#------------------------------------------------------------------------------
#$Date: 2016-03-21 10:23:07 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178648 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/59/4075939.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_4075939
loop_
_publ_author_name
'Takao, Toshiro'
'Kawashima, Takashi'
'Matsubara, Kouki'
'Suzuki, Hiroharu'
_publ_section_title
;
 Synthesis and Structure of a Triruthenium Complex Containing a
 Perpendicularly Coordinated\m3-\h2:\h2(&#x22A5;)-Nitrile Ligand and Its
 Protonation To Yield a Perpendicularly Coordinated Iminoacyl Ligand
;
_journal_issue                   14
_journal_name_full               Organometallics
_journal_page_first              3371
_journal_paper_doi               10.1021/om050320x
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C37 H53 N Ru3'
_chemical_formula_weight         815.01
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           12
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 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                 106.663(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.354(2)
_cell_length_b                   18.293(3)
_cell_length_c                   11.311(2)
_cell_measurement_reflns_used    20345
_cell_measurement_temperature    153(2)
_cell_measurement_theta_max      30.03
_cell_measurement_theta_min      3.31
_cell_volume                     3440.0(9)
_computing_cell_refinement       PROCESS-AUTO
_computing_data_collection       'PROCESS-AUTO (Rigaku, 1998)'
_computing_data_reduction        'SHELXS-97 (Sheldrick, 1990)'
_computing_molecular_graphics    'ORTEX (P.McArdle, 1995)'
_computing_publication_material  SHELXL-97
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    SHELXS-97
_diffrn_ambient_temperature      153(2)
_diffrn_detector_area_resol_mean 10
_diffrn_measured_fraction_theta_full 0.993
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID Imaging Plate'
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Rigaku Rotating Anode Ultrax18'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0219
_diffrn_reflns_av_sigmaI/netI    0.0180
_diffrn_reflns_limit_h_max       24
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       25
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            20345
_diffrn_reflns_theta_full        30.03
_diffrn_reflns_theta_max         30.03
_diffrn_reflns_theta_min         3.31
_exptl_absorpt_coefficient_mu    1.325
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.7430
_exptl_absorpt_correction_type   empirical
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.574
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1656
_exptl_crystal_size_max          0.400
_exptl_crystal_size_mid          0.400
_exptl_crystal_size_min          0.300
_refine_diff_density_max         5.087
_refine_diff_density_min         -0.810
_refine_diff_density_rms         0.130
_refine_ls_extinction_coef       0.00078(15)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.053
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     153
_refine_ls_number_reflns         5149
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.053
_refine_ls_R_factor_all          0.0405
_refine_ls_R_factor_gt           0.0381
_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)+(0.0481P)²+20.4362P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0992
_refine_ls_wR_factor_ref         0.1006
_reflns_number_gt                4836
_reflns_number_total             5174
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om050320xsi20050421_111633.cif
_cod_data_source_block           3a
_cod_depositor_comments
;
The following automatic conversions were performed:
'_atom_site_symetry_multiplicity' tag replaced with
'_atom_site_symmetry_multiplicity'.

Automatic conversion script
Id: cif_correct_tags 1440 2010-10-19 06:21:57Z saulius 

The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Empirical'
changed to 'empirical' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_cell_volume        3439.7(10)
_cod_original_sg_symbol_H-M      C2/m
_cod_database_code               4075939
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'x, -y, z'
'x+1/2, y+1/2, z'
'x+1/2, -y+1/2, z'
'-x, -y, -z'
'-x, y, -z'
'-x+1/2, -y+1/2, -z'
'-x+1/2, y+1/2, -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
_atom_site_disorder_group
Ru1 Ru 0.653391(18) 0.5000 0.31047(3) 0.01872(9) Uani 1 2 d S .
Ru2 Ru 0.760607(13) 0.580259(12) 0.22287(2) 0.01990(9) Uani 1 1 d . .
N1 N 0.8341(2) 0.5000 0.3149(3) 0.0249(7) Uani 1 2 d S .
C1 C 0.7807(3) 0.5000 0.3824(4) 0.0262(8) Uani 1 2 d S .
C2 C 0.8154(3) 0.5000 0.5183(4) 0.0244(8) Uani 1 2 d S .
C3 C 0.8330(2) 0.5650(2) 0.5829(3) 0.0380(8) Uani 1 1 d . .
H3 H 0.8195 0.6101 0.5403 0.046 Uiso 1 1 calc R .
C4 C 0.8701(3) 0.5653(3) 0.7089(4) 0.0517(12) Uani 1 1 d . .
H4 H 0.8825 0.6104 0.7518 0.062 Uiso 1 1 calc R .
C5 C 0.88928(7) 0.5000 0.77209(11) 0.0485(16) Uani 1 2 d S .
H5 H 0.9154 0.5000 0.8583 0.058 Uiso 1 2 calc SR .
C6 C 0.52202(7) 0.5115 0.26078(11) 0.0269(11) Uiso 0.50 1 d PR 1
C7 C 0.56083(7) 0.5621 0.35769(11) 0.0277(12) Uiso 0.50 1 d PR 1
C8 C 0.60322(7) 0.5229 0.46403(11) 0.0265(12) Uiso 0.50 1 d PR 1
C9 C 0.46659(7) 0.5269 0.13454(11) 0.051(2) Uiso 0.50 1 d PR 1
C10 C 0.54642(7) 0.6432 0.34379(11) 0.062(3) Uiso 0.50 1 d PR 1
C11 C 0.64363(7) 0.5539 0.58781(11) 0.0495(19) Uiso 0.50 1 d PR 1
C7A C 0.54290(7) 0.5598 0.30988(11) 0.0166(9) Uiso 0.50 1 d PR 2
C8A C 0.59133(7) 0.5530 0.43232(11) 0.0198(9) Uiso 0.50 1 d PR 2
C10A C 0.51333(7) 0.6319 0.24655(11) 0.0373(15) Uiso 0.50 1 d PR 2
C11A C 0.62096(7) 0.6148 0.52481(11) 0.0375(15) Uiso 0.50 1 d PR 2
C12 C 0.71679(7) 0.6796 0.11386(11) 0.0255(6) Uani 1 1 d R .
C13 C 0.76617(7) 0.6393 0.05709(11) 0.0404(9) Uani 1 1 d R .
C14 C 0.84413(7) 0.6347 0.14027(11) 0.0474(11) Uani 1 1 d R .
C15 C 0.84286(7) 0.6705 0.25114(11) 0.0412(9) Uani 1 1 d R .
C16 C 0.76364(7) 0.6983 0.23556(11) 0.0281(6) Uani 1 1 d R .
C17 C 0.63252(7) 0.7031 0.05219(11) 0.0536(12) Uani 1 1 d R .
H17A H 0.6084 0.7227 0.1141 0.080 Uiso 1 1 calc R .
H17B H 0.6011 0.6611 0.0109 0.080 Uiso 1 1 calc R .
H17C H 0.6327 0.7411 -0.0089 0.080 Uiso 1 1 calc R .
C18 C 0.7391(6) 0.6117(3) -0.0743(4) 0.095(3) Uani 1 1 d . .
H18A H 0.6827 0.5965 -0.0947 0.142 Uiso 1 1 calc R .
H18B H 0.7724 0.5699 -0.0831 0.142 Uiso 1 1 calc R .
H18C H 0.7448 0.6508 -0.1305 0.142 Uiso 1 1 calc R .
C19 C 0.9169(4) 0.6015(4) 0.1151(9) 0.118(4) Uani 1 1 d . .
