#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/05/17/7051772.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7051772
loop_
_publ_author_name
'Wei, Qiao-Hua'
'Argent, Stephen P.'
'Adams, Harry'
'Ward, Michael D.'
_publ_section_title
;
 Post-coordination functionalisation of pyrazolyl-based ligands as a
 route to polynuclear complexes based on an inert RuIIN6 core
;
_journal_issue                   1
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              73
_journal_paper_doi               10.1039/b708572a
_journal_volume                  32
_journal_year                    2008
_chemical_formula_sum            'C120 H107 B4 Cu4 F52 N26 O6.5 Ru Sb6'
_chemical_formula_weight         4134.29
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 96.158(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   16.1145(8)
_cell_length_b                   43.921(2)
_cell_length_c                   24.9915(12)
_cell_measurement_temperature    150(2)
_cell_volume                     17586.0(15)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.745
_diffrn_measured_fraction_theta_max 0.745
_diffrn_measurement_device_type  'Bruker APEX-2 CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0517
_diffrn_reflns_av_sigmaI/netI    0.1161
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       49
_diffrn_reflns_limit_k_min       -31
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            127534
_diffrn_reflns_theta_full        24.99
_diffrn_reflns_theta_max         24.99
_diffrn_reflns_theta_min         0.93
_exptl_absorpt_coefficient_mu    1.568
_exptl_absorpt_correction_T_max  0.7655
_exptl_absorpt_correction_T_min  0.7342
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.561
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             8060
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.18
_refine_diff_density_max         3.978
_refine_diff_density_min         -2.048
_refine_diff_density_rms         0.227
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.249
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1904
_refine_ls_number_reflns         23020
_refine_ls_number_restraints     311
_refine_ls_restrained_S_all      1.605
_refine_ls_R_factor_all          0.2086
_refine_ls_R_factor_gt           0.1281
_refine_ls_shift/su_max          0.015
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.2000P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3540
_refine_ls_wR_factor_ref         0.3847
_reflns_number_gt                10637
_reflns_number_total             23020
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b708572a.txt
_cod_data_source_block           RuCu4
_cod_original_cell_volume        17586.1(15)
_cod_original_sg_symbol_H-M      P2(1)/c
_cod_original_formula_sum        'C120 H107 B4 Cu4 F52 N26 O6.50 Ru Sb6'
_cod_database_code               7051772
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ru1 Ru 0.04778(10) 0.32921(3) 0.91869(6) 0.0379(5) Uani 1 1 d . . .
Cu1 Cu -0.2816(2) 0.38398(8) 0.50443(14) 0.0963(12) Uani 1 1 d . . .
Cu2 Cu -0.4756(2) 0.37469(9) 1.17129(14) 0.0988(13) Uani 1 1 d . . .
Cu3 Cu 0.2080(2) 0.09522(6) 1.11636(12) 0.0769(10) Uani 1 1 d . . .
Cu4 Cu 0.64916(15) 0.45369(6) 0.90641(10) 0.0480(7) Uani 1 1 d . . .
C12 C 0.069(2) 0.0925(5) 1.0314(11) 0.077(8) Uani 1 1 d . . .
C13 C 0.0149(15) 0.0813(6) 0.9913(11) 0.069(7) Uani 1 1 d . . .
H13 H -0.0202 0.0947 0.9693 0.083 Uiso 1 1 calc R . .
C14 C 0.011(2) 0.0514(6) 0.9821(13) 0.094(11) Uani 1 1 d . . .
H14 H -0.0289 0.0437 0.9546 0.113 Uiso 1 1 calc R . .
C15 C 0.060(2) 0.0328(9) 1.0101(16) 0.130(15) Uani 1 1 d . . .
H15 H 0.0546 0.0115 1.0034 0.156 Uiso 1 1 calc R . .
C16 C 0.120(2) 0.0430(6) 1.0494(14) 0.101(11) Uani 1 1 d . . .
H16 H 0.1581 0.0289 1.0670 0.121 Uiso 1 1 calc R . .
C22 C 0.1736(15) 0.1578(5) 1.1003(9) 0.050(6) Uani 1 1 d . . .
C23 C 0.1280(15) 0.1825(5) 1.0780(8) 0.050(6) Uani 1 1 d . . .
H23 H 0.1465 0.2026 1.0867 0.060 Uiso 1 1 calc R . .
C24 C 0.0555(17) 0.1782(4) 1.0429(9) 0.054(6) Uani 1 1 d . . .
C25 C 0.0390(15) 0.1489(4) 1.0223(9) 0.063(7) Uani 1 1 d . . .
H25 H -0.0034 0.1457 0.9934 0.076 Uiso 1 1 calc R . .
C26 C 0.085(2) 0.1250(5) 1.0445(11) 0.072(8) Uani 1 1 d . . .
C32 C 0.330(2) 0.1256(5) 1.1920(12) 0.073(8) Uani 1 1 d . . .
H32 H 0.3462 0.1056 1.2032 0.088 Uiso 1 1 calc R . .
C33 C 0.3739(17) 0.1501(9) 1.2159(11) 0.091(9) Uani 1 1 d . . .
H33 H 0.4223 0.1467 1.2404 0.110 Uiso 1 1 calc R . .
C34 C 0.346(2) 0.1803(7) 1.2040(11) 0.085(8) Uani 1 1 d . . .
H34 H 0.3729 0.1975 1.2215 0.101 Uiso 1 1 calc R . .
C35 C 0.2816(16) 0.1829(6) 1.1670(11) 0.062(7) Uani 1 1 d . . .
H35 H 0.2601 0.2026 1.1573 0.074 Uiso 1 1 calc R . .
C36 C 0.2452(15) 0.1576(5) 1.1427(9) 0.049(6) Uani 1 1 d . . .
C41 C 0.0077(13) 0.2050(4) 1.0184(9) 0.043(5) Uani 1 1 d . . .
C42 C -0.0393(13) 0.2028(4) 0.9710(10) 0.054(6) Uani 1 1 d . . .
H42 H -0.0433 0.1840 0.9519 0.064 Uiso 1 1 calc R . .
C43 C -0.0819(14) 0.2283(5) 0.9503(9) 0.058(6) Uani 1 1 d . . .
H43 H -0.1136 0.2273 0.9161 0.070 Uiso 1 1 calc R . .
C44 C -0.0787(13) 0.2565(4) 0.9804(10) 0.049(6) Uani 1 1 d . . .
C45 C -0.0360(14) 0.2578(5) 1.0276(9) 0.047(6) Uani 1 1 d . . .
H45 H -0.0356 0.2761 1.0480 0.056 Uiso 1 1 calc R . .
C46 C 0.0104(13) 0.2319(5) 1.0492(9) 0.051(6) Uani 1 1 d . . .
H46 H 0.0422 0.2328 1.0834 0.061 Uiso 1 1 calc R . .
C47 C -0.1291(11) 0.2821(4) 0.9533(8) 0.039(5) Uani 1 1 d . . .
H47A H -0.1148 0.2844 0.9160 0.047 Uiso 1 1 calc R . .
H47B H -0.1892 0.2771 0.9516 0.047 Uiso 1 1 calc R . .
C53 C -0.0371(13) 0.3499(5) 1.0112(8) 0.042(5) Uani 1 1 d . . .
C54 C -0.0987(15) 0.3475(6) 1.0446(9) 0.058(6) Uani 1 1 d . . .
H54 H -0.1089 0.3606 1.0735 0.069 Uiso 1 1 calc R . .
C55 C -0.1425(16) 0.3221(6) 1.0268(9) 0.068(8) Uani 1 1 d . . .
H55 H -0.1873 0.3135 1.0436 0.082 Uiso 1 1 calc R . .
C62 C 0.1360(14) 0.3839(4) 0.9541(9) 0.044(5) Uani 1 1 d . . .
C63 C 0.1574(15) 0.4098(6) 0.9868(11) 0.070(7) Uani 1 1 d . . .
H63 H 0.2001 0.4236 0.9794 0.084 Uiso 1 1 calc R . .
C64 C 0.113(2) 0.4136(6) 1.0290(13) 0.098(10) Uani 1 1 d . . .
H64 H 0.1295 0.4298 1.0531 0.118 Uiso 1 1 calc R . .
C65 C 0.0434(16) 0.3951(6) 1.0408(9) 0.063(7) Uani 1 1 d . . .
H65 H 0.0102 0.3997 1.0690 0.076 Uiso 1 1 calc R . .
C66 C 0.0293(16) 0.3702(5) 1.0074(9) 0.050(6) Uani 1 1 d . . .
C73 C 0.2557(15) 0.3648(7) 0.8474(10) 0.069(7) Uani 1 1 d . . .
H73 H 0.2976 0.3655 0.8234 0.083 Uiso 1 1 calc R . .
C74 C 0.2443(14) 0.3861(6) 0.8853(10) 0.063(7) Uani 1 1 d . . .
H74 H 0.2743 0.4045 0.8922 0.076 Uiso 1 1 calc R . .
C75 C 0.1770(12) 0.3747(4) 0.9126(9) 0.043(5) Uani 1 1 d . . .
C81 C 0.1862(14) 0.3180(5) 0.8100(9) 0.065(7) Uani 1 1 d . . .
H81A H 0.1672 0.2996 0.8281 0.078 Uiso 1 1 calc R . .
H81B H 0.2384 0.3130 0.7944 0.078 Uiso 1 1 calc R . .
C82 C 0.1163(14) 0.3288(6) 0.7638(9) 0.057(6) Uani 1 1 d . . .
C83 C 0.0920(16) 0.3595(5) 0.7573(11) 0.066(7) Uani 1 1 d . . .
H83 H 0.1164 0.3749 0.7806 0.079 Uiso 1 1 calc R . .
C84 C 0.0297(14) 0.3665(5) 0.7146(10) 0.056(7) Uani 1 1 d . . .
H84 H 0.0123 0.3871 0.7102 0.068 Uiso 1 1 calc R . .
C85 C -0.0066(15) 0.3454(5) 0.6793(10) 0.052(6) Uani 1 1 d . . .
C86 C 0.0204(16) 0.3149(6) 0.6850(10) 0.066(7) Uani 1 1 d . . .
H86 H -0.0017 0.2999 0.6602 0.079 Uiso 1 1 calc R . .
C87 C 0.0795(15) 0.3072(5) 0.7271(12) 0.065(7) Uani 1 1 d . . .
H87 H 0.0959 0.2865 0.7314 0.078 Uiso 1 1 calc R . .
C92 C -0.176(3) 0.4243(6) 0.5642(15) 0.101(11) Uani 1 1 d . . .
C93 C -0.137(2) 0.4503(6) 0.5926(11) 0.088(9) Uani 1 1 d . . .
H93 H -0.0965 0.4486 0.6229 0.106 Uiso 1 1 calc R . .
C94 C -0.166(2) 0.4778(7) 0.5708(13) 0.105(10) Uani 1 1 d . . .
H94 H -0.1404 0.4962 0.5844 0.126 Uiso 1 1 calc R . .
C95 C -0.231(3) 0.4791(10) 0.5289(14) 0.116(12) Uani 1 1 d . . .
H95 H -0.2494 0.4980 0.5133 0.140 Uiso 1 1 calc R . .
C96 C -0.271(3) 0.4507(10) 0.5102(13) 0.115(12) Uani 1 1 d . . .
H96 H -0.3212 0.4510 0.4863 0.138 Uiso 1 1 calc R . .
C102 C -0.150(2) 0.3919(6) 0.5838(14) 0.087(10) Uani 1 1 d . . .
C103 C -0.0817(19) 0.3853(6) 0.6241(10) 0.072(7) Uani 1 1 d . . .
H103 H -0.0478 0.4011 0.6407 0.086 Uiso 1 1 calc R . .
C104 C -0.0671(16) 0.3540(6) 0.6383(10) 0.056(6) Uani 1 1 d . . .
C105 C -0.1204(17) 0.3343(6) 0.6119(10) 0.066(7) Uani 1 1 d . . .
H105 H -0.1144 0.3133 0.6211 0.079 Uiso 1 1 calc R . .
C106 C -0.1847(17) 0.3424(6) 0.5716(10) 0.063(7) Uani 1 1 d . . .
