4) . . . . ? C11 Os2 C13 C12 -28.8(2) . . . . ? Os1 Os2 C13 C12 114.6(2) . . . . ? O2 Os2 C13 C14 -97.3(2) . . . . ? O3 Os2 C13 C14 -30.6(4) . . . . ? O1 Os2 C13 C14 -173.5(2) . . . . ? C15 Os2 C13 C14 30.4(2) . . . . ? C12 Os2 C13 C14 134.2(4) . . . . ? C16 Os2 C13 C14 68.2(3) . . . . ? C11 Os2 C13 C14 105.4(3) . . . . ? Os1 Os2 C13 C14 -111.2(2) . . . . ? C12 C13 C14 C15 -0.7(6) . . . . ? Os2 C13 C14 C15 -53.6(3) . . . . ? C12 C13 C14 C18 177.5(4) . . . . ? Os2 C13 C14 C18 124.5(4) . . . . ? C12 C13 C14 Os2 52.9(4) . . . . ? O2 Os2 C14 C15 -138.7(2) . . . . ? O3 Os2 C14 C15 -64.7(3) . . . . ? O1 Os2 C14 C15 156.9(7) . . . . ? C13 Os2 C14 C15 130.1(4) . . . . ? C12 Os2 C14 C15 102.0(3) . . . . ? C16 Os2 C14 C15 28.5(2) . . . . ? C11 Os2 C14 C15 65.0(3) . . . . ? Os1 Os2 C14 C15 -112.0(2) . . . . ? O2 Os2 C14 C13 91.1(3) . . . . ? O3 Os2 C14 C13 165.2(2) . . . . ? O1 Os2 C14 C13 26.7(9) . . . . ? C15 Os2 C14 C13 -130.1(4) . . . . ? C12 Os2 C14 C13 -28.1(2) . . . . ? C16 Os2 C14 C13 -101.7(3) . . . . ? C11 Os2 C14 C13 -65.1(3) . . . . ? Os1 Os2 C14 C13 117.9(2) . . . . ? O2 Os2 C14 C18 -23.3(4) . . . . ? O3 Os2 C14 C18 50.7(4) . . . . ? O1 Os2 C14 C18 -87.7(8) . . . . ? C15 Os2 C14 C18 115.4(5) . . . . ? C13 Os2 C14 C18 -114.4(5) . . . . ? C12 Os2 C14 C18 -142.5(4) . . . . ? C16 Os2 C14 C18 143.9(4) . . . . ? C11 Os2 C14 C18 -179.6(4) . . . . ? Os1 Os2 C14 C18 3.5(5) . . . . ? C13 C14 C15 C16 0.1(6) . . . . ? C18 C14 C15 C16 -178.0(4) . . . . ? Os2 C14 C15 C16 -53.5(4) . . . . ? C13 C14 C15 Os2 53.6(3) . . . . ? C18 C14 C15 Os2 -124.5(4) . . . . ? O2 Os2 C15 C14 55.7(3) . . . . ? O3 Os2 C15 C14 126.0(2) . . . . ? O1 Os2 C15 C14 -170.9(3) . . . . ? C13 Os2 C15 C14 -30.8(2) . . . . ? C12 Os2 C15 C14 -68.1(3) . . . . ? C16 Os2 C15 C14 -134.0(4) . . . . ? C11 Os2 C15 C14 -105.7(3) . . . . ? Os1 Os2 C15 C14 113.6(2) . . . . ? O2 Os2 C15 C16 -170.3(2) . . . . ? O3 Os2 C15 C16 -100.0(2) . . . . ? O1 Os2 C15 C16 -36.9(4) . . . . ? C13 Os2 C15 C16 103.2(3) . . . . ? C12 Os2 C15 C16 65.9(3) . . . . ? C14 Os2 C15 C16 134.0(4) . . . . ? C11 Os2 C15 C16 28.4(2) . . . . ? Os1 Os2 C15 C16 -112.4(2) . . . . ? C12 C11 C16 C15 -1.3(6) . . . . ? C17 C11 C16 C15 175.5(4) . . . . ? Os2 C11 C16 C15 52.1(4) . . . . ? C12 C11 C16 Os2 -53.4(4) . . . . ? C17 C11 C16 Os2 123.4(4) . . . . ? C14 C15 C16 C11 0.9(6) . . . . ? Os2 C15 C16 C11 -52.7(4) . . . . ? C14 C15 C16 Os2 53.6(4) . . . . ? O2 