H19A H 0.9426 0.5675 0.1817 0.176 Uiso 1 1 calc R .
H19B H 0.9550 0.6402 0.1107 0.176 Uiso 1 1 calc R .
H19C H 0.9007 0.5750 0.0365 0.176 Uiso 1 1 calc R .
C20 C 0.9138(3) 0.6827(3) 0.3639(7) 0.102(3) Uani 1 1 d . .
H20A H 0.8943 0.6980 0.4333 0.153 Uiso 1 1 calc R .
H20B H 0.9486 0.7208 0.3463 0.153 Uiso 1 1 calc R .
H20C H 0.9443 0.6371 0.3851 0.153 Uiso 1 1 calc R .
C21 C 0.7358(4) 0.7443(2) 0.3240(4) 0.0579(14) Uani 1 1 d . .
H21A H 0.7636 0.7292 0.4087 0.087 Uiso 1 1 calc R .
H21B H 0.6776 0.7382 0.3088 0.087 Uiso 1 1 calc R .
H21C H 0.7478 0.7957 0.3128 0.087 Uiso 1 1 calc R .
H1 H 0.679(9) 0.5000 0.129(15) 0.19(6) Uiso 1 2 d S .
H2 H 0.672(3) 0.578(3) 0.229(5) 0.061(16) Uiso 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'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
C1 Ru1 C7 132.23(9) . 2_565
C1 Ru1 C7 132.23(9) . .
C7 Ru1 C7 63.6 2_565 .
C1 Ru1 C8 107.59(13) . 2_565
C7 Ru1 C8 37.9 2_565 2_565
C7 Ru1 C8 54.0 . 2_565
C1 Ru1 C8 107.59(13) . .
C7 Ru1 C8 54.0 2_565 .
C7 Ru1 C8 37.9 . .
C8 Ru1 C8 22.0 2_565 .
C1 Ru1 C6 170.92(10) . 2_565
C7 Ru1 C6 38.8 2_565 2_565
C7 Ru1 C6 47.2 . 2_565
C8 Ru1 C6 64.3 2_565 2_565
C8 Ru1 C6 66.6 . 2_565
C1 Ru1 C6 170.92(10) . .
C7 Ru1 C6 47.2 2_565 .
C7 Ru1 C6 38.8 . .
C8 Ru1 C6 66.6 2_565 .
C8 Ru1 C6 64.3 . .
C6 Ru1 C6 10.9 2_565 .
C1 Ru1 C8A 113.70(11) . 2_565
C7 Ru1 C8A 23.1 2_565 2_565
C7 Ru1 C8A 62.9 . 2_565
C8 Ru1 C8A 17.2 2_565 2_565
C8 Ru1 C8A 38.1 . 2_565
C6 Ru1 C8A 57.3 2_565 2_565
C6 Ru1 C8A 62.9 . 2_565
C1 Ru1 C8A 113.70(11) . .
C7 Ru1 C8A 62.9 2_565 .
C7 Ru1 C8A 23.1 . .
C8 Ru1 C8A 38.1 2_565 .
C8 Ru1 C8A 17.2 . .
C6 Ru1 C8A 62.9 2_565 .
C6 Ru1 C8A 57.3 . .
C8A Ru1 C8A 52.3 2_565 .
C1 Ru1 C7A 143.98(7) . 2_565
C7 Ru1 C7A 14.2 2_565 2_565
C7 Ru1 C7A 63.5 . 2_565
C8 Ru1 C7A 50.7 2_565 2_565
C8 Ru1 C7A 63.6 . 2_565
C6 Ru1 C7A 27.7 2_565 2_565
C6 Ru1 C7A 37.7 . 2_565
C8A Ru1 C7A 37.2 2_565 2_565
C8A Ru1 C7A 68.9 . 2_565
C1 Ru1 C7A 143.98(7) . .
C7 Ru1 C7A 63.5 2_565 .
C7 Ru1 C7A 14.2 . .
C8 Ru1 C7A 63.6 2_565 .
C8 Ru1 C7A 50.7 . .
C6 Ru1 C7A 37.7 2_565 .
C6 Ru1 C7A 27.7 . .
C8A Ru1 C7A 68.9 2_565 .
C8A Ru1 C7A 37.2 . .
C7A Ru1 C7A 59.5 2_565 .
C1 Ru1 Ru2 53.47(9) . .
C7 Ru1 Ru2 173.50(4) 2_565 .
C7 Ru1 Ru2 115.74(2) . .
C8 Ru1 Ru2 147.63(3) 2_565 .
C8 Ru1 Ru2 129.96(2) . .
C6 Ru1 Ru2 135.59(3) 2_565 .
C6 Ru1 Ru2 127.81(2) . .
C8A Ru1 Ru2 163.21(3) 2_565 .
C8A Ru1 Ru2 119.345(19) . .
C7A Ru1 Ru2 159.26(4) 2_565 .
C7A Ru1 Ru2 114.13(2) . .
N1 Ru2 C15 100.77(9) . .
N1 Ru2 C16 133.58(8) . .
C15 Ru2 C16 38.7 . .
N1 Ru2 C14 98.83(11) . .
C15 Ru2 C14 38.4 . .
C16 Ru2 C14 64.3 . .
N1 Ru2 C13 128.43(11) . .
C15 Ru2 C13 63.7 . .
C16 Ru2 C13 63.8 . .
C14 Ru2 C13 37.7 . .
N1 Ru2 C12 161.77(11) . .
C15 Ru2 C12 63.7 . .
C16 Ru2 C12 38.1 . .
C14 Ru2 C12 63.2 . .
C13 Ru2 C12 37.6 . .
N1 Ru2 C1 36.25(16) . .
C15 Ru2 C1 115.73(10) . .
C16 Ru2 C1 126.61(8) . .
C14 Ru2 C1 131.75(13) . .
C13 Ru2 C1 164.42(11) . .
C12 Ru2 C1 157.75(10) . .
N1 Ru2 Ru1 79.65(10) . .
C15 Ru2 Ru1 147.34(3) . .
C16 Ru2 Ru1 120.78(3) . .
C14 Ru2 Ru1 174.22(2) . .
C13 Ru2 Ru1 140.13(3) . .
C12 Ru2 Ru1 118.55(3) . .
C1 Ru2 Ru1 48.66(12) . .
N1 Ru2 Ru2 43.56(8) . 2_565
C15 Ru2 Ru2 140.29(3) . 2_565
C16 Ru2 Ru2 176.34(3) . 2_565
C14 Ru2 Ru2 117.212(16) . 2_565
C13 Ru2 Ru2 119.540(18) . 2_565
C12 Ru2 Ru2 145.48(3) . 2_565
C1 Ru2 Ru2 49.79(7) . 2_565
Ru1 Ru2 Ru2 57.955(8) . 2_565
C1 N1 Ru2 81.9(2) . 2_565
C1 N1 Ru2 81.87(19) . .
Ru2 N1 Ru2 92.88(15) 2_565 .
N1 C1 C2 116.3(4) . .
N1 C1 Ru1 125.9(3) . .
C2 C1 Ru1 117.8(3) . .
N1 C1 Ru2 61.88(17) . 2_565
C2 C1 Ru2 138.38(10) . 2_565
Ru1 C1 Ru2 77.88(13) . 2_565
N1 C1 Ru2 61.88(17) . .
C2 C1 Ru2 138.38(10) . .
Ru1 C1 Ru2 77.88(13) . .
Ru2 C1 Ru2 80.42(14) 2_565 .