C112 C -0.248(2) 0.3231(9) 0.5366(15) 0.114(13) Uani 1 1 d . . .
C113 C -0.2442(18) 0.2892(6) 0.5428(12) 0.092(10) Uani 1 1 d . . .
H113 H -0.2049 0.2782 0.5665 0.110 Uiso 1 1 calc R . .
C114 C -0.309(3) 0.2762(7) 0.5075(16) 0.123(13) Uani 1 1 d . . .
H114 H -0.3164 0.2548 0.5094 0.148 Uiso 1 1 calc R . .
C115 C -0.365(2) 0.2923(11) 0.4693(13) 0.125(14) Uani 1 1 d . . .
H115 H -0.4051 0.2822 0.4447 0.150 Uiso 1 1 calc R . .
C116 C -0.357(2) 0.3240(8) 0.4706(12) 0.088(9) Uani 1 1 d . . .
H116 H -0.3947 0.3353 0.4463 0.105 Uiso 1 1 calc R . .
C122 C -0.4450(17) 0.3327(9) 1.0879(13) 0.088(9) Uani 1 1 d . . .
C123 C -0.4500(17) 0.3065(9) 1.0568(14) 0.095(10) Uani 1 1 d . . .
H123 H -0.4168 0.3048 1.0278 0.114 Uiso 1 1 calc R . .
C124 C -0.501(2) 0.2839(8) 1.0670(13) 0.097(10) Uani 1 1 d . . .
H124 H -0.5000 0.2655 1.0470 0.117 Uiso 1 1 calc R . .
C125 C -0.551(2) 0.2867(9) 1.1044(17) 0.106(12) Uani 1 1 d . . .
H125 H -0.5891 0.2706 1.1096 0.127 Uiso 1 1 calc R . .
C126 C -0.552(2) 0.3102(10) 1.1338(16) 0.116(12) Uani 1 1 d . . .
H126 H -0.5893 0.3109 1.1606 0.139 Uiso 1 1 calc R . .
C132 C -0.3619(15) 0.4069(6) 1.1151(9) 0.053(6) Uani 1 1 d . . .
C133 C -0.3071(12) 0.4118(5) 1.0774(8) 0.051(6) Uani 1 1 d . . .
H133 H -0.2757 0.4301 1.0781 0.062 Uiso 1 1 calc R . .
C134 C -0.2977(12) 0.3899(5) 1.0383(8) 0.039(5) Uani 1 1 d . . .
C135 C -0.3408(12) 0.3626(5) 1.0420(8) 0.046(5) Uani 1 1 d . . .
H135 H -0.3353 0.3464 1.0175 0.056 Uiso 1 1 calc R . .
C136 C -0.3931(13) 0.3600(7) 1.0839(10) 0.056(6) Uani 1 1 d . . .
C142 C -0.3770(17) 0.4294(9) 1.1597(10) 0.092(11) Uani 1 1 d . . .
C143 C -0.339(2) 0.4591(7) 1.1700(12) 0.088(9) Uani 1 1 d . . .
H143 H -0.2942 0.4657 1.1509 0.105 Uiso 1 1 calc R . .
C144 C -0.3677(19) 0.4766(8) 1.2064(12) 0.093(10) Uani 1 1 d . . .
H144 H -0.3444 0.4963 1.2125 0.111 Uiso 1 1 calc R . .
C145 C -0.427(3) 0.4679(8) 1.2343(13) 0.100(13) Uani 1 1 d . . .
H145 H -0.4453 0.4813 1.2606 0.120 Uiso 1 1 calc R . .
C146 C -0.463(2) 0.4416(11) 1.2272(12) 0.126(14) Uani 1 1 d . . .
H146 H -0.5054 0.4371 1.2493 0.151 Uiso 1 1 calc R . .
C151 C -0.2432(13) 0.3946(5) 0.9947(9) 0.053(6) Uani 1 1 d . . .
C152 C -0.1821(13) 0.4178(4) 0.9981(9) 0.051(6) Uani 1 1 d . . .
H152 H -0.1825 0.4327 1.0255 0.061 Uiso 1 1 calc R . .
C153 C -0.1226(14) 0.4195(5) 0.9635(9) 0.057(6) Uani 1 1 d . . .
H153 H -0.0785 0.4339 0.9687 0.068 Uiso 1 1 calc R . .
C154 C -0.1290(12) 0.3987(4) 0.9186(8) 0.038(5) Uani 1 1 d . . .
C155 C -0.1921(13) 0.3785(4) 0.9140(8) 0.044(5) Uani 1 1 d . . .
H155 H -0.1982 0.3653 0.8836 0.053 Uiso 1 1 calc R . .
C156 C -0.2473(12) 0.3762(4) 0.9511(8) 0.037(5) Uani 1 1 d . . .
H156 H -0.2901 0.3612 0.9463 0.045 Uiso 1 1 calc R . .
C157 C -0.0625(12) 0.4013(5) 0.8776(8) 0.047(5) Uani 1 1 d . . .
H15A H -0.0723 0.4201 0.8560 0.056 Uiso 1 1 calc R . .
H15B H -0.0059 0.4025 0.8974 0.056 Uiso 1 1 calc R . .
C163 C -0.1161(15) 0.3733(5) 0.7983(11) 0.057(6) Uani 1 1 d . . .
H163 H -0.1437 0.3898 0.7795 0.068 Uiso 1 1 calc R . .
C164 C -0.1219(14) 0.3444(6) 0.7818(8) 0.054(6) Uani 1 1 d . . .
H164 H -0.1547 0.3368 0.7508 0.065 Uiso 1 1 calc R . .
C165 C -0.0693(12) 0.3273(5) 0.8198(8) 0.042(5) Uani 1 1 d . . .
C172 C -0.0390(15) 0.2976(5) 0.8255(9) 0.053(6) Uani 1 1 d . . .
C173 C -0.0605(15) 0.2733(5) 0.7933(9) 0.059(6) Uani 1 1 d . . .
H173 H -0.1015 0.2756 0.7633 0.070 Uiso 1 1 calc R . .
C174 C -0.0225(18) 0.2446(6) 0.8040(11) 0.080(8) Uani 1 1 d . . .
H174 H -0.0377 0.2278 0.7810 0.096 Uiso 1 1 calc R . .
C175 C 0.0341(14) 0.2411(5) 0.8459(10) 0.049(6) Uani 1 1 d . . .
H175 H 0.0619 0.2223 0.8533 0.059 Uiso 1 1 calc R . .
C176 C 0.0516(13) 0.2673(5) 0.8796(9) 0.046(6) Uani 1 1 d . . .
C183 C 0.1969(15) 0.2593(6) 1.0051(10) 0.058(6) Uani 1 1 d . . .
H183 H 0.2360 0.2513 1.0326 0.069 Uiso 1 1 calc R . .
C184 C 0.1595(14) 0.2443(5) 0.9629(11) 0.065(7) Uani 1 1 d . . .
H184 H 0.1639 0.2232 0.9559 0.078 Uiso 1 1 calc R . .
C185 C 0.1081(15) 0.2676(5) 0.9277(11) 0.060(7) Uani 1 1 d . . .
C191 C 0.1961(13) 0.3118(5) 1.0418(9) 0.059(6) Uani 1 1 d . . .
H19A H 0.1481 0.3253 1.0463 0.071 Uiso 1 1 calc R . .
H19B H 0.2148 0.3025 1.0771 0.071 Uiso 1 1 calc R . .
C192 C 0.2670(12) 0.3305(5) 1.0227(9) 0.041(5) Uani 1 1 d . . .
C193 C 0.2847(15) 0.3580(5) 1.0472(8) 0.056(6) Uani 1 1 d . . .
H193 H 0.2524 0.3647 1.0745 0.067 Uiso 1 1 calc R . .
C194 C 0.3481(15) 0.3757(5) 1.0327(9) 0.057(6) Uani 1 1 d . . .
H194 H 0.3619 0.3941 1.0516 0.068 Uiso 1 1 calc R . .
C195 C 0.3912(12) 0.3673(5) 0.9919(9) 0.044(5) Uani 1 1 d . . .
C196 C 0.3775(12) 0.3389(5) 0.9671(9) 0.051(6) Uani 1 1 d . . .
H196 H 0.4110 0.3321 0.9405 0.061 Uiso 1 1 calc R . .
C197 C 0.3120(16) 0.3206(5) 0.9831(9) 0.061(7) Uani 1 1 d . . .
H197 H 0.2997 0.3015 0.9662 0.073 Uiso 1 1 calc R . .
C202 C 0.6811(13) 0.4210(5) 0.8044(11) 0.062(7) Uani 1 1 d . . .
H202 H 0.7162 0.4376 0.7975 0.075 Uiso 1 1 calc R . .
C203 C 0.6723(14) 0.3975(7) 0.7665(9) 0.066(7) Uani 1 1 d . . .
H203 H 0.7000 0.3988 0.7348 0.079 Uiso 1 1 calc R . .
C204 C 0.6247(15) 0.3731(6) 0.7745(9) 0.065(7) Uani 1 1 d . . .
H204 H 0.6207 0.3566 0.7498 0.078 Uiso 1 1 calc R . .
C205 C 0.5785(14) 0.3725(5) 0.8231(10) 0.064(7) Uani 1 1 d . . .
H205 H 0.5428 0.3562 0.8305 0.077 Uiso 1 1 calc R . .
C206 C 0.5918(13) 0.3983(6) 0.8575(8) 0.049(6) Uani 1 1 d . . .
C212 C 0.5366(12) 0.4331(5) 0.9787(9) 0.042(5) Uani 1 1 d . . .
C213 C 0.4839(13) 0.4140(5) 0.9982(8) 0.041(5) Uani 1 1 d . . .
H213 H 0.4644 0.4184 1.0318 0.049 Uiso 1 1 calc R . .
C214 C 0.4566(12) 0.3880(5) 0.9713(8) 0.046(6) Uani 1 1 d . . .
C215 C 0.4924(12) 0.3820(5) 0.9232(8) 0.048(6) Uani 1 1 d . . .
H215 H 0.4762 0.3642 0.9031 0.058 Uiso 1 1 calc R . .
C216 C 0.5493(12) 0.4009(5) 0.9051(9) 0.044(5) Uani 1 1 d . . .
C222 C 0.5710(12) 0.4617(4) 1.0041(8) 0.039(5) Uani 1 1 d . . .
C223 C 0.5495(12) 0.4749(5) 1.0497(8) 0.042(5) Uani 1 1 d . . .
H223 H 0.5109 0.4648 1.0698 0.051 Uiso 1 1 calc R . .
C224 C 0.5806(14) 0.5015(5) 1.0671(8) 0.055(6) Uani 1 1 d . . .
H224 H 0.5618 0.5113 1.0975 0.066 Uiso 1 1 calc R . .
C225 C 0.6443(14) 0.5152(5) 1.0380(10) 0.061(6) Uani 1 1 d . . .
H225 H 0.6713 0.5334 1.0506 0.074 Uiso 1 1 calc R . .
C226 C 0.6639(12) 0.5021(4) 0.9945(8) 0.039(5) Uani 1 1 d . . .
H226 H 0.7041 0.5117 0.9750 0.047 Uiso 1 1 calc R . .
C301 C -0.729(2) 0.3709(9) 1.2321(19) 0.21(3) Uani 1 1 d D . .
H30A H -0.7509 0.3504 1.2378 0.318 Uiso 1 1 calc R . .
H30B H -0.7645 0.3809 1.2029 0.318 Uiso 1 1 calc R . .
H30C H -0.7296 0.3828 1.2652 0.318 Uiso 1 1 calc R . .
C302 C -0.638(2) 0.3685(8) 1.2168(19) 0.20(2) Uani 1 1 d D . .
C304 C 0.1406(16) 0.0447(6) 1.2730(9) 0.098(10) Uani 1 1 d D . .
H30D H 0.1445 0.0227 1.2668 0.148 Uiso 1 1 calc R . .
H30E H 0.0871 0.0493 1.2865 0.148 Uiso 1 1 calc R . .
H30F H 0.1864 0.0511 1.2996 0.148 Uiso 1 1 calc R . .
C305 C 0.1466(16) 0.0621(5) 1.2190(10) 0.081(9) Uani 1 1 d D . .
