#------------------------------------------------------------------------------
#$Date: 2016-03-25 16:56:20 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179996 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/90/7029028.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_7029028
loop_
_publ_author_name
'Delgado-Martínez, Patricia'
'González-Prieto, Rodrigo'
'Gómez-García, Carlos J'
'Jiménez-Aparicio, Reyes'
'Priego, José L'
'Torres, M. Rosario'
_publ_section_title
;
 Structural, magnetic and electrical properties of one-dimensional
 tetraamidatodiruthenium compounds.
;
_journal_issue                   8
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              3227
_journal_page_last               3237
_journal_paper_doi               10.1039/c3dt52727a
_journal_volume                  43
_journal_year                    2014
_chemical_formula_sum            'C32 H32 I N4 O4 Ru2'
_chemical_formula_weight         865.66
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                94.4770(10)
_cell_angle_beta                 94.7350(10)
_cell_angle_gamma                90.3450(10)
_cell_formula_units_Z            4
_cell_length_a                   11.8852(7)
_cell_length_b                   13.4489(8)
_cell_length_c                   20.6974(12)
_cell_measurement_reflns_used    4064
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      23.58
_cell_measurement_theta_min      2.28
_cell_volume                     3286.7(3)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.972
_diffrn_measured_fraction_theta_max 0.972
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0519
_diffrn_reflns_av_sigmaI/netI    0.0830
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            25323
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.52
_exptl_absorpt_coefficient_mu    1.899
_exptl_absorpt_correction_T_max  0.9279
_exptl_absorpt_correction_T_min  0.7637
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.749
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             1700
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.04
_refine_diff_density_max         0.732
_refine_diff_density_min         -0.560
_refine_diff_density_rms         0.131
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.993
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     764
_refine_ls_number_reflns         11265
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.993
_refine_ls_R_factor_all          0.0943
_refine_ls_R_factor_gt           0.0423
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0424P)²+0.8283P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0838
_refine_ls_wR_factor_ref         0.1050
_reflns_number_gt                6817
_reflns_number_total             11265
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3dt52727a.txt
_cod_data_source_block           3pdm121
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/automatic-downloads/current/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7029028
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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
C1 C 0.3806(6) 0.5202(6) 0.1038(3) 0.0376(19) Uani 1 1 d .
C2 C 0.3216(7) 0.5368(6) 0.1652(3) 0.044(2) Uani 1 1 d .
C3 C 0.3540(8) 0.6112(6) 0.2109(4) 0.057(2) Uani 1 1 d .
C4 C 0.2983(9) 0.6197(8) 0.2677(5) 0.082(3) Uani 1 1 d .
H4 H 0.3160 0.6726 0.2986 0.099 Uiso 1 1 calc R
C5 C 0.2194(10) 0.5524(8) 0.2782(5) 0.081(3) Uani 1 1 d .
H5 H 0.1844 0.5583 0.3168 0.097 Uiso 1 1 calc R
C6 C 0.1901(9) 0.4763(8) 0.2335(5) 0.091(4) Uani 1 1 d .
H6 H 0.1359 0.4298 0.2416 0.110 Uiso 1 1 calc R
C7 C 0.2409(8) 0.4675(7) 0.1755(5) 0.074(3) Uani 1 1 d .
H7 H 0.2209 0.4157 0.1442 0.089 Uiso 1 1 calc R
C8 C 0.4559(9) 0.6793(7) 0.2038(5) 0.090(3) Uani 1 1 d .
H8A H 0.5228 0.6400 0.2020 0.135 Uiso 1 1 calc R
H8B H 0.4649 0.7280 0.2404 0.135 Uiso 1 1 calc R
H8C H 0.4435 0.7126 0.1645 0.135 Uiso 1 1 calc R
C9 C 0.6659(6) 0.6034(6) 0.0692(3) 0.0330(18) Uani 1 1 d .
C10 C 0.7595(7) 0.6593(6) 0.1106(4) 0.045(2) Uani 1 1 d .
C11 C 0.8684(8) 0.6240(7) 0.1170(5) 0.063(3) Uani 1 1 d .
C12 C 0.9488(9) 0.6768(9) 0.1613(6) 0.096(4) Uani 1 1 d .
H12 H 1.0229 0.6548 0.1653 0.115 Uiso 1 1 calc R
C13 C 0.9195(12) 0.7591(10) 0.1977(7) 0.117(5) Uani 1 1 d .
H13 H 0.9732 0.7922 0.2271 0.141 Uiso 1 1 calc R
C14 C 0.8108(10) 0.7942(8) 0.1918(5) 0.094(4) Uani 1 1 d .
H14 H 0.7906 0.8508 0.2168 0.113 Uiso 1 1 calc R
C15 C 0.7328(8) 0.7438(6) 0.1480(4) 0.066(3) Uani 1 1 d .
H15 H 0.6595 0.7676 0.1435 0.079 Uiso 1 1 calc R
C16 C 0.9057(8) 0.5341(8) 0.0758(5) 0.100(4) Uani 1 1 d .
H16A H 0.8871 0.4743 0.0953 0.150 Uiso 1 1 calc R
H16B H 0.9858 0.5377 0.0730 0.150 Uiso 1 1 calc R
H16C H 0.8677 0.5331 0.0329 0.150 Uiso 1 1 calc R
C17 C 0.2995(6) 0.0888(6) 0.0041(4) 0.042(2) Uani 1 1 d .
C18 C 0.1900(7) 0.1361(6) 0.0133(4) 0.052(2) Uani 1 1 d .
C19 C 0.1748(9) 0.1920(7) 0.0729(6) 0.077(3) Uani 1 1 d .
C20 C 0.0709(12) 0.2373(9) 0.0796(7) 0.106(4) Uani 1 1 d .
H20 H 0.0590 0.2757 0.1178 0.127 Uiso 1 1 calc R
C21 C -0.0131(11) 0.2261(11) 0.0310(9) 0.119(5) Uani 1 1 d .
H21 H -0.0821 0.2564 0.0366 0.143 Uiso 1 1 calc R
C22 C 0.0020(10) 0.1700(11) -0.0271(8) 0.120(5) Uani 1 1 d .
H22 H -0.0557 0.1645 -0.0605 0.144 Uiso 1 1 calc R
C23 C 0.1038(9) 0.1224(8) -0.0347(6) 0.089(3) Uani 1 1 d .
H23 H 0.1133 0.0814 -0.0721 0.106 Uiso 1 1 calc R
C24 C 0.2655(10) 0.2037(9) 0.1288(5) 0.124(5) Uani 1 1 d .
