#------------------------------------------------------------------------------
#$Date: 2016-03-21 11:04:52 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178679 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/90/4079044.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_4079044
loop_
_publ_author_name
'Nagaoka, Masahiro'
'Takao, Toshiro'
'Suzuki, Hiroharu'
_publ_section_title
;
 Synthesis of a Heterometallic Trinuclear Cluster Containing Ruthenium and
 Cobalt and Its Reactivity with Internal Alkynes
;
_journal_issue                   18
_journal_name_full               Organometallics
_journal_page_first              6547
_journal_paper_doi               10.1021/om300371g
_journal_volume                  31
_journal_year                    2012
_chemical_formula_sum            'C39 H55 Co Ru2'
_chemical_formula_weight         784.90
_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                 102.8920(13)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.3373(6)
_cell_length_b                   17.9205(6)
_cell_length_c                   11.4374(5)
_cell_measurement_reflns_used    17395
_cell_measurement_temperature    153(2)
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      3.31
_cell_volume                     3463.9(2)
_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 0.995
_diffrn_measured_fraction_theta_max 0.995
_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  0.0259
_diffrn_reflns_av_sigmaI/netI    0.0214
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            17395
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.31
_exptl_absorpt_coefficient_mu    1.359
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.6791
_exptl_absorpt_correction_type   empirical
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    1.505
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1616
_exptl_crystal_size_max          0.184
_exptl_crystal_size_mid          0.127
_exptl_crystal_size_min          0.059
_refine_diff_density_max         0.876
_refine_diff_density_min         -0.989
_refine_diff_density_rms         0.101
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.911
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     259
_refine_ls_number_reflns         4088
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.911
_refine_ls_R_factor_all          0.0393
_refine_ls_R_factor_gt           0.0346
_refine_ls_shift/su_max          0.032
_refine_ls_shift/su_mean         0.002
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0603P)²+17.8293P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0942
_refine_ls_wR_factor_ref         0.0984
_reflns_number_gt                3705
_reflns_number_total             4100
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om300371g_si_002.cif
_cod_data_source_block           6a
_cod_depositor_comments
;
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 2.4.2 from
2011-04-26.

'_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 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 

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_sg_symbol_H-M      C2/m
_cod_database_code               4079044
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 0.164053(19) 0.5000 0.31194(3) 0.02613(10) Uani 1 2 d S .
Ru2 Ru 0.270060(17) 0.423111(16) 0.22167(2) 0.02318(10) Uani 0.50 1 d P .
Co1 Co 0.270060(17) 0.423111(16) 0.22167(2) 0.02318(10) Uani 0.50 1 d P .
C1 C 0.2873(2) 0.5000 0.3748(4) 0.0270(8) Uani 1 2 d S .
C2 C 0.3442(2) 0.5000 0.3044(4) 0.0268(8) Uani 1 2 d S .
C3 C 0.4318(3) 0.5000 0.3502(4) 0.0350(10) Uani 1 2 d S .
H3A H 0.442(3) 0.461(2) 0.399(4) 0.052(12) Uiso 1 1 d . .
H3B H 0.461(4) 0.5000 0.277(6) 0.050(17) Uiso 1 2 d S .
C4 C 0.3165(2) 0.5000 0.5073(4) 0.0288(9) Uani 1 2 d S .
C5 C 0.3335(2) 0.4333(2) 0.5706(3) 0.0368(7) Uani 1 1 d . .
H5 H 0.317(2) 0.390(2) 0.527(4) 0.041(10) Uiso 1 1 d . .
C6 C 0.3663(2) 0.4337(2) 0.6932(3) 0.0409(8) Uani 1 1 d . .
H6 H 0.375(2) 0.388(2) 0.740(4) 0.047(11) Uiso 1 1 d . .
C7 C 0.3831(3) 0.5000 0.7551(4) 0.0398(11) Uani 1 2 d S .
H7 H 0.408(4) 0.5000 0.840(6) 0.06(2) Uiso 1 2 d S .
C8 C 0.3450(2) 0.32727(19) 0.2349(4) 0.0420(8) Uani 1 1 d . .
C9 C 0.2657(2) 0.30367(18) 0.2314(3) 0.0355(7) Uani 1 1 d . .
C10 C 0.2182(2) 0.32580(19) 0.1186(3) 0.0387(7) Uani 1 1 d . .
C11 C 0.2674(3) 0.3654(2) 0.0555(3) 0.0455(9) Uani 1 1 d . .
C12 C 0.3466(2) 0.3648(2) 0.1268(4) 0.0472(9) Uani 1 1 d . .
C13 C 0.4156(3) 0.3054(3) 0.3322(6) 0.0708(15) Uani 1 1 d . .
H13A H 0.4032 0.3128 0.4108 0.10(2) Uiso 1 1 calc R .
H13B H 0.4611 0.3365 0.3261 0.10(2) Uiso 1 1 calc R .
H13C H 0.4284 0.2528 0.3227 0.057(13) Uiso 1 1 calc R .
C14 C 0.2393(3) 0.2567(2) 0.3236(4) 0.0542(11) Uani 1 1 d . .
H14A H 0.1825 0.2638 0.3171 0.16(4) Uiso 1 1 calc R .
H14B H 0.2683 0.2716 0.4039 0.082(18) Uiso 1 1 calc R .
H14C H 0.2499 0.2040 0.3102 0.061(14) Uiso 1 1 calc R .
C15 C 0.1338(3) 0.3064(3) 0.0671(4) 0.0588(11) Uani 1 1 d . .
H15A H 0.1112 0.2823 0.1287 0.084(19) Uiso 1 1 calc R .
H15B H 0.1308 0.2722 -0.0007 0.072(16) Uiso 1 1 calc R .
H15C H 0.1041 0.3520 0.0393 0.10(2) Uiso 1 1 calc R .
C16 C 0.2406(5) 0.3950(3) -0.0694(4) 0.0799(18) Uani 1 1 d . .
H16A H 0.2801 0.4301 -0.0862 0.12(3) Uiso 1 1 calc R .
H16B H 0.1898 0.4207 -0.0771 0.10(3) Uiso 1 1 calc R .
H16C H 0.2344 0.3536 -0.1267 0.13(3) Uiso 1 1 calc R .
C17 C 0.4184(4) 0.3922(3) 0.0863(7) 0.085(2) Uani 1 1 d . .
H17A H 0.4036 0.4342 0.0311 0.13(3) Uiso 1 1 calc R .
H17B H 0.4397 0.3517 0.0453 0.13(3) Uiso 1 1 calc R .
H17C H 0.4587 0.4084 0.1561 0.11(3) Uiso 1 1 calc R .
C18 C 0.0917(2) 0.4457(2) 0.4262(3) 0.036(2) Uani 0.50 1 d PG -1
C19 C 0.1089(2) 0.5218(2) 0.4681(4) 0.042(3) Uani 0.50 1 d PG -1
C20 C 0.0749(2) 0.5704(2) 0.3735(4) 0.046(2) Uani 0.50 1 d PG -1
C21 C 0.0363(2) 0.5267(3) 0.2725(4) 0.052(4) Uani 0.50 1 d PG -1
C22 C 0.0467(2) 0.4496(3) 0.3051(4) 0.042(2) Uani 0.50 1 d PG -1
C23 C 0.1166(4) 0.3746(3) 0.4975(5) 0.063(3) Uani 0.50 1 d PG -1
C24 C 0.1558(3) 0.5426(3) 0.5926(5) 0.071(3) Uani 0.50 1 d PG -1
C25 C 0.0789(4) 0.6552(3) 0.3789(6) 0.108(6) Uani 0.50 1 d PG -1
C26 C -0.0079(3) 0.5569(4) 0.1518(6) 0.117(6) Uani 0.50 1 d PG -1
C27 C 0.0154(3) 0.3835(4) 0.2251(5) 0.093(5) Uani 0.50 1 d PG -1
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'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Co Co 0.3494 0.9721 '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 C21 165.32(15) . .