C307 C 0.4139(16) 0.0224(6) 1.1475(14) 0.123(11) Uani 1 1 d D . .
H30G H 0.4691 0.0319 1.1545 0.184 Uiso 1 1 calc R . .
H30H H 0.4141 0.0080 1.1176 0.184 Uiso 1 1 calc R . .
H30I H 0.4006 0.0116 1.1798 0.184 Uiso 1 1 calc R . .
C308 C 0.3468(16) 0.0476(6) 1.1326(12) 0.084(9) Uani 1 1 d D . .
C310 C -0.472(3) 0.4196(12) 0.384(2) 0.25(3) Uiso 1 1 d D . .
H30J H -0.5212 0.4251 0.4012 0.381 Uiso 1 1 calc R . .
H30K H -0.4878 0.4052 0.3543 0.381 Uiso 1 1 calc R . .
H30L H -0.4483 0.4380 0.3688 0.381 Uiso 1 1 calc R . .
C311 C -0.405(2) 0.4046(9) 0.4255(15) 0.147(14) Uiso 1 1 d D . .
C313 C 0.8654(15) 0.5116(5) 0.8624(12) 0.096(10) Uani 1 1 d D . .
H30M H 0.8554 0.5318 0.8771 0.144 Uiso 1 1 calc R . .
H30N H 0.8625 0.5128 0.8231 0.144 Uiso 1 1 calc R . .
H30O H 0.9209 0.5044 0.8769 0.144 Uiso 1 1 calc R . .
C314 C 0.7977(14) 0.4890(5) 0.8785(10) 0.072(8) Uani 1 1 d D . .
N11 N 0.1248(14) 0.0740(4) 1.0644(9) 0.094(7) Uani 1 1 d . . .
N21 N 0.1471(12) 0.1298(4) 1.0843(8) 0.055(5) Uani 1 1 d . . .
N31 N 0.2694(15) 0.1292(4) 1.1549(8) 0.077(7) Uani 1 1 d . . .
N51 N -0.1132(11) 0.3110(4) 0.9822(7) 0.048(5) Uani 1 1 d . . .
N52 N -0.0403(9) 0.3280(4) 0.9728(7) 0.040(4) Uani 1 1 d . . .
N61 N 0.0740(10) 0.3654(4) 0.9677(7) 0.044(4) Uani 1 1 d . . .
N71 N 0.1508(10) 0.3489(4) 0.8872(7) 0.047(4) Uani 1 1 d . . .
N72 N 0.2006(11) 0.3431(4) 0.8488(7) 0.046(4) Uani 1 1 d . . .
N91 N -0.2379(18) 0.4248(6) 0.5260(10) 0.094(8) Uani 1 1 d . . .
N101 N -0.1969(12) 0.3712(5) 0.5590(7) 0.062(5) Uani 1 1 d . . .
N111 N -0.3041(18) 0.3393(6) 0.5009(11) 0.100(9) Uani 1 1 d . . .
N121 N -0.4963(14) 0.3365(5) 1.1285(9) 0.089(7) Uani 1 1 d . . .
N131 N -0.4024(12) 0.3809(6) 1.1164(8) 0.066(6) Uani 1 1 d . . .
N141 N -0.4433(14) 0.4173(6) 1.1879(8) 0.093(8) Uani 1 1 d . . .
N161 N -0.0359(9) 0.3486(4) 0.8588(6) 0.037(4) Uani 1 1 d . . .
N162 N -0.0674(11) 0.3761(4) 0.8438(7) 0.044(4) Uani 1 1 d . . .
N171 N 0.0167(11) 0.2934(3) 0.8688(7) 0.039(4) Uani 1 1 d . . .
N181 N 0.1191(10) 0.2936(4) 0.9560(8) 0.048(4) Uani 1 1 d . . .
N182 N 0.1696(10) 0.2871(4) 1.0013(7) 0.047(4) Uani 1 1 d . . .
N201 N 0.6443(10) 0.4218(4) 0.8490(7) 0.046(4) Uani 1 1 d . . .
N211 N 0.5709(9) 0.4259(4) 0.9332(7) 0.043(4) Uani 1 1 d . . .
N221 N 0.6305(10) 0.4756(5) 0.9753(6) 0.052(5) Uani 1 1 d . . .
N303 N -0.576(2) 0.3747(10) 1.2087(17) 0.071(13) Uiso 0.50 1 d PD . .
N306 N 0.1593(17) 0.0767(5) 1.1862(10) 0.095(8) Uani 1 1 d D . .
N309 N 0.3003(14) 0.0648(5) 1.1218(9) 0.090(7) Uani 1 1 d D . .
N312 N -0.359(2) 0.3931(7) 0.4525(13) 0.052(9) Uiso 0.50 1 d PD . .
N315 N 0.7487(11) 0.4748(5) 0.8911(8) 0.077(7) Uani 1 1 d D . .
O1 O 0.5695(8) 0.4869(3) 0.8562(6) 0.059(4) Uani 1 1 d . . .
O2 O -0.380(3) 0.3562(8) 1.2362(11) 0.128(18) Uani 0.50 1 d P . .
O3 O 0.8350(19) 0.3724(7) 0.4454(10) 0.189(12) Uani 1 1 d . . .
O4 O 0.5531(9) 0.3944(4) 0.6097(6) 0.078(5) Uiso 1 1 d . . .
O03 O 0.903(2) 0.4083(9) 0.1503(16) 0.114(13) Uiso 0.50 1 d P . .
O04 O 0.601(3) 0.9783(10) 0.1925(17) 0.123(14) Uiso 0.50 1 d P A 1
O05 O 0.6858(19) 0.1747(6) 0.1716(12) 0.192(11) Uiso 1 1 d . . .
O06 O 0.058(3) 0.3068(11) 0.126(2) 0.157(18) Uiso 0.50 1 d P B 2
O07 O 0.015(4) 0.3281(15) 0.197(3) 0.23(3) Uiso 0.50 1 d P C 1
B1 B 0.6701(6) 0.9398(2) 0.3709(4) 0.077(10) Uani 1 1 d D . .
B2 B 0.3969(6) 0.4352(2) 0.8023(4) 0.047(7) Uani 1 1 d D . .
B8 B 0.6447(7) 0.1910(2) 0.4184(4) 0.100 Uiso 1 1 d D . .
B9 B 0.8895(6) 0.4537(2) 0.7335(4) 0.043(6) Uiso 1 1 d GD . .
F1 F 0.5926(7) 0.9319(3) 0.3844(5) 0.113(6) Uani 1 1 d D . .
F2 F 0.7182(8) 0.9503(3) 0.4157(5) 0.110(5) Uani 1 1 d D . .
F3 F 0.6618(8) 0.9621(3) 0.3322(5) 0.097(5) Uani 1 1 d D . .
F4 F 0.7080(9) 0.9148(3) 0.3515(6) 0.135(7) Uani 1 1 d D . .
F5 F 0.3342(7) 0.4450(3) 0.7655(5) 0.111(5) Uani 1 1 d D . .
F6 F 0.4030(7) 0.4043(2) 0.7998(5) 0.084(4) Uani 1 1 d D . .
F7 F 0.4704(7) 0.4481(3) 0.7915(5) 0.092(4) Uani 1 1 d D . .
F8 F 0.3805(8) 0.4433(3) 0.8527(5) 0.112(5) Uani 1 1 d D . .
F11 F 0.9610(5) 1.02906(17) 0.5615(3) 0.075(4) Uani 1 1 d D . .
F12 F 0.8275(5) 0.96410(16) 0.5978(3) 0.071(4) Uani 1 1 d D . .
F13 F 0.9834(5) 0.96939(19) 0.5747(3) 0.084(4) Uani 1 1 d D . .
F14 F 0.8051(5) 1.02331(18) 0.5847(3) 0.082(4) Uani 1 1 d D . .
F15 F 0.8585(5) 0.9901(2) 0.5066(3) 0.076(4) Uani 1 1 d D . .
F16 F 0.9301(5) 1.0027(2) 0.6525(3) 0.067(4) Uani 1 1 d D . .
F21 F 0.3283(14) 0.2916(6) 0.2595(10) 0.145(10) Uiso 0.672(9) 1 d PD D 1
F22 F 0.1729(16) 0.2897(8) 0.2446(14) 0.169(12) Uiso 0.672(9) 1 d PD D 1
F23 F 0.3265(13) 0.2562(6) 0.1809(10) 0.230 Uiso 1 1 d D . .
F24 F 0.2573(14) 0.3029(4) 0.1740(8) 0.102(7) Uiso 0.672(9) 1 d PDU D 1
F25 F 0.2564(11) 0.2390(3) 0.2566(7) 0.130(6) Uani 1 1 d D . .
F26 F 0.244(4) 0.2564(12) 0.1352(13) 0.137(11) Uiso 0.328(9) 1 d PDU D 2
F31 F 0.8895(10) 0.2833(6) 0.1423(10) 0.202(10) Uani 1 1 d D E .
F32 F 0.8165(13) 0.2902(6) 0.2327(5) 0.176(9) Uani 1 1 d D E .
F33 F 0.824(4) 0.2423(6) 0.165(2) 0.144(11) Uiso 0.41(3) 1 d PDU E 1
F34 F 0.685(2) 0.2993(14) 0.182(2) 0.148(11) Uiso 0.41(3) 1 d PDU E 1
F35 F 0.800(4) 0.3223(5) 0.148(2) 0.132(11) Uiso 0.41(3) 1 d PDU E 1
F36 F 0.778(3) 0.2685(10) 0.0905(8) 0.106(9) Uiso 0.41(3) 1 d PDU E 1
F41 F 0.240(2) 0.9879(7) 0.1040(14) 0.144(10) Uiso 0.50 1 d PDU F 1
F42 F 0.150(3) 0.9246(9) 0.116(2) 0.212(16) Uiso 0.50 1 d PDU F 1
F43 F 0.0968(19) 0.9774(11) 0.138(2) 0.21(2) Uiso 0.50 1 d PD F 1
F44 F 0.251(5) 0.9263(11) 0.183(3) 0.26(2) Uiso 0.50 1 d PDU F 1
F45 F 0.296(2) 0.9366(11) 0.150(2) 0.164(12) Uiso 0.50 1 d PDU F 1
F46 F 0.226(3) 0.9873(8) 0.2000(14) 0.145(11) Uiso 0.50 1 d PDU F 1
F51 F -0.0275(14) 0.3690(6) 0.3918(9) 0.24(3) Uani 0.50 1 d PD . .
F52 F -0.0062(18) 0.3301(4) 0.3172(12) 0.19(2) Uani 0.50 1 d PD . .
F53 F 0.1036(14) 0.3348(5) 0.4028(8) 0.120(13) Uani 0.50 1 d PD . .
F54 F 0.1165(19) 0.3936(4) 0.3852(11) 0.200 Uiso 0.50 1 d PD . .
F55 F 0.1448(14) 0.3540(6) 0.3071(10) 0.28(4) Uani 0.50 1 d PD . .
F56 F 0.007(2) 0.3889(5) 0.2995(11) 0.200 Uiso 0.50 1 d PD . .
F61 F 0.392(3) 0.3389(9) 0.5641(13) 0.155(12) Uiso 0.50 1 d PDU G 1
F62 F 0.410(3) 0.2826(6) 0.489(2) 0.181(14) Uiso 0.50 1 d PDU G 1
F63 F 0.2730(10) 0.3163(10) 0.5052(18) 0.150(11) Uiso 0.50 1 d PDU G 1
F64 F 0.4355(13) 0.3379(5) 0.4763(8) 0.185(9) Uani 1 1 d D . .
F65 F 0.326(2) 0.2918(7) 0.5473(13) 0.130(10) Uiso 0.50 1 d PDU G 1
F66 F 0.467(2) 0.3122(14) 0.550(2) 0.227(19) Uiso 0.50 1 d PDU G 1
F71 F 0.604(2) 0.5217(18) 0.482(3) 0.27(2) Uiso 0.50 1 d PDU . 1
F72 F 0.459(3) 0.5286(12) 0.4514(16) 0.195(15) Uiso 0.50 1 d PDU . 1
F73 F 0.4626(17) 0.5249(6) 0.5483(10) 0.200 Uiso 1 1 d D . .