C3 C2 C3 118.5(4) . 2_565
C3 C2 C1 120.7(2) . .
C3 C2 C1 120.7(2) 2_565 .
C2 C3 C4 121.0(4) . .
C5 C4 C3 120.0(4) . .
C4 C5 C4 119.5(3) 2_565 .
C6 C6 C7 129.9 2_565 .
C6 C6 C9 100.8 2_565 .
C7 C6 C9 129.2 . .
C6 C6 C9 64.6 2_565 2_565
C7 C6 C9 165.3 . 2_565
C9 C6 C9 36.2 . 2_565
C6 C6 C7 39.5 2_565 2_565
C7 C6 C7 90.4 . 2_565
C9 C6 C7 140.2 . 2_565
C9 C6 C7 104.1 2_565 2_565
C6 C6 Ru1 84.5 2_565 .
C7 C6 Ru1 69.1 . .
C9 C6 Ru1 126.6 . .
C9 C6 Ru1 119.4 2_565 .
C7 C6 Ru1 65.2 2_565 .
C8 C7 C6 109.6 . .
C8 C7 C10 128.3 . .
C6 C7 C10 121.7 . .
C8 C7 C6 99.0 . 2_565
C6 C7 C6 10.6 . 2_565
C10 C7 C6 132.2 . 2_565
C8 C7 C8 21.4 . 2_565
C6 C7 C8 88.2 . 2_565
C10 C7 C8 149.5 . 2_565
C6 C7 C8 77.6 2_565 2_565
C8 C7 Ru1 72.5 . .
C6 C7 Ru1 72.1 . .
C10 C7 Ru1 127.4 . .
C6 C7 Ru1 67.6 2_565 .
C8 C7 Ru1 64.0 2_565 .
C8 C8 C7 120.5 2_565 .
C8 C8 C11 112.4 2_565 .
C7 C8 C11 126.7 . .
C8 C8 C11 44.4 2_565 2_565
C7 C8 C11 164.2 . 2_565
C11 C8 C11 68.1 . 2_565
C8 C8 C7 38.0 2_565 2_565
C7 C8 C7 82.5 . 2_565
C11 C8 C7 150.1 . 2_565
C11 C8 C7 82.3 2_565 2_565
C8 C8 Ru1 79.0 2_565 .
C7 C8 Ru1 69.6 . .
C11 C8 Ru1 129.1 . .
C11 C8 Ru1 106.6 2_565 .
C7 C8 Ru1 62.0 2_565 .
C9 C9 C6 79.2 2_565 .
C9 C9 C6 64.6 2_565 2_565
C6 C9 C6 14.6 . 2_565
C8 C11 C8 23.2 . 2_565
C8 C11 C11 67.6 . 2_565
C8 C11 C11 44.4 2_565 2_565
C8A C7A C10A 124.6 . .
C8A C7A Ru1 71.3 . .
C10A C7A Ru1 127.5 . .
C7A C8A C11A 126.8 . .
C7A C8A C8A 95.1 . 2_565
C11A C8A C8A 137.8 . 2_565
C7A C8A Ru1 71.6 . .
C11A C8A Ru1 128.8 . .
C8A C8A Ru1 63.9 2_565 .
C13 C12 C16 108.1 . .
C13 C12 C17 125.3 . .
C16 C12 C17 126.4 . .
C13 C12 Ru2 70.6 . .
C16 C12 Ru2 69.4 . .
C17 C12 Ru2 129.4 . .
C14 C13 C12 108.5 . .
C14 C13 C18 127.1(3) . .
C12 C13 C18 124.2(3) . .
C14 C13 Ru2 70.7 . .
C12 C13 Ru2 71.8 . .
C18 C13 Ru2 126.9(2) . .
C13 C14 C15 107.9 . .
C13 C14 C19 126.6(4) . .
C15 C14 C19 125.5(4) . .
C13 C14 Ru2 71.6 . .
C15 C14 Ru2 69.6 . .
C19 C14 Ru2 126.6(2) . .
C14 C15 C16 108.2 . .
C14 C15 C20 126.7(4) . .
C16 C15 C20 124.9(4) . .
C14 C15 Ru2 72.1 . .
C16 C15 Ru2 71.3 . .
C20 C15 Ru2 125.8(2) . .
C12 C16 C15 107.2 . .
C12 C16 C21 125.4(2) . .
C15 C16 C21 127.2(2) . .
C12 C16 Ru2 72.5 . .
C15 C16 Ru2 69.9 . .
C21 C16 Ru2 127.00(17) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ru1 C1 2.125(5) .
Ru1 C7 2.1560(10) 2_565
Ru1 C7 2.1560(10) .
Ru1 C8 2.1947(12) 2_565
Ru1 C8 2.1947(12) .
Ru1 C6 2.1960(13) 2_565
Ru1 C6 2.1960(13) .
Ru1 C8A 2.2026(11) 2_565
Ru1 C8A 2.2026(11) .
Ru1 C7A 2.2060(11) 2_565
Ru1 C7A 2.2060(11) .
Ru1 Ru2 2.7670(4) .
Ru2 N1 2.026(3) .
Ru2 C15 2.1450 .
Ru2 C16 2.1631 .
Ru2 C14 2.1775(11) .
Ru2 C13 2.1896(11) .
Ru2 C12 2.2047 .
Ru2 C1 2.274(3) .
Ru2 Ru2 2.9363(7) 2_565
N1 C1 1.358(6) .
N1 Ru2 2.026(3) 2_565
C1 C2 1.481(6) .
C1 Ru2 2.274(3) 2_565
C2 C3 1.384(4) .
C2 C3 1.384(4) 2_565
C3 C4 1.384(5) .
C4 C5 1.384(5) .
C5 C4 1.384(5) 2_565
C6 C6 0.4190 2_565
C6 C7 1.4459 .
C6 C9 1.5019 .
C6 C9 1.6332 2_565
C6 C7 1.7444 2_565
C7 C8 1.4126 .
C7 C10 1.5044 .
C7 C6 1.7444 2_565
C7 C8 1.9743 2_565
C8 C8 0.8370 2_565
C8 C11 1.4870 .
C8 C11 1.9652 2_565
C8 C7 1.9743 2_565
C9 C9 0.9823 2_565
C9 C6 1.6332 2_565
C11 C8 1.9652 2_565
C11 C11 1.9724 2_565
C7A C8A 1.4044 .
C7A C10A 1.5186 .
C8A C11A 1.5260 .
C8A C8A 1.9399 2_565
C12 C13 1.4160 .
C12 C16 1.4251 .
C12 C17 1.4920 .
C13 C14 1.4116 .
C13 C18 1.511(5) .
C14 C15 1.4202 .
C14 C19 1.500(5) .
C15 C16 1.4286 .
C15 C20 1.513(5) .
C16 C21 1.490(4) .
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
C1 Ru1 Ru2 N1 21.37(13) . .
C7 Ru1 Ru2 N1 -131.07(18) 2_565 .
C7 Ru1 Ru2 N1 146.23(9) . .
C8 Ru1 Ru2 N1 83.57(10) 2_565 .
C8 Ru1 Ru2 N1 103.89(10) . .
C6 Ru1 Ru2 N1 -159.56(9) 2_565 .
C6 Ru1 Ru2 N1 -169.92(9) . .
C8A Ru1 Ru2 N1 65.03(11) 2_565 .
C8A Ru1 Ru2 N1 120.43(9) . .
C7A Ru1 Ru2 N1 -131.02(10) 2_565 .