H24A H 0.2990 0.1401 0.1354 0.185 Uiso 1 1 calc R
H24B H 0.2326 0.2286 0.1676 0.185 Uiso 1 1 calc R
H24C H 0.3224 0.2498 0.1188 0.185 Uiso 1 1 calc R
C25 C 0.5248(7) 0.0353(6) -0.1224(4) 0.044(2) Uani 1 1 d .
C26 C 0.5452(9) 0.0496(6) -0.1920(4) 0.057(2) Uani 1 1 d .
C27 C 0.6529(11) 0.0790(8) -0.2076(5) 0.084(4) Uani 1 1 d .
C28 C 0.6653(15) 0.0897(9) -0.2735(6) 0.133(6) Uani 1 1 d .
H28 H 0.7360 0.1080 -0.2852 0.159 Uiso 1 1 calc R
C29 C 0.5819(16) 0.0752(10) -0.3202(7) 0.133(6) Uani 1 1 d .
H29 H 0.5947 0.0835 -0.3631 0.159 Uiso 1 1 calc R
C30 C 0.4758(13) 0.0475(8) -0.3045(5) 0.121(5) Uani 1 1 d .
H30 H 0.4166 0.0392 -0.3369 0.145 Uiso 1 1 calc R
C31 C 0.4573(10) 0.0319(6) -0.2389(4) 0.077(3) Uani 1 1 d .
H31 H 0.3873 0.0101 -0.2280 0.092 Uiso 1 1 calc R
C32 C 0.7512(10) 0.0985(10) -0.1591(7) 0.133(5) Uani 1 1 d .
H32A H 0.8066 0.0478 -0.1654 0.199 Uiso 1 1 calc R
H32B H 0.7268 0.0978 -0.1160 0.199 Uiso 1 1 calc R
H32C H 0.7838 0.1626 -0.1643 0.199 Uiso 1 1 calc R
C33 C 0.0520(6) 0.9509(6) 0.6209(3) 0.0327(18) Uani 1 1 d .
C34 C 0.0845(7) 0.9254(5) 0.6895(3) 0.0364(18) Uani 1 1 d .
C35 C 0.1776(8) 0.8665(6) 0.7049(4) 0.052(2) Uani 1 1 d .
C36 C 0.1997(8) 0.8471(8) 0.7704(5) 0.077(3) Uani 1 1 d .
H36 H 0.2615 0.8084 0.7821 0.093 Uiso 1 1 calc R
C37 C 0.1336(9) 0.8830(8) 0.8172(5) 0.079(3) Uani 1 1 d .
H37 H 0.1501 0.8682 0.8600 0.095 Uiso 1 1 calc R
C38 C 0.0425(8) 0.9411(7) 0.8013(4) 0.068(3) Uani 1 1 d .
H38 H -0.0025 0.9661 0.8334 0.081 Uiso 1 1 calc R
C39 C 0.0184(7) 0.9621(6) 0.7380(4) 0.054(2) Uani 1 1 d .
H39 H -0.0432 1.0017 0.7273 0.065 Uiso 1 1 calc R
C40 C 0.2556(8) 0.8226(8) 0.6553(5) 0.089(3) Uani 1 1 d .
H40A H 0.2182 0.7676 0.6297 0.134 Uiso 1 1 calc R
H40B H 0.3235 0.7999 0.6776 0.134 Uiso 1 1 calc R
H40C H 0.2742 0.8729 0.6273 0.134 Uiso 1 1 calc R
C41 C 0.2054(7) 1.0884(6) 0.5095(3) 0.0389(19) Uani 1 1 d .
C42 C 0.3172(7) 1.1366(6) 0.5207(4) 0.048(2) Uani 1 1 d .
C43 C 0.3452(8) 1.2079(6) 0.5732(4) 0.059(2) Uani 1 1 d .
C44 C 0.4533(10) 1.2509(8) 0.5775(6) 0.090(4) Uani 1 1 d .
H44 H 0.4731 1.2997 0.6109 0.108 Uiso 1 1 calc R
C45 C 0.5298(10) 1.2241(10) 0.5350(8) 0.107(5) Uani 1 1 d .
H45 H 0.6016 1.2529 0.5410 0.128 Uiso 1 1 calc R
C46 C 0.5047(9) 1.1566(10) 0.4841(7) 0.099(4) Uani 1 1 d .
H46 H 0.5573 1.1403 0.4542 0.119 Uiso 1 1 calc R
C47 C 0.3956(8) 1.1112(7) 0.4773(5) 0.068(3) Uani 1 1 d .
H47 H 0.3771 1.0636 0.4430 0.081 Uiso 1 1 calc R
C48 C 0.2651(9) 1.2360(8) 0.6229(5) 0.093(4) Uani 1 1 d .
H48A H 0.2163 1.2876 0.6079 0.140 Uiso 1 1 calc R
H48B H 0.3068 1.2600 0.6629 0.140 Uiso 1 1 calc R
H48C H 0.2206 1.1788 0.6301 0.140 Uiso 1 1 calc R
C49 C 0.1566(6) 0.5184(6) 0.6002(3) 0.0364(18) Uani 1 1 d .
C50 C 0.2422(6) 0.5313(6) 0.6570(3) 0.042(2) Uani 1 1 d .
C51 C 0.2109(8) 0.5531(7) 0.7189(4) 0.063(3) Uani 1 1 d .
C56 C 0.0893(9) 0.5668(10) 0.7313(5) 0.119(5) Uani 1 1 d .
H56A H 0.0531 0.6059 0.6989 0.179 Uiso 1 1 calc R
H56B H 0.0844 0.6006 0.7736 0.179 Uiso 1 1 calc R
H56C H 0.0524 0.5028 0.7294 0.179 Uiso 1 1 calc R
C52 C 0.2924(10) 0.5640(8) 0.7695(4) 0.083(3) Uani 1 1 d .
H52 H 0.2712 0.5767 0.8116 0.100 Uiso 1 1 calc R
C53 C 0.4035(10) 0.5567(8) 0.7597(5) 0.083(3) Uani 1 1 d .
H53 H 0.4578 0.5692 0.7945 0.100 Uiso 1 1 calc R
C54 C 0.4361(8) 0.5309(8) 0.6984(5) 0.089(4) Uani 1 1 d .
H54 H 0.5115 0.5198 0.6917 0.107 Uiso 1 1 calc R
C55 C 0.3524(7) 0.5217(7) 0.6464(4) 0.062(3) Uani 1 1 d .
H55 H 0.3729 0.5088 0.6042 0.074 Uiso 1 1 calc R
C57 C 0.1376(6) 0.3860(5) 0.4312(3) 0.0307(17) Uani 1 1 d .