Os2 C16 C11 165.4(5) . . . . ? O3 Os2 C16 C11 -139.7(2) . . . . ? O1 Os2 C16 C11 -65.0(3) . . . . ? C15 Os2 C16 C11 133.6(4) . . . . ? C13 Os2 C16 C11 67.2(3) . . . . ? C12 Os2 C16 C11 29.9(2) . . . . ? C14 Os2 C16 C11 105.3(3) . . . . ? Os1 Os2 C16 C11 -113.4(2) . . . . ? O2 Os2 C16 C15 31.8(7) . . . . ? O3 Os2 C16 C15 86.7(2) . . . . ? O1 Os2 C16 C15 161.4(2) . . . . ? C13 Os2 C16 C15 -66.4(3) . . . . ? C12 Os2 C16 C15 -103.7(3) . . . . ? C14 Os2 C16 C15 -28.3(2) . . . . ? C11 Os2 C16 C15 -133.6(4) . . . . ? Os1 Os2 C16 C15 113.0(2) . . . . ? C15 C14 C18 C20 53.2(5) . . . . ? C13 C14 C18 C20 -124.9(4) . . . . ? Os2 C14 C18 C20 -36.2(5) . . . . ? C15 C14 C18 C19 -68.8(5) . . . . ? C13 C14 C18 C19 113.1(4) . . . . ? Os2 C14 C18 C19 -158.2(3) . . . . ? O6 Os3 Os4 O5 -116.64(19) . . . . ? O4 Os3 Os4 O5 120.14(18) . . . . ? C26 Os3 Os4 O5 -19.1(2) . . . . ? C28 Os3 Os4 O5 -135.9(2) . . . . ? C29 Os3 Os4 O5 163.8(2) . . . . ? C27 Os3 Os4 O5 -77.3(2) . . . . ? C25 Os3 Os4 O5 40.9(2) . . . . ? C24 Os3 Os4 O5 101.8(2) . . . . ? O5 Os3 Os4 O6 116.64(19) . . . . ? O4 Os3 Os4 O6 -123.22(18) . . . . ? C26 Os3 Os4 O6 97.6(2) . . . . ? C28 Os3 Os4 O6 -19.2(2) . . . . ? C29 Os3 Os4 O6 -79.6(2) . . . . ? C27 Os3 Os4 O6 39.4(2) . . . . ? C25 Os3 Os4 O6 157.5(2) . . . . ? C24 Os3 Os4 O6 -141.6(2) . . . . ? O5 Os3 Os4 O4 -120.14(18) . . . . ? O6 Os3 Os4 O4 123.22(18) . . . . ? C26 Os3 Os4 O4 -139.2(2) . . . . ? C28 Os3 Os4 O4 104.0(2) . . . . ? C29 Os3 Os4 O4 43.6(2) . . . . ? C27 Os3 Os4 O4 162.6(2) . . . . ? C25 Os3 Os4 O4 -79.3(2) . . . . ? C24 Os3 Os4 O4 -18.3(2) . . . . ? O5 Os3 Os4 C36 -3.2(3) . . . . ? O6 Os3 Os4 C36 -119.8(3) . . . . ? O4 Os3 Os4 C36 117.0(3) . . . . ? C26 Os3 Os4 C36 -22.3(3) . . . . ? C28 Os3 Os4 C36 -139.0(3) . . . . ? C29 Os3 Os4 C36 160.6(3) . . . . ? C27 Os3 Os4 C36 -80.4(3) . . . . ? C25 Os3 Os4 C36 37.7(3) . . . . ? C24 Os3 Os4 C36 98.6(3) . . . . ? O5 Os3 Os4 C38 111.8(2) . . . . ? O6 Os3 Os4 C38 -4.8(2) . . . . ? O4 Os3 Os4 C38 -128.0(2) . . . . ? C26 Os3 Os4 C38 92.8(3) . . . . ? C28 Os3 Os4 C38 -24.0(3) . . . . ? C29 Os3 Os4 C38 -84.4(3) . . . . ? C27 Os3 Os4 C38 34.6(3) . . . . ? C25 Os3 Os4 C38 152.7(3) . . . . ? C24 Os3 Os4 C38 -146.4(3) . . . . ? O5 Os3 Os4 C35 -63.2(3) . . . . ? O6 Os3 Os4 C35 -179.8(3) . . . . ? O4 Os3 Os4 C35 56.9(3) . . . . ? C26 Os3 Os4 C35 -82.3(3) . . . . ? C28 Os3 Os4 C35 160.9(3) . . . . ? C29 Os3 Os4 C35 100.6(3) . . . . ? C27 