C7A Ru1 Ru2 N1 161.83(9) . .
C1 Ru1 Ru2 C15 -72.47(11) . .
C7 Ru1 Ru2 C15 135.08(19) 2_565 .
C7 Ru1 Ru2 C15 52.38(4) . .
C8 Ru1 Ru2 C15 -10.28(4) 2_565 .
C8 Ru1 Ru2 C15 10.04(3) . .
C6 Ru1 Ru2 C15 106.59(5) 2_565 .
C6 Ru1 Ru2 C15 96.24(5) . .
C8A Ru1 Ru2 C15 -28.82(6) 2_565 .
C8A Ru1 Ru2 C15 26.58(3) . .
C7A Ru1 Ru2 C15 135.13(8) 2_565 .
C7A Ru1 Ru2 C15 67.98(4) . .
C1 Ru1 Ru2 C16 -113.61(11) . .
C7 Ru1 Ru2 C16 93.95(17) 2_565 .
C7 Ru1 Ru2 C16 11.25(2) . .
C8 Ru1 Ru2 C16 -51.41(4) 2_565 .
C8 Ru1 Ru2 C16 -31.09(2) . .
C6 Ru1 Ru2 C16 65.46(3) 2_565 .
C6 Ru1 Ru2 C16 55.10(3) . .
C8A Ru1 Ru2 C16 -69.95(6) 2_565 .
C8A Ru1 Ru2 C16 -14.55(2) . .
C7A Ru1 Ru2 C16 94.00(7) 2_565 .
C7A Ru1 Ru2 C16 26.85(2) . .
C1 Ru1 Ru2 C14 96.6(3) . .
C7 Ru1 Ru2 C14 -55.8(3) 2_565 .
C7 Ru1 Ru2 C14 -138.5(3) . .
C8 Ru1 Ru2 C14 158.8(3) 2_565 .
C8 Ru1 Ru2 C14 179(19) . .
C6 Ru1 Ru2 C14 -84.3(3) 2_565 .
C6 Ru1 Ru2 C14 -94.7(3) . .
C8A Ru1 Ru2 C14 140.3(3) 2_565 .
C8A Ru1 Ru2 C14 -164.3(3) . .
C7A Ru1 Ru2 C14 -55.8(3) 2_565 .
C7A Ru1 Ru2 C14 -122.9(3) . .
C1 Ru1 Ru2 C13 161.46(11) . .
C7 Ru1 Ru2 C13 9.01(15) 2_565 .
C7 Ru1 Ru2 C13 -73.69(4) . .
C8 Ru1 Ru2 C13 -136.35(6) 2_565 .
C8 Ru1 Ru2 C13 -116.03(5) . .
C6 Ru1 Ru2 C13 -19.48(3) 2_565 .
C6 Ru1 Ru2 C13 -29.83(3) . .
C8A Ru1 Ru2 C13 -154.89(9) 2_565 .
C8A Ru1 Ru2 C13 -99.49(5) . .
C7A Ru1 Ru2 C13 9.06(4) 2_565 .
C7A Ru1 Ru2 C13 -58.09(4) . .
C1 Ru1 Ru2 C12 -157.63(11) . .
C7 Ru1 Ru2 C12 49.93(16) 2_565 .
C7 Ru1 Ru2 C12 -32.78(2) . .
C8 Ru1 Ru2 C12 -95.43(4) 2_565 .
C8 Ru1 Ru2 C12 -75.11(3) . .
C6 Ru1 Ru2 C12 21.44(2) 2_565 .
C6 Ru1 Ru2 C12 11.08(2) . .
C8A Ru1 Ru2 C12 -113.97(7) 2_565 .
C8A Ru1 Ru2 C12 -58.57(3) . .
C7A Ru1 Ru2 C12 49.97(5) 2_565 .
C7A Ru1 Ru2 C12 -17.170(19) . .
C7 Ru1 Ru2 C1 -152.45(19) 2_565 .
C7 Ru1 Ru2 C1 124.85(11) . .
C8 Ru1 Ru2 C1 62.20(11) 2_565 .
C8 Ru1 Ru2 C1 82.52(11) . .
C6 Ru1 Ru2 C1 179.07(11) 2_565 .
C6 Ru1 Ru2 C1 168.71(11) . .
C8A Ru1 Ru2 C1 43.66(12) 2_565 .
C8A Ru1 Ru2 C1 99.06(11) . .
C7A Ru1 Ru2 C1 -152.40(11) 2_565 .
C7A Ru1 Ru2 C1 140.46(11) . .
C1 Ru1 Ru2 Ru2 62.37(10) . 2_565
C7 Ru1 Ru2 Ru2 -90.08(16) 2_565 2_565
C7 Ru1 Ru2 Ru2 -172.78(4) . 2_565
C8 Ru1 Ru2 Ru2 124.57(5) 2_565 2_565
C8 Ru1 Ru2 Ru2 144.89(4) . 2_565
C6 Ru1 Ru2 Ru2 -118.56(4) 2_565 2_565
C6 Ru1 Ru2 Ru2 -128.92(4) . 2_565
C8A Ru1 Ru2 Ru2 106.03(7) 2_565 2_565
C8A Ru1 Ru2 Ru2 161.43(4) . 2_565
C7A Ru1 Ru2 Ru2 -90.03(5) 2_565 2_565
C7A Ru1 Ru2 Ru2 -157.17(4) . 2_565
C15 Ru2 N1 C1 119.20(17) . .
C16 Ru2 N1 C1 95.4(2) . .
C14 Ru2 N1 C1 158.09(17) . .
C13 Ru2 N1 C1 -175.89(15) . .
C12 Ru2 N1 C1 149.6(3) . .
Ru1 Ru2 N1 C1 -27.56(16) . .
Ru2 Ru2 N1 C1 -81.4(2) 2_565 .
C15 Ru2 N1 Ru2 -159.44(10) . 2_565
C16 Ru2 N1 Ru2 176.78(5) . 2_565
C14 Ru2 N1 Ru2 -120.54(11) . 2_565
C13 Ru2 N1 Ru2 -94.53(13) . 2_565
C12 Ru2 N1 Ru2 -129.0(2) . 2_565
C1 Ru2 N1 Ru2 81.4(2) . 2_565
Ru1 Ru2 N1 Ru2 53.80(10) . 2_565
Ru2 N1 C1 C2 132.94(6) 2_565 .
Ru2 N1 C1 C2 -132.94(6) . .
Ru2 N1 C1 Ru1 -47.06(6) 2_565 .
Ru2 N1 C1 Ru1 47.06(6) . .
Ru2 N1 C1 Ru2 94.12(13) . 2_565
Ru2 N1 C1 Ru2 -94.12(13) 2_565 .
C7 Ru1 C1 N1 134.62(9) 2_565 .
C7 Ru1 C1 N1 -134.62(9) . .
C8 Ru1 C1 N1 168.461(11) 2_565 .
C8 Ru1 C1 N1 -168.461(11) . .
C6 Ru1 C1 N1 142.8(5) 2_565 .
C6 Ru1 C1 N1 -142.8(5) . .
C8A Ru1 C1 N1 151.25(3) 2_565 .
C8A Ru1 C1 N1 -151.25(3) . .
C7A Ru1 C1 N1 122.47(15) 2_565 .
C7A Ru1 C1 N1 -122.47(15) . .
Ru2 Ru1 C1 N1 -41.33(6) . .
C7 Ru1 C1 C2 -45.38(9) 2_565 .
C7 Ru1 C1 C2 45.38(9) . .