F81 F 0.6929(13) 0.1714(4) 0.4030(7) 0.26(3) Uiso 0.40 1 d PD . .
F81' F 0.5973(14) 0.2083(4) 0.3722(8) 0.054(6) Uiso 0.60 1 d P . .
F82 F 0.5744(10) 0.1794(4) 0.4208(6) 0.152(7) Uiso 1 1 d D . .
F83 F 0.6735(9) 0.2007(3) 0.4636(5) 0.108(5) Uiso 1 1 d D . .
F84 F 0.6377(6) 0.21226(18) 0.3856(3) 0.015(2) Uiso 1 1 d D . .
F21' F 0.147(7) 0.302(3) 0.269(4) 0.30(5) Uiso 0.328(9) 1 d PD D 2
F22' F 0.0786(13) 0.275(2) 0.204(5) 0.28(5) Uiso 0.328(9) 1 d PD D 2
F24' F 0.209(3) 0.3234(6) 0.1695(18) 0.114(9) Uiso 0.328(9) 1 d PDU D 2
F26' F 0.1955(16) 0.2514(6) 0.1679(9) 0.138(9) Uiso 0.672(9) 1 d PDU D 1
F33' F 0.780(3) 0.2409(4) 0.1810(15) 0.145(10) Uiso 0.59(3) 1 d PDU E 2
F34' F 0.6723(11) 0.2805(10) 0.1793(15) 0.146(11) Uiso 0.59(3) 1 d PDU E 2
F35' F 0.756(2) 0.3218(4) 0.1442(15) 0.133(10) Uiso 0.59(3) 1 d PDU E 2
F36' F 0.734(2) 0.2784(7) 0.0906(7) 0.106(8) Uiso 0.59(3) 1 d PDU E 2
F41' F 0.166(2) 0.9798(8) 0.0832(10) 0.129(10) Uiso 0.50 1 d PDU F 2
F42' F 0.188(4) 0.9296(11) 0.0921(18) 0.212(16) Uiso 0.50 1 d PDU F 2
F43' F 0.130(2) 0.9297(9) 0.1747(19) 0.178(17) Uiso 0.50 1 d PD F 2
F44' F 0.230(4) 0.9418(16) 0.2154(16) 0.26(2) Uiso 0.50 1 d PDU F 2
F45' F 0.3090(15) 0.9558(11) 0.1285(18) 0.157(12) Uiso 0.50 1 d PDU F 2
F46' F 0.239(3) 0.9972(6) 0.1718(17) 0.146(11) Uiso 0.50 1 d PDU F 2
F61' F 0.331(3) 0.3461(6) 0.5410(18) 0.157(12) Uiso 0.50 1 d PDU H 2
F62' F 0.361(3) 0.2767(9) 0.4615(14) 0.184(14) Uiso 0.50 1 d PDU H 2
F63' F 0.299(2) 0.3106(9) 0.4631(13) 0.152(11) Uiso 0.50 1 d PDU H 2
F65' F 0.342(2) 0.2732(7) 0.5766(13) 0.135(10) Uiso 0.50 1 d PDU H 2
F66' F 0.436(4) 0.3350(12) 0.5893(19) 0.228(19) Uiso 0.50 1 d PDU H 2
F71' F 0.592(4) 0.4960(18) 0.475(3) 0.27(2) Uiso 0.50 1 d PDU . 2
F72' F 0.452(3) 0.5056(14) 0.4465(15) 0.196(15) Uiso 0.50 1 d PDU . 2
F91 F 0.8718(9) 0.4829(2) 0.7110(6) 0.135(6) Uiso 1 1 d GD . .
F92 F 0.8817(9) 0.4518(3) 0.7902(3) 0.128(6) Uiso 1 1 d GD . .
F93 F 0.9596(6) 0.4349(3) 0.7245(6) 0.135(6) Uiso 1 1 d GD . .
F94 F 0.8248(6) 0.4329(2) 0.7120(5) 0.099(5) Uiso 1 1 d GD . .
Sb1 Sb 0.89459(9) 0.99638(3) 0.57932(6) 0.0549(5) Uani 1 1 d D . .
Sb2 Sb 0.2547(3) 0.27210(8) 0.21729(12) 0.0774(12) Uiso 0.672(9) 1 d PDU D 1
Sb3 Sb 0.78114(15) 0.28155(6) 0.16110(9) 0.1245(10) Uani 1 1 d D . .
Sb4 Sb 0.19948(18) 0.95886(6) 0.14724(10) 0.1308(10) Uani 1 1 d D . .
Sb5 Sb 0.0588(3) 0.36161(9) 0.34941(16) 0.1000(14) Uani 0.50 1 d PD . .
Sb6 Sb 0.3770(3) 0.31593(13) 0.5108(2) 0.1068(17) Uiso 0.50 1 d PDU G 1
Sb7 Sb 0.5147(6) 0.51180(14) 0.5011(4) 0.153(3) Uani 0.50 1 d PD . .
Sb2' Sb 0.2154(6) 0.27889(15) 0.2096(2) 0.071(2) Uiso 0.328(9) 1 d PDU D 2
Sb6' Sb 0.3920(4) 0.30519(14) 0.5276(2) 0.1175(19) Uiso 0.50 1 d PDU H 2
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'
B B 0.0013 0.0007 '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'
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'
Cu Cu 0.3201 1.2651 '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'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N61 Ru1 N171 177.7(7) . . ?
N61 Ru1 N52 74.8(7) . . ?
N171 Ru1 N52 103.9(6) . . ?
N61 Ru1 N161 101.0(6) . . ?
N171 Ru1 N161 77.2(7) . . ?
N52 Ru1 N161 92.5(5) . . ?
N61 Ru1 N71 77.4(8) . . ?
N171 Ru1 N71 104.0(7) . . ?
N52 Ru1 N71 152.1(7) . . ?
N161 Ru1 N71 92.3(6) . . ?
N61 Ru1 N181 104.4(7) . . ?
N171 Ru1 N181 77.5(7) . . ?
N52 Ru1 N181 94.1(6) . . ?
N161 Ru1 N181 154.7(7) . . ?
N71 Ru1 N181 93.2(6) . . ?
N312 Cu1 N101 175.9(13) . . ?
N312 Cu1 N91 101.5(14) . . ?
N101 Cu1 N91 82.3(11) . . ?
N312 Cu1 N111 94.7(14) . . ?
N101 Cu1 N111 81.6(11) . . ?
N91 Cu1 N111 163.7(12) . . ?
N131 Cu2 N303 160.9(14) . . ?
N131 Cu2 N141 81.2(11) . . ?
N303 Cu2 N141 96.4(14) . . ?
N131 Cu2 N121 79.5(11) . . ?
N303 Cu2 N121 99.1(14) . . ?
N141 Cu2 N121 158.9(9) . . ?
N131 Cu2 O2 97.9(12) . . ?
N303 Cu2 O2 101.1(17) . . ?
N141 Cu2 O2 92.5(12) . . ?
N121 Cu2 O2 98.3(11) . . ?
N21 Cu3 N31 79.3(9) . . ?
N21 Cu3 N309 153.7(8) . . ?
N31 Cu3 N309 98.2(9) . . ?
N21 Cu3 N11 79.6(9) . . ?
N31 Cu3 N11 158.9(8) . . ?
N309 Cu3 N11 100.2(9) . . ?
N21 Cu3 N306 114.8(8) . . ?
N31 Cu3 N306 95.5(9) . . ?
N309 Cu3 N306 91.5(8) . . ?
N11 Cu3 N306 94.2(10) . . ?
N211 Cu4 N315 164.6(8) . . ?
N211 Cu4 N201 80.2(8) . . ?
N315 Cu4 N201 99.3(9) . . ?
N211 Cu4 N221 81.0(8) . . ?
N315 Cu4 N221 98.3(9) . . ?
N201 Cu4 N221 161.0(8) . . ?
N211 Cu4 O1 104.6(6) . . ?
N315 Cu4 O1 90.8(7) . . ?
N201 Cu4 O1 94.5(6) . . ?
N221 Cu4 O1 92.2(6) . . ?
C13 C12 N11 123(2) . . ?
C13 C12 C26 127(2) . . ?
N11 C12 C26 110(3) . . ?
C14 C13 C12 120(2) . . ?
C14 C13 H13 119.8 . . ?
C12 C13 H13 119.8 . . ?
C15 C14 C13 121(3) . . ?
C15 C14 H14 119.5 . . ?
C13 C14 H14 119.5 . . ?
C14 C15 C16 121(4) . . ?
C14 C15 H15 119.3 . . ?
C16 C15 H15 119.3 . . ?
C15 C16 N11 121(3) . . ?
C15 C16 H16 119.3 . . ?
N11 C16 H16 119.3 . . ?
N21 C22 C23 117(2) . . ?
N21 C22 C36 113.7(19) . . ?
C23 C22 C36 129(2) . . ?
C22 C23 C24 121(2) . . ?
C22 C23 H23 119.5 . . ?
C24 C23 H23 119.5 . . ?
C23 C24 C25 118(2) . . ?
C23 C24 C41 120(2) . . ?
C25 C24 C41 120(2) . . ?
C26 C25 C24 119(2) . . ?
C26 C25 H25 120.6 . . ?
C24 C25 H25 120.6 . . ?
N21 C26 C25 120(2) . . ?
N21 C26 C12 114(2) . . ?
C25 C26 C12 125(3) . . ?
N31 C32 C33 122(2) . . ?
N31 C32 H32 119.0 . . ?
C33 C32 H32 119.0 . . ?
C32 C33 C34 120(3) . . ?
C32 C33 H33 119.9 . . ?
C34 C33 H33 119.9 . . ?
C35 C34 C33 116(3) . . ?
C35 C34 H34 122.2 . . ?
C33 C34 H34 122.2 . . ?
C34 C35 C36 121(2) . . ?
C34 C35 H35 119.7 . . ?
C36 C35 H35 119.7 . . ?
N31 C36 C35 124(2) . . ?
N31 C36 C22 111(2) . . ?
C35 C36 C22 125(2) . . ?
C42 C41 C46 121.9(19) . . ?
C42 C41 C24 121.2(19) . . ?
C46 C41 C24 117(2) . . ?
C41 C42 C43 119(2) . . ?
C41 C42 H42 120.7 . . ?
C43 C42 H42 120.7 . . ?
C42 C43 C44 121(2) . . ?
C42 C43 H43 119.7 . . ?
C44 C43 H43 119.7 . . ?
C45 C44 C43 119.7(19) . . ?
C45 C44 C47 125(2) . . ?
C43 C44 C47 115(2) . . ?
C44 C45 C46 121(2) . . ?
C44 C45 H45 119.7 . . ?
C46 C45 H45 119.7 . . ?
C41 C46 C45 118(2) . . ?
C41 C46 H46 120.8 . . ?
C45 C46 H46 120.8 . . ?
N51 C47 C44 111.6(16) . . ?
N51 C47 H47A 109.3 . . ?
C44 C47 H47A 109.3 . . ?
N51 C47 H47B 109.3 . . ?
C44 C47 H47B 109.3 . . ?
H47A C47 H47B 108.0 . . ?
N52 C53 C54 114(2) . . ?
N52 C53 C66 112.0(19) . . ?
C54 C53 C66 134(2) . . ?
C55 C54 C53 104(2) . . ?
C55 C54 H54 127.9 . . ?
C53 C54 H54 127.9 . . ?
N51 C55 C54 110(2) . . ?
N51 C55 H55 124.8 . . ?
C54 C55 H55 124.8 . . ?
C75 C62 N61 116.6(19) . . ?
C75 C62 C63 125(2) . . ?
N61 C62 C63 118(2) . . ?
C64 C63 C62 116(2) . . ?
C64 C63 H63 122.1 . . ?
C62 C63 H63 122.1 . . ?
C63 C64 C65 126(2) . . ?
C63 C64 H64 117.2 . . ?
C65 C64 H64 117.2 . . ?
C66 C65 C64 114(2) . . ?
C66 C65 H65 123.1 . . ?
C64 C65 H65 123.1 . . ?
N61 C66 C65 121(2) . . ?