C1 Ru1 C21 165.32(15) . 2_565
C21 Ru1 C21 25.0(3) . 2_565
C1 Ru1 C22 150.61(13) . .
C21 Ru1 C22 37.77(6) . .
C21 Ru1 C22 14.7(2) 2_565 .
C1 Ru1 C22 150.61(12) . 2_565
C21 Ru1 C22 14.73(17) . 2_565
C21 Ru1 C22 37.77(8) 2_565 2_565
C22 Ru1 C22 48.2(2) . 2_565
C1 Ru1 C20 128.13(13) . 2_565
C21 Ru1 C20 56.86(16) . 2_565
C21 Ru1 C20 37.63(10) 2_565 2_565
C22 Ru1 C20 23.38(8) . 2_565
C22 Ru1 C20 62.91(10) 2_565 2_565
C1 Ru1 C20 128.13(15) . .
C21 Ru1 C20 37.63(7) . .
C21 Ru1 C20 56.9(2) 2_565 .
C22 Ru1 C20 62.91(10) . .
C22 Ru1 C20 23.38(11) 2_565 .
C20 Ru1 C20 69.02(17) 2_565 .
C1 Ru1 C18 117.60(14) . .
C21 Ru1 C18 62.91(9) . .
C21 Ru1 C18 49.87(12) 2_565 .
C22 Ru1 C18 37.63(6) . .
C22 Ru1 C18 64.20(18) 2_565 .
C20 Ru1 C18 17.39(9) 2_565 .
C20 Ru1 C18 62.66(10) . .
C1 Ru1 C18 117.60(14) . 2_565
C21 Ru1 C18 49.87(13) . 2_565
C21 Ru1 C18 62.91(9) 2_565 2_565
C22 Ru1 C18 64.20(19) . 2_565
C22 Ru1 C18 37.63(10) 2_565 2_565
C20 Ru1 C18 62.66(9) 2_565 2_565
C20 Ru1 C18 17.39(11) . 2_565
C18 Ru1 C18 51.8(2) . 2_565
C1 Ru1 C19 108.06(15) . 2_565
C21 Ru1 C19 67.33(11) . 2_565
C21 Ru1 C19 62.54(11) 2_565 2_565
C22 Ru1 C19 53.42(11) . 2_565
C22 Ru1 C19 63.04(11) 2_565 2_565
C20 Ru1 C19 36.84(8) 2_565 2_565
C20 Ru1 C19 52.95(16) . 2_565
C18 Ru1 C19 19.87(16) . 2_565
C18 Ru1 C19 38.01(6) 2_565 2_565
C1 Ru1 C19 108.06(15) . .
C21 Ru1 C19 62.54(10) . .
C21 Ru1 C19 67.33(11) 2_565 .
C22 Ru1 C19 63.04(10) . .
C22 Ru1 C19 53.42(10) 2_565 .
C20 Ru1 C19 52.95(15) 2_565 .
C20 Ru1 C19 36.84(7) . .
C18 Ru1 C19 38.01(6) . .
C18 Ru1 C19 19.87(16) 2_565 .
C19 Ru1 C19 20.11(19) 2_565 .
C1 Ru1 Ru2 53.01(9) . 2_565
C21 Ru1 Ru2 123.47(11) . 2_565
C21 Ru1 Ru2 140.71(13) 2_565 2_565
C22 Ru1 Ru2 154.23(11) . 2_565
C22 Ru1 Ru2 118.75(12) 2_565 2_565
C20 Ru1 Ru2 175.09(10) 2_565 2_565
C20 Ru1 Ru2 114.46(10) . 2_565
C18 Ru1 Ru2 167.09(11) . 2_565
C18 Ru1 Ru2 121.71(10) 2_565 2_565
C19 Ru1 Ru2 147.97(10) 2_565 2_565
C19 Ru1 Ru2 131.93(10) . 2_565
C2 Ru2 C8 101.90(14) . .
C2 Ru2 C9 134.23(13) . .
C8 Ru2 C9 39.01(14) . .
C2 Ru2 C11 129.86(16) . .
C8 Ru2 C11 64.54(16) . .
C9 Ru2 C11 64.72(13) . .
C2 Ru2 C12 99.85(15) . .
C8 Ru2 C12 38.36(16) . .
C9 Ru2 C12 64.94(14) . .
C11 Ru2 C12 38.76(17) . .
C2 Ru2 C10 164.01(14) . .
C8 Ru2 C10 64.36(14) . .
C9 Ru2 C10 38.39(13) . .
C11 Ru2 C10 38.31(14) . .
C12 Ru2 C10 64.41(14) . .
C2 Ru2 C1 38.91(15) . .
C8 Ru2 C1 118.37(14) . .
C9 Ru2 C1 125.79(11) . .
C11 Ru2 C1 167.63(13) . .
C12 Ru2 C1 135.55(16) . .
C10 Ru2 C1 153.94(13) . .
C2 Ru2 Ru1 83.43(11) . .
C8 Ru2 Ru1 147.51(11) . .
C9 Ru2 Ru1 117.24(9) . .
C11 Ru2 Ru1 134.78(12) . .
C12 Ru2 Ru1 172.74(13) . .
C10 Ru2 Ru1 112.53(10) . .
C1 Ru2 Ru1 49.73(11) . .
C2 Ru2 Co1 45.78(8) . 2_565
C8 Ru2 Co1 143.43(10) . 2_565
C9 Ru2 Co1 176.06(9) . 2_565
C11 Ru2 Co1 118.67(10) . 2_565
C12 Ru2 Co1 118.90(10) . 2_565
C10 Ru2 Co1 143.01(9) . 2_565
C1 Ru2 Co1 51.13(7) . 2_565
Ru1 Ru2 Co1 59.076(7) . 2_565
C2 Ru2 Ru2 45.78(8) . 2_565
C8 Ru2 Ru2 143.43(10) . 2_565
C9 Ru2 Ru2 176.06(9) . 2_565
C11 Ru2 Ru2 118.67(10) . 2_565
C12 Ru2 Ru2 118.90(10) . 2_565
C10 Ru2 Ru2 143.01(9) . 2_565
C1 Ru2 Ru2 51.13(7) . 2_565
Ru1 Ru2 Ru2 59.076(7) . 2_565
Co1 Ru2 Ru2 0.0 2_565 2_565
C2 C1 C4 117.5(4) . .
C2 C1 Ru1 126.5(3) . .
C4 C1 Ru1 116.0(3) . .
C2 C1 Ru2 62.05(17) . .
C4 C1 Ru2 140.16(9) . .
Ru1 C1 Ru2 77.26(12) . .
C2 C1 Co1 62.05(17) . 2_565
C4 C1 Co1 140.16(9) . 2_565
Ru1 C1 Co1 77.26(12) . 2_565
Ru2 C1 Co1 77.74(13) . 2_565
C2 C1 Ru2 62.05(17) . 2_565
C4 C1 Ru2 140.16(9) . 2_565
Ru1 C1 Ru2 77.26(12) . 2_565
Ru2 C1 Ru2 77.74(13) . 2_565
Co1 C1 Ru2 0.000(15) 2_565 2_565
C1 C2 C3 126.1(4) . .
C1 C2 Ru2 79.04(19) . .
C3 C2 Ru2 132.10(14) . .