C8 Ru1 C1 C2 -11.539(11) 2_565 .
C8 Ru1 C1 C2 11.539(11) . .
C6 Ru1 C1 C2 -37.2(5) 2_565 .
C6 Ru1 C1 C2 37.2(5) . .
C8A Ru1 C1 C2 -28.75(3) 2_565 .
C8A Ru1 C1 C2 28.75(3) . .
C7A Ru1 C1 C2 -57.53(15) 2_565 .
C7A Ru1 C1 C2 57.53(15) . .
Ru2 Ru1 C1 C2 138.67(6) . .
C7 Ru1 C1 Ru2 93.29(14) 2_565 2_565
C7 Ru1 C1 Ru2 -175.94(4) . 2_565
C8 Ru1 C1 Ru2 127.14(7) 2_565 2_565
C8 Ru1 C1 Ru2 150.21(5) . 2_565
C6 Ru1 C1 Ru2 101.5(5) 2_565 2_565
C6 Ru1 C1 Ru2 175.9(4) . 2_565
C8A Ru1 C1 Ru2 109.93(9) 2_565 2_565
C8A Ru1 C1 Ru2 167.42(4) . 2_565
C7A Ru1 C1 Ru2 81.1(2) 2_565 2_565
C7A Ru1 C1 Ru2 -163.80(10) . 2_565
Ru2 Ru1 C1 Ru2 -82.65(12) . 2_565
C7 Ru1 C1 Ru2 175.94(4) 2_565 .
C7 Ru1 C1 Ru2 -93.29(14) . .
C8 Ru1 C1 Ru2 -150.21(5) 2_565 .
C8 Ru1 C1 Ru2 -127.14(7) . .
C6 Ru1 C1 Ru2 -175.9(4) 2_565 .
C6 Ru1 C1 Ru2 -101.5(5) . .
C8A Ru1 C1 Ru2 -167.42(4) 2_565 .
C8A Ru1 C1 Ru2 -109.93(9) . .
C7A Ru1 C1 Ru2 163.80(10) 2_565 .
C7A Ru1 C1 Ru2 -81.1(2) . .
C15 Ru2 C1 N1 -72.16(18) . .
C16 Ru2 C1 N1 -116.05(16) . .
C14 Ru2 C1 N1 -29.6(2) . .
C13 Ru2 C1 N1 12.1(5) . .
C12 Ru2 C1 N1 -155.3(2) . .
Ru1 Ru2 C1 N1 142.7(2) . .
Ru2 Ru2 C1 N1 63.14(16) 2_565 .
N1 Ru2 C1 C2 98.9(5) . .
C15 Ru2 C1 C2 26.8(5) . .
C16 Ru2 C1 C2 -17.1(6) . .
C14 Ru2 C1 C2 69.3(5) . .
C13 Ru2 C1 C2 111.0(4) . .
C12 Ru2 C1 C2 -56.4(7) . .
Ru1 Ru2 C1 C2 -118.4(5) . .
Ru2 Ru2 C1 C2 162.1(6) 2_565 .
N1 Ru2 C1 Ru1 -142.7(2) . .
C15 Ru2 C1 Ru1 145.16(5) . .
C16 Ru2 C1 Ru1 101.28(10) . .
C14 Ru2 C1 Ru1 -172.29(4) . .
C13 Ru2 C1 Ru1 -130.6(3) . .
C12 Ru2 C1 Ru1 62.0(3) . .
Ru2 Ru2 C1 Ru1 -79.54(10) 2_565 .
N1 Ru2 C1 Ru2 -63.14(16) . 2_565
C15 Ru2 C1 Ru2 -135.30(7) . 2_565
C16 Ru2 C1 Ru2 -179.18(4) . 2_565
C14 Ru2 C1 Ru2 -92.75(12) . 2_565
C13 Ru2 C1 Ru2 -51.1(4) . 2_565
C12 Ru2 C1 Ru2 141.54(18) . 2_565
Ru1 Ru2 C1 Ru2 79.54(10) . 2_565
N1 C1 C2 C3 89.1(4) . .
Ru1 C1 C2 C3 -90.9(4) . .
Ru2 C1 C2 C3 165.5(4) 2_565 .
Ru2 C1 C2 C3 12.7(7) . .
N1 C1 C2 C3 -89.1(4) . 2_565
Ru1 C1 C2 C3 90.9(4) . 2_565
Ru2 C1 C2 C3 -12.7(7) 2_565 2_565
Ru2 C1 C2 C3 -165.5(4) . 2_565
C3 C2 C3 C4 2.3(8) 2_565 .
C1 C2 C3 C4 -175.9(4) . .
C2 C3 C4 C5 -0.8(7) . .
C3 C4 C5 C4 -0.8(7) . 2_565
C1 Ru1 C6 C6 -126.8(5) . 2_565
C7 Ru1 C6 C6 -35.9 2_565 2_565
C7 Ru1 C6 C6 -136.5 . 2_565
C8 Ru1 C6 C6 -75.5 2_565 2_565
C8 Ru1 C6 C6 -99.6 . 2_565
C8A Ru1 C6 C6 -56.9 2_565 2_565
C8A Ru1 C6 C6 -117.7 . 2_565
C7A Ru1 C6 C6 -20.2 2_565 2_565
C7A Ru1 C6 C6 -153.0 . 2_565
Ru2 Ru1 C6 C6 138.51(3) . 2_565
C1 Ru1 C6 C7 9.7(5) . .
C7 Ru1 C6 C7 100.6 2_565 .
C8 Ru1 C6 C7 61.0 2_565 .
C8 Ru1 C6 C7 37.0 . .
C6 Ru1 C6 C7 136.5 2_565 .
C8A Ru1 C6 C7 79.6 2_565 .
C8A Ru1 C6 C7 18.9 . .
C7A Ru1 C6 C7 116.4 2_565 .
C7A Ru1 C6 C7 -16.4 . .
Ru2 Ru1 C6 C7 -84.95(2) . .
C1 Ru1 C6 C9 133.7(5) . .
C7 Ru1 C6 C9 -135.3 2_565 .
C7 Ru1 C6 C9 124.1 . .
C8 Ru1 C6 C9 -174.9 2_565 .
C8 Ru1 C6 C9 161.0 . .
C6 Ru1 C6 C9 -99.4 2_565 .
C8A Ru1 C6 C9 -156.3 2_565 .
C8A Ru1 C6 C9 142.9 . .
C7A Ru1 C6 C9 -119.6 2_565 .
C7A Ru1 C6 C9 107.6 . .
Ru2 Ru1 C6 C9 39.10(3) . .
C1 Ru1 C6 C9 176.4(5) . 2_565
C7 Ru1 C6 C9 -92.7 2_565 2_565
C7 Ru1 C6 C9 166.7 . 2_565
C8 Ru1 C6 C9 -132.2 2_565 2_565
C8 Ru1 C6 C9 -156.3 . 2_565
C6 Ru1 C6 C9 -56.7 2_565 2_565
C8A Ru1 C6 C9 -113.6 2_565 2_565
C8A Ru1 C6 C9 -174.4 . 2_565
C7A Ru1 C6 C9 -76.9 2_565 2_565
C7A Ru1 C6 C9 150.3 . 2_565
Ru2 Ru1 C6 C9 81.783(19) . 2_565
C1 Ru1 C6 C7 -90.9(5) . 2_565
C7 Ru1 C6 C7 -100.6 . 2_565
C8 Ru1 C6 C7 -39.6 2_565 2_565
C8 Ru1 C6 C7 -63.6 . 2_565
C6 Ru1 C6 C7 35.9 2_565 2_565
C8A Ru1 C6 C7 -21.0 2_565 2_565
C8A Ru1 C6 C7 -81.7 . 2_565
C7A Ru1 C6 C7 15.8 2_565 2_565
C7A Ru1 C6 C7 -117.0 . 2_565
Ru2 Ru1 C6 C7 174.45(3) . 2_565
C6 C6 C7 C8 -0.1 2_565 .