N61 C66 C53 116(2) . . ?
C65 C66 C53 123(2) . . ?
N72 C73 C74 110(2) . . ?
N72 C73 H73 125.1 . . ?
C74 C73 H73 125.1 . . ?
C73 C74 C75 105(2) . . ?
C73 C74 H74 127.5 . . ?
C75 C74 H74 127.5 . . ?
C62 C75 N71 117.4(19) . . ?
C62 C75 C74 136(2) . . ?
N71 C75 C74 107(2) . . ?
N72 C81 C82 107.6(18) . . ?
N72 C81 H81A 110.2 . . ?
C82 C81 H81A 110.2 . . ?
N72 C81 H81B 110.2 . . ?
C82 C81 H81B 110.2 . . ?
H81A C81 H81B 108.5 . . ?
C87 C82 C83 119(2) . . ?
C87 C82 C81 119(2) . . ?
C83 C82 C81 122(2) . . ?
C82 C83 C84 117(2) . . ?
C82 C83 H83 121.3 . . ?
C84 C83 H83 121.3 . . ?
C85 C84 C83 124(2) . . ?
C85 C84 H84 118.1 . . ?
C83 C84 H84 118.1 . . ?
C84 C85 C104 121(2) . . ?
C84 C85 C86 118(2) . . ?
C104 C85 C86 121(2) . . ?
C87 C86 C85 119(2) . . ?
C87 C86 H86 120.3 . . ?
C85 C86 H86 120.3 . . ?
C86 C87 C82 122(2) . . ?
C86 C87 H87 118.8 . . ?
C82 C87 H87 118.8 . . ?
N91 C92 C93 127(3) . . ?
N91 C92 C102 114(3) . . ?
C93 C92 C102 119(4) . . ?
C94 C93 C92 113(3) . . ?
C94 C93 H93 123.6 . . ?
C92 C93 H93 123.6 . . ?
C93 C94 C95 121(3) . . ?
C93 C94 H94 119.4 . . ?
C95 C94 H94 119.4 . . ?
C94 C95 C96 118(3) . . ?
C94 C95 H95 120.8 . . ?
C96 C95 H95 120.8 . . ?
N91 C96 C95 120(4) . . ?
N91 C96 H96 120.1 . . ?
C95 C96 H96 120.1 . . ?
N101 C102 C103 124(2) . . ?
N101 C102 C92 112(3) . . ?
C103 C102 C92 125(3) . . ?
C104 C103 C102 117(2) . . ?
C104 C103 H103 121.3 . . ?
C102 C103 H103 121.3 . . ?
C105 C104 C85 123(2) . . ?
C105 C104 C103 115(2) . . ?
C85 C104 C103 122(2) . . ?
C104 C105 C106 125(2) . . ?
C104 C105 H105 117.6 . . ?
C106 C105 H105 117.6 . . ?
N101 C106 C105 120(2) . . ?
N101 C106 C112 109(3) . . ?
C105 C106 C112 132(3) . . ?
N111 C112 C113 126(3) . . ?
N111 C112 C106 116(3) . . ?
C113 C112 C106 118(4) . . ?
C114 C113 C112 109(3) . . ?
C114 C113 H113 125.7 . . ?
C112 C113 H113 125.7 . . ?
C113 C114 C115 126(3) . . ?
C113 C114 H114 117.0 . . ?
C115 C114 H114 117.0 . . ?
C116 C115 C114 115(3) . . ?
C116 C115 H115 122.4 . . ?
C114 C115 H115 122.4 . . ?
N111 C116 C115 127(3) . . ?
N111 C116 H116 116.7 . . ?
C115 C116 H116 116.7 . . ?
N121 C122 C123 120(3) . . ?
N121 C122 C136 110(3) . . ?
C123 C122 C136 130(3) . . ?
C124 C123 C122 121(3) . . ?
C124 C123 H123 119.5 . . ?
C122 C123 H123 119.5 . . ?
C125 C124 C123 120(3) . . ?
C125 C124 H124 119.8 . . ?
C123 C124 H124 119.8 . . ?
C126 C125 C124 122(4) . . ?
C126 C125 H125 118.9 . . ?
C124 C125 H125 118.9 . . ?
C125 C126 N121 123(3) . . ?
C125 C126 H126 118.5 . . ?
N121 C126 H126 118.5 . . ?
N131 C132 C133 121(2) . . ?
N131 C132 C142 115(2) . . ?
C133 C132 C142 124(3) . . ?
C132 C133 C134 120(2) . . ?
C132 C133 H133 120.0 . . ?
C134 C133 H133 120.0 . . ?
C133 C134 C135 117(2) . . ?
C133 C134 C151 122(2) . . ?
C135 C134 C151 120.4(19) . . ?
C134 C135 C136 117(2) . . ?
C134 C135 H135 121.4 . . ?
C136 C135 H135 121.4 . . ?
N131 C136 C135 123(2) . . ?
N131 C136 C122 117(3) . . ?
C135 C136 C122 120(3) . . ?
C143 C142 N141 124(3) . . ?
C143 C142 C132 128(3) . . ?
N141 C142 C132 108(3) . . ?
C144 C143 C142 118(3) . . ?
C144 C143 H143 120.9 . . ?
C142 C143 H143 120.9 . . ?
C145 C144 C143 122(4) . . ?
C145 C144 H144 118.8 . . ?
C143 C144 H144 118.8 . . ?
C146 C145 C144 122(4) . . ?
C146 C145 H145 119.1 . . ?
C144 C145 H145 119.1 . . ?
C145 C146 N141 127(4) . . ?
C145 C146 H146 116.3 . . ?
N141 C146 H146 116.4 . . ?
C156 C151 C152 116.8(19) . . ?
C156 C151 C134 122(2) . . ?
C152 C151 C134 121(2) . . ?
C153 C152 C151 122.5(19) . . ?
C153 C152 H152 118.8 . . ?
C151 C152 H152 118.8 . . ?
C152 C153 C154 117.6(19) . . ?
C152 C153 H153 121.2 . . ?
C154 C153 H153 121.2 . . ?
C155 C154 C153 118.4(18) . . ?
C155 C154 C157 123.7(18) . . ?
C153 C154 C157 117.9(18) . . ?
C154 C155 C156 122.4(19) . . ?
C154 C155 H155 118.8 . . ?
C156 C155 H155 118.8 . . ?
C151 C156 C155 122(2) . . ?
C151 C156 H156 119.1 . . ?
C155 C156 H156 119.1 . . ?
N162 C157 C154 110.1(16) . . ?
N162 C157 H15A 109.6 . . ?
C154 C157 H15A 109.7 . . ?
N162 C157 H15B 109.6 . . ?
C154 C157 H15B 109.6 . . ?
H15A C157 H15B 108.2 . . ?
N162 C163 C164 112(2) . . ?
N162 C163 H163 124.0 . . ?
C164 C163 H163 124.0 . . ?
C163 C164 C165 106(2) . . ?
C163 C164 H164 126.9 . . ?
C165 C164 H164 126.9 . . ?
C172 C165 N161 116.4(19) . . ?
C172 C165 C164 138(2) . . ?
N161 C165 C164 105.5(19) . . ?
N171 C172 C173 118(2) . . ?
N171 C172 C165 114.0(19) . . ?
C173 C172 C165 128(2) . . ?
C172 C173 C174 121(2) . . ?
C172 C173 H173 119.7 . . ?
C174 C173 H173 119.7 . . ?
C175 C174 C173 120(2) . . ?
C175 C174 H174 120.0 . . ?
C173 C174 H174 120.0 . . ?
C174 C175 C176 117(2) . . ?
C174 C175 H175 121.7 . . ?
C176 C175 H175 121.7 . . ?
N171 C176 C185 113(2) . . ?
N171 C176 C175 122(2) . . ?
C185 C176 C175 125(2) . . ?
N182 C183 C184 107(2) . . ?
N182 C183 H183 126.7 . . ?
C184 C183 H183 126.7 . . ?
C183 C184 C185 107(2) . . ?
C183 C184 H184 126.4 . . ?
C185 C184 H184 126.4 . . ?
N181 C185 C176 119.1(19) . . ?
N181 C185 C184 103(2) . . ?
C176 C185 C184 137(2) . . ?
C192 C191 N182 110.1(18) . . ?
C192 C191 H19A 109.6 . . ?
N182 C191 H19A 109.6 . . ?
C192 C191 H19B 109.6 . . ?
N182 C191 H19B 109.6 . . ?
H19A C191 H19B 108.1 . . ?
C197 C192 C193 120(2) . . ?
C197 C192 C191 122(2) . . ?
C193 C192 C191 117(2) . . ?
C194 C193 C192 121(2) . . ?
C194 C193 H193 119.7 . . ?
C192 C193 H193 119.7 . . ?
C195 C194 C193 120(2) . . ?
C195 C194 H194 119.8 . . ?
C193 C194 H194 119.8 . . ?
C194 C195 C196 121(2) . . ?
C194 C195 C214 122(2) . . ?
C196 C195 C214 118(2) . . ?
C195 C196 C197 118(2) . . ?
C195 C196 H196 121.0 . . ?
C197 C196 H196 121.0 . . ?
C192 C197 C196 120(2) . . ?
C192 C197 H197 120.2 . . ?
C196 C197 H197 120.2 . . ?
N201 C202 C203 125(2) . . ?
N201 C202 H202 117.6 . . ?
C203 C202 H202 117.6 . . ?
C204 C203 C202 120(2) . . ?
C204 C203 H203 119.8 . . ?
C202 C203 H203 119.8 . . ?
C203 C204 C205 118(2) . . ?
C203 C204 H204 120.8 . . ?
C205 C204 H204 120.8 . . ?
C206 C205 C204 115(2) . . ?
C206 C205 H205 122.5 . . ?
C204 C205 H205 122.5 . . ?
N201 C206 C205 124(2) . . ?
N201 C206 C216 115(2) . . ?
C205 C206 C216 121(2) . . ?
C213 C212 N211 119.6(19) . . ?
C213 C212 C222 127(2) . . ?
N211 C212 C222 113(2) . . ?
C212 C213 C214 122(2) . . ?
C212 C213 H213 118.8 . . ?
C214 C213 H213 118.8 . . ?
C213 C214 C215 116(2) . . ?
C213 C214 C195 122(2) . . ?
C215 C214 C195 122(2) . . ?
C216 C215 C214 122(2) . . ?
C216 C215 H215 119.2 . . ?
C214 C215 H215 119.2 . . ?
N211 C216 C215 119(2) . . ?
N211 C216 C206 113(2) . . ?
C215 C216 C206 129(2) . . ?
C223 C222 N221 119.8(18) . . ?
C223 C222 C212 127.0(19) . . ?
N221 C222 C212 113.2(19) . . ?
C224 C223 C222 122.0(19) . . ?
C224 C223 H223 119.0 . . ?
C222 C223 H223 119.0 . . ?
C223 C224 C225 118(2) . . ?
C223 C224 H224 121.2 . . ?
C225 C224 H224 121.2 . . ?
C226 C225 C224 119(2) . . ?
C226 C225 H225 120.5 . . ?
C224 C225 H225 120.5 . . ?
C225 C226 N221 124(2) . . ?
C225 C226 H226 118.1 . . ?
N221 C226 H226 118.1 . . ?
C302 C301 H30A 109.5 . . ?
C302 C301 H30B 109.5 . . ?
H30A C301 H30B 109.5 . . ?
C302 C301 H30C 109.5 . . ?
H30A C301 H30C 109.5 . . ?
H30B C301 H30C 109.5 . . ?
N303 C302 C301 161(5) . . ?
C305 C304 H30D 109.5 . . ?
C305 C304 H30E 109.5 . . ?
H30D C304 H30E 109.5 . . ?
C305 C304 H30F 109.5 . . ?
H30D C304 H30F 109.5 . . ?
H30E C304 H30F 109.5 . . ?
N306 C305 C304 169(3) . . ?
C308 C307 H30G 109.5 . . ?
C308 C307 H30H 109.5 . . ?
H30G C307 H30H 109.5 . . ?
C308 C307 H30I 109.5 . . ?
H30G C307 H30I 109.5 . . ?
H30H C307 H30I 109.5 . . ?