C1 C2 Co1 79.04(19) . 2_565
C3 C2 Co1 132.10(14) . 2_565
Ru2 C2 Co1 88.44(17) . 2_565
C1 C2 Ru2 79.04(19) . 2_565
C3 C2 Ru2 132.10(14) . 2_565
Ru2 C2 Ru2 88.44(17) . 2_565
Co1 C2 Ru2 0.000(14) 2_565 2_565
C5 C4 C5 118.0(4) 2_565 .
C5 C4 C1 120.9(2) 2_565 .
C5 C4 C1 120.9(2) . .
C6 C5 C4 120.7(3) . .
C7 C6 C5 120.9(4) . .
C6 C7 C6 118.8(4) . 2_565
C12 C8 C9 108.8(3) . .
C12 C8 C13 126.7(4) . .
C9 C8 C13 124.0(4) . .
C12 C8 Ru2 71.7(2) . .
C9 C8 Ru2 70.76(19) . .
C13 C8 Ru2 129.8(3) . .
C10 C9 C8 107.5(3) . .
C10 C9 C14 126.0(4) . .
C8 C9 C14 126.1(4) . .
C10 C9 Ru2 72.23(19) . .
C8 C9 Ru2 70.24(19) . .
C14 C9 Ru2 128.1(3) . .
C11 C10 C9 107.9(3) . .
C11 C10 C15 124.2(4) . .
C9 C10 C15 127.7(4) . .
C11 C10 Ru2 69.8(2) . .
C9 C10 Ru2 69.4(2) . .
C15 C10 Ru2 130.5(3) . .
C10 C11 C12 108.3(3) . .
C10 C11 C16 124.6(4) . .
C12 C11 C16 126.8(4) . .
C10 C11 Ru2 71.9(2) . .
C12 C11 Ru2 70.8(2) . .
C16 C11 Ru2 127.8(3) . .
C8 C12 C11 107.4(3) . .
C8 C12 C17 127.1(5) . .
C11 C12 C17 125.2(5) . .
C8 C12 Ru2 69.98(19) . .
C11 C12 Ru2 70.4(2) . .
C17 C12 Ru2 129.8(3) . .
C22 C18 C19 107.5 . .
C22 C18 C23 126.0 . .
C19 C18 C23 126.5 . .
C22 C18 Ru1 70.58(12) . .
C19 C18 Ru1 71.46(13) . .
C23 C18 Ru1 123.40(12) . .
C20 C19 C18 107.8 . .
C20 C19 C24 127.7 . .
C18 C19 C24 124.5 . .
C20 C19 Ru1 71.07(13) . .
C18 C19 Ru1 70.53(13) . .
C24 C19 Ru1 123.73(11) . .
C19 C20 C21 108.7 . .
C19 C20 C25 125.3 . .
C21 C20 C25 126.0 . .
C19 C20 Ru1 72.09(12) . .
C21 C20 Ru1 70.58(12) . .
C25 C20 Ru1 123.38(12) . .
C20 C21 C22 108.0 . .
C20 C21 C26 126.0 . .
C22 C21 C26 126.0 . .
C20 C21 Ru1 71.79(13) . .
C22 C21 Ru1 71.12(13) . .
C26 C21 Ru1 122.76(12) . .
C18 C22 C21 108.0 . .
C18 C22 C27 126.0 . .
C21 C22 C27 126.0 . .
C18 C22 Ru1 71.80(12) . .
C21 C22 Ru1 71.10(13) . .
C27 C22 Ru1 122.77(13) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ru1 C1 2.098(4) .
Ru1 C21 2.211(3) .
Ru1 C21 2.211(3) 2_565
Ru1 C22 2.212(3) .
Ru1 C22 2.212(4) 2_565
Ru1 C20 2.227(4) 2_565
Ru1 C20 2.227(4) .
Ru1 C18 2.228(3) .
Ru1 C18 2.228(3) 2_565
Ru1 C19 2.240(3) 2_565
Ru1 C19 2.240(3) .
Ru1 Ru2 2.6812(4) 2_565
Ru2 C2 1.976(3) .
Ru2 C8 2.139(3) .
Ru2 C9 2.146(3) .
Ru2 C11 2.155(4) .
Ru2 C12 2.161(3) .
Ru2 C10 2.183(3) .
Ru2 C1 2.196(3) .
Ru2 Co1 2.7558(6) 2_565
Ru2 Ru2 2.7558(6) 2_565
C1 C2 1.405(6) .
C1 C4 1.487(6) .
C1 Co1 2.196(3) 2_565
C1 Ru2 2.196(3) 2_565
C2 C3 1.492(6) .
C2 Co1 1.976(3) 2_565
C2 Ru2 1.976(3) 2_565
C4 C5 1.395(4) 2_565
C4 C5 1.395(4) .
C5 C6 1.391(5) .
C6 C7 1.381(5) .
C7 C6 1.381(5) 2_565
C8 C12 1.413(6) .
C8 C9 1.430(5) .
C8 C13 1.510(6) .
C9 C10 1.424(5) .
C9 C14 1.499(5) .
C10 C11 1.424(5) .
C10 C15 1.491(5) .
C11 C12 1.432(6) .
C11 C16 1.497(6) .
C12 C17 1.505(6) .
C18 C22 1.432(2) .
C18 C19 1.455(2) .
C18 C23 1.522(2) .
C19 C20 1.4117(19) .
C19 C24 1.519(2) .
C20 C21 1.432(2) .
C20 C25 1.522(2) .
C21 C22 1.432(2) .
C21 C26 1.522(2) .
C22 C27 1.522(2) .
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 C2 -21.71(13) . .
C21 Ru1 Ru2 C2 151.0(2) . .
C21 Ru1 Ru2 C2 175.77(18) 2_565 .
C22 Ru1 Ru2 C2 -167.91(16) . .
C22 Ru1 Ru2 C2 139.9(3) 2_565 .
C20 Ru1 Ru2 C2 -142.15(15) 2_565 .
C20 Ru1 Ru2 C2 83.5(14) . .
C18 Ru1 Ru2 C2 -124.21(16) . .
C18 Ru1 Ru2 C2 -68.1(5) 2_565 .
C19 Ru1 Ru2 C2 -102.80(16) 2_565 .
C19 Ru1 Ru2 C2 -83.5(2) . .
Ru2 Ru1 Ru2 C2 41.46(10) 2_565 .
C1 Ru1 Ru2 C8 80.2(2) . .
C21 Ru1 Ru2 C8 -107.2(3) . .
C21 Ru1 Ru2 C8 -82.4(2) 2_565 .
C22 Ru1 Ru2 C8 -66.0(2) . .
C22 Ru1 Ru2 C8 -118.3(3) 2_565 .
C20 Ru1 Ru2 C8 -40.3(2) 2_565 .
C20 Ru1 Ru2 C8 -174.6(14) . .
C18 Ru1 Ru2 C8 -22.3(2) . .
C18 Ru1 Ru2 C8 33.8(5) 2_565 .
C19 Ru1 Ru2 C8 -0.9(2) 2_565 .
C19 Ru1 Ru2 C8 18.3(3) . .
Ru2 Ru1 Ru2 C8 143.33(19) 2_565 .
C1 Ru1 Ru2 C9 115.21(14) . .
C21 Ru1 Ru2 C9 -72.1(2) . .
C21 Ru1 Ru2 C9 -47.31(19) 2_565 .
C22 Ru1 Ru2 C9 -30.99(16) . .
C22 Ru1 Ru2 C9 -83.2(3) 2_565 .
C20 Ru1 Ru2 C9 -5.23(16) 2_565 .