C58 C 0.2138(6) 0.3234(5) 0.3928(3) 0.0387(19) Uani 1 1 d .
C59 C 0.3294(7) 0.3464(6) 0.3966(4) 0.050(2) Uani 1 1 d .
C60 C 0.3946(8) 0.2841(7) 0.3581(4) 0.065(3) Uani 1 1 d .
H60 H 0.4721 0.2960 0.3606 0.078 Uiso 1 1 calc R
C61 C 0.3510(9) 0.2060(7) 0.3166(5) 0.076(3) Uani 1 1 d .
H61 H 0.3973 0.1675 0.2908 0.091 Uiso 1 1 calc R
C62 C 0.2380(9) 0.1864(7) 0.3144(5) 0.079(3) Uani 1 1 d .
H62 H 0.2063 0.1342 0.2865 0.095 Uiso 1 1 calc R
C63 C 0.1712(7) 0.2431(6) 0.3529(4) 0.055(2) Uani 1 1 d .
H63 H 0.0948 0.2270 0.3521 0.066 Uiso 1 1 calc R
C64 C 0.3819(7) 0.4289(7) 0.4418(4) 0.075(3) Uani 1 1 d .
H64A H 0.4612 0.4171 0.4499 0.113 Uiso 1 1 calc R
H64B H 0.3470 0.4314 0.4822 0.113 Uiso 1 1 calc R
H64C H 0.3712 0.4912 0.4226 0.113 Uiso 1 1 calc R
I1 I 0.65651(4) 0.25725(4) 0.06500(2) 0.04408(15) Uani 1 1 d .
I2 I 0.13265(4) 0.74404(3) 0.42506(2) 0.04075(15) Uani 1 1 d .
O1 O 0.4429(4) 0.4429(4) 0.0980(2) 0.0404(13) Uani 1 1 d .
O2 O 0.6619(4) 0.5093(4) 0.0729(2) 0.0409(13) Uani 1 1 d .
O3 O 0.3884(4) 0.1434(4) 0.0135(2) 0.0441(13) Uani 1 1 d .
O4 O 0.5546(4) 0.1056(4) -0.0795(2) 0.0461(14) Uani 1 1 d .
O5 O 0.0684(4) 0.8855(3) 0.5743(2) 0.0423(13) Uani 1 1 d .
O6 O -0.1181(4) 0.8576(4) 0.4784(2) 0.0418(13) Uani 1 1 d .
O7 O 0.1592(4) 0.5795(4) 0.5544(2) 0.0489(14) Uani 1 1 d .
O8 O 0.1398(4) 0.4800(3) 0.4256(2) 0.0353(12) Uani 1 1 d .
N1 N 0.6277(5) 0.4171(4) -0.0592(3) 0.0360(11) Uani 1 1 d .
H1 H 0.6741 0.3686 -0.0631 0.043 Uiso 1 1 calc R
N2 N 0.4069(5) 0.3513(4) -0.0324(3) 0.0360(11) Uani 1 1 d .
H2 H 0.4004 0.2880 -0.0298 0.043 Uiso 1 1 calc R
N3 N 0.6927(5) 0.0062(5) 0.0118(3) 0.0440(17) Uani 1 1 d .
H3 H 0.7539 0.0406 0.0213 0.053 Uiso 1 1 calc R
N4 N 0.5247(5) 0.0459(4) 0.1082(3) 0.0454(17) Uani 1 1 d .
H4A H 0.5506 0.0880 0.1393 0.054 Uiso 1 1 calc R
N5 N -0.0062(5) 0.9657(4) 0.3906(3) 0.0349(15) Uani 1 1 d .
H5A H 0.0072 0.9250 0.3580 0.042 Uiso 1 1 calc R
N6 N 0.1892(5) 0.9949(4) 0.4895(3) 0.0395(16) Uani 1 1 d .
H6A H 0.2468 0.9607 0.4791 0.047 Uiso 1 1 calc R
N7 N -0.0679(5) 0.6529(4) 0.5315(3) 0.0366(15) Uani 1 1 d .
H7A H -0.0668 0.7165 0.5295 0.044 Uiso 1 1 calc R
N8 N -0.0828(4) 0.5514(4) 0.4031(2) 0.0243(13) Uani 1 1 d .
H8 H -0.0840 0.5919 0.3729 0.029 Uiso 1 1 calc R
Ru1 Ru 0.53659(5) 0.42810(4) 0.01942(3) 0.03012(16) Uani 1 1 d .
Ru2 Ru 0.54280(5) 0.07654(4) 0.01528(3) 0.03689(17) Uani 1 1 d .
Ru3 Ru 0.03650(5) 0.92469(4) 0.48143(3) 0.03294(16) Uani 1 1 d .
Ru4 Ru 0.03739(5) 0.56832(4) 0.47849(3) 0.02685(15) Uani 1 1 d .
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'
O O 0.0106 0.0060 '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'
I I -0.4742 1.8119 '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
O1 C1 N1 120.9(7) . 2_665
O1 C1 C2 117.4(7) . .
N1 C1 C2 121.7(7) 2_665 .
C3 C2 C7 121.5(7) . .
C3 C2 C1 121.3(7) . .
C7 C2 C1 116.9(7) . .
C2 C3 C4 118.1(9) . .
C2 C3 C8 121.5(8) . .
C4 C3 C8 120.1(8) . .
C5 C4 C3 120.7(10) . .
C5 C4 H4 119.6 . .
C3 C4 H4 119.6 . .
C4 C5 C6 120.9(10) . .
C4 C5 H5 119.5 . .
C6 C5 H5 119.5 . .
C7 C6 C5 120.0(10) . .
C7 C6 H6 120.0 . .
C5 C6 H6 120.0 . .
C6 C7 C2 118.6(9) . .
C6 C7 H7 120.7 . .
C2 C7 H7 120.7 . .
C3 C8 H8A 109.5 . .
C3 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
C3 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
O2 C9 N2 122.0(6) . 2_665
O2 C9 C10 116.4(7) . .
N2 C9 C10 121.6(7) 2_665 .
C11 C10 C15 118.9(8) . .
C11 C10 C9 122.4(7) . .
C15 C10 C9 118.4(8) . .
C10 C11 C12 118.7(9) . .
C10 C11 C16 122.1(8) . .
C12 C11 C16 119.2(9) . .
C13 C12 C11 120.9(11) . .
C13 C12 H12 119.5 . .
C11 C12 H12 119.5 . .
C14 C13 C12 120.6(11) . .