N309 C308 C307 179(4) . . ?
C311 C310 H30J 109.5 . . ?
C311 C310 H30K 109.5 . . ?
H30J C310 H30K 109.5 . . ?
C311 C310 H30L 109.5 . . ?
H30J C310 H30L 109.5 . . ?
H30K C310 H30L 109.5 . . ?
N312 C311 C310 176(5) . . ?
C314 C313 H30M 109.5 . . ?
C314 C313 H30N 109.5 . . ?
H30M C313 H30N 109.5 . . ?
C314 C313 H30O 109.5 . . ?
H30M C313 H30O 109.5 . . ?
H30N C313 H30O 109.5 . . ?
N315 C314 C313 176(3) . . ?
C16 N11 C12 113(2) . . ?
C16 N11 Cu3 130(2) . . ?
C12 N11 Cu3 117.2(18) . . ?
C26 N21 C22 123(2) . . ?
C26 N21 Cu3 119.2(17) . . ?
C22 N21 Cu3 117.7(17) . . ?
C32 N31 C36 117(2) . . ?
C32 N31 Cu3 124.1(16) . . ?
C36 N31 Cu3 118.4(18) . . ?
C55 N51 N52 108.2(18) . . ?
C55 N51 C47 131(2) . . ?
N52 N51 C47 118.2(16) . . ?
C53 N52 N51 102.9(16) . . ?
C53 N52 Ru1 118.0(14) . . ?
N51 N52 Ru1 139.0(13) . . ?
C66 N61 C62 125.1(19) . . ?
C66 N61 Ru1 119.4(15) . . ?
C62 N61 Ru1 115.4(15) . . ?
N72 N71 C75 108.4(17) . . ?
N72 N71 Ru1 138.6(14) . . ?
C75 N71 Ru1 113.0(15) . . ?
C73 N72 N71 110.1(18) . . ?
C73 N72 C81 126(2) . . ?
N71 N72 C81 123.3(17) . . ?
C96 N91 C92 120(3) . . ?
C96 N91 Cu1 126(3) . . ?
C92 N91 Cu1 114(2) . . ?
C102 N101 C106 120(2) . . ?
C102 N101 Cu1 118(2) . . ?
C106 N101 Cu1 122(2) . . ?
C116 N111 C112 117(3) . . ?
C116 N111 Cu1 131(2) . . ?
C112 N111 Cu1 112(2) . . ?
C122 N121 C126 113(3) . . ?
C122 N121 Cu2 115(2) . . ?
C126 N121 Cu2 133(2) . . ?
C136 N131 C132 122(2) . . ?
C136 N131 Cu2 119(2) . . ?
C132 N131 Cu2 119.1(19) . . ?
C142 N141 C146 106(3) . . ?
C142 N141 Cu2 116(2) . . ?
C146 N141 Cu2 138(3) . . ?
N162 N161 C165 107.3(16) . . ?
N162 N161 Ru1 139.5(13) . . ?
C165 N161 Ru1 113.1(13) . . ?
C163 N162 N161 109.1(17) . . ?
C163 N162 C157 126.2(19) . . ?
N161 N162 C157 123.3(17) . . ?
C176 N171 C172 121.8(18) . . ?
C176 N171 Ru1 119.0(16) . . ?
C172 N171 Ru1 119.2(14) . . ?
N182 N181 C185 107.2(18) . . ?
N182 N181 Ru1 141.3(14) . . ?
C185 N181 Ru1 111.3(16) . . ?
C183 N182 N181 115.4(19) . . ?
C183 N182 C191 124(2) . . ?
N181 N182 C191 120.6(17) . . ?
C202 N201 C206 117.0(18) . . ?
C202 N201 Cu4 129.7(17) . . ?
C206 N201 Cu4 113.2(14) . . ?
C216 N211 C212 122.0(18) . . ?
C216 N211 Cu4 119.0(15) . . ?
C212 N211 Cu4 118.9(15) . . ?
C226 N221 C222 117.6(17) . . ?
C226 N221 Cu4 128.5(14) . . ?
C222 N221 Cu4 113.8(15) . . ?
C302 N303 Cu2 157(5) . . ?
C305 N306 Cu3 163(2) . . ?
C308 N309 Cu3 169(2) . . ?
C311 N312 Cu1 165(4) . . ?
C314 N315 Cu4 171(2) . . ?
F2 B1 F1 109.5(5) . . ?
F2 B1 F4 108.9(5) . . ?
F1 B1 F4 109.6(5) . . ?
F2 B1 F3 109.9(5) . . ?
F1 B1 F3 109.4(5) . . ?
F4 B1 F3 109.5(5) . . ?
F5 B2 F8 109.7(5) . . ?
F5 B2 F6 109.6(5) . . ?
F8 B2 F6 109.0(5) . . ?
F5 B2 F7 109.4(5) . . ?
F8 B2 F7 109.4(5) . . ?
F6 B2 F7 109.6(5) . . ?
F84 B8 F83 109.9(5) . . ?
F84 B8 F81 109.2(6) . . ?
F83 B8 F81 109.3(6) . . ?
F84 B8 F82 108.7(5) . . ?
F83 B8 F82 110.3(5) . . ?
F81 B8 F82 109.3(6) . . ?
F84 B8 F81' 28.1(8) . . ?
F83 B8 F81' 128.8(10) . . ?
F81 B8 F81' 112.8(10) . . ?
F82 B8 F81' 81.7(9) . . ?
F91 B9 F93 125.9(4) . . ?
F91 B9 F92 114.1(3) . . ?
F93 B9 F92 105.8(3) . . ?
F91 B9 F94 108.6(3) . . ?
F93 B9 F94 97.3(3) . . ?
F92 B9 F94 101.1(3) . . ?
F26 F23 Sb2 79.9(9) . . ?
F26 F23 Sb2' 66.9(8) . . ?
Sb2 F23 Sb2' 13.6(3) . . ?
Sb2 F25 Sb2' 16.8(2) . . ?
F23 F26 Sb2' 69.3(9) . . ?
F45 F44 Sb4 70.0(12) . . ?
F44 F45 Sb4 70.3(12) . . ?
Sb6 F61 F66 58.7(13) . . ?
Sb6 F63 F65 60.2(9) . . ?
Sb6 F64 Sb6' 15.2(3) . . ?
Sb6 F65 F63 59.7(9) . . ?
Sb6 F66 F61 58.5(13) . . ?
Sb7 F71 Sb7 21.3(13) . 3_666 ?
Sb7 F72 Sb7 31.4(10) . 3_666 ?
F71' F73 Sb7 79.2(16) 3_666 . ?
F71' F73 Sb7 51.2(8) 3_666 3_666 ?
Sb7 F73 Sb7 32.9(6) . 3_666 ?
F84 F81' B8 53.9(16) . . ?
F81' F84 B8 98.0(19) . . ?
F63' F62' Sb6' 64.7(9) . . ?
F62' F63' Sb6' 64.7(9) . . ?
F73 F71' Sb7 88(3) 3_666 . ?
F73 F71' Sb7 56(2) 3_666 3_666 ?
Sb7 F71' Sb7 36.4(12) . 3_666 ?
Sb7 F72' Sb7 41.8(9) 3_666 . ?
F15 Sb1 F12 90.1(3) . . ?
F15 Sb1 F13 90.4(2) . . ?
F12 Sb1 F13 90.1(3) . . ?
F15 Sb1 F11 90.4(3) . . ?
F12 Sb1 F11 179.2(3) . . ?
F13 Sb1 F11 90.6(3) . . ?
F15 Sb1 F16 179.6(3) . . ?
F12 Sb1 F16 89.7(3) . . ?
F13 Sb1 F16 89.9(2) . . ?
F11 Sb1 F16 89.8(3) . . ?
F15 Sb1 F14 90.0(2) . . ?
F12 Sb1 F14 89.5(3) . . ?
F13 Sb1 F14 179.4(4) . . ?
F11 Sb1 F14 89.8(3) . . ?
F16 Sb1 F14 89.7(2) . . ?
F23 Sb2 F21 94.0(14) . . ?
F23 Sb2 F22 170.8(16) . . ?
F21 Sb2 F22 92.3(16) . . ?
F23 Sb2 F26' 75.9(14) . . ?
F21 Sb2 F26' 169.6(14) . . ?
F22 Sb2 F26' 97.5(16) . . ?
F23 Sb2 F24 85.7(12) . . ?
F21 Sb2 F24 86.1(12) . . ?
F22 Sb2 F24 88.1(14) . . ?
F26' Sb2 F24 90.8(12) . . ?
F23 Sb2 F25 89.3(12) . . ?
F21 Sb2 F25 95.8(12) . . ?
F22 Sb2 F25 96.7(14) . . ?
F26' Sb2 F25 86.4(11) . . ?
F24 Sb2 F25 174.8(10) . . ?
F36' Sb3 F33' 99.7(15) . . ?
F36' Sb3 F36 25.8(14) . . ?
F33' Sb3 F36 87.6(19) . . ?
F36' Sb3 F32 170.4(13) . . ?
F33' Sb3 F32 87.1(14) . . ?
F36 Sb3 F32 163.1(18) . . ?
F36' Sb3 F35' 78.3(16) . . ?
F33' Sb3 F35' 167(2) . . ?
F36 Sb3 F35' 95.4(19) . . ?
F32 Sb3 F35' 93.6(14) . . ?
F36' Sb3 F35 88(2) . . ?
F33' Sb3 F35 170(2) . . ?
F36 Sb3 F35 97(2) . . ?
F32 Sb3 F35 86.3(18) . . ?
F35' Sb3 F35 22.0(19) . . ?
F36' Sb3 F31 93.7(14) . . ?
F33' Sb3 F31 98.1(16) . . ?
F36 Sb3 F31 72.9(18) . . ?
F32 Sb3 F31 92.0(10) . . ?
F35' Sb3 F31 95.3(15) . . ?
F35 Sb3 F31 75(2) . . ?
F36' Sb3 F33 95(2) . . ?
F33' Sb3 F33 26.6(18) . . ?
F36 Sb3 F33 75(2) . . ?
F32 Sb3 F33 93.7(18) . . ?
F35' Sb3 F33 166(3) . . ?
F35 Sb3 F33 147(3) . . ?
F31 Sb3 F33 72(2) . . ?
F36' Sb3 F34' 85.9(17) . . ?
F33' Sb3 F34' 83(2) . . ?
F36 Sb3 F34' 107(2) . . ?
F32 Sb3 F34' 88.2(14) . . ?
F35' Sb3 F34' 83.7(15) . . ?
F35 Sb3 F34' 104(2) . . ?
F31 Sb3 F34' 179.0(16) . . ?
F33 Sb3 F34' 109(3) . . ?
F36' Sb3 F34 91(2) . . ?
F33' Sb3 F34 107(3) . . ?
F36 Sb3 F34 117(3) . . ?
F32 Sb3 F34 80.2(18) . . ?
F35' Sb3 F34 60(2) . . ?
F35 Sb3 F34 79(2) . . ?
F31 Sb3 F34 153(2) . . ?
F33 Sb3 F34 134(3) . . ?
F34' Sb3 F34 26.4(18) . . ?
F45 Sb4 F46 102(2) . . ?
F45 Sb4 F42 85(3) . . ?
F46 Sb4 F42 157(3) . . ?
F45 Sb4 F41 92(2) . . ?
F46 Sb4 F41 83.0(18) . . ?
F42 Sb4 F41 119(2) . . ?
F45 Sb4 F44 40(2) . . ?
F46 Sb4 F44 97(3) . . ?
F42 Sb4 F44 74(3) . . ?
F41 Sb4 F44 131(3) . . ?
F45 Sb4 F43 172(2) . . ?
F46 Sb4 F43 86(2) . . ?
F42 Sb4 F43 88(3) . . ?
F41 Sb4 F43 89(2) . . ?
F44 Sb4 F43 139(3) . . ?
F45 Sb4 F41' 117(2) . . ?
F46 Sb4 F41' 107.6(18) . . ?
F42 Sb4 F41' 89(2) . . ?
F41 Sb4 F41' 40.7(14) . . ?
F44 Sb4 F41' 150(3) . . ?
F43 Sb4 F41' 60(2) . . ?