Os3 Os4 C35 -140.5(3) . . . . ? C25 Os3 Os4 C35 -22.3(3) . . . . ? C24 Os3 Os4 C35 38.6(3) . . . . ? O5 Os3 Os4 C37 54.6(2) . . . . ? O6 Os3 Os4 C37 -62.1(2) . . . . ? O4 Os3 Os4 C37 174.7(2) . . . . ? C26 Os3 Os4 C37 35.5(3) . . . . ? C28 Os3 Os4 C37 -81.3(3) . . . . ? C29 Os3 Os4 C37 -141.7(2) . . . . ? C27 Os3 Os4 C37 -22.7(3) . . . . ? C25 Os3 Os4 C37 95.4(3) . . . . ? C24 Os3 Os4 C37 156.4(2) . . . . ? O5 Os3 Os4 C39 172.9(3) . . . . ? O6 Os3 Os4 C39 56.2(3) . . . . ? O4 Os3 Os4 C39 -67.0(3) . . . . ? C26 Os3 Os4 C39 153.8(3) . . . . ? C28 Os3 Os4 C39 37.0(3) . . . . ? C29 Os3 Os4 C39 -23.4(3) . . . . ? C27 Os3 Os4 C39 95.6(3) . . . . ? C25 Os3 Os4 C39 -146.3(3) . . . . ? C24 Os3 Os4 C39 -85.3(3) . . . . ? O5 Os3 Os4 C34 -124.3(3) . . . . ? O6 Os3 Os4 C34 119.0(3) . . . . ? O4 Os3 Os4 C34 -4.2(3) . . . . ? C26 Os3 Os4 C34 -143.4(3) . . . . ? C28 Os3 Os4 C34 99.8(3) . . . . ? C29 Os3 Os4 C34 39.4(3) . . . . ? C27 Os3 Os4 C34 158.4(3) . . . . ? C25 Os3 Os4 C34 -83.5(3) . . . . ? C24 Os3 Os4 C34 -22.5(3) . . . . ? O5 Os3 O4 C44 173.4(3) . . . . ? O6 Os3 O4 C44 99.9(3) . . . . ? C26 Os3 O4 C44 -116.7(4) . . . . ? C28 Os3 O4 C44 13.8(4) . . . . ? C29 Os3 O4 C44 -17.1(4) . . . . ? C27 Os3 O4 C44 42.7(9) . . . . ? C25 Os3 O4 C44 -90.0(3) . . . . ? C24 Os3 O4 C44 -55.9(3) . . . . ? Os4 Os3 O4 C44 135.8(4) . . . . ? O5 Os3 O4 Os4 37.52(11) . . . . ? O6 Os3 O4 Os4 -35.91(11) . . . . ? C26 Os3 O4 Os4 107.4(3) . . . . ? C28 Os3 O4 Os4 -122.05(17) . . . . ? C29 Os3 O4 Os4 -152.98(13) . . . . ? C27 Os3 O4 Os4 -93.1(7) . . . . ? C25 Os3 O4 Os4 134.11(16) . . . . ? C24 Os3 O4 Os4 168.25(14) . . . . ? O5 Os4 O4 C44 -172.2(3) . . . . ? O6 Os4 O4 C44 -98.6(3) . . . . ? C36 Os4 O4 C44 110.2(4) . . . . ? C38 Os4 O4 C44 -23.0(5) . . . . ? C35 Os4 O4 C44 80.0(4) . . . . ? C39 Os4 O4 C44 6.1(4) . . . . ? C34 Os4 O4 C44 42.6(3) . . . . ? Os3 Os4 O4 C44 -134.7(4) . . . . ? O5 Os4 O4 Os3 -37.48(11) . . . . ? O6 Os4 O4 Os3 36.10(11) . . . . ? C36 Os4 O4 Os3 -115.1(2) . . . . ? C38 Os4 O4 Os3 111.7(3) . . . . ? C35 Os4 O4 Os3 -145.31(16) . . . . ? C39 Os4 O4 Os3 140.79(17) . . . . ? C34 Os4 O4 Os3 177.34(16) . . . . ? O6 Os3 O5 C45 178.1(4) . . . . ? O4 Os3 O5 C45 100.0(4) . . . . ? C26 Os3 O5 C45 -54.4(4) . . . . ? C28 Os3 O5 C45 -112.9(4) . . . . ? C29 Os3 O5 C45 29.9(10) . . . . ? C27 Os3 O5 C45 -90.1(4) . . . . ? C25 Os3 O5 C45 -16.1(4) . . . . ? C24 Os3 O5 C45 14.8(4) . . . . ? Os4 