#------------------------------------------------------------------------------
#$Date: 2016-03-25 11:38:34 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179800 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/96/7009658.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_7009658
loop_
_publ_author_name
'Gemel, Christian'
'John, Roland'
'Slugovc, Christian'
'Mereiter, Kurt'
'Schmid, Roland'
'Kirchner, Karl'
_publ_section_title
;
 Synthesis and characterization of ruthenium quinolin-8-olate
 complexes. Unexpected formation of a κ1-hydrotris(pyrazolyl)borate
 complex
;
_journal_issue                   15
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              2607
_journal_paper_doi               10.1039/b002490m
_journal_year                    2000
_chemical_formula_sum            'C26 H24 N2 O2 Ru'
_chemical_formula_weight         497.54
_chemical_name_systematic
; 
 trans(O,O),cis(N,N)-bis(8-hydroxyquinolinato-N,O)-(eta$4!-cyclo-octa-
 1,5-diene)-ruthenium(II) 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 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                 92.47(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.412(4)
_cell_length_b                   12.927(5)
_cell_length_c                   19.141(8)
_cell_measurement_reflns_used    8192
_cell_measurement_temperature    295(2)
_cell_measurement_theta_max      25
_cell_measurement_theta_min      2
_cell_volume                     2079.5(15)
_computing_cell_refinement       'Siemens SAINT'
_computing_data_collection       'Siemens SMART'
_computing_data_reduction        'Siemens SAINT and SHELXTL'
_computing_molecular_graphics    'Siemens SHELXTL'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      295(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type
'Siemens SMART 3-circle with CCD area detector'
_diffrn_measurement_method       '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  0.0346
_diffrn_reflns_av_sigmaI/netI    0.0287
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            16365
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.90
_exptl_absorpt_coefficient_mu    0.781
_exptl_absorpt_correction_T_max  0.98
_exptl_absorpt_correction_T_min  0.90
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.589
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             1016
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.03
_refine_diff_density_max         0.368
_refine_diff_density_min         -0.410
_refine_diff_density_rms         0.060
_refine_ls_extinction_coef       0.00027(16)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.096
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     281
_refine_ls_number_reflns         3651
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.096
_refine_ls_R_factor_all          0.0434
_refine_ls_R_factor_gt           0.0290
_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)+(0.0259P)²+1.5178P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0623
_refine_ls_wR_factor_ref         0.0697
_reflns_number_gt                2938
_reflns_number_total             3651
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b002490m.txt
_cod_data_source_block           kipi431
_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 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7009658
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ru Ru 0.71595(3) 0.256331(17) 0.364765(11) 0.02968(9) Uani 1 1 d . . .
O1 O 0.5019(2) 0.30000(15) 0.31423(10) 0.0364(5) Uani 1 1 d . . .
O2 O 0.8871(2) 0.23414(16) 0.44598(11) 0.0413(5) Uani 1 1 d . . .
N1 N 0.6869(3) 0.40408(18) 0.40727(12) 0.0339(6) Uani 1 1 d . . .
N2 N 0.5766(3) 0.18953(18) 0.44020(13) 0.0346(6) Uani 1 1 d . . .
C1 C 0.9312(4) 0.3067(2) 0.31467(17) 0.0407(8) Uani 1 1 d . . .
H1 H 0.9760 0.3714 0.3336 0.049 Uiso 1 1 calc R . .
C2 C 0.8052(4) 0.3205(2) 0.26761(16) 0.0385(7) Uani 1 1 d . . .
H2 H 0.7765 0.3931 0.2593 0.046 Uiso 1 1 calc R . .
C3 C 0.7704(4) 0.2503(3) 0.20559(17) 0.0513(9) Uani 1 1 d . . .
H3A H 0.8704 0.2234 0.1897 0.062 Uiso 1 1 calc R . .
H3B H 0.7221 0.2910 0.1678 0.062 Uiso 1 1 calc R . .
C4 C 0.6610(5) 0.1592(3) 0.22031(17) 0.0516(9) Uani 1 1 d . . .
H4A H 0.5522 0.1788 0.2077 0.062 Uiso 1 1 calc R . .
H4B H 0.6888 0.1015 0.1908 0.062 Uiso 1 1 calc R . .
C5 C 0.6699(4) 0.1245(2) 0.29565(17) 0.0426(8) Uani 1 1 d . . .
H5 H 0.5796 0.0819 0.3087 0.051 Uiso 1 1 calc R . .
C6 C 0.8087(4) 0.1053(2) 0.33523(18) 0.0429(8) Uani 1 1 d . . .
H6 H 0.7983 0.0516 0.3709 0.052 Uiso 1 1 calc R . .