C14 C13 H13 119.7 . .
C12 C13 H13 119.7 . .
C13 C14 C15 118.5(11) . .
C13 C14 H14 120.7 . .
C15 C14 H14 120.7 . .
C14 C15 C10 122.4(10) . .
C14 C15 H15 118.8 . .
C10 C15 H15 118.8 . .
C11 C16 H16A 109.5 . .
C11 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
C11 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
O3 C17 N3 120.1(7) . 2_655
O3 C17 C18 118.1(7) . .
N3 C17 C18 121.8(7) 2_655 .
C23 C18 C19 121.3(9) . .
C23 C18 C17 119.4(9) . .
C19 C18 C17 119.2(9) . .
C18 C19 C20 117.8(11) . .
C18 C19 C24 123.0(9) . .
C20 C19 C24 119.2(11) . .
C21 C20 C19 120.6(13) . .
C21 C20 H20 119.7 . .
C19 C20 H20 119.7 . .
C20 C21 C22 121.3(13) . .
C20 C21 H21 119.4 . .
C22 C21 H21 119.4 . .
C23 C22 C21 119.4(13) . .
C23 C22 H22 120.3 . .
C21 C22 H22 120.3 . .
C18 C23 C22 119.5(12) . .
C18 C23 H23 120.3 . .
C22 C23 H23 120.3 . .
C19 C24 H24A 109.5 . .
C19 C24 H24B 109.5 . .
H24A C24 H24B 109.5 . .
C19 C24 H24C 109.5 . .
H24A C24 H24C 109.5 . .
H24B C24 H24C 109.5 . .
O4 C25 N4 122.2(7) . 2_655
O4 C25 C26 117.9(7) . .
N4 C25 C26 119.9(7) 2_655 .
C31 C26 C27 121.8(9) . .
C31 C26 C25 118.3(9) . .
C27 C26 C25 119.9(9) . .
C28 C27 C26 116.5(13) . .
C28 C27 C32 119.5(13) . .
C26 C27 C32 124.0(9) . .
C29 C28 C27 123.7(17) . .
C29 C28 H28 118.2 . .
C27 C28 H28 118.2 . .
C28 C29 C30 119.7(14) . .
C28 C29 H29 120.2 . .
C30 C29 H29 120.2 . .
C29 C30 C31 120.0(13) . .
C29 C30 H30 120.0 . .
C31 C30 H30 120.0 . .
C26 C31 C30 118.3(11) . .
C26 C31 H31 120.8 . .
C30 C31 H31 120.8 . .
C27 C32 H32A 109.5 . .
C27 C32 H32B 109.5 . .
H32A C32 H32B 109.5 . .
C27 C32 H32C 109.5 . .
H32A C32 H32C 109.5 . .
H32B C32 H32C 109.5 . .
N5 C33 O5 120.7(6) 2_576 .
N5 C33 C34 121.1(7) 2_576 .
O5 C33 C34 118.1(7) . .
C35 C34 C39 120.0(7) . .
C35 C34 C33 122.0(7) . .
C39 C34 C33 118.0(7) . .
C34 C35 C36 117.1(8) . .
C34 C35 C40 124.1(8) . .
C36 C35 C40 118.8(9) . .
C37 C36 C35 122.1(9) . .
C37 C36 H36 119.0 . .
C35 C36 H36 119.0 . .
C36 C37 C38 120.2(9) . .
C36 C37 H37 119.9 . .
C38 C37 H37 119.9 . .
C39 C38 C37 119.5(9) . .
C39 C38 H38 120.2 . .
C37 C38 H38 120.2 . .
C38 C39 C34 121.1(8) . .
C38 C39 H39 119.5 . .
C34 C39 H39 119.5 . .
C35 C40 H40A 109.5 . .
C35 C40 H40B 109.5 . .
H40A C40 H40B 109.5 . .
C35 C40 H40C 109.5 . .
H40A C40 H40C 109.5 . .
H40B C40 H40C 109.5 . .
O6 C41 N6 118.5(7) 2_576 .
O6 C41 C42 117.7(7) 2_576 .
N6 C41 C42 123.8(8) . .
C47 C42 C43 119.8(8) . .
C47 C42 C41 117.9(8) . .
C43 C42 C41 122.3(8) . .
C42 C43 C44 117.0(10) . .
C42 C43 C48 122.2(8) . .
C44 C43 C48 120.7(9) . .
C45 C44 C43 122.4(11) . .
C45 C44 H44 118.8 . .
C43 C44 H44 118.8 . .
C44 C45 C46 121.6(12) . .
C44 C45 H45 119.2 . .
C46 C45 H45 119.2 . .
C45 C46 C47 118.1(12) . .
C45 C46 H46 120.9 . .
C47 C46 H46 120.9 . .
C42 C47 C46 121.0(10) . .
C42 C47 H47 119.5 . .
C46 C47 H47 119.5 . .
C43 C48 H48A 109.5 . .
C43 C48 H48B 109.5 . .
H48A C48 H48B 109.5 . .
C43 C48 H48C 109.5 . .
H48A C48 H48C 109.5 . .
H48B C48 H48C 109.5 . .
N8 C49 O7 121.2(6) 2_566 .
N8 C49 C50 120.1(7) 2_566 .
O7 C49 C50 118.7(6) . .
C51 C50 C55 120.3(7) . .
C51 C50 C49 121.3(7) . .
C55 C50 C49 118.4(7) . .
C50 C51 C52 119.2(9) . .
C50 C51 C56 121.0(8) . .
C52 C51 C56 119.9(9) . .
C51 C56 H56A 109.5 . .
C51 C56 H56B 109.5 . .
H56A C56 H56B 109.5 . .
C51 C56 H56C 109.5 . .
H56A C56 H56C 109.5 . .
H56B C56 H56C 109.5 . .
C53 C52 C51 121.5(10) . .
C53 C52 H52 119.3 . .
C51 C52 H52 119.3 . .
C52 C53 C54 120.1(9) . .
C52 C53 H53 120.0 . .
C54 C53 H53 120.0 . .
C55 C54 C53 118.2(10) . .
C55 C54 H54 120.9 . .
C53 C54 H54 120.9 . .
C50 C55 C54 120.6(9) . .
C50 C55 H55 119.7 . .
C54 C55 H55 119.7 . .
O8 C57 N7 120.7(6) . 2_566
O8 C57 C58 117.6(6) . .
N7 C57 C58 121.7(6) 2_566 .
C63 C58 C59 119.9(7) . .
C63 C58 C57 120.1(7) . .
C59 C58 C57 120.0(7) . .