C20 Ru1 Ru2 C9 -139.5(14) . .
C18 Ru1 Ru2 C9 12.71(16) . .
C18 Ru1 Ru2 C9 68.9(5) 2_565 .
C19 Ru1 Ru2 C9 34.12(17) 2_565 .
C19 Ru1 Ru2 C9 53.4(2) . .
Ru2 Ru1 Ru2 C9 178.38(10) 2_565 .
C1 Ru1 Ru2 C11 -164.34(16) . .
C21 Ru1 Ru2 C11 8.3(2) . .
C21 Ru1 Ru2 C11 33.1(2) 2_565 .
C22 Ru1 Ru2 C11 49.47(19) . .
C22 Ru1 Ru2 C11 -2.7(3) 2_565 .
C20 Ru1 Ru2 C11 75.22(18) 2_565 .
C20 Ru1 Ru2 C11 -59.1(14) . .
C18 Ru1 Ru2 C11 93.17(18) . .
C18 Ru1 Ru2 C11 149.3(5) 2_565 .
C19 Ru1 Ru2 C11 114.57(19) 2_565 .
C19 Ru1 Ru2 C11 133.8(2) . .
Ru2 Ru1 Ru2 C11 -101.16(14) 2_565 .
C1 Ru1 Ru2 C12 -139.0(8) . .
C21 Ru1 Ru2 C12 33.7(8) . .
C21 Ru1 Ru2 C12 58.5(8) 2_565 .
C22 Ru1 Ru2 C12 74.8(8) . .
C22 Ru1 Ru2 C12 22.6(9) 2_565 .
C20 Ru1 Ru2 C12 100.6(8) 2_565 .
C20 Ru1 Ru2 C12 -33.7(17) . .
C18 Ru1 Ru2 C12 118.5(8) . .
C18 Ru1 Ru2 C12 174.7(9) 2_565 .
C19 Ru1 Ru2 C12 139.9(8) 2_565 .
C19 Ru1 Ru2 C12 159.2(8) . .
Ru2 Ru1 Ru2 C12 -75.8(8) 2_565 .
C1 Ru1 Ru2 C10 157.40(14) . .
C21 Ru1 Ru2 C10 -29.9(2) . .
C21 Ru1 Ru2 C10 -5.11(19) 2_565 .
C22 Ru1 Ru2 C10 11.21(16) . .
C22 Ru1 Ru2 C10 -41.0(3) 2_565 .
C20 Ru1 Ru2 C10 36.96(15) 2_565 .
C20 Ru1 Ru2 C10 -97.3(14) . .
C18 Ru1 Ru2 C10 54.91(16) . .
C18 Ru1 Ru2 C10 111.1(5) 2_565 .
C19 Ru1 Ru2 C10 76.31(17) 2_565 .
C19 Ru1 Ru2 C10 95.6(2) . .
Ru2 Ru1 Ru2 C10 -139.42(10) 2_565 .
C21 Ru1 Ru2 C1 172.7(2) . .
C21 Ru1 Ru2 C1 -162.52(18) 2_565 .
C22 Ru1 Ru2 C1 -146.20(15) . .
C22 Ru1 Ru2 C1 161.6(3) 2_565 .
C20 Ru1 Ru2 C1 -120.44(15) 2_565 .
C20 Ru1 Ru2 C1 105.3(14) . .
C18 Ru1 Ru2 C1 -102.49(15) . .
C18 Ru1 Ru2 C1 -46.3(5) 2_565 .
C19 Ru1 Ru2 C1 -81.09(16) 2_565 .
C19 Ru1 Ru2 C1 -61.8(2) . .
Ru2 Ru1 Ru2 C1 63.18(9) 2_565 .
C1 Ru1 Ru2 Co1 -63.18(9) . 2_565
C21 Ru1 Ru2 Co1 109.50(18) . 2_565
C21 Ru1 Ru2 Co1 134.31(16) 2_565 2_565
C22 Ru1 Ru2 Co1 150.63(12) . 2_565
C22 Ru1 Ru2 Co1 98.4(3) 2_565 2_565
C20 Ru1 Ru2 Co1 176.38(12) 2_565 2_565
C20 Ru1 Ru2 Co1 42.1(14) . 2_565
C18 Ru1 Ru2 Co1 -165.67(12) . 2_565
C18 Ru1 Ru2 Co1 -109.5(5) 2_565 2_565
C19 Ru1 Ru2 Co1 -144.27(13) 2_565 2_565
C19 Ru1 Ru2 Co1 -125.00(19) . 2_565
Ru2 Ru1 Ru2 Co1 0.0 2_565 2_565
C1 Ru1 Ru2 Ru2 -63.18(9) . 2_565
C21 Ru1 Ru2 Ru2 109.50(18) . 2_565
C21 Ru1 Ru2 Ru2 134.31(16) 2_565 2_565
C22 Ru1 Ru2 Ru2 150.63(12) . 2_565
C22 Ru1 Ru2 Ru2 98.4(3) 2_565 2_565
C20 Ru1 Ru2 Ru2 176.38(12) 2_565 2_565
C20 Ru1 Ru2 Ru2 42.1(14) . 2_565
C18 Ru1 Ru2 Ru2 -165.67(12) . 2_565
C18 Ru1 Ru2 Ru2 -109.5(5) 2_565 2_565
C19 Ru1 Ru2 Ru2 -144.27(13) 2_565 2_565
C19 Ru1 Ru2 Ru2 -125.00(19) . 2_565
C21 Ru1 C1 C2 -121.4(6) . .
C21 Ru1 C1 C2 121.4(6) 2_565 .
C22 Ru1 C1 C2 123.7(3) . .
C22 Ru1 C1 C2 -123.7(3) 2_565 .
C20 Ru1 C1 C2 133.92(14) 2_565 .
C20 Ru1 C1 C2 -133.92(14) . .
C18 Ru1 C1 C2 150.46(12) . .
C18 Ru1 C1 C2 -150.46(12) 2_565 .
C19 Ru1 C1 C2 169.42(10) 2_565 .
C19 Ru1 C1 C2 -169.42(10) . .
Ru2 Ru1 C1 C2 -40.04(5) 2_565 .
C21 Ru1 C1 C4 58.6(6) . .
C21 Ru1 C1 C4 -58.6(6) 2_565 .
C22 Ru1 C1 C4 -56.3(3) . .
C22 Ru1 C1 C4 56.3(3) 2_565 .
C20 Ru1 C1 C4 -46.08(14) 2_565 .
C20 Ru1 C1 C4 46.08(14) . .
C18 Ru1 C1 C4 -29.54(12) . .
C18 Ru1 C1 C4 29.54(12) 2_565 .
C19 Ru1 C1 C4 -10.58(10) 2_565 .
C19 Ru1 C1 C4 10.58(10) . .
Ru2 Ru1 C1 C4 139.96(5) 2_565 .
C21 Ru1 C1 Ru2 -161.4(5) . .
C21 Ru1 C1 Ru2 81.3(6) 2_565 .
C22 Ru1 C1 Ru2 83.7(3) . .
C22 Ru1 C1 Ru2 -163.8(3) 2_565 .
C20 Ru1 C1 Ru2 93.88(17) 2_565 .
C20 Ru1 C1 Ru2 -173.97(13) . .
C18 Ru1 C1 Ru2 110.42(14) . .
C18 Ru1 C1 Ru2 169.49(12) 2_565 .
C19 Ru1 C1 Ru2 129.37(12) 2_565 .
C19 Ru1 C1 Ru2 150.54(11) . .
Ru2 Ru1 C1 Ru2 -80.09(11) 2_565 .