Os3 O5 C45 138.3(4) . . . . ? O6 Os3 O5 Os4 39.78(12) . . . . ? O4 Os3 O5 Os4 -38.34(12) . . . . ? C26 Os3 O5 Os4 167.30(15) . . . . ? C28 Os3 O5 Os4 108.7(3) . . . . ? C29 Os3 O5 Os4 -108.4(8) . . . . ? C27 Os3 O5 Os4 131.63(15) . . . . ? C25 Os3 O5 Os4 -154.38(15) . . . . ? C24 Os3 O5 Os4 -123.56(18) . . . . ? O6 Os4 O5 C45 -178.7(4) . . . . ? O4 Os4 O5 C45 -100.7(4) . . . . ? C36 Os4 O5 C45 39.1(4) . . . . ? C38 Os4 O5 C45 103.9(4) . . . . ? C35 Os4 O5 C45 3.0(4) . . . . ? C37 Os4 O5 C45 77.0(4) . . . . ? C34 Os4 O5 C45 -22.5(5) . . . . ? Os3 Os4 O5 C45 -138.8(4) . . . . ? O6 Os4 O5 Os3 -39.95(12) . . . . ? O4 Os4 O5 Os3 38.11(12) . . . . ? C36 Os4 O5 Os3 177.86(17) . . . . ? C38 Os4 O5 Os3 -117.3(2) . . . . ? C35 Os4 O5 Os3 141.78(17) . . . . ? C37 Os4 O5 Os3 -144.25(15) . . . . ? C34 Os4 O5 Os3 116.3(2) . . . . ? O5 Os4 O6 C46 178.2(4) . . . . ? O4 Os4 O6 C46 102.5(3) . . . . ? C36 Os4 O6 C46 -107.6(4) . . . . ? C38 Os4 O6 C46 -44.5(4) . . . . ? C37 Os4 O6 C46 -81.3(4) . . . . ? C39 Os4 O6 C46 -7.6(4) . . . . ? C34 Os4 O6 C46 20.0(5) . . . . ? Os3 Os4 O6 C46 138.7(4) . . . . ? O5 Os4 O6 Os3 39.45(12) . . . . ? O4 Os4 O6 Os3 -36.26(12) . . . . ? C36 Os4 O6 Os3 113.7(2) . . . . ? C38 Os4 O6 Os3 176.82(15) . . . . ? C37 Os4 O6 Os3 140.01(15) . . . . ? C39 Os4 O6 Os3 -146.33(15) . . . . ? C34 Os4 O6 Os3 -118.7(2) . . . . ? O5 Os3 O6 C46 -178.2(4) . . . . ? O4 Os3 O6 C46 -102.1(4) . . . . ? C26 Os3 O6 C46 98.1(4) . . . . ? C28 Os3 O6 C46 28.8(4) . . . . ? C29 Os3 O6 C46 -4.8(4) . . . . ? C27 Os3 O6 C46 67.8(4) . . . . ? C25 Os3 O6 C46 114.3(6) . . . . ? C24 Os3 O6 C46 -28.9(5) . . . . ? Os4 Os3 O6 C46 -138.6(4) . . . . ? O5 Os3 O6 Os4 -39.62(12) . . . . ? O4 Os3 O6 Os4 36.54(12) . . . . ? C26 Os3 O6 Os4 -123.29(17) . . . . ? C28 Os3 O6 Os4 167.41(16) . . . . ? C29 Os3 O6 Os4 133.84(15) . . . . ? C27 Os3 O6 Os4 -153.62(15) . . . . ? C25 Os3 O6 Os4 -107.1(5) . . . . ? C24 Os3 O6 Os4 109.7(3) . . . . ? O5 Os3 C24 C25 -53.9(3) . . . . ? O6 Os3 C24 C25 165.5(3) . . . . ? O4 Os3 C24 C25 -126.8(2) . . . . ? C26 Os3 C24 C25 28.0(3) . . . . ? C28 Os3 C24 C25 102.0(3) . . . . ? C29 Os3 C24 C25 130.6(4) . . . . ? C27 Os3 C24 C25 65.0(3) . . . . ? Os4 Os3 C24 C25 -114.3(3) . . . . ? O5 Os3 C24 C29 175.5(2) . . . . ? O6 Os3 C24 C29 34.9(5) . . . . ? O4 Os3 C24 C29 102.6(3) . . . . ? C26 Os3 C24 C29 -102.6(3) . . . . ? C28 Os3 C24 C29 -28.6(3) . . . . ? C27 Os3 C24 C29 -65.6(3) . . . . ? C25 Os3 C24 C29 -130.6(4) . . . . ? Os4 Os3 C24 C29 115.1(2) . . . . ? O5 Os3 C24 C30 60.9(5) . . . . ? O6 Os3 C24 C30 -79.7(5) . . . . ? O4 Os3 C24 C30 -12.0(4) . . . . ? C26 Os3 C24 C30 142.7(5) . . . . ? C28 Os3 C24 C30 -143.2(5) . . . . ? C29 Os3 C24 C30 -114.6(5) . . . . ? C27 Os3 C24 C30 179.8(4) . . . . ? C25 Os3 C24 C30 114.8(5) . . . . ? Os4 Os3 C24 C30 0.5(5) . . . . ? C29 C24 C25 C26 2.4(6) . . . . ? C30 C24 C25 C26 -176.5(4) . . . . ? Os3 C24 C25 C26 -51.2(4) . . . . ? C29 C24 C25 Os3 53.6(3) . . . . ? C30 C24 C25 Os3 -125.2(4) . . . . ? O5 Os3 C25 C26 -84.1(3) . . . . ? O6 Os3 C25 C26 -20.9(7) . . . . ? O4 Os3 C25 C26 -160.6(2) . . . . ? C28 Os3 C25 C26 66.9(3) . . . . ? C29 Os3 C25 C26 104.3(3) . . . . ? C27 Os3 C25 C26 28.7(3) . . . . ? C24 Os3 C25 C26 134.8(4) . . . . ? Os4 Os3 C25 C26 -110.9(3) . . . . ? O5 Os3 C25 C24 141.1(2) . . . . ? O6 Os3 C25 C24 -155.6(5) . . . . ? O4 Os3 C25 C24 64.6(3) . . . . ? C26 Os3 C25 C24 -134.8(4) . . . . ? C28 Os3 C25 C24 -67.8(3) . . . . ? C29 Os3 C25 C24 -30.5(3) . . . . ? C27 Os3 C25 C24 -106.1(3) . . . . ? Os4 Os3 C25 C24 114.3(2) . . . . ? C24 C25 C26 C27 -1.5(7) . . . . ? Os3 C25 C26 C27 -53.3(4) . . . . ? C24 C25 C26 Os3 51.8(4) . . . . ? O5 Os3 C26 C25 103.5(3) . . . . ? O6 Os3 C26 C25 173.4(2) . . . . ? O4 Os3 C26 C25 39.6(5) . . . . ? C28 Os3 C26 C25 -102.7(3) . . . . ? C29 Os3 C26 C25 -65.6(3) . . . . ? C27 Os3 C26 C25 -133.8(4) . . . . ? C24 Os3 C26 C25 -27.8(2) . . . . ? Os4 Os3 C26 C25 116.3(3) . . . . ? O5 Os3 C26 C27 -122.7(3) . . . . ? O6 Os3 C26 C27 -52.9(3) . . . . ? O4 Os3 C26 C27 173.3(3) . . . . ? C28 Os3 C26 C27 31.1(3) . . . . ? C29 Os3 C26 C27 68.2(3) . . . . ? C25 Os3 C26 C27 133.8(4) . . . . ? C24 Os3 C26 C27 106.0(3) . . . . ? Os4 Os3 C26 C27 -110.0(3) . . . . ? C25 C26 C27 C28 -1.1(6) . . . . ? Os3 C26 C27 C28 -54.7(4) . . . . ? C25 C26 C27 C31 176.9(4) . . . . ? Os3 C26 C27 C31 123.3(4) . . . . ? C25 C26 C27 Os3 53.6(4) . . . . ? O5 Os3 C27 C26 68.1(3) . . . . ? O6 Os3 C27 C26 140.1(3) . . . . ? O4 Os3 C27 C26 -165.1(6) . . . . ? C28 Os3 C27 C26 -129.4(4) . . . . ? C29 Os3 C27 C26 -101.9(3) . . . . ? C25 Os3 C27 C26 -28.4(3) . . . . ? C24 Os3 C27 C26 -64.9(3) . . . . ? Os4 Os3 C27 C26 114.5(3) . . . . ? O5 Os3 C27 C28 -162.5(2) . . . . ? O6 Os3 C27 C28 -90.4(3) . . . . ? O4 Os3 C27 C28 -35.6(8) . . . . ? C26 Os3 C27 C28 129.4(4) . . . . ? C29 Os3 C27 C28 27.5(2) . . . . ? C25 