C60 C59 C58 116.1(7) . .
C60 C59 C64 121.4(8) . .
C58 C59 C64 122.5(7) . .
C59 C60 C61 123.8(9) . .
C59 C60 H60 118.1 . .
C61 C60 H60 118.1 . .
C62 C61 C60 118.2(9) . .
C62 C61 H61 120.9 . .
C60 C61 H61 120.9 . .
C61 C62 C63 120.2(9) . .
C61 C62 H62 119.9 . .
C63 C62 H62 119.9 . .
C58 C63 C62 121.7(8) . .
C58 C63 H63 119.1 . .
C62 C63 H63 119.1 . .
C59 C64 H64A 109.5 . .
C59 C64 H64B 109.5 . .
H64A C64 H64B 109.5 . .
C59 C64 H64C 109.5 . .
H64A C64 H64C 109.5 . .
H64B C64 H64C 109.5 . .
Ru2 I1 Ru1 110.67(2) . .
Ru3 I2 Ru4 110.16(2) . .
C1 O1 Ru1 117.4(4) . .
C9 O2 Ru1 119.0(4) . .
C17 O3 Ru2 118.8(5) . .
C25 O4 Ru2 116.5(5) . .
C33 O5 Ru3 117.9(4) . .
C41 O6 Ru3 119.2(4) 2_576 .
C49 O7 Ru4 119.4(4) . .
C57 O8 Ru4 118.6(4) . .
C1 N1 Ru1 123.1(5) 2_665 .
C1 N1 H1 118.5 2_665 .
Ru1 N1 H1 118.5 . .
C9 N2 Ru1 120.6(5) 2_665 .
C9 N2 H2 119.7 2_665 .
Ru1 N2 H2 119.7 . .
C17 N3 Ru2 122.8(5) 2_655 .
C17 N3 H3 118.6 2_655 .
Ru2 N3 H3 118.6 . .
C25 N4 Ru2 122.4(5) 2_655 .
C25 N4 H4A 118.8 2_655 .
Ru2 N4 H4A 118.8 . .
C33 N5 Ru3 123.4(5) 2_576 .
C33 N5 H5A 118.3 2_576 .
Ru3 N5 H5A 118.3 . .
C41 N6 Ru3 124.1(5) . .
C41 N6 H6A 118.0 . .
Ru3 N6 H6A 118.0 . .
C57 N7 Ru4 122.3(5) 2_566 .
C57 N7 H7A 118.8 2_566 .
Ru4 N7 H7A 118.8 . .
C49 N8 Ru4 121.0(5) 2_566 .
C49 N8 H8 119.5 2_566 .
Ru4 N8 H8 119.5 . .
N1 Ru1 O2 91.4(2) . .
N1 Ru1 O1 178.4(2) . .
O2 Ru1 O1 88.49(19) . .
N1 Ru1 N2 90.3(2) . .
O2 Ru1 N2 177.6(2) . .
O1 Ru1 N2 89.8(2) . .
N1 Ru1 Ru1 86.81(17) . 2_665
O2 Ru1 Ru1 90.07(14) . 2_665
O1 Ru1 Ru1 91.60(14) . 2_665
N2 Ru1 Ru1 88.35(17) . 2_665
N1 Ru1 I1 88.14(17) . .
O2 Ru1 I1 84.73(14) . .
O1 Ru1 I1 93.43(14) . .
N2 Ru1 I1 97.00(16) . .
Ru1 Ru1 I1 172.66(4) 2_665 .
N3 Ru2 N4 93.8(2) . .
N3 Ru2 O4 87.7(2) . .
N4 Ru2 O4 177.7(2) . .
N3 Ru2 O3 176.6(2) . .
N4 Ru2 O3 88.5(2) . .
O4 Ru2 O3 89.9(2) . .
N3 Ru2 Ru2 87.24(17) . 2_655
N4 Ru2 Ru2 86.51(17) . 2_655
O4 Ru2 Ru2 91.89(14) . 2_655
O3 Ru2 Ru2 90.47(14) . 2_655
N3 Ru2 I1 90.37(17) . .
N4 Ru2 I1 88.37(17) . .
O4 Ru2 I1 93.31(14) . .
O3 Ru2 I1 92.14(14) . .
Ru2 Ru2 I1 174.19(4) 2_655 .
N6 Ru3 O6 176.8(2) . .
N6 Ru3 N5 94.2(2) . .
O6 Ru3 N5 88.1(2) . .
N6 Ru3 O5 88.8(2) . .
O6 Ru3 O5 88.85(19) . .
N5 Ru3 O5 176.1(2) . .
N6 Ru3 Ru3 86.77(17) . 2_576
O6 Ru3 Ru3 91.07(15) . 2_576
N5 Ru3 Ru3 86.54(17) . 2_576
O5 Ru3 Ru3 91.04(14) . 2_576
N6 Ru3 I2 91.17(17) . .
O6 Ru3 I2 91.17(15) . .
N5 Ru3 I2 89.17(17) . .
O5 Ru3 I2 93.38(14) . .
Ru3 Ru3 I2 175.09(4) 2_576 .
O8 Ru4 N7 178.26(19) . .
O8 Ru4 O7 89.9(2) . .
N7 Ru4 O7 90.6(2) . .
O8 Ru4 N8 88.71(19) . .
N7 Ru4 N8 90.7(2) . .
O7 Ru4 N8 177.8(2) . .
O8 Ru4 Ru4 91.35(13) . 2_566
N7 Ru4 Ru4 87.02(15) . 2_566
O7 Ru4 Ru4 89.07(15) . 2_566
N8 Ru4 Ru4 89.22(14) . 2_566
O8 Ru4 I2 89.20(12) . .
N7 Ru4 I2 92.44(15) . .
O7 Ru4 I2 90.54(14) . .
N8 Ru4 I2 91.19(14) . .
Ru4 Ru4 I2 179.33(4) 2_566 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.284(8) .
C1 N1 1.297(8) 2_665
C1 C2 1.503(9) .
C2 C3 1.354(10) .
C2 C7 1.374(11) .
C3 C4 1.393(11) .
C3 C8 1.537(12) .
C4 C5 1.341(13) .
C4 H4 0.9300 .
C5 C6 1.349(13) .
C5 H5 0.9300 .
C6 C7 1.384(11) .
C6 H6 0.9300 .
C7 H7 0.9300 .
C8 H8A 0.9600 .
C8 H8B 0.9600 .
C8 H8C 0.9600 .
C9 O2 1.275(8) .
C9 N2 1.293(8) 2_665
C9 C10 1.507(10) .
C10 C11 1.381(11) .