C9 C6 C7 C8 175.9 . .
C9 C6 C7 C8 168.7 2_565 .
C7 C6 C7 C8 -0.1 2_565 .
Ru1 C6 C7 C8 -63.3 . .
C6 C6 C7 C10 -173.5 2_565 .
C9 C6 C7 C10 2.6 . .
C9 C6 C7 C10 -4.6 2_565 .
C7 C6 C7 C10 -173.5 2_565 .
Ru1 C6 C7 C10 123.4 . .
C9 C6 C7 C6 176.1 . 2_565
C9 C6 C7 C6 168.9 2_565 2_565
C7 C6 C7 C6 0.0 2_565 2_565
Ru1 C6 C7 C6 -63.1 . 2_565
C6 C6 C7 C8 -0.1 2_565 2_565
C9 C6 C7 C8 176.0 . 2_565
C9 C6 C7 C8 168.8 2_565 2_565
C7 C6 C7 C8 -0.1 2_565 2_565
Ru1 C6 C7 C8 -63.2 . 2_565
C6 C6 C7 Ru1 63.1 2_565 .
C9 C6 C7 Ru1 -120.8 . .
C9 C6 C7 Ru1 -128.0 2_565 .
C7 C6 C7 Ru1 63.1 2_565 .
C1 Ru1 C7 C8 -59.84(12) . .
C7 Ru1 C7 C8 64.4 2_565 .
C8 Ru1 C7 C8 21.2 2_565 .
C6 Ru1 C7 C8 107.8 2_565 .
C6 Ru1 C7 C8 118.1 . .
C8A Ru1 C7 C8 38.5 2_565 .
C8A Ru1 C7 C8 -17.9 . .
C7A Ru1 C7 C8 80.3 2_565 .
C7A Ru1 C7 C8 150.4 . .
Ru2 Ru1 C7 C8 -122.79(3) . .
C1 Ru1 C7 C6 -177.94(12) . .
C7 Ru1 C7 C6 -53.7 2_565 .
C8 Ru1 C7 C6 -96.9 2_565 .
C8 Ru1 C7 C6 -118.1 . .
C6 Ru1 C7 C6 -10.2 2_565 .
C8A Ru1 C7 C6 -79.6 2_565 .
C8A Ru1 C7 C6 -136.0 . .
C7A Ru1 C7 C6 -37.8 2_565 .
C7A Ru1 C7 C6 32.3 . .
Ru2 Ru1 C7 C6 119.11(3) . .
C1 Ru1 C7 C10 65.46(13) . .
C7 Ru1 C7 C10 -170.3 2_565 .
C8 Ru1 C7 C10 146.5 2_565 .
C8 Ru1 C7 C10 125.3 . .
C6 Ru1 C7 C10 -126.9 2_565 .
C6 Ru1 C7 C10 -116.6 . .
C8A Ru1 C7 C10 163.8 2_565 .
C8A Ru1 C7 C10 107.4 . .
C7A Ru1 C7 C10 -154.4 2_565 .
C7A Ru1 C7 C10 -84.3 . .
Ru2 Ru1 C7 C10 2.51(5) . .
C1 Ru1 C7 C6 -167.69(12) . 2_565
C7 Ru1 C7 C6 -43.4 2_565 2_565
C8 Ru1 C7 C6 -86.7 2_565 2_565
C8 Ru1 C7 C6 -107.8 . 2_565
C6 Ru1 C7 C6 10.2 . 2_565
C8A Ru1 C7 C6 -69.3 2_565 2_565
C8A Ru1 C7 C6 -125.8 . 2_565
C7A Ru1 C7 C6 -27.5 2_565 2_565
C7A Ru1 C7 C6 42.5 . 2_565
Ru2 Ru1 C7 C6 129.36(3) . 2_565
C1 Ru1 C7 C8 -81.04(12) . 2_565
C7 Ru1 C7 C8 43.2 2_565 2_565
C8 Ru1 C7 C8 -21.2 . 2_565
C6 Ru1 C7 C8 86.7 2_565 2_565
C6 Ru1 C7 C8 96.9 . 2_565
C8A Ru1 C7 C8 17.3 2_565 2_565
C8A Ru1 C7 C8 -39.1 . 2_565
C7A Ru1 C7 C8 59.1 2_565 2_565
C7A Ru1 C7 C8 129.2 . 2_565
Ru2 Ru1 C7 C8 -143.98(3) . 2_565
C6 C7 C8 C8 0.1 . 2_565
C10 C7 C8 C8 172.9 . 2_565
C6 C7 C8 C8 0.1 2_565 2_565
Ru1 C7 C8 C8 -62.9 . 2_565
C6 C7 C8 C11 -172.8 . .
C10 C7 C8 C11 0.0 . .
C6 C7 C8 C11 -172.8 2_565 .
C8 C7 C8 C11 -172.9 2_565 .
Ru1 C7 C8 C11 124.2 . .
C6 C7 C8 C11 -15.8 . 2_565
C10 C7 C8 C11 157.0 . 2_565
C6 C7 C8 C11 -15.8 2_565 2_565
C8 C7 C8 C11 -15.9 2_565 2_565
Ru1 C7 C8 C11 -78.8 . 2_565
C6 C7 C8 C7 0.1 . 2_565
C10 C7 C8 C7 172.9 . 2_565
C6 C7 C8 C7 0.1 2_565 2_565
C8 C7 C8 C7 0.0 2_565 2_565
Ru1 C7 C8 C7 -62.9 . 2_565
C6 C7 C8 Ru1 63.0 . .
C10 C7 C8 Ru1 -124.2 . .
C6 C7 C8 Ru1 63.0 2_565 .
C8 C7 C8 Ru1 62.9 2_565 .
C1 Ru1 C8 C8 -93.53(3) . 2_565
C7 Ru1 C8 C8 36.4 2_565 2_565
C7 Ru1 C8 C8 128.7 . 2_565
C6 Ru1 C8 C8 79.0 2_565 2_565
C6 Ru1 C8 C8 90.8 . 2_565
C8A Ru1 C8 C8 12.7 2_565 2_565
C8A Ru1 C8 C8 152.8 . 2_565
C7A Ru1 C8 C8 48.7 2_565 2_565
C7A Ru1 C8 C8 119.6 . 2_565
Ru2 Ru1 C8 C8 -150.22(3) . 2_565
C1 Ru1 C8 C7 137.81(3) . .
C7 Ru1 C8 C7 -92.3 2_565 .
C8 Ru1 C8 C7 -128.7 2_565 .
C6 Ru1 C8 C7 -49.6 2_565 .
C6 Ru1 C8 C7 -37.8 . .
C8A Ru1 C8 C7 -116.0 2_565 .
C8A Ru1 C8 C7 24.1 . .
C7A Ru1 C8 C7 -80.0 2_565 .
C7A Ru1 C8 C7 -9.0 . .
Ru2 Ru1 C8 C7 81.12(2) . .
C1 Ru1 C8 C11 16.55(3) . .