C21 Ru1 C1 Co1 -81.3(6) . 2_565
C21 Ru1 C1 Co1 161.4(5) 2_565 2_565
C22 Ru1 C1 Co1 163.8(3) . 2_565
C22 Ru1 C1 Co1 -83.7(3) 2_565 2_565
C20 Ru1 C1 Co1 173.97(13) 2_565 2_565
C20 Ru1 C1 Co1 -93.88(17) . 2_565
C18 Ru1 C1 Co1 -169.49(12) . 2_565
C18 Ru1 C1 Co1 -110.42(14) 2_565 2_565
C19 Ru1 C1 Co1 -150.54(11) 2_565 2_565
C19 Ru1 C1 Co1 -129.37(12) . 2_565
Ru2 Ru1 C1 Co1 0.0 2_565 2_565
C21 Ru1 C1 Ru2 -81.3(6) . 2_565
C21 Ru1 C1 Ru2 161.4(5) 2_565 2_565
C22 Ru1 C1 Ru2 163.8(3) . 2_565
C22 Ru1 C1 Ru2 -83.7(3) 2_565 2_565
C20 Ru1 C1 Ru2 173.97(13) 2_565 2_565
C20 Ru1 C1 Ru2 -93.88(17) . 2_565
C18 Ru1 C1 Ru2 -169.49(12) . 2_565
C18 Ru1 C1 Ru2 -110.42(14) 2_565 2_565
C19 Ru1 C1 Ru2 -150.54(11) 2_565 2_565
C19 Ru1 C1 Ru2 -129.37(12) . 2_565
C8 Ru2 C1 C2 72.8(2) . .
C9 Ru2 C1 C2 118.42(19) . .
C11 Ru2 C1 C2 -27.6(8) . .
C12 Ru2 C1 C2 29.0(3) . .
C10 Ru2 C1 C2 161.9(3) . .
Ru1 Ru2 C1 C2 -144.18(19) . .
Co1 Ru2 C1 C2 -64.68(16) 2_565 .
Ru2 Ru2 C1 C2 -64.68(16) 2_565 .
C2 Ru2 C1 C4 -100.3(5) . .
C8 Ru2 C1 C4 -27.5(5) . .
C9 Ru2 C1 C4 18.1(5) . .
C11 Ru2 C1 C4 -128.0(6) . .
C12 Ru2 C1 C4 -71.3(5) . .
C10 Ru2 C1 C4 61.6(6) . .
Ru1 Ru2 C1 C4 115.5(5) . .
Co1 Ru2 C1 C4 -165.0(5) 2_565 .
Ru2 Ru2 C1 C4 -165.0(5) 2_565 .
C2 Ru2 C1 Ru1 144.18(19) . .
C8 Ru2 C1 Ru1 -143.02(13) . .
C9 Ru2 C1 Ru1 -97.40(14) . .
C11 Ru2 C1 Ru1 116.5(7) . .
C12 Ru2 C1 Ru1 173.20(16) . .
C10 Ru2 C1 Ru1 -53.9(3) . .
Co1 Ru2 C1 Ru1 79.50(9) 2_565 .
Ru2 Ru2 C1 Ru1 79.50(9) 2_565 .
C2 Ru2 C1 Co1 64.68(16) . 2_565
C8 Ru2 C1 Co1 137.48(13) . 2_565
C9 Ru2 C1 Co1 -176.90(12) . 2_565
C11 Ru2 C1 Co1 37.0(7) . 2_565
C12 Ru2 C1 Co1 93.71(19) . 2_565
C10 Ru2 C1 Co1 -133.4(2) . 2_565
Ru1 Ru2 C1 Co1 -79.50(9) . 2_565
Ru2 Ru2 C1 Co1 0.0 2_565 2_565
C2 Ru2 C1 Ru2 64.68(16) . 2_565
C8 Ru2 C1 Ru2 137.48(13) . 2_565
C9 Ru2 C1 Ru2 -176.90(12) . 2_565
C11 Ru2 C1 Ru2 37.0(7) . 2_565
C12 Ru2 C1 Ru2 93.71(19) . 2_565
C10 Ru2 C1 Ru2 -133.4(2) . 2_565
Ru1 Ru2 C1 Ru2 -79.50(9) . 2_565
Co1 Ru2 C1 Ru2 0.0 2_565 2_565
C4 C1 C2 C3 0.0 . .
Ru1 C1 C2 C3 180.0 . .
Ru2 C1 C2 C3 -134.73(7) . .
Co1 C1 C2 C3 134.73(7) 2_565 .
Ru2 C1 C2 C3 134.73(7) 2_565 .
C4 C1 C2 Ru2 134.73(7) . .
Ru1 C1 C2 Ru2 -45.27(7) . .
Co1 C1 C2 Ru2 -90.53(14) 2_565 .
Ru2 C1 C2 Ru2 -90.53(14) 2_565 .
C4 C1 C2 Co1 -134.73(7) . 2_565
Ru1 C1 C2 Co1 45.27(7) . 2_565
Ru2 C1 C2 Co1 90.53(14) . 2_565
Ru2 C1 C2 Co1 0.0 2_565 2_565
C4 C1 C2 Ru2 -134.73(7) . 2_565
Ru1 C1 C2 Ru2 45.27(7) . 2_565
Ru2 C1 C2 Ru2 90.53(14) . 2_565
Co1 C1 C2 Ru2 0.0 2_565 2_565
C8 Ru2 C2 C1 -120.79(19) . .
C9 Ru2 C2 C1 -95.4(2) . .
C11 Ru2 C2 C1 172.56(19) . .
C12 Ru2 C2 C1 -159.83(19) . .
C10 Ru2 C2 C1 -150.3(4) . .
Ru1 Ru2 C2 C1 26.71(15) . .
Co1 Ru2 C2 C1 79.14(18) 2_565 .
Ru2 Ru2 C2 C1 79.14(18) 2_565 .
C8 Ru2 C2 C3 8.5(4) . .
C9 Ru2 C2 C3 33.9(5) . .
C11 Ru2 C2 C3 -58.2(4) . .
C12 Ru2 C2 C3 -30.5(4) . .
C10 Ru2 C2 C3 -21.0(8) . .
C1 Ru2 C2 C3 129.3(5) . .
Ru1 Ru2 C2 C3 156.0(4) . .
Co1 Ru2 C2 C3 -151.6(5) 2_565 .
Ru2 Ru2 C2 C3 -151.6(5) 2_565 .
C8 Ru2 C2 Co1 160.07(15) . 2_565
C9 Ru2 C2 Co1 -174.49(13) . 2_565
C11 Ru2 C2 Co1 93.42(19) . 2_565
C12 Ru2 C2 Co1 121.03(16) . 2_565
C10 Ru2 C2 Co1 130.5(4) . 2_565
C1 Ru2 C2 Co1 -79.14(18) . 2_565
Ru1 Ru2 C2 Co1 -52.43(11) . 2_565
Ru2 Ru2 C2 Co1 0.0 2_565 2_565
C8 Ru2 C2 Ru2 160.07(15) . 2_565
C9 Ru2 C2 Ru2 -174.49(13) . 2_565
C11 Ru2 C2 Ru2 93.42(19) . 2_565
C12 Ru2 C2 Ru2 121.03(16) . 2_565
C10 Ru2 C2 Ru2 130.5(4) . 2_565
C1 Ru2 C2 Ru2 -79.14(18) . 2_565
Ru1 Ru2 C2 Ru2 -52.43(11) . 2_565
Co1 Ru2 C2 Ru2 0.0 2_565 2_565
C2 C1 C4 C5 87.5(3) . 2_565
Ru1 C1 C4 C5 -92.5(3) . 2_565
Ru2 C1 C4 C5 165.8(3) . 2_565
Co1 C1 C4 C5 9.1(7) 2_565 2_565
Ru2 C1 C4 C5 9.1(7) 2_565 2_565
C2 C1 C4 C5 -87.5(3) . .