C10 C15 1.378(11) .
C11 C12 1.415(12) .
C11 C16 1.516(12) .
C12 C13 1.354(15) .
C12 H12 0.9300 .
C13 C14 1.377(15) .
C13 H13 0.9300 .
C14 C15 1.379(11) .
C14 H14 0.9300 .
C15 H15 0.9300 .
C16 H16A 0.9600 .
C16 H16B 0.9600 .
C16 H16C 0.9600 .
C17 O3 1.276(8) .
C17 N3 1.299(9) 2_655
C17 C18 1.472(10) .
C18 C23 1.369(12) .
C18 C19 1.419(12) .
C19 C20 1.393(13) .
C19 C24 1.512(14) .
C20 C21 1.356(16) .
C20 H20 0.9300 .
C21 C22 1.395(17) .
C21 H21 0.9300 .
C22 C23 1.387(14) .
C22 H22 0.9300 .
C23 H23 0.9300 .
C24 H24A 0.9600 .
C24 H24B 0.9600 .
C24 H24C 0.9600 .
C25 O4 1.273(8) .
C25 N4 1.303(9) 2_655
C25 C26 1.507(11) .
C26 C31 1.372(12) .
C26 C27 1.407(13) .
C27 C28 1.401(13) .
C27 C32 1.486(14) .
C28 C29 1.33(2) .
C28 H28 0.9300 .
C29 C30 1.383(18) .
C29 H29 0.9300 .
C30 C31 1.427(13) .
C30 H30 0.9300 .
C31 H31 0.9300 .
C32 H32A 0.9600 .
C32 H32B 0.9600 .
C32 H32C 0.9600 .
C33 N5 1.280(8) 2_576
C33 O5 1.282(8) .
C33 C34 1.506(9) .
C34 C35 1.394(10) .
C34 C39 1.388(10) .
C35 C36 1.404(11) .
C35 C40 1.528(11) .
C36 C37 1.358(12) .
C36 H36 0.9300 .
C37 C38 1.371(12) .
C37 H37 0.9300 .
C38 C39 1.371(11) .
C38 H38 0.9300 .
C39 H39 0.9300 .
C40 H40A 0.9600 .
C40 H40B 0.9600 .
C40 H40C 0.9600 .
C41 O6 1.299(8) 2_576
C41 N6 1.301(8) .
C41 C42 1.468(10) .
C42 C47 1.373(11) .
C42 C43 1.409(11) .
C43 C44 1.399(12) .
C43 C48 1.488(12) .
C44 C45 1.348(15) .
C44 H44 0.9300 .
C45 C46 1.349(16) .
C45 H45 0.9300 .
C46 C47 1.422(13) .
C46 H46 0.9300 .
C47 H47 0.9300 .
C48 H48A 0.9600 .
C48 H48B 0.9600 .
C48 H48C 0.9600 .
C49 N8 1.275(8) 2_566
C49 O7 1.304(8) .
C49 C50 1.489(9) .
C50 C51 1.374(10) .
C50 C55 1.351(10) .
C51 C52 1.364(11) .
C51 C56 1.499(12) .
C56 H56A 0.9600 .
C56 H56B 0.9600 .
C56 H56C 0.9600 .
C52 C53 1.355(13) .
C52 H52 0.9300 .
C53 C54 1.377(13) .
C53 H53 0.9300 .
C54 C55 1.401(11) .
C54 H54 0.9300 .
C55 H55 0.9300 .
C57 O8 1.278(7) .
C57 N7 1.311(8) 2_566
C57 C58 1.478(9) .
C58 C63 1.374(10) .
C58 C59 1.402(10) .
C59 C60 1.394(11) .
C59 C64 1.494(10) .
C60 C61 1.373(12) .
C60 H60 0.9300 .
C61 C62 1.363(12) .
C61 H61 0.9300 .
C62 C63 1.366(11) .
C62 H62 0.9300 .
C63 H63 0.9300 .
C64 H64A 0.9600 .
C64 H64B 0.9600 .
C64 H64C 0.9600 .
I1 Ru2 2.8517(8) .
I1 Ru1 2.8908(8) .
I2 Ru3 2.8950(8) .
I2 Ru4 2.9447(7) .
O1 Ru1 2.045(4) .
O2 Ru1 2.038(5) .
O3 Ru2 2.048(5) .
O4 Ru2 2.045(5) .
O5 Ru3 2.039(5) .
O6 C41 1.299(8) 2_576
O6 Ru3 2.037(5) .
O7 Ru4 2.042(5) .
O8 Ru4 2.031(4) .
N1 C1 1.297(8) 2_665
N1 Ru1 2.024(6) .
N1 H1 0.8600 .
N2 C9 1.293(8) 2_665
N2 Ru1 2.032(6) .
N2 H2 0.8600 .
N3 C17 1.299(9) 2_655
N3 Ru2 2.027(6) .
N3 H3 0.8600 .
N4 C25 1.303(9) 2_655
N4 Ru2 2.026(6) .
N4 H4A 0.8600 .
N5 C33 1.280(8) 2_576
N5 Ru3 2.027(6) .
N5 H5A 0.8600 .
N6 Ru3 2.029(6) .
N6 H6A 0.8600 .
N7 C57 1.311(8) 2_566
N7 Ru4 2.028(5) .
N7 H7A 0.8600 .
N8 C49 1.275(8) 2_566
N8 Ru4 2.024(5) .
N8 H8 0.8600 .
Ru1 Ru1 2.3001(11) 2_665
Ru2 Ru2 2.3106(12) 2_655
Ru3 Ru3 2.3097(12) 2_576
Ru4 Ru4 2.3079(10) 2_566
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_4
O1 C1 C2 C3 108.7(9) . .
N1 C1 C2 C3 -69.1(11) 2_665 .
O1 C1 C2 C7 -65.2(10) . .
N1 C1 C2 C7 117.0(9) 2_665 .
C7 C2 C3 C4 -4.0(14) . .
C1 C2 C3 C4 -177.5(8) . .
C7 C2 C3 C8 170.9(9) . .
C1 C2 C3 C8 -2.7(13) . .
C2 C3 C4 C5 3.9(16) . .
C8 C3 C4 C5 -171.0(10) . .
C3 C4 C5 C6 -1.6(18) . .
C4 C5 C6 C7 -0.7(18) . .
C5 C6 C7 C2 0.6(17) . .
C3 C2 C7 C6 1.8(15) . .
C1 C2 C7 C6 175.6(9) . .
O2 C9 C10 C11 42.2(10) . .
N2 C9 C10 C11 -138.5(8) 2_665 .