C7 C 0.9734(4) 0.1129(3) 0.3065(2) 0.0574(10) Uani 1 1 d . . .
H7A H 1.0421 0.0627 0.3303 0.069 Uiso 1 1 calc R . .
H7B H 0.9667 0.0948 0.2573 0.069 Uiso 1 1 calc R . .
C8 C 1.0486(4) 0.2184(3) 0.3142(2) 0.0555(10) Uani 1 1 d . . .
H8A H 1.1191 0.2290 0.2761 0.067 Uiso 1 1 calc R . .
H8B H 1.1129 0.2201 0.3575 0.067 Uiso 1 1 calc R . .
C9 C 0.7823(4) 0.4546(2) 0.45187(17) 0.0440(8) Uani 1 1 d . . .
H9 H 0.8756 0.4229 0.4686 0.053 Uiso 1 1 calc R . .
C10 C 0.7472(5) 0.5549(3) 0.47490(18) 0.0512(9) Uani 1 1 d . . .
H10 H 0.8170 0.5889 0.5061 0.061 Uiso 1 1 calc R . .
C11 C 0.6111(5) 0.6020(3) 0.45146(18) 0.0512(9) Uani 1 1 d . . .
H11 H 0.5879 0.6684 0.4668 0.061 Uiso 1 1 calc R . .
C12 C 0.5046(4) 0.5515(2) 0.40420(16) 0.0398(8) Uani 1 1 d . . .
C13 C 0.3607(4) 0.5923(3) 0.37770(19) 0.0520(9) Uani 1 1 d . . .
H13 H 0.3294 0.6584 0.3905 0.062 Uiso 1 1 calc R . .
C14 C 0.2663(4) 0.5348(3) 0.3330(2) 0.0532(9) Uani 1 1 d . . .
H14 H 0.1694 0.5620 0.3166 0.064 Uiso 1 1 calc R . .
C15 C 0.3106(4) 0.4359(3) 0.31083(17) 0.0446(8) Uani 1 1 d . . .
H15 H 0.2434 0.3993 0.2799 0.054 Uiso 1 1 calc R . .
C16 C 0.4532(3) 0.3921(2) 0.33435(15) 0.0322(7) Uani 1 1 d . . .
C17 C 0.5495(3) 0.4507(2) 0.38244(14) 0.0322(7) Uani 1 1 d . . .
C18 C 0.4243(4) 0.1654(2) 0.43464(17) 0.0414(8) Uani 1 1 d . . .
H18 H 0.3679 0.1779 0.3926 0.050 Uiso 1 1 calc R . .
C19 C 0.3448(4) 0.1212(3) 0.49052(19) 0.0491(9) Uani 1 1 d . . .
H19 H 0.2376 0.1042 0.4851 0.059 Uiso 1 1 calc R . .
C20 C 0.4249(5) 0.1036(2) 0.55222(19) 0.0515(9) Uani 1 1 d . . .
H20 H 0.3718 0.0755 0.5894 0.062 Uiso 1 1 calc R . .
C21 C 0.5881(4) 0.1277(2) 0.56059(17) 0.0433(8) Uani 1 1 d . . .
C22 C 0.6826(5) 0.1137(3) 0.62218(18) 0.0549(10) Uani 1 1 d . . .
H22 H 0.6385 0.0853 0.6616 0.066 Uiso 1 1 calc R . .
C23 C 0.8399(5) 0.1418(3) 0.62415(19) 0.0587(10) Uani 1 1 d . . .
H23 H 0.9001 0.1343 0.6657 0.070 Uiso 1 1 calc R . .
C24 C 0.9123(4) 0.1815(3) 0.56557(18) 0.0519(9) Uani 1 1 d . . .
H24 H 1.0199 0.1982 0.5686 0.062 Uiso 1 1 calc R . .
C25 C 0.8261(4) 0.1962(2) 0.50281(16) 0.0399(7) Uani 1 1 d . . .
C26 C 0.6614(4) 0.1699(2) 0.50153(15) 0.0354(7) 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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
O1 Ru N2 86.17(9) . . ?
O1 Ru O2 159.17(8) . . ?
N2 Ru O2 79.53(10) . . ?
O1 Ru N1 79.66(9) . . ?
N2 Ru N1 91.73(9) . . ?
O2 Ru N1 85.67(9) . . ?
O1 Ru C5 78.64(11) . . ?
N2 Ru C5 90.34(11) . . ?
O2 Ru C5 116.22(11) . . ?
N1 Ru C5 158.01(11) . . ?
O1 Ru C1 115.55(11) . . ?
N2 Ru C1 158.22(11) . . ?
O2 Ru C1 79.06(11) . . ?
N1 Ru C1 90.65(11) . . ?
C5 Ru C1 95.48(12) . . ?