Ru1 C1 C4 C5 92.5(3) . .
Ru2 C1 C4 C5 -9.1(7) . .
Co1 C1 C4 C5 -165.8(3) 2_565 .
Ru2 C1 C4 C5 -165.8(3) 2_565 .
C5 C4 C5 C6 0.2(6) 2_565 .
C1 C4 C5 C6 175.3(4) . .
C4 C5 C6 C7 -0.3(6) . .
C5 C6 C7 C6 0.5(7) . 2_565
C2 Ru2 C8 C12 -90.9(2) . .
C9 Ru2 C8 C12 118.4(3) . .
C11 Ru2 C8 C12 37.8(2) . .
C10 Ru2 C8 C12 80.5(2) . .
C1 Ru2 C8 C12 -128.7(2) . .
Ru1 Ru2 C8 C12 172.62(18) . .
Co1 Ru2 C8 C12 -66.7(3) 2_565 .
Ru2 Ru2 C8 C12 -66.7(3) 2_565 .
C2 Ru2 C8 C9 150.7(2) . .
C11 Ru2 C8 C9 -80.6(2) . .
C12 Ru2 C8 C9 -118.4(3) . .
C10 Ru2 C8 C9 -37.9(2) . .
C1 Ru2 C8 C9 112.9(2) . .
Ru1 Ru2 C8 C9 54.2(3) . .
Co1 Ru2 C8 C9 174.93(14) 2_565 .
Ru2 Ru2 C8 C9 174.93(14) 2_565 .
C2 Ru2 C8 C13 32.0(5) . .
C9 Ru2 C8 C13 -118.7(5) . .
C11 Ru2 C8 C13 160.7(5) . .
C12 Ru2 C8 C13 122.9(5) . .
C10 Ru2 C8 C13 -156.7(5) . .
C1 Ru2 C8 C13 -5.8(5) . .
Ru1 Ru2 C8 C13 -64.5(5) . .
Co1 Ru2 C8 C13 56.2(5) 2_565 .
Ru2 Ru2 C8 C13 56.2(5) 2_565 .
C12 C8 C9 C10 1.1(4) . .
C13 C8 C9 C10 -171.4(4) . .
Ru2 C8 C9 C10 63.0(2) . .
C12 C8 C9 C14 174.8(3) . .
C13 C8 C9 C14 2.3(6) . .
Ru2 C8 C9 C14 -123.3(4) . .
C12 C8 C9 Ru2 -61.9(2) . .
C13 C8 C9 Ru2 125.6(4) . .
C2 Ru2 C9 C10 -158.7(2) . .
C8 Ru2 C9 C10 -116.8(3) . .
C11 Ru2 C9 C10 -36.7(2) . .
C12 Ru2 C9 C10 -79.8(2) . .
C1 Ru2 C9 C10 150.9(2) . .
Ru1 Ru2 C9 C10 92.5(2) . .
Co1 Ru2 C9 C10 113.1(13) 2_565 .
Ru2 Ru2 C9 C10 113.1(13) 2_565 .
C2 Ru2 C9 C8 -41.9(3) . .
C11 Ru2 C9 C8 80.1(2) . .
C12 Ru2 C9 C8 37.1(2) . .
C10 Ru2 C9 C8 116.8(3) . .
C1 Ru2 C9 C8 -92.3(3) . .
Ru1 Ru2 C9 C8 -150.65(19) . .
Co1 Ru2 C9 C8 -130.0(13) 2_565 .
Ru2 Ru2 C9 C8 -130.0(13) 2_565 .
C2 Ru2 C9 C14 79.0(4) . .
C8 Ru2 C9 C14 120.9(5) . .
C11 Ru2 C9 C14 -159.0(4) . .
C12 Ru2 C9 C14 158.0(4) . .
C10 Ru2 C9 C14 -122.3(4) . .
C1 Ru2 C9 C14 28.6(4) . .
Ru1 Ru2 C9 C14 -29.7(4) . .
Co1 Ru2 C9 C14 -9.1(16) 2_565 .
Ru2 Ru2 C9 C14 -9.1(16) 2_565 .
C8 C9 C10 C11 -2.4(4) . .
C14 C9 C10 C11 -176.1(3) . .
Ru2 C9 C10 C11 59.4(2) . .
C8 C9 C10 C15 172.4(4) . .
C14 C9 C10 C15 -1.3(6) . .
Ru2 C9 C10 C15 -125.9(4) . .
C8 C9 C10 Ru2 -61.7(2) . .
C14 C9 C10 Ru2 124.6(4) . .
C2 Ru2 C10 C11 -48.4(6) . .
C8 Ru2 C10 C11 -80.7(3) . .
C9 Ru2 C10 C11 -119.2(3) . .
C12 Ru2 C10 C11 -38.0(2) . .
C1 Ru2 C10 C11 176.7(3) . .
Ru1 Ru2 C10 C11 134.8(2) . .
Co1 Ru2 C10 C11 66.8(3) 2_565 .
Ru2 Ru2 C10 C11 66.8(3) 2_565 .
C2 Ru2 C10 C9 70.9(5) . .
C8 Ru2 C10 C9 38.5(2) . .
C11 Ru2 C10 C9 119.2(3) . .
C12 Ru2 C10 C9 81.3(2) . .
C1 Ru2 C10 C9 -64.1(4) . .
Ru1 Ru2 C10 C9 -105.93(19) . .
Co1 Ru2 C10 C9 -173.97(15) 2_565 .
Ru2 Ru2 C10 C9 -173.97(15) 2_565 .
C2 Ru2 C10 C15 -166.5(5) . .
C8 Ru2 C10 C15 161.1(4) . .
C9 Ru2 C10 C15 122.6(5) . .
C11 Ru2 C10 C15 -118.2(5) . .
C12 Ru2 C10 C15 -156.1(4) . .
C1 Ru2 C10 C15 58.5(5) . .
Ru1 Ru2 C10 C15 16.7(4) . .
Co1 Ru2 C10 C15 -51.4(4) 2_565 .
Ru2 Ru2 C10 C15 -51.4(4) 2_565 .
C9 C10 C11 C12 2.7(4) . .
C15 C10 C11 C12 -172.3(4) . .
Ru2 C10 C11 C12 61.8(2) . .
C9 C10 C11 C16 177.0(4) . .
C15 C10 C11 C16 2.0(6) . .
Ru2 C10 C11 C16 -123.9(4) . .
C9 C10 C11 Ru2 -59.1(2) . .
C15 C10 C11 Ru2 125.9(4) . .
C2 Ru2 C11 C10 164.4(2) . .
C8 Ru2 C11 C10 80.2(2) . .
C9 Ru2 C11 C10 36.8(2) . .
C12 Ru2 C11 C10 117.6(3) . .
C1 Ru2 C11 C10 -173.2(6) . .
Ru1 Ru2 C11 C10 -67.3(3) . .
Co1 Ru2 C11 C10 -140.93(18) 2_565 .
Ru2 Ru2 C11 C10 -140.93(18) 2_565 .
C2 Ru2 C11 C12 46.8(3) . .
C8 Ru2 C11 C12 -37.4(2) . .
C9 Ru2 C11 C12 -80.8(2) . .
C10 Ru2 C11 C12 -117.6(3) . .
C1 Ru2 C11 C12 69.1(7) . .
Ru1 Ru2 C11 C12 175.05(17) . .