O2 C9 C10 C15 -131.6(8) . .
N2 C9 C10 C15 47.8(10) 2_665 .
C15 C10 C11 C12 -0.8(13) . .
C9 C10 C11 C12 -174.6(8) . .
C15 C10 C11 C16 -177.6(9) . .
C9 C10 C11 C16 8.7(13) . .
C10 C11 C12 C13 1.5(17) . .
C16 C11 C12 C13 178.3(11) . .
C11 C12 C13 C14 -1(2) . .
C12 C13 C14 C15 0(2) . .
C13 C14 C15 C10 0.6(17) . .
C11 C10 C15 C14 -0.2(14) . .
C9 C10 C15 C14 173.8(8) . .
O3 C17 C18 C23 128.7(9) . .
N3 C17 C18 C23 -52.7(12) 2_655 .
O3 C17 C18 C19 -53.6(11) . .
N3 C17 C18 C19 125.0(9) 2_655 .
C23 C18 C19 C20 -3.5(14) . .
C17 C18 C19 C20 178.9(8) . .
C23 C18 C19 C24 176.1(10) . .
C17 C18 C19 C24 -1.5(14) . .
C18 C19 C20 C21 1.3(17) . .
C24 C19 C20 C21 -178.3(12) . .
C19 C20 C21 C22 -1(2) . .
C20 C21 C22 C23 2(2) . .
C19 C18 C23 C22 4.8(15) . .
C17 C18 C23 C22 -177.6(9) . .
C21 C22 C23 C18 -3.9(19) . .
O4 C25 C26 C31 -129.8(8) . .
N4 C25 C26 C31 48.4(11) 2_655 .
O4 C25 C26 C27 51.2(11) . .
N4 C25 C26 C27 -130.7(9) 2_655 .
C31 C26 C27 C28 0.4(14) . .
C25 C26 C27 C28 179.4(8) . .
C31 C26 C27 C32 -179.6(10) . .
C25 C26 C27 C32 -0.6(15) . .
C26 C27 C28 C29 1.0(18) . .
C32 C27 C28 C29 -179.1(13) . .
C27 C28 C29 C30 0(2) . .
C28 C29 C30 C31 -2(2) . .
C27 C26 C31 C30 -2.4(14) . .
C25 C26 C31 C30 178.6(8) . .
C29 C30 C31 C26 3.2(16) . .
N5 C33 C34 C35 -147.6(7) 2_576 .
O5 C33 C34 C35 34.5(10) . .
N5 C33 C34 C39 32.5(10) 2_576 .
O5 C33 C34 C39 -145.3(7) . .
C39 C34 C35 C36 0.1(12) . .
C33 C34 C35 C36 -179.7(7) . .
C39 C34 C35 C40 -179.9(8) . .
C33 C34 C35 C40 0.3(12) . .
C34 C35 C36 C37 0.4(14) . .
C40 C35 C36 C37 -179.6(10) . .
C35 C36 C37 C38 -0.7(17) . .
C36 C37 C38 C39 0.4(16) . .
C37 C38 C39 C34 0.2(14) . .
C35 C34 C39 C38 -0.4(12) . .
C33 C34 C39 C38 179.4(7) . .
O6 C41 C42 C47 -141.6(8) 2_576 .
N6 C41 C42 C47 39.6(11) . .
O6 C41 C42 C43 37.5(11) 2_576 .
N6 C41 C42 C43 -141.4(8) . .
C47 C42 C43 C44 1.0(13) . .
C41 C42 C43 C44 -178.0(8) . .
C47 C42 C43 C48 -178.0(9) . .
C41 C42 C43 C48 3.0(13) . .
C42 C43 C44 C45 -2.0(16) . .
C48 C43 C44 C45 177.0(11) . .
C43 C44 C45 C46 3(2) . .
C44 C45 C46 C47 -2.1(19) . .
C43 C42 C47 C46 -0.7(14) . .
C41 C42 C47 C46 178.4(8) . .
C45 C46 C47 C42 1.2(16) . .
N8 C49 C50 C51 -62.1(11) 2_566 .
O7 C49 C50 C51 118.0(9) . .
N8 C49 C50 C55 118.2(9) 2_566 .
O7 C49 C50 C55 -61.7(10) . .
C55 C50 C51 C52 -0.5(14) . .
C49 C50 C51 C52 179.8(9) . .
C55 C50 C51 C56 178.3(10) . .
C49 C50 C51 C56 -1.4(14) . .
C50 C51 C52 C53 1.9(16) . .
C56 C51 C52 C53 -176.9(11) . .
C51 C52 C53 C54 -4.7(18) . .
C52 C53 C54 C55 5.8(17) . .
C51 C50 C55 C54 1.8(14) . .
C49 C50 C55 C54 -178.5(8) . .
C53 C54 C55 C50 -4.4(16) . .
O8 C57 C58 C63 -126.5(8) . .
N7 C57 C58 C63 51.8(10) 2_566 .
O8 C57 C58 C59 52.8(10) . .
N7 C57 C58 C59 -128.9(8) 2_566 .
C63 C58 C59 C60 0.1(12) . .
C57 C58 C59 C60 -179.2(7) . .
C63 C58 C59 C64 -176.3(8) . .
C57 C58 C59 C64 4.3(12) . .
C58 C59 C60 C61 2.1(13) . .
C64 C59 C60 C61 178.7(9) . .
C59 C60 C61 C62 -2.0(15) . .
C60 C61 C62 C63 -0.4(16) . .
C59 C58 C63 C62 -2.5(13) . .
C57 C58 C63 C62 176.8(8) . .
C61 C62 C63 C58 2.7(15) . .
N1 C1 O1 Ru1 4.3(9) 2_665 .
C2 C1 O1 Ru1 -173.5(5) . .
N2 C9 O2 Ru1 -0.2(9) 2_665 .
C10 C9 O2 Ru1 179.2(4) . .
N3 C17 O3 Ru2 -8.2(10) 2_655 .
C18 C17 O3 Ru2 170.4(5) . .
N4 C25 O4 Ru2 8.9(10) 2_655 .
C26 C25 O4 Ru2 -173.0(6) . .
N5 C33 O5 Ru3 7.1(9) 2_576 .
C34 C33 O5 Ru3 -175.0(5) . .
N8 C49 O7 Ru4 3.5(9) 2_566 .
C50 C49 O7 Ru4 -176.6(5) . .
N7 C57 O8 Ru4 2.3(9) 2_566 .
C58 C57 O8 Ru4 -179.4(5) . .
O6 C41 N6 Ru3 -4.3(9) 2_576 .