O1 Ru C6 115.63(11) . . ?
N2 Ru C6 91.53(11) . . ?
O2 Ru C6 80.09(11) . . ?
N1 Ru C6 164.56(12) . . ?
C5 Ru C6 37.01(12) . . ?
C1 Ru C6 80.85(12) . . ?
O1 Ru C2 79.91(10) . . ?
N2 Ru C2 164.71(11) . . ?
O2 Ru C2 115.55(11) . . ?
N1 Ru C2 91.96(11) . . ?
C5 Ru C2 80.79(12) . . ?
C1 Ru C2 36.51(11) . . ?
C6 Ru C2 88.84(12) . . ?
C16 O1 Ru 112.38(17) . . ?
C25 O2 Ru 112.60(19) . . ?
C9 N1 C17 119.1(3) . . ?
C9 N1 Ru 128.7(2) . . ?
C17 N1 Ru 112.15(19) . . ?
C18 N2 C26 119.6(3) . . ?
C18 N2 Ru 128.0(2) . . ?
C26 N2 Ru 112.4(2) . . ?
C2 C1 C8 125.6(3) . . ?
C2 C1 Ru 72.28(17) . . ?
C8 C1 Ru 109.4(2) . . ?
C2 C1 H1 113.9 . . ?
C8 C1 H1 113.9 . . ?
Ru C1 H1 113.9 . . ?
C1 C2 C3 123.7(3) . . ?
C1 C2 Ru 71.21(18) . . ?
C3 C2 Ru 112.1(2) . . ?
C1 C2 H2 114.1 . . ?
C3 C2 H2 114.1 . . ?
Ru C2 H2 114.1 . . ?
C2 C3 C4 114.5(3) . . ?
C2 C3 H3A 108.6 . . ?
C4 C3 H3A 108.6 . . ?
C2 C3 H3B 108.6 . . ?
C4 C3 H3B 108.6 . . ?
H3A C3 H3B 107.6 . . ?
C5 C4 C3 113.6(3) . . ?
C5 C4 H4A 108.9 . . ?
C3 C4 H4A 108.9 . . ?
C5 C4 H4B 108.9 . . ?
C3 C4 H4B 108.9 . . ?
H4A C4 H4B 107.7 . . ?
C6 C5 C4 125.6(3) . . ?
C6 C5 Ru 71.65(18) . . ?
C4 C5 Ru 110.3(2) . . ?
C6 C5 H5 113.8 . . ?
C4 C5 H5 113.8 . . ?
Ru C5 H5 113.8 . . ?
C5 C6 C7 123.4(3) . . ?
C5 C6 Ru 71.34(17) . . ?
C7 C6 Ru 112.2(2) . . ?
C5 C6 H6 114.2 . . ?
C7 C6 H6 114.2 . . ?
Ru C6 H6 114.2 . . ?
C8 C7 C6 114.1(3) . . ?
C8 C7 H7A 108.7 . . ?
C6 C7 H7A 108.7 . . ?
C8 C7 H7B 108.7 . . ?
C6 C7 H7B 108.7 . . ?
H7A C7 H7B 107.6 . . ?
C7 C8 C1 114.4(3) . . ?
C7 C8 H8A 108.7 . . ?
C1 C8 H8A 108.7 . . ?
C7 C8 H8B 108.7 . . ?
C1 C8 H8B 108.7 . . ?
H8A C8 H8B 107.6 . . ?
N1 C9 C10 122.0(3) . . ?
N1 C9 H9 119.0 . . ?
C10 C9 H9 119.0 . . ?
C11 C10 C9 119.8(3) . . ?
C11 C10 H10 120.1 . . ?
C9 C10 H10 120.1 . . ?
C10 C11 C12 120.6(3) . . ?
C10 C11 H11 119.7 . . ?
C12 C11 H11 119.7 . . ?
C13 C12 C11 125.2(3) . . ?
C13 C12 C17 118.5(3) . . ?
C11 C12 C17 116.3(3) . . ?
C14 C13 C12 119.6(3) . . ?
C14 C13 H13 120.2 . . ?
C12 C13 H13 120.2 . . ?
C13 C14 C15 122.1(3) . . ?
C13 C14 H14 118.9 . . ?
C15 C14 H14 118.9 . . ?
C16 C15 C14 120.9(3) . . ?
C16 C15 H15 119.6 . . ?
C14 C15 H15 119.6 . . ?
O1 C16 C15 123.3(3) . . ?
O1 C16 C17 119.7(3) . . ?
C15 C16 C17 117.0(3) . . ?
N1 C17 C16 116.1(3) . . ?
N1 C17 C12 122.1(3) . . ?
C16 C17 C12 121.8(3) . . ?