Os3 C27 C28 101.0(3) . . . . ? C24 Os3 C27 C28 64.6(3) . . . . ? Os4 Os3 C27 C28 -116.0(2) . . . . ? O5 Os3 C27 C31 -47.8(4) . . . . ? O6 Os3 C27 C31 24.2(4) . . . . ? O4 Os3 C27 C31 79.0(9) . . . . ? C26 Os3 C27 C31 -115.9(5) . . . . ? C28 Os3 C27 C31 114.7(5) . . . . ? C29 Os3 C27 C31 142.2(4) . . . . ? C25 Os3 C27 C31 -144.3(4) . . . . ? C24 Os3 C27 C31 179.2(4) . . . . ? Os4 Os3 C27 C31 -1.4(5) . . . . ? C26 C27 C28 C29 2.7(6) . . . . ? C31 C27 C28 C29 -175.3(4) . . . . ? Os3 C27 C28 C29 -51.8(4) . . . . ? C26 C27 C28 Os3 54.5(3) . . . . ? C31 C27 C28 Os3 -123.5(4) . . . . ? O5 Os3 C28 C29 169.4(3) . . . . ? O6 Os3 C28 C29 -128.6(3) . . . . ? O4 Os3 C28 C29 -54.0(3) . . . . ? C26 Os3 C28 C29 104.1(3) . . . . ? C27 Os3 C28 C29 135.2(4) . . . . ? C25 Os3 C28 C29 66.4(3) . . . . ? C24 Os3 C28 C29 28.9(3) . . . . ? Os4 Os3 C28 C29 -115.7(2) . . . . ? O5 Os3 C28 C27 34.2(4) . . . . ? O6 Os3 C28 C27 96.2(3) . . . . ? O4 Os3 C28 C27 170.8(2) . . . . ? C26 Os3 C28 C27 -31.1(3) . . . . ? C29 Os3 C28 C27 -135.2(4) . . . . ? C25 Os3 C28 C27 -68.8(3) . . . . ? C24 Os3 C28 C27 -106.3(3) . . . . ? Os4 Os3 C28 C27 109.1(3) . . . . ? C27 C28 C29 C24 -1.8(7) . . . . ? Os3 C28 C29 C24 -53.6(4) . . . . ? C27 C28 C29 Os3 51.8(4) . . . . ? C25 C24 C29 C28 -0.8(6) . . . . ? C30 C24 C29 C28 178.1(4) . . . . ? Os3 C24 C29 C28 53.2(4) . . . . ? C25 C24 C29 Os3 -54.0(4) . . . . ? C30 C24 C29 Os3 124.8(4) . . . . ? O5 Os3 C29 C28 -151.8(7) . . . . ? O6 Os3 C29 C28 62.8(3) . . . . ? O4 Os3 C29 C28 141.2(3) . . . . ? C26 Os3 C29 C28 -65.9(3) . . . . ? C27 Os3 C29 C28 -27.9(3) . . . . ? C25 Os3 C29 C28 -103.2(3) . . . . ? C24 Os3 C29 C28 -133.3(4) . . . . ? Os4 Os3 C29 C28 112.2(3) . . . . ? O5 Os3 C29 C24 -18.5(10) . . . . ? O6 Os3 C29 C24 -163.8(2) . . . . ? O4 Os3 C29 C24 -85.5(3) . . . . ? C26 Os3 C29 C24 67.4(3) . . . . ? C28 Os3 C29 C24 133.3(4) . . . . ? C27 Os3 C29 C24 105.4(3) . . . . ? C25 Os3 C29 C24 30.1(3) . . . . ? Os4 Os3 C29 C24 -114.5(3) . . . . ? C26 C27 C31 C32 -41.7(6) . . . . ? C28 C27 C31 C32 136.2(5) . . . . ? Os3 C27 C31 C32 47.5(6) . . . . ? C26 C27 C31 C33 83.2(5) . . . . ? C28 C27 C31 C33 -98.9(5) . . . . ? Os3 C27 C31 C33 172.4(3) . . . . ? O5 Os4 C34 C35 40.7(4) . . . . ? O6 Os4 C34 C35 -176.5(3) . . . . ? O4 Os4 C34 C35 110.2(3) . . . . ? C36 Os4 C34 C35 -29.1(3) . . . . ? C38 Os4 C34 C35 -102.8(3) . . . . ? C37 Os4 C34 C35 -66.2(3) . . . . ? C39 Os4 C34 