C42 C41 N6 Ru3 174.5(5) . .
C1 N1 Ru1 O2 -92.4(5) 2_665 .
C1 N1 Ru1 O1 -6(8) 2_665 .
C1 N1 Ru1 N2 85.9(6) 2_665 .
C1 N1 Ru1 Ru1 -2.4(5) 2_665 2_665
C1 N1 Ru1 I1 -177.1(5) 2_665 .
C9 O2 Ru1 N1 85.3(5) . .
C9 O2 Ru1 O1 -93.1(5) . .
C9 O2 Ru1 N2 -50(5) . .
C9 O2 Ru1 Ru1 -1.5(5) . 2_665
C9 O2 Ru1 I1 173.3(5) . .
C1 O1 Ru1 N1 1(8) . .
C1 O1 Ru1 O2 88.0(5) . .
C1 O1 Ru1 N2 -90.4(5) . .
C1 O1 Ru1 Ru1 -2.1(5) . 2_665
C1 O1 Ru1 I1 172.6(5) . .
C9 N2 Ru1 N1 -84.0(5) 2_665 .
C9 N2 Ru1 O2 51(5) 2_665 .
C9 N2 Ru1 O1 94.4(5) 2_665 .
C9 N2 Ru1 Ru1 2.8(5) 2_665 2_665
C9 N2 Ru1 I1 -172.2(5) 2_665 .
Ru2 I1 Ru1 N1 -88.86(16) . .
Ru2 I1 Ru1 O2 179.55(14) . .
Ru2 I1 Ru1 O1 91.39(14) . .
Ru2 I1 Ru1 N2 1.21(15) . .
Ru2 I1 Ru1 Ru1 -135.4(3) . 2_665
C17 N3 Ru2 N4 86.7(6) 2_655 .
C17 N3 Ru2 O4 -91.6(6) 2_655 .
C17 N3 Ru2 O3 -47(4) 2_655 .
C17 N3 Ru2 Ru2 0.4(6) 2_655 2_655
C17 N3 Ru2 I1 175.1(6) 2_655 .
C25 N4 Ru2 N3 -89.1(6) 2_655 .
C25 N4 Ru2 O4 43(6) 2_655 .
C25 N4 Ru2 O3 88.5(6) 2_655 .
C25 N4 Ru2 Ru2 -2.1(6) 2_655 2_655
C25 N4 Ru2 I1 -179.3(6) 2_655 .
C25 O4 Ru2 N3 81.3(6) . .
C25 O4 Ru2 N4 -51(6) . .
C25 O4 Ru2 O3 -96.3(5) . .
C25 O4 Ru2 Ru2 -5.8(5) . 2_655
C25 O4 Ru2 I1 171.6(5) . .
C17 O3 Ru2 N3 54(4) . .
C17 O3 Ru2 N4 -80.1(6) . .
C17 O3 Ru2 O4 98.3(5) . .
C17 O3 Ru2 Ru2 6.4(5) . 2_655
C17 O3 Ru2 I1 -168.4(5) . .
Ru1 I1 Ru2 N3 146.93(17) . .
Ru1 I1 Ru2 N4 -119.27(18) . .
Ru1 I1 Ru2 O4 59.17(15) . .
Ru1 I1 Ru2 O3 -30.80(14) . .
Ru1 I1 Ru2 Ru2 -147.4(4) . 2_655
C41 N6 Ru3 O6 -48(4) . .
C41 N6 Ru3 N5 86.3(6) . .
C41 N6 Ru3 O5 -91.1(6) . .
C41 N6 Ru3 Ru3 0.0(6) . 2_576
C41 N6 Ru3 I2 175.5(6) . .
C41 O6 Ru3 N6 54(4) 2_576 .
C41 O6 Ru3 N5 -80.8(5) 2_576 .
C41 O6 Ru3 O5 96.7(5) 2_576 .
C41 O6 Ru3 Ru3 5.7(5) 2_576 2_576
C41 O6 Ru3 I2 -169.9(5) 2_576 .
C33 N5 Ru3 N6 -85.5(6) 2_576 .
C33 N5 Ru3 O6 92.2(6) 2_576 .
C33 N5 Ru3 O5 53(3) 2_576 .
C33 N5 Ru3 Ru3 1.0(5) 2_576 2_576
C33 N5 Ru3 I2 -176.6(5) 2_576 .
C33 O5 Ru3 N6 80.5(5) . .
C33 O5 Ru3 O6 -97.3(5) . .
C33 O5 Ru3 N5 -58(3) . .
C33 O5 Ru3 Ru3 -6.3(5) . 2_576
C33 O5 Ru3 I2 171.6(5) . .
Ru4 I2 Ru3 N6 138.92(16) . .
Ru4 I2 Ru3 O6 -38.85(14) . .
Ru4 I2 Ru3 N5 -126.94(15) . .
Ru4 I2 Ru3 O5 50.07(14) . .
Ru4 I2 Ru3 Ru3 -156.0(5) . 2_576
C57 O8 Ru4 N7 -21(7) . .
C57 O8 Ru4 O7 87.4(5) . .
C57 O8 Ru4 N8 -90.9(5) . .
C57 O8 Ru4 Ru4 -1.7(5) . 2_566
C57 O8 Ru4 I2 177.9(5) . .
C57 N7 Ru4 O8 19(7) 2_566 .
C57 N7 Ru4 O7 -89.3(6) 2_566 .
C57 N7 Ru4 N8 88.9(6) 2_566 .
C57 N7 Ru4 Ru4 -0.3(5) 2_566 2_566
C57 N7 Ru4 I2 -179.9(5) 2_566 .
C49 O7 Ru4 O8 -94.3(5) . .
C49 O7 Ru4 N7 84.0(5) . .
C49 O7 Ru4 N8 -43(5) . .
C49 O7 Ru4 Ru4 -3.0(5) . 2_566
C49 O7 Ru4 I2 176.5(5) . .
C49 N8 Ru4 O8 91.7(5) 2_566 .
C49 N8 Ru4 N7 -86.7(5) 2_566 .
C49 N8 Ru4 O7 40(5) 2_566 .
C49 N8 Ru4 Ru4 0.3(5) 2_566 2_566
C49 N8 Ru4 I2 -179.1(5) 2_566 .
Ru3 I2 Ru4 O8 -177.43(13) . .
Ru3 I2 Ru4 N7 3.14(16) . .
Ru3 I2 Ru4 O7 -87.53(15) . .
Ru3 I2 Ru4 N8 93.88(15) . .
Ru3 I2 Ru4 Ru4 -33(4) . 2_566