Co1 Ru2 C11 C12 101.5(2) 2_565 .
Ru2 Ru2 C11 C12 101.5(2) 2_565 .
C2 Ru2 C11 C16 -75.4(5) . .
C8 Ru2 C11 C16 -159.7(5) . .
C9 Ru2 C11 C16 157.0(5) . .
C12 Ru2 C11 C16 -122.2(5) . .
C10 Ru2 C11 C16 120.1(6) . .
C1 Ru2 C11 C16 -53.1(9) . .
Ru1 Ru2 C11 C16 52.8(5) . .
Co1 Ru2 C11 C16 -20.8(5) 2_565 .
Ru2 Ru2 C11 C16 -20.8(5) 2_565 .
C9 C8 C12 C11 0.5(4) . .
C13 C8 C12 C11 172.8(4) . .
Ru2 C8 C12 C11 -60.8(3) . .
C9 C8 C12 C17 -173.3(4) . .
C13 C8 C12 C17 -1.0(6) . .
Ru2 C8 C12 C17 125.4(4) . .
C9 C8 C12 Ru2 61.3(2) . .
C13 C8 C12 Ru2 -126.4(4) . .
C10 C11 C12 C8 -2.0(4) . .
C16 C11 C12 C8 -176.1(4) . .
Ru2 C11 C12 C8 60.5(2) . .
C10 C11 C12 C17 171.9(4) . .
C16 C11 C12 C17 -2.2(7) . .
Ru2 C11 C12 C17 -125.5(4) . .
C10 C11 C12 Ru2 -62.5(3) . .
C16 C11 C12 Ru2 123.4(4) . .
C2 Ru2 C12 C8 96.8(2) . .
C9 Ru2 C12 C8 -37.7(2) . .
C11 Ru2 C12 C8 -117.8(3) . .
C10 Ru2 C12 C8 -80.3(2) . .
C1 Ru2 C12 C8 78.8(3) . .
Ru1 Ru2 C12 C8 -146.9(7) . .
Co1 Ru2 C12 C8 141.32(19) 2_565 .
Ru2 Ru2 C12 C8 141.32(19) 2_565 .
C2 Ru2 C12 C11 -145.4(2) . .
C8 Ru2 C12 C11 117.8(3) . .
C9 Ru2 C12 C11 80.2(2) . .
C10 Ru2 C12 C11 37.5(2) . .
C1 Ru2 C12 C11 -163.39(19) . .
Ru1 Ru2 C12 C11 -29.0(9) . .
Co1 Ru2 C12 C11 -100.8(2) 2_565 .
Ru2 Ru2 C12 C11 -100.8(2) 2_565 .
C2 Ru2 C12 C17 -25.4(6) . .
C8 Ru2 C12 C17 -122.2(6) . .
C9 Ru2 C12 C17 -159.8(6) . .
C11 Ru2 C12 C17 120.0(6) . .
C10 Ru2 C12 C17 157.5(6) . .
C1 Ru2 C12 C17 -43.4(6) . .
Ru1 Ru2 C12 C17 91.0(10) . .
Co1 Ru2 C12 C17 19.2(6) 2_565 .
Ru2 Ru2 C12 C17 19.2(6) 2_565 .
C1 Ru1 C18 C22 -158.79(16) . .
C21 Ru1 C18 C22 37.75(5) . .
C21 Ru1 C18 C22 11.9(3) 2_565 .
C22 Ru1 C18 C22 54.15(16) 2_565 .
C20 Ru1 C18 C22 -27.3(6) 2_565 .
C20 Ru1 C18 C22 80.28(8) . .
C18 Ru1 C18 C22 96.50(13) 2_565 .
C19 Ru1 C18 C22 135.9(3) 2_565 .
C19 Ru1 C18 C22 116.99(7) . .
Ru2 Ru1 C18 C22 160.5(5) 2_565 .
C1 Ru1 C18 C19 84.22(14) . .
C21 Ru1 C18 C19 -79.25(9) . .
C21 Ru1 C18 C19 -105.1(3) 2_565 .
C22 Ru1 C18 C19 -116.99(7) . .
C22 Ru1 C18 C19 -62.85(14) 2_565 .
C20 Ru1 C18 C19 -144.3(5) 2_565 .
C20 Ru1 C18 C19 -36.72(5) . .
C18 Ru1 C18 C19 -20.49(12) 2_565 .
C19 Ru1 C18 C19 18.9(3) 2_565 .
Ru2 Ru1 C18 C19 43.5(5) 2_565 .
C1 Ru1 C18 C23 -37.85(17) . .
C21 Ru1 C18 C23 158.7 . .
C21 Ru1 C18 C23 132.9(3) 2_565 .
C22 Ru1 C18 C23 120.93(7) . .
C22 Ru1 C18 C23 175.08(16) 2_565 .
C20 Ru1 C18 C23 93.6(6) 2_565 .
C20 Ru1 C18 C23 -158.8 . .
C18 Ru1 C18 C23 -142.56(13) 2_565 .
C19 Ru1 C18 C23 -103.2(3) 2_565 .
C19 Ru1 C18 C23 -122.07(7) . .
Ru2 Ru1 C18 C23 -78.5(5) 2_565 .
C22 C18 C19 C20 -0.1 . .
C23 C18 C19 C20 180.0 . .
Ru1 C18 C19 C20 61.65(13) . .
C22 C18 C19 C24 -179.9 . .
C23 C18 C19 C24 0.2 . .
Ru1 C18 C19 C24 -118.14(13) . .
C22 C18 C19 Ru1 -61.76(13) . .
C23 C18 C19 Ru1 118.30(13) . .
C1 Ru1 C19 C20 130.39(12) . .
C21 Ru1 C19 C20 -37.35(5) . .
C21 Ru1 C19 C20 -64.5(2) 2_565 .
C22 Ru1 C19 C20 -80.04(8) . .
C22 Ru1 C19 C20 -23.7(3) 2_565 .
C20 Ru1 C19 C20 -105.03(16) 2_565 .
C18 Ru1 C19 C20 -117.65(7) . .
C18 Ru1 C19 C20 8.3(4) 2_565 .
C19 Ru1 C19 C20 -136.30(6) 2_565 .
Ru2 Ru1 C19 C20 74.29(13) 2_565 .
C1 Ru1 C19 C18 -111.97(12) . .
C21 Ru1 C19 C18 80.30(8) . .
C21 Ru1 C19 C18 53.2(2) 2_565 .
C22 Ru1 C19 C18 37.61(5) . .
C22 Ru1 C19 C18 94.0(2) 2_565 .
C20 Ru1 C19 C18 12.61(14) 2_565 .
C20 Ru1 C19 C18 117.65(7) . .
C18 Ru1 C19 C18 125.9(4) 2_565 .
C19 Ru1 C19 C18 -18.7 2_565 .
Ru2 Ru1 C19 C18 -168.07(14) 2_565 .
C1 Ru1 C19 C24 7.08(13) . .
C21 Ru1 C19 C24 -160.7 . .
C21 Ru1 C19 C24 172.2(3) 2_565 .
C22 Ru1 C19 C24 156.7 . .
C22 Ru1 C19 C24 -147.0(3) 2_565 .
C20 Ru1 C19 C24 131.66(18) 2_565 .
C20 Ru1 C19 C24 -123.31(7) . .
C18 Ru1 C19 C24 119.04(7) . .
C18 Ru1 C19 C24 -115.0(4) 2_565 .
C19 Ru1 C19 C24 100.39(9) 2_565 .
Ru2 Ru1 C19 C24 -49.02(15) 2_565 .
C18 C19 C20 C21 0.1 . .