F45 Sb4 F44' 67(3) . . ?
F46 Sb4 F44' 66(3) . . ?
F42 Sb4 F44' 97(3) . . ?
F41 Sb4 F44' 137(3) . . ?
F44 Sb4 F44' 36(3) . . ?
F43 Sb4 F44' 116(3) . . ?
F41' Sb4 F44' 174(3) . . ?
F45 Sb4 F43' 99(2) . . ?
F46 Sb4 F43' 108(2) . . ?
F42 Sb4 F43' 49(2) . . ?
F41 Sb4 F43' 162(2) . . ?
F44 Sb4 F43' 63(3) . . ?
F43 Sb4 F43' 78(2) . . ?
F41' Sb4 F43' 121.5(19) . . ?
F44' Sb4 F43' 60(2) . . ?
F45 Sb4 F45' 32.2(18) . . ?
F46 Sb4 F45' 94.1(19) . . ?
F42 Sb4 F45' 103(2) . . ?
F41 Sb4 F45' 60.0(19) . . ?
F44 Sb4 F45' 71(3) . . ?
F43 Sb4 F45' 149(2) . . ?
F41' Sb4 F45' 90.6(19) . . ?
F44' Sb4 F45' 92(3) . . ?
F43' Sb4 F45' 131(2) . . ?
F45 Sb4 F42' 71(2) . . ?
F46 Sb4 F42' 172(2) . . ?
F42 Sb4 F42' 29(2) . . ?
F41 Sb4 F42' 93(2) . . ?
F44 Sb4 F42' 80(3) . . ?
F43 Sb4 F42' 101(2) . . ?
F41' Sb4 F42' 73(2) . . ?
F44' Sb4 F42' 113(3) . . ?
F43' Sb4 F42' 78(2) . . ?
F45' Sb4 F42' 78(2) . . ?
F45 Sb4 F46' 102(2) . . ?
F46 Sb4 F46' 27.1(16) . . ?
F42 Sb4 F46' 171(2) . . ?
F41 Sb4 F46' 56.0(18) . . ?
F44 Sb4 F46' 115(3) . . ?
F43 Sb4 F46' 85(2) . . ?
F41' Sb4 F46' 83.9(18) . . ?
F44' Sb4 F46' 91(3) . . ?
F43' Sb4 F46' 133(2) . . ?
F45' Sb4 F46' 81(2) . . ?
F42' Sb4 F46' 149(2) . . ?
F54 Sb5 F55 92.5(8) . . ?
F54 Sb5 F56 90.0(3) . . ?
F55 Sb5 F56 92.4(8) . . ?
F54 Sb5 F51 87.7(8) . . ?
F55 Sb5 F51 179.8(4) . . ?
F56 Sb5 F51 87.7(8) . . ?
F54 Sb5 F53 89.9(3) . . ?
F55 Sb5 F53 92.3(8) . . ?
F56 Sb5 F53 175.3(15) . . ?
F51 Sb5 F53 87.6(8) . . ?
F54 Sb5 F52 175.2(15) . . ?
F55 Sb5 F52 92.3(8) . . ?
F56 Sb5 F52 89.9(3) . . ?
F51 Sb5 F52 87.5(8) . . ?
F53 Sb5 F52 89.8(3) . . ?
F64 Sb6 F63 125.0(17) . . ?
F64 Sb6 F61 91.0(18) . . ?
F63 Sb6 F61 97(2) . . ?
F64 Sb6 F62 96.9(19) . . ?
F63 Sb6 F62 109(2) . . ?
F61 Sb6 F62 140(3) . . ?
F64 Sb6 F66 82(2) . . ?
F63 Sb6 F66 148(3) . . ?
F61 Sb6 F66 63(3) . . ?
F62 Sb6 F66 80(3) . . ?
F64 Sb6 F65 174.8(15) . . ?
F63 Sb6 F65 60.1(18) . . ?
F61 Sb6 F65 89(2) . . ?
F62 Sb6 F65 80(2) . . ?
F66 Sb6 F65 94(3) . . ?
Sb7 Sb7 F72' 72.3(18) 3_666 3_666 ?
Sb7 Sb7 F73 96.4(14) 3_666 . ?
F72' Sb7 F73 74(2) 3_666 . ?
Sb7 Sb7 F72 101(2) 3_666 . ?
F72' Sb7 F72 167(3) 3_666 . ?
F73 Sb7 F72 96(2) . . ?
Sb7 Sb7 F71 127(3) 3_666 . ?
F72' Sb7 F71 98(3) 3_666 . ?
F73 Sb7 F71 132(3) . . ?
F72 Sb7 F71 95(3) . . ?
Sb7 Sb7 F71' 86(3) 3_666 . ?
F72' Sb7 F71' 85(3) 3_666 . ?
F73 Sb7 F71' 157(3) . . ?
F72 Sb7 F71' 106(3) . . ?
F71 Sb7 F71' 42(3) . . ?
Sb7 Sb7 F72' 66(2) 3_666 . ?
F72' Sb7 F72' 138.2(9) 3_666 . ?
F73 Sb7 F72' 110(2) . . ?
F72 Sb7 F72' 37(2) . . ?
F71 Sb7 F72' 107(3) . . ?
F71' Sb7 F72' 91(4) . . ?
Sb7 Sb7 F71' 58(2) 3_666 3_666 ?
F72' Sb7 F71' 84(3) 3_666 3_666 ?
F73 Sb7 F71' 44(2) . 3_666 ?
F72 Sb7 F71' 83(3) . 3_666 ?
F71 Sb7 F71' 175(3) . 3_666 ?
F71' Sb7 F71' 143.6(12) . 3_666 ?
F72' Sb7 F71' 75(3) . 3_666 ?
Sb7 Sb7 F73 50.8(10) 3_666 3_666 ?
F72' Sb7 F73 93(2) 3_666 3_666 ?
F73 Sb7 F73 147.1(6) . 3_666 ?
F72 Sb7 F73 91(2) . 3_666 ?
F71 Sb7 F73 79(3) . 3_666 ?
F71' Sb7 F73 41(3) . 3_666 ?
F72' Sb7 F73 60(2) . 3_666 ?
F71' Sb7 F73 105(2) 3_666 3_666 ?
Sb7 Sb7 F72 48.0(15) 3_666 3_666 ?
F72' Sb7 F72 26.3(18) 3_666 3_666 ?
F73 Sb7 F72 88.6(18) . 3_666 ?
F72 Sb7 F72 148.6(10) . 3_666 ?
F71 Sb7 F72 105(3) . 3_666 ?
F71' Sb7 F72 76(3) . 3_666 ?
F72' Sb7 F72 113(2) . 3_666 ?
F71' Sb7 F72 79(3) 3_666 3_666 ?
F73 Sb7 F72 69.8(16) 3_666 3_666 ?
Sb7 Sb7 F71 31(2) 3_666 3_666 ?
F72' Sb7 F71 76(3) 3_666 3_666 ?
F73 Sb7 F71 67(2) . 3_666 ?
F72 Sb7 F71 92(3) . 3_666 ?
F71 Sb7 F71 158.7(13) . 3_666 ?
F71' Sb7 F71 117(3) . 3_666 ?
F72' Sb7 F71 68(3) . 3_666 ?
F71' Sb7 F71 27(2) 3_666 3_666 ?
F73 Sb7 F71 80.3(19) 3_666 3_666 ?
F72 Sb7 F71 62(2) 3_666 3_666 ?
F25 Sb2' F24' 164.1(15) . . ?
F25 Sb2' F21' 99(4) . . ?
F24' Sb2' F21' 84(4) . . ?
F25 Sb2' F26 90.9(16) . . ?
F24' Sb2' F26 91(2) . . ?
F21' Sb2' F26 162(4) . . ?
F25 Sb2' F22' 103(3) . . ?
F24' Sb2' F22' 92(3) . . ?
F21' Sb2' F22' 60(4) . . ?
F26 Sb2' F22' 102(3) . . ?
F25 Sb2' F23 66.8(10) . . ?
F24' Sb2' F23 104.4(16) . . ?
F21' Sb2' F23 155(3) . . ?
F26 Sb2' F23 43.8(16) . . ?
F22' Sb2' F23 141(3) . . ?
F65' Sb6' F66' 97(2) . . ?
F65' Sb6' F62' 89.1(18) . . ?
F66' Sb6' F62' 173(2) . . ?
F65' Sb6' F63' 103.7(16) . . ?
F66' Sb6' F63' 131(2) . . ?
F62' Sb6' F63' 50.6(17) . . ?
F65' Sb6' F61' 105.4(16) . . ?
F66' Sb6' F61' 58(2) . . ?
F62' Sb6' F61' 124.2(19) . . ?
F63' Sb6' F61' 73.5(18) . . ?
F65' Sb6' F64 176.6(13) . . ?
F66' Sb6' F64 85(2) . . ?
F62' Sb6' F64 89.7(16) . . ?
F63' Sb6' F64 73.1(13) . . ?
F61' Sb6' F64 72.6(14) . . ?
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 N61 2.026(17) . ?
Ru1 N171 2.035(15) . ?
Ru1 N52 2.064(16) . ?
Ru1 N161 2.085(15) . ?
Ru1 N71 2.097(16) . ?
Ru1 N181 2.100(17) . ?
Cu1 N312 1.74(3) . ?
Cu1 N101 1.908(18) . ?
Cu1 N91 1.98(3) . ?
Cu1 N111 1.99(3) . ?
Cu2 N131 1.923(17) . ?
Cu2 N303 1.95(3) . ?
Cu2 N141 1.98(3) . ?
Cu2 N121 2.00(2) . ?
Cu2 O2 2.27(4) . ?
Cu3 N21 1.934(18) . ?
Cu3 N31 1.98(2) . ?
Cu3 N309 1.99(2) . ?
Cu3 N11 2.00(2) . ?
Cu3 N306 2.15(2) . ?
Cu4 N211 1.927(16) . ?
Cu4 N315 1.926(19) . ?
Cu4 N201 2.000(17) . ?
Cu4 N221 2.022(17) . ?
Cu4 O1 2.239(13) . ?
C12 C13 1.35(3) . ?
C12 N11 1.41(3) . ?
C12 C26 1.48(3) . ?
C13 C14 1.33(3) . ?
C13 H13 0.9500 . ?
C14 C15 1.29(4) . ?
C14 H14 0.9500 . ?
C15 C16 1.38(4) . ?
C15 H15 0.9500 . ?
C16 N11 1.41(3) . ?
C16 H16 0.9500 . ?
C22 N21 1.35(3) . ?
C22 C23 1.39(3) . ?
C22 C36 1.48(3) . ?
C23 C24 1.40(3) . ?
C23 H23 0.9500 . ?
C24 C25 1.40(3) . ?
C24 C41 1.50(3) . ?
C25 C26 1.37(3) . ?
C25 H25 0.9500 . ?
C26 N21 1.35(3) . ?
C32 N31 1.29(3) . ?
C32 C33 1.38(3) . ?
C32 H32 0.9500 . ?
C33 C34 1.42(4) . ?
C33 H33 0.9500 . ?
C34 C35 1.32(3) . ?
C34 H34 0.9500 . ?
C35 C36 1.37(3) . ?
C35 H35 0.9500 . ?
C36 N31 1.33(2) . ?
C41 C42 1.34(3) . ?
C41 C46 1.40(3) . ?
C42 C43 1.38(3) . ?
C42 H42 0.9500 . ?
C43 C44 1.45(3) . ?
C43 H43 0.9500 . ?
C44 C45 1.30(3) . ?
C44 C47 1.51(3) . ?
C45 C46 1.44(3) . ?
C45 H45 0.9500 . ?
C46 H46 0.9500 . ?
C47 N51 1.47(2) . ?
C47 H47A 0.9900 . ?
C47 H47B 0.9900 . ?
C53 N52 1.35(2) . ?
C53 C54 1.37(3) . ?
C53 C66 1.41(3) . ?
C54 C55 1.37(3) . ?
C54 H54 0.9500 . ?
C55 N51 1.35(3) . ?
C55 H55 0.9500 . ?
C62 C75 1.35(3) . ?
C62 N61 1.36(2) . ?
C62 C63 1.42(3) . ?