C35 -131.5(4) . . . . ? Os3 Os4 C34 C35 113.1(3) . . . . ? O5 Os4 C34 C39 172.2(3) . . . . ? O6 Os4 C34 C39 -45.0(4) . . . . ? O4 Os4 C34 C39 -118.3(3) . . . . ? C36 Os4 C34 C39 102.5(3) . . . . ? C38 Os4 C34 C39 28.7(3) . . . . ? C35 Os4 C34 C39 131.5(4) . . . . ? C37 Os4 C34 C39 65.4(3) . . . . ? Os3 Os4 C34 C39 -115.4(3) . . . . ? O5 Os4 C34 C40 -71.8(6) . . . . ? O6 Os4 C34 C40 71.0(6) . . . . ? O4 Os4 C34 C40 -2.3(6) . . . . ? C36 Os4 C34 C40 -141.5(6) . . . . ? C38 Os4 C34 C40 144.7(6) . . . . ? C35 Os4 C34 C40 -112.5(7) . . . . ? C37 Os4 C34 C40 -178.6(6) . . . . ? C39 Os4 C34 C40 116.0(6) . . . . ? Os3 Os4 C34 C40 0.6(7) . . . . ? C39 C34 C35 C36 -0.6(7) . . . . ? C40 C34 C35 C36 178.7(4) . . . . ? Os4 C34 C35 C36 52.9(4) . . . . ? C39 C34 C35 Os4 -53.5(4) . . . . ? C40 C34 C35 Os4 125.8(4) . . . . ? O5 Os4 C35 C34 -156.0(3) . . . . ? O4 Os4 C35 C34 -79.2(3) . . . . ? C36 Os4 C35 C34 133.1(4) . . . . ? C38 Os4 C35 C34 67.3(3) . . . . ? C37 Os4 C35 C34 104.6(3) . . . . ? C39 Os4 C35 C34 29.9(3) . . . . ? Os3 Os4 C35 C34 -116.0(3) . . . . ? O5 Os4 C35 C36 70.9(3) . . . . ? O4 Os4 C35 C36 147.7(3) . . . . ? C38 Os4 C35 C36 -65.8(3) . . . . ? C37 Os4 C35 C36 -28.5(3) . . . . ? C39 Os4 C35 C36 -103.2(3) . . . . ? C34 Os4 C35 C36 -133.1(4) . . . . ? Os3 Os4 C35 C36 110.9(3) . . . . ? C34 C35 C36 C37 -0.4(7) . . . . ? Os4 C35 C36 C37 53.4(4) . . . . ? C34 C35 C36 Os4 -53.7(4) . . . . ? O5 Os4 C36 C35 -118.4(3) . . . . ? O6 Os4 C36 C35 176.5(2) . . . . ? O4 Os4 C36 C35 -50.1(4) . . . . ? C38 Os4 C36 C35 103.8(3) . . . . ? C37 Os4 C36 C35 133.9(4) . . . . ? C39 Os4 C36 C35 66.2(3) . . . . ? C34 Os4 C36 C35 28.6(3) . . . . ? Os3 Os4 C36 C35 -116.3(3) . . . . ? O5 Os4 C36 C37 107.7(3) . . . . ? O6 Os4 C36 C37 42.6(4) . . . . ? O4 Os4 C36 C37 176.0(2) . . . . ? C38 Os4 C36 C37 -30.1(3) . . . . ? C35 Os4 C36 C37 -133.9(4) . . . . ? C39 Os4 C36 C37 -67.7(3) . . . . ? C34 Os4 C36 C37 -105.3(3) . . . . ? Os3 Os4 C36 C37 109.8(3) . . . . ? C35 C36 C37 C38 0.7(6) . . . . ? Os4 C36 C37 C38 54.0(4) . . . . ? C35 C36 C37 C41 -177.2(4) . . . . ? Os4 C36 C37 C41 -123.8(4) . . . . ? C35 C36 C37 Os4 -53.4(4) . . . . ? O5 Os4 C37 C38 149.4(3) . . . . ? O6 Os4 C37 C38 76.2(3) . . . . ? C36 Os4 C37 C38 -130.7(4) . . . . ? C35 Os4 C37 C38 -102.2(3) . . . . ? C39 Os4 C37 C38 -28.7(3) . . . . ? C34 Os4 C37 C38 -65.6(3) . . . . ? Os3 Os4 C37 C38 115.0(3) . . . . ? O5 Os4 C37 C36 -80.0(3) . . . . ? O6 Os4 C37 C36 -153.1(3) . . . . ? C38 Os4 C37 C36 130.7(4) . . . . ? C35 Os4 C37 C36 28.4(3) . . . . ? C39 Os4 C37 C36 101.9(3) . . . . ? C34 Os4 C37 C36 65.0(3) . . . . ? Os3 Os4 C37 C36 -114.3(3) . . . . ? O5 Os4 C37 C41 31.7(4) . . . . ? O6 Os4 C37 C41 -41.4(4) . . . . ? C36 Os4 C37 C41 111.7(5) . . . . ? C38 Os4 C37 C41 -117.7(5) . . . . ? C35 Os4 C37 C41 140.1(5) . . . . ? C39 Os4 C37 C41 -146.4(5) . . . . ? C34 Os4 C37 C41 176.7(5) . . . . ? Os3 Os4 C37 C41 -2.6(5) . . . . ? C36 C37 C38 C39 0.1(6) . . . . ? C41 C37 C38 C39 177.8(4) . . . . ? Os4 C37 C38 C39 53.8(4) . . . . ? C36 C37 C38 Os4 -53.8(4) . . . . ? C41 C37 C38 Os4 124.0(4) . . . . ? O5 Os4 C38 C37 -45.3(4) . . . . ? O6 Os4 C38 C37 -112.1(3) . . . . ? O4 Os4 C38 C37 179.3(3) . . . . ? C36 Os4 C38 C37 30.4(3) . . . . ? C35 Os4 C38 C37 67.9(3) . . . . ? C39 Os4 C38 C37 133.5(4) . . . . ? C34 Os4 C38 C37 105.0(3) . . . . ? Os3 Os4 C38 C37 -108.9(3) . . . . ? O5 Os4 C38 C39 -178.8(2) . . . . ? O6 Os4 C38 C39 114.4(3) . . . . ? O4 Os4 C38 C39 45.8(4) . . . . ? C36 Os4 C38 C39 -103.1(3) . . . . ? C35 Os4 C38 C39 -65.6(3) . . . . ? C37 Os4 C38 C39 -133.5(4) . . . . ? C34 Os4 C38 C39 -28.6(3) . . . . ? Os3 Os4 C38 C39 117.6(3) . . . . ? C37 C38 C39 C34 -1.0(7) . . . . ? Os4 C38 C39 C34 52.6(4) . . . . ? C37 C38 C39 Os4 -53.7(4) . . . . ? C35 C34 C39 C38 1.3(7) . . . . ? C40 C34 C39 C38 -178.0(4) . . . . ? Os4 C34 C39 C38 -52.1(4) . . . . ? C35 C34 C39 Os4 53.3(4) . . . . ? C40 C34 C39 Os4 -125.9(5) . . . . ? O6 Os4 C39 C38 -74.5(3) . . . . ? O4 Os4 C39 C38 -153.9(3) . . . . ? C36 Os4 C39 C38 66.3(3) . . . . ? C35 Os4 C39 C38 104.0(3) . . . . ? C37 Os4 C39 C38 28.4(3) . . . . ? C34 Os4 C39 C38 133.5(4) . . . . ? Os3 Os4 C39 C38 -111.0(3) . . . . ? O6 Os4 C39 C34 152.0(3) . . . . ? O4 Os4 C39 C34 72.6(3) . . . . ? C36 Os4 C39 C34 -67.2(3) . . . . ? C38 Os4 C39 C34 -133.5(4) . . . . ? C35 Os4 C39 C34 -29.5(3) . . . . ? C37 Os4 C39 C34 -105.1(3) . . . . ? Os3 Os4 C39 C34 115.5(3) . . . . ? C38 C37 C41 C43 -32.9(6) . . . . ? C36 C37 C41 C43 144.9(4) . . . . ? Os4 C37 C41 C43 58.1(6) . . . . ? C38 C37 C41 C42 92.7(6) . . . . ? C36 C37 C41 C42 -89.6(6) . . . . ? Os4 C37 C41 C42 -176.4(5) . . . . ? _diffrn_measured_fraction_theta_max 0.998 _diffrn_reflns_theta_full 30.12 _diffrn_measured_fraction_theta_full 0.998 _refine_diff_density_max 0.854 _refine_diff_density_min -0.935 _refine_diff_density_rms 0.139