C7 Ru1 C8 C11 146.4 2_565 .
C7 Ru1 C8 C11 -121.3 . .
C8 Ru1 C8 C11 110.1 2_565 .
C6 Ru1 C8 C11 -170.9 2_565 .
C6 Ru1 C8 C11 -159.1 . .
C8A Ru1 C8 C11 122.8 2_565 .
C8A Ru1 C8 C11 -97.2 . .
C7A Ru1 C8 C11 158.7 2_565 .
C7A Ru1 C8 C11 -130.3 . .
Ru2 Ru1 C8 C11 -40.14(4) . .
C1 Ru1 C8 C11 -58.40(3) . 2_565
C7 Ru1 C8 C11 71.5 2_565 2_565
C7 Ru1 C8 C11 163.8 . 2_565
C8 Ru1 C8 C11 35.1 2_565 2_565
C6 Ru1 C8 C11 114.2 2_565 2_565
C6 Ru1 C8 C11 125.9 . 2_565
C8A Ru1 C8 C11 47.8 2_565 2_565
C8A Ru1 C8 C11 -172.1 . 2_565
C7A Ru1 C8 C11 83.8 2_565 2_565
C7A Ru1 C8 C11 154.7 . 2_565
Ru2 Ru1 C8 C11 -115.09(2) . 2_565
C1 Ru1 C8 C7 -129.89(3) . 2_565
C7 Ru1 C8 C7 92.3 . 2_565
C8 Ru1 C8 C7 -36.4 2_565 2_565
C6 Ru1 C8 C7 42.7 2_565 2_565
C6 Ru1 C8 C7 54.5 . 2_565
C8A Ru1 C8 C7 -23.7 2_565 2_565
C8A Ru1 C8 C7 116.4 . 2_565
C7A Ru1 C8 C7 12.3 2_565 2_565
C7A Ru1 C8 C7 83.3 . 2_565
Ru2 Ru1 C8 C7 173.42(4) . 2_565
C6 C6 C9 C9 0.0 2_565 2_565
C7 C6 C9 C9 -176.9 . 2_565
C7 C6 C9 C9 -3.1 2_565 2_565
Ru1 C6 C9 C9 91.2 . 2_565
C7 C6 C9 C6 -176.9 . 2_565
C9 C6 C9 C6 0.0 2_565 2_565
C7 C6 C9 C6 -3.1 2_565 2_565
Ru1 C6 C9 C6 91.2 . 2_565
C7 C8 C11 C8 173.4 . 2_565
C11 C8 C11 C8 0.0 2_565 2_565
C7 C8 C11 C8 7.6 2_565 2_565
Ru1 C8 C11 C8 -94.0 . 2_565
C8 C8 C11 C11 0.0 2_565 2_565
C7 C8 C11 C11 173.4 . 2_565
C7 C8 C11 C11 7.6 2_565 2_565
Ru1 C8 C11 C11 -94.0 . 2_565
C1 Ru1 C7A C8A -46.88(18) . .
C7 Ru1 C7A C8A 79.4 2_565 .
C7 Ru1 C7A C8A -7.6 . .
C8 Ru1 C7A C8A 36.8 2_565 .
C8 Ru1 C7A C8A 15.5 . .
C6 Ru1 C7A C8A 118.2 2_565 .
C6 Ru1 C7A C8A 126.3 . .
C8A Ru1 C7A C8A 54.8 2_565 .
C7A Ru1 C7A C8A 94.9 2_565 .
Ru2 Ru1 C7A C8A -107.34(2) . .
C1 Ru1 C7A C10A 72.84(19) . .
C7 Ru1 C7A C10A -160.9 2_565 .
C7 Ru1 C7A C10A 112.1 . .
C8 Ru1 C7A C10A 156.6 2_565 .
C8 Ru1 C7A C10A 135.3 . .
C6 Ru1 C7A C10A -122.1 2_565 .
C6 Ru1 C7A C10A -113.9 . .
C8A Ru1 C7A C10A 174.5 2_565 .
C8A Ru1 C7A C10A 119.7 . .
C7A Ru1 C7A C10A -145.4 2_565 .
Ru2 Ru1 C7A C10A 12.38(4) . .
C10A C7A C8A C11A 2.0 . .
Ru1 C7A C8A C11A 125.1 . .
C10A C7A C8A C8A 176.6 . 2_565
Ru1 C7A C8A C8A -60.3 . 2_565
C10A C7A C8A Ru1 -123.1 . .
C1 Ru1 C8A C7A 152.05(7) . .
C7 Ru1 C8A C7A -81.1 2_565 .
C7 Ru1 C8A C7A 4.7 . .
C8 Ru1 C8A C7A -119.4 2_565 .
C8 Ru1 C8A C7A -135.5 . .
C6 Ru1 C8A C7A -37.3 2_565 .
C6 Ru1 C8A C7A -26.4 . .
C8A Ru1 C8A C7A -105.5 2_565 .
C7A Ru1 C8A C7A -66.9 2_565 .
Ru2 Ru1 C8A C7A 91.98(2) . .
C1 Ru1 C8A C11A 29.21(7) . .
C7 Ru1 C8A C11A 156.1 2_565 .
C7 Ru1 C8A C11A -118.1 . .
C8 Ru1 C8A C11A 117.8 2_565 .
C8 Ru1 C8A C11A 101.6 . .
C6 Ru1 C8A C11A -160.1 2_565 .
C6 Ru1 C8A C11A -149.2 . .
C8A Ru1 C8A C11A 131.6 2_565 .
C7A Ru1 C8A C11A 170.2 2_565 .
C7A Ru1 C8A C11A -122.8 . .
Ru2 Ru1 C8A C11A -30.85(4) . .
C1 Ru1 C8A C8A -102.43(7) . 2_565
C7 Ru1 C8A C8A 24.4 2_565 2_565
C7 Ru1 C8A C8A 110.3 . 2_565
C8 Ru1 C8A C8A -13.9 2_565 2_565
C8 Ru1 C8A C8A -30.0 . 2_565
C6 Ru1 C8A C8A 68.2 2_565 2_565
C6 Ru1 C8A C8A 79.1 . 2_565
C7A Ru1 C8A C8A 38.6 2_565 2_565
C7A Ru1 C8A C8A 105.5 . 2_565
Ru2 Ru1 C8A C8A -162.50(4) . 2_565
N1 Ru2 C12 C13 46.6(3) . .
C15 Ru2 C12 C13 80.3 . .
C16 Ru2 C12 C13 119.0 . .
C14 Ru2 C12 C13 37.2 . .
C1 Ru2 C12 C13 174.5(3) . .
Ru1 Ru2 C12 C13 -136.51(3) . .
Ru2 Ru2 C12 C13 -62.46(4) 2_565 .
N1 Ru2 C12 C16 -72.4(3) . .
C15 Ru2 C12 C16 -38.7 . .
C14 Ru2 C12 C16 -81.7 . .
C13 Ru2 C12 C16 -119.0 . .
C1 Ru2 C12 C16 55.5(3) . .
Ru1 Ru2 C12 C16 104.49(3) . .
Ru2 Ru2 C12 C16 178.54(6) 2_565 .
N1 Ru2 C12 C17 166.9(3) . .
C15 Ru2 C12 C17 -159.4 . .
C16 Ru2 C12 C17 -120.8 . .
C14 Ru2 C12 C17 157.5 . .
C13 Ru2 C12 C17 120.2 . .
C1 Ru2 C12 C17 -65.3(3) . .
Ru1 Ru2 C12 C17 -16.27(4) . .