C63 C64 1.34(4) . ?
C63 H63 0.9500 . ?
C64 C65 1.44(4) . ?
C64 H64 0.9500 . ?
C65 C66 1.38(3) . ?
C65 H65 0.9500 . ?
C66 N61 1.30(3) . ?
C73 N72 1.30(3) . ?
C73 C74 1.36(3) . ?
C73 H73 0.9500 . ?
C74 C75 1.43(3) . ?
C74 H74 0.9500 . ?
C75 N71 1.35(2) . ?
C81 N72 1.47(3) . ?
C81 C82 1.60(3) . ?
C81 H81A 0.9900 . ?
C81 H81B 0.9900 . ?
C82 C87 1.41(3) . ?
C82 C83 1.41(3) . ?
C83 C84 1.42(3) . ?
C83 H83 0.9500 . ?
C84 C85 1.37(3) . ?
C84 H84 0.9500 . ?
C85 C104 1.39(3) . ?
C85 C86 1.41(3) . ?
C86 C87 1.38(3) . ?
C86 H86 0.9500 . ?
C87 H87 0.9500 . ?
C92 N91 1.31(4) . ?
C92 C93 1.45(4) . ?
C92 C102 1.55(4) . ?
C93 C94 1.38(4) . ?
C93 H93 0.9500 . ?
C94 C95 1.41(4) . ?
C94 H94 0.9500 . ?
C95 C96 1.46(5) . ?
C95 H95 0.9500 . ?
C96 N91 1.30(4) . ?
C96 H96 0.9500 . ?
C102 N101 1.30(3) . ?
C102 C103 1.44(4) . ?
C103 C104 1.43(3) . ?
C103 H103 0.9500 . ?
C104 C105 1.34(3) . ?
C105 C106 1.41(3) . ?
C105 H105 0.9500 . ?
C106 N101 1.31(3) . ?
C106 C112 1.52(4) . ?
C112 N111 1.40(4) . ?
C112 C113 1.50(4) . ?
C113 C114 1.42(4) . ?
C113 H113 0.9500 . ?
C114 C115 1.43(4) . ?
C114 H114 0.9500 . ?
C115 C116 1.40(4) . ?
C115 H115 0.9500 . ?
C116 N111 1.27(3) . ?
C116 H116 0.9500 . ?
C122 N121 1.39(3) . ?
C122 C123 1.38(4) . ?
C122 C136 1.47(4) . ?
C123 C124 1.33(4) . ?
C123 H123 0.9500 . ?
C124 C125 1.31(4) . ?
C124 H124 0.9500 . ?
C125 C126 1.27(4) . ?
C125 H125 0.9500 . ?
C126 N121 1.47(4) . ?
C126 H126 0.9500 . ?
C132 N131 1.31(3) . ?
C132 C133 1.38(3) . ?
C132 C142 1.53(4) . ?
C133 C134 1.39(3) . ?
C133 H133 0.9500 . ?
C134 C135 1.39(3) . ?
C134 C151 1.49(3) . ?
C135 C136 1.42(3) . ?
C135 H135 0.9500 . ?
C136 N131 1.25(3) . ?
C142 C143 1.45(4) . ?
C142 N141 1.44(3) . ?
C143 C144 1.31(3) . ?
C143 H143 0.9500 . ?
C144 C145 1.30(4) . ?
C144 H144 0.9500 . ?
C145 C146 1.29(5) . ?
C145 H145 0.9500 . ?
C146 N141 1.51(4) . ?
C146 H146 0.9500 . ?
C151 C156 1.35(3) . ?
C151 C152 1.41(3) . ?
C152 C153 1.36(3) . ?
C152 H152 0.9500 . ?
C153 C154 1.44(3) . ?
C153 H153 0.9500 . ?
C154 C155 1.35(2) . ?
C154 C157 1.56(3) . ?
C155 C156 1.36(3) . ?
C155 H155 0.9500 . ?
C156 H156 0.9500 . ?
C157 N162 1.39(2) . ?
C157 H15A 0.9900 . ?
C157 H15B 0.9900 . ?
C163 N162 1.32(3) . ?
C163 C164 1.34(3) . ?
C163 H163 0.9500 . ?
C164 C165 1.42(3) . ?
C164 H164 0.9500 . ?
C165 C172 1.40(3) . ?
C165 N161 1.42(2) . ?
C172 N171 1.34(2) . ?
C172 C173 1.36(3) . ?
C173 C174 1.41(3) . ?
C173 H173 0.9500 . ?
C174 C175 1.32(3) . ?
C174 H174 0.9500 . ?
C175 C176 1.43(3) . ?
C175 H175 0.9500 . ?
C176 N171 1.29(2) . ?
C176 C185 1.43(3) . ?
C183 N182 1.30(2) . ?
C183 C184 1.33(3) . ?
C183 H183 0.9500 . ?
C184 C185 1.53(3) . ?
C184 H184 0.9500 . ?
C185 N181 1.34(3) . ?
C191 C192 1.52(3) . ?
C191 N182 1.51(3) . ?
C191 H19A 0.9900 . ?
C191 H19B 0.9900 . ?
C192 C197 1.36(3) . ?
C192 C193 1.37(3) . ?
C193 C194 1.36(3) . ?
C193 H193 0.9500 . ?
C194 C195 1.35(3) . ?
C194 H194 0.9500 . ?
C195 C196 1.40(3) . ?
C195 C214 1.52(3) . ?
C196 C197 1.42(3) . ?
C196 H196 0.9500 . ?
C197 H197 0.9500 . ?
C202 N201 1.32(3) . ?
C202 C203 1.40(3) . ?
C202 H202 0.9500 . ?
C203 C204 1.35(3) . ?
C203 H203 0.9500 . ?
C204 C205 1.49(3) . ?
C204 H204 0.9500 . ?
C205 C206 1.42(3) . ?
C205 H205 0.9500 . ?
C206 N201 1.37(3) . ?
C206 C216 1.44(3) . ?
C212 C213 1.32(3) . ?
C212 N211 1.36(2) . ?
C212 C222 1.49(3) . ?
C213 C214 1.37(3) . ?
C213 H213 0.9500 . ?
C214 C215 1.41(3) . ?
C215 C216 1.35(3) . ?
C215 H215 0.9500 . ?
C216 N211 1.33(2) . ?
C222 C223 1.36(3) . ?
C222 N221 1.40(2) . ?
C223 C224 1.33(3) . ?
C223 H223 0.9500 . ?
C224 C225 1.45(3) . ?
C224 H224 0.9500 . ?
C225 C226 1.30(3) . ?
C225 H225 0.9500 . ?
C226 N221 1.35(2) . ?
C226 H226 0.9500 . ?
C301 C302 1.57(2) . ?
C301 H30A 0.9800 . ?
C301 H30B 0.9800 . ?
C301 H30C 0.9800 . ?
C302 N303 1.078(16) . ?
C304 C305 1.56(2) . ?
C304 H30D 0.9800 . ?
C304 H30E 0.9800 . ?
C304 H30F 0.9800 . ?
C305 N306 1.079(16) . ?
C307 C308 1.56(2) . ?
C307 H30G 0.9800 . ?
C307 H30H 0.9800 . ?
C307 H30I 0.9800 . ?
C308 N309 1.078(16) . ?
C310 C311 1.57(2) . ?
C310 H30J 0.9800 . ?
C310 H30K 0.9800 . ?
C310 H30L 0.9800 . ?
C311 N312 1.076(16) . ?
C313 C314 1.56(2) . ?
C313 H30M 0.9800 . ?
C313 H30N 0.9800 . ?
C313 H30O 0.9800 . ?
C314 N315 1.079(16) . ?
N51 N52 1.43(2) . ?
N71 N72 1.34(2) . ?
N161 N162 1.349(19) . ?
N181 N182 1.35(2) . ?
B1 F2 1.372(9) . ?
B1 F1 1.373(9) . ?
B1 F4 1.373(9) . ?
B1 F3 1.373(9) . ?
B2 F5 1.362(8) . ?
B2 F8 1.363(8) . ?
B2 F6 1.364(8) . ?
B2 F7 1.364(8) . ?
B8 F84 1.239(10) . ?
B8 F83 1.248(10) . ?
B8 F81 1.248(10) . ?
B8 F82 1.249(10) . ?
B8 F81' 1.52(2) . ?
B9 F91 1.416(4) . ?
B9 F93 1.435(5) . ?
B9 F92 1.439(5) . ?
B9 F94 1.445(5) . ?
F11 Sb1 1.873(7) . ?
F12 Sb1 1.871(7) . ?
F13 Sb1 1.871(6) . ?
F14 Sb1 1.881(6) . ?
F15 Sb1 1.867(6) . ?
F16 Sb1 1.877(6) . ?
F21 Sb2 1.728(11) . ?
F22 Sb2 1.731(12) . ?
F23 F26 1.65(6) . ?
F23 Sb2 1.697(11) . ?
F23 Sb2' 2.234(13) . ?
F24 Sb2 1.736(11) . ?
F25 Sb2 1.754(10) . ?
F25 Sb2' 2.173(13) . ?
F26 Sb2' 2.197(14) . ?
F31 Sb3 1.858(12) . ?
F32 Sb3 1.857(12) . ?
F33 Sb3 1.858(13) . ?
F34 Sb3 1.859(13) . ?
F35 Sb3 1.851(15) . ?
F36 Sb3 1.849(15) . ?
F41 Sb4 1.84(2) . ?
F42 Sb4 1.83(2) . ?
F43 Sb4 1.84(2) . ?
F44 F45 1.25(7) . ?
F44 Sb4 1.84(2) . ?
F45 Sb4 1.83(2) . ?
F46 Sb4 1.83(2) . ?
F51 Sb5 1.864(15) . ?
F52 Sb5 1.866(15) . ?
F53 Sb5 1.866(15) . ?
F54 Sb5 1.862(15) . ?
F55 Sb5 1.862(15) . ?
F56 Sb5 1.863(15) . ?
F61 Sb6 1.669(14) . ?
F61 F66 1.74(6) . ?
F62 Sb6 1.671(14) . ?
F63 Sb6 1.666(14) . ?
F63 F65 1.67(5) . ?
F64 Sb6 1.656(13) . ?
F64 Sb6' 2.097(13) . ?
F65 Sb6 1.674(14) . ?
F66 Sb6 1.671(14) . ?
F71 Sb7 1.627(19) . ?
F71 Sb7 2.49(4) 3_666 ?
F72 Sb7 1.626(19) . ?
F72 Sb7 2.15(4) 3_666 ?
F73 F71' 1.36(8) 3_666 ?
F73 Sb7 1.626(19) . ?
F73 Sb7 2.09(3) 3_666 ?
F81' F84 0.72(2) . ?
F21' Sb2' 2.198(14) . ?
F22' Sb2' 2.199(14) . ?
F24' Sb2' 2.194(14) . ?
F26' Sb2 1.735(11) . ?
F33' Sb3 1.854(12) . ?
F34' Sb3 1.858(12) . ?
F35' Sb3 1.851(15) . ?
F36' Sb3 1.848(15) . ?
F41' Sb4 1.87(2) . ?
F42' Sb4 1.88(2) . ?
F43' Sb4 1.88(2) . ?
F44' Sb4 1.88(2) . ?
F45' Sb4 1.88(2) . ?
F46' Sb4 1.88(2) . ?
F61' Sb6' 2.093(14) . ?
F62' F63' 1.79(5) . ?
F62' Sb6' 2.091(14) . ?
F63' Sb6' 2.092(14) . ?
F65' Sb6' 2.084(14) . ?
F66' Sb6' 2.090(14) . ?
F71' F73 1.36(8) 3_666 ?
F71' Sb7 1.627(19) . ?
F71' Sb7 1.92(6) 3_666 ?
F72' Sb7 1.56(4) 3_666 ?
F72' Sb7 1.629(19) . ?
Sb7 Sb7 1.139(13) 3_666 ?
Sb7 F72' 1.56(4) 3_666 ?
Sb7 F71' 1.92(6) 3_666 ?
Sb7 F73 2.09(3) 3_666 ?
Sb7 F72 2.15(4) 3_666 ?
Sb7 F71 2.49(4) 3_666 ?