C24 C19 C20 C21 179.9 . .
Ru1 C19 C20 C21 61.41(12) . .
C18 C19 C20 C25 -180.0 . .
C24 C19 C20 C25 -0.2 . .
Ru1 C19 C20 C25 -118.66(13) . .
C18 C19 C20 Ru1 -61.30(12) . .
C24 C19 C20 Ru1 118.48(12) . .
C1 Ru1 C20 C19 -67.02(16) . .
C21 Ru1 C20 C19 118.15(7) . .
C21 Ru1 C20 C19 95.95(15) 2_565 .
C22 Ru1 C20 C19 80.40(8) . .
C22 Ru1 C20 C19 125.6(4) 2_565 .
C20 Ru1 C20 C19 55.65(7) 2_565 .
C18 Ru1 C20 C19 37.9 . .
C18 Ru1 C20 C19 -9.4(6) 2_565 .
C19 Ru1 C20 C19 17.32(13) 2_565 .
Ru2 Ru1 C20 C19 -128.12(10) 2_565 .
C1 Ru1 C20 C21 174.83(17) . .
C21 Ru1 C20 C21 -22.20(17) 2_565 .
C22 Ru1 C20 C21 -37.7 . .
C22 Ru1 C20 C21 7.5(5) 2_565 .
C20 Ru1 C20 C21 -62.51(7) 2_565 .
C18 Ru1 C20 C21 -80.27(8) . .
C18 Ru1 C20 C21 -127.6(5) 2_565 .
C19 Ru1 C20 C21 -100.84(11) 2_565 .
C19 Ru1 C20 C21 -118.15(7) . .
Ru2 Ru1 C20 C21 113.73(10) 2_565 .
C1 Ru1 C20 C25 53.89(17) . .
C21 Ru1 C20 C25 -120.94(7) . .
C21 Ru1 C20 C25 -143.14(15) 2_565 .
C22 Ru1 C20 C25 -158.7 . .
C22 Ru1 C20 C25 -113.4(5) 2_565 .
C20 Ru1 C20 C25 176.6 2_565 .
C18 Ru1 C20 C25 158.8 . .
C18 Ru1 C20 C25 111.5(6) 2_565 .
C19 Ru1 C20 C25 138.23(12) 2_565 .
C19 Ru1 C20 C25 120.91(7) . .
Ru2 Ru1 C20 C25 -7.21(12) 2_565 .
C19 C20 C21 C22 -0.1 . .
C25 C20 C21 C22 180.0 . .
Ru1 C20 C21 C22 62.29(13) . .
C19 C20 C21 C26 179.9 . .
C25 C20 C21 C26 0.0 . .
Ru1 C20 C21 C26 -117.71(13) . .
C19 C20 C21 Ru1 -62.36(13) . .
C25 C20 C21 Ru1 117.71(13) . .
C1 Ru1 C21 C20 -16.2(6) . .
C21 Ru1 C21 C20 131.52(6) 2_565 .
C22 Ru1 C21 C20 117.15(7) . .
C22 Ru1 C21 C20 -11.7(6) 2_565 .
C20 Ru1 C21 C20 98.43(14) 2_565 .
C18 Ru1 C21 C20 79.55(8) . .
C18 Ru1 C21 C20 18.0(2) 2_565 .
C19 Ru1 C21 C20 58.17(18) 2_565 .
C19 Ru1 C21 C20 36.56(5) . .
Ru2 Ru1 C21 C20 -87.44(10) 2_565 .
C1 Ru1 C21 C22 -133.4(6) . .
C21 Ru1 C21 C22 14.4 2_565 .
C22 Ru1 C21 C22 -128.9(6) 2_565 .
C20 Ru1 C21 C22 -18.72(13) 2_565 .
C20 Ru1 C21 C22 -117.15(7) . .
C18 Ru1 C21 C22 -37.60(5) . .
C18 Ru1 C21 C22 -99.1(2) 2_565 .
C19 Ru1 C21 C22 -58.98(17) 2_565 .
C19 Ru1 C21 C22 -80.58(8) . .
Ru2 Ru1 C21 C22 155.41(12) 2_565 .
C1 Ru1 C21 C26 105.4(6) . .
C21 Ru1 C21 C26 -106.87(8) 2_565 .
C22 Ru1 C21 C26 -121.24(7) . .
C22 Ru1 C21 C26 109.9(6) 2_565 .
C20 Ru1 C21 C26 -139.96(17) 2_565 .
C20 Ru1 C21 C26 121.61(7) . .
C18 Ru1 C21 C26 -158.8 . .
C18 Ru1 C21 C26 139.6(3) 2_565 .
C19 Ru1 C21 C26 179.8(2) 2_565 .
C19 Ru1 C21 C26 158.2 . .
Ru2 Ru1 C21 C26 34.17(13) 2_565 .
C19 C18 C22 C21 0.1 . .
C23 C18 C22 C21 180.0 . .
Ru1 C18 C22 C21 -62.27(14) . .
C19 C18 C22 C27 -179.9 . .
C23 C18 C22 C27 0.0 . .
Ru1 C18 C22 C27 117.73(14) . .
C19 C18 C22 Ru1 62.33(14) . .
C23 C18 C22 Ru1 -117.73(14) . .
C20 C21 C22 C18 0.0 . .
C26 C21 C22 C18 180.0 . .
Ru1 C21 C22 C18 62.72(13) . .
C20 C21 C22 C27 180.0 . .
C26 C21 C22 C27 0.0 . .
Ru1 C21 C22 C27 -117.28(13) . .
C20 C21 C22 Ru1 -62.72(13) . .
C26 C21 C22 Ru1 117.29(13) . .
C1 Ru1 C22 C18 40.8(3) . .
C21 Ru1 C22 C18 -117.16(7) . .
C21 Ru1 C22 C18 -141.5(6) 2_565 .
C22 Ru1 C22 C18 -101.76(7) 2_565 .
C20 Ru1 C22 C18 20.2(5) 2_565 .
C20 Ru1 C22 C18 -79.55(8) . .
C18 Ru1 C22 C18 -60.16(15) 2_565 .
C19 Ru1 C22 C18 -17.1(2) 2_565 .
C19 Ru1 C22 C18 -38.0 . .
Ru2 Ru1 C22 C18 -170.1(3) 2_565 .
C1 Ru1 C22 C21 158.0(3) . .
C21 Ru1 C22 C21 -24.4(6) 2_565 .
C22 Ru1 C22 C21 15.4 2_565 .
C20 Ru1 C22 C21 137.4(4) 2_565 .
C20 Ru1 C22 C21 37.61(5) . .
C18 Ru1 C22 C21 117.16(7) . .
C18 Ru1 C22 C21 56.99(13) 2_565 .
C19 Ru1 C22 C21 100.02(18) 2_565 .
C19 Ru1 C22 C21 79.16(8) . .
Ru2 Ru1 C22 C21 -53.0(2) 2_565 .
C1 Ru1 C22 C27 -80.8(3) . .
C21 Ru1 C22 C27 121.23(7) . .
C21 Ru1 C22 C27 96.9(6) 2_565 .
C22 Ru1 C22 C27 136.63(6) 2_565 .
C20 Ru1 C22 C27 -101.4(5) 2_565 .
C20 Ru1 C22 C27 158.8 . .
C18 Ru1 C22 C27 -121.61(7) . .
C18 Ru1 C22 C27 178.22(15) 2_565 .
C19 Ru1 C22 C27 -138.7(2) 2_565 .
C19 Ru1 C22 C27 -159.6 . .
Ru2 Ru1 C22 C27 68.3(3) 2_565 .