Ru2 Ru2 C12 C17 57.78(6) 2_565 .
C16 C12 C13 C14 -2.0 . .
C17 C12 C13 C14 173.5 . .
Ru2 C12 C13 C14 -61.5 . .
C16 C12 C13 C18 -177.8(3) . .
C17 C12 C13 C18 -2.3(3) . .
Ru2 C12 C13 C18 122.7(3) . .
C16 C12 C13 Ru2 59.5 . .
C17 C12 C13 Ru2 -125.1 . .
N1 Ru2 C13 C14 -45.12(10) . .
C15 Ru2 C13 C14 37.7 . .
C16 Ru2 C13 C14 81.1 . .
C12 Ru2 C13 C14 118.0 . .
C1 Ru2 C13 C14 -54.2(4) . .
Ru1 Ru2 C13 C14 -171.43(3) . .
Ru2 Ru2 C13 C14 -97.26(2) 2_565 .
N1 Ru2 C13 C12 -163.13(10) . .
C15 Ru2 C13 C12 -80.3 . .
C16 Ru2 C13 C12 -36.9 . .
C14 Ru2 C13 C12 -118.0 . .
C1 Ru2 C13 C12 -172.2(4) . .
Ru1 Ru2 C13 C12 70.56(3) . .
Ru2 Ru2 C13 C12 144.72(3) 2_565 .
N1 Ru2 C13 C18 77.4(4) . .
C15 Ru2 C13 C18 160.1(4) . .
C16 Ru2 C13 C18 -156.5(4) . .
C14 Ru2 C13 C18 122.5(4) . .
C12 Ru2 C13 C18 -119.5(4) . .
C1 Ru2 C13 C18 68.3(6) . .
Ru1 Ru2 C13 C18 -49.0(4) . .
Ru2 Ru2 C13 C18 25.2(4) 2_565 .
C12 C13 C14 C15 1.7 . .
C18 C13 C14 C15 177.4(3) . .
Ru2 C13 C14 C15 -60.4 . .
C12 C13 C14 C19 -175.4(3) . .
C18 C13 C14 C19 0.2(4) . .
Ru2 C13 C14 C19 122.4(3) . .
C12 C13 C14 Ru2 62.2 . .
C18 C13 C14 Ru2 -122.2(3) . .
N1 Ru2 C14 C13 145.83(8) . .
C15 Ru2 C14 C13 -117.9 . .
C16 Ru2 C14 C13 -79.8 . .
C12 Ru2 C14 C13 -37.1 . .
C1 Ru2 C14 C13 163.03(10) . .
Ru1 Ru2 C14 C13 71.5(3) . .
Ru2 Ru2 C14 C13 103.97(2) 2_565 .
N1 Ru2 C14 C15 -96.23(9) . .
C16 Ru2 C14 C15 38.2 . .
C13 Ru2 C14 C15 117.9 . .
C12 Ru2 C14 C15 80.8 . .
C1 Ru2 C14 C15 -79.03(10) . .
Ru1 Ru2 C14 C15 -170.5(3) . .
Ru2 Ru2 C14 C15 -138.09(3) 2_565 .
N1 Ru2 C14 C19 23.5(5) . .
C15 Ru2 C14 C19 119.7(5) . .
C16 Ru2 C14 C19 157.9(5) . .
C13 Ru2 C14 C19 -122.3(5) . .
C12 Ru2 C14 C19 -159.5(5) . .
C1 Ru2 C14 C19 40.7(5) . .
Ru1 Ru2 C14 C19 -50.8(7) . .
Ru2 Ru2 C14 C19 -18.4(5) 2_565 .
C13 C14 C15 C16 -0.8 . .
C19 C14 C15 C16 176.4(3) . .
Ru2 C14 C15 C16 -62.5 . .
C13 C14 C15 C20 -176.6(2) . .
C19 C14 C15 C20 0.6(3) . .
Ru2 C14 C15 C20 121.7(2) . .
C13 C14 C15 Ru2 61.7 . .
C19 C14 C15 Ru2 -121.1(3) . .
N1 Ru2 C15 C14 90.65(11) . .
C16 Ru2 C15 C14 -117.2 . .
C13 Ru2 C15 C14 -37.1 . .
C12 Ru2 C15 C14 -79.2 . .
C1 Ru2 C15 C14 125.61(12) . .
Ru1 Ru2 C15 C14 178.24(5) . .
Ru2 Ru2 C15 C14 68.40(4) 2_565 .
N1 Ru2 C15 C16 -152.17(11) . .
C14 Ru2 C15 C16 117.2 . .
C13 Ru2 C15 C16 80.1 . .
C12 Ru2 C15 C16 38.0 . .
C1 Ru2 C15 C16 -117.21(12) . .
Ru1 Ru2 C15 C16 -64.59(4) . .
Ru2 Ru2 C15 C16 -174.43(5) 2_565 .
N1 Ru2 C15 C20 -32.1(5) . .
C16 Ru2 C15 C20 120.1(5) . .
C14 Ru2 C15 C20 -122.7(5) . .
C13 Ru2 C15 C20 -159.8(5) . .
C12 Ru2 C15 C20 158.1(5) . .
C1 Ru2 C15 C20 2.9(5) . .
Ru1 Ru2 C15 C20 55.5(5) . .
Ru2 Ru2 C15 C20 -54.3(5) 2_565 .
C13 C12 C16 C15 1.5 . .
C17 C12 C16 C15 -173.9 . .
Ru2 C12 C16 C15 61.7 . .
C13 C12 C16 C21 176.3(2) . .
C17 C12 C16 C21 1.0(2) . .
Ru2 C12 C16 C21 -123.4(2) . .
C13 C12 C16 Ru2 -60.3 . .
C17 C12 C16 Ru2 124.4 . .
C14 C15 C16 C12 -0.4 . .
C20 C15 C16 C12 175.5(2) . .
Ru2 C15 C16 C12 -63.4 . .
C14 C15 C16 C21 -175.2(2) . .
C20 C15 C16 C21 0.7(3) . .
Ru2 C15 C16 C21 121.8(2) . .
C14 C15 C16 Ru2 63.0 . .
C20 C15 C16 Ru2 -121.1(2) . .
N1 Ru2 C16 C12 155.70(15) . .
C15 Ru2 C16 C12 116.4 . .
C14 Ru2 C16 C12 78.6 . .
C13 Ru2 C16 C12 36.5 . .
C1 Ru2 C16 C12 -157.13(15) . .
Ru1 Ru2 C16 C12 -98.14(3) . .
Ru2 Ru2 C16 C12 -166.9(5) 2_565 .
N1 Ru2 C16 C15 39.28(15) . .
C14 Ru2 C16 C15 -37.8 . .
C13 Ru2 C16 C15 -79.9 . .
C12 Ru2 C16 C15 -116.4 . .
C1 Ru2 C16 C15 86.45(15) . .
Ru1 Ru2 C16 C15 145.43(3) . .
Ru2 Ru2 C16 C15 76.6(5) 2_565 .
N1 Ru2 C16 C21 -82.8(4) . .
C15 Ru2 C16 C21 -122.0(3) . .
C14 Ru2 C16 C21 -159.8(3) . .
C13 Ru2 C16 C21 158.0(3) . .
C12 Ru2 C16 C21 121.5(3) . .
C1 Ru2 C16 C21 -35.6(4) . .
Ru1 Ru2 C16 C21 23.4(3) . .
Ru2 Ru2 C16 C21 -45.4(6) 2_565 .