N2 C18 C19 121.8(3) . . ?
N2 C18 H18 119.1 . . ?
C19 C18 H18 119.1 . . ?
C20 C19 C18 119.8(3) . . ?
C20 C19 H19 120.1 . . ?
C18 C19 H19 120.1 . . ?
C19 C20 C21 120.5(3) . . ?
C19 C20 H20 119.8 . . ?
C21 C20 H20 119.8 . . ?
C22 C21 C20 125.4(3) . . ?
C22 C21 C26 117.9(3) . . ?
C20 C21 C26 116.6(3) . . ?
C23 C22 C21 120.0(3) . . ?
C23 C22 H22 120.0 . . ?
C21 C22 H22 120.0 . . ?
C22 C23 C24 121.9(3) . . ?
C22 C23 H23 119.0 . . ?
C24 C23 H23 119.0 . . ?
C25 C24 C23 121.0(4) . . ?
C25 C24 H24 119.5 . . ?
C23 C24 H24 119.5 . . ?
O2 C25 C24 123.9(3) . . ?
O2 C25 C26 119.2(3) . . ?
C24 C25 C26 116.9(3) . . ?
N2 C26 C21 121.6(3) . . ?
N2 C26 C25 116.1(3) . . ?
C21 C26 C25 122.2(3) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ru O1 2.085(2) . ?
Ru N2 2.086(2) . ?
Ru O2 2.093(2) . ?
Ru N1 2.094(2) . ?
Ru C5 2.182(3) . ?
Ru C1 2.184(3) . ?
Ru C6 2.186(3) . ?
Ru C2 2.198(3) . ?
O1 C16 1.321(3) . ?
O2 C25 1.317(4) . ?
N1 C9 1.319(4) . ?
N1 C17 1.370(4) . ?
N2 C18 1.318(4) . ?
N2 C26 1.371(4) . ?
C1 C2 1.373(4) . ?
C1 C8 1.509(5) . ?
C1 H1 0.9800 . ?
C2 C3 1.513(4) . ?
C2 H2 0.9800 . ?
C3 C4 1.528(5) . ?
C3 H3A 0.9700 . ?
C3 H3B 0.9700 . ?
C4 C5 1.509(5) . ?
C4 H4A 0.9700 . ?
C4 H4B 0.9700 . ?
C5 C6 1.386(5) . ?
C5 H5 0.9800 . ?
C6 C7 1.516(5) . ?
C6 H6 0.9800 . ?
C7 C8 1.508(5) . ?
C7 H7A 0.9700 . ?
C7 H7B 0.9700 . ?
C8 H8A 0.9700 . ?
C8 H8B 0.9700 . ?
C9 C10 1.405(5) . ?
C9 H9 0.9300 . ?
C10 C11 1.356(5) . ?
C10 H10 0.9300 . ?
C11 C12 1.406(5) . ?
C11 H11 0.9300 . ?
C12 C13 1.396(5) . ?
C12 C17 1.424(4) . ?
C13 C14 1.363(5) . ?
C13 H13 0.9300 . ?
C14 C15 1.402(5) . ?
C14 H14 0.9300 . ?
C15 C16 1.384(4) . ?
C15 H15 0.9300 . ?
C16 C17 1.419(4) . ?
C18 C19 1.406(5) . ?
C18 H18 0.9300 . ?
C19 C20 1.353(5) . ?
C19 H19 0.9300 . ?
C20 C21 1.411(5) . ?
C20 H20 0.9300 . ?
C21 C22 1.405(5) . ?
C21 C26 1.420(4) . ?
C22 C23 1.371(5) . ?
C22 H22 0.9300 . ?
C23 C24 1.396(5) . ?
C23 H23 0.9300 . ?
C24 C25 1.389(4) . ?
C24 H24 0.9300 . ?
C25 C26 1.425(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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N2 Ru O1 C16 90.38(19) . . . . ?
O2 Ru O1 C16 43.9(3) . . . . ?
N1 Ru O1 C16 -2.08(18) . . . . ?
C5 Ru O1 C16 -178.5(2) . . . . ?
C1 Ru O1 C16 -87.8(2) . . . . ?
C6 Ru O1 C16 -179.75(18) . . . . ?
C2 Ru O1 C16 -96.0(2) . . . . ?
O1 Ru O2 C25 44.3(3) . . . . ?
N2 Ru O2 C25 -3.1(2) . . . . ?
N1 Ru O2 C25 89.5(2) . . . . ?
C5 Ru O2 C25 -88.3(2) . . . . ?
C1 Ru O2 C25 -179.0(2) . . . . ?
C6 Ru O2 C25 -96.5(2) . . . . ?
C2 Ru O2 C25 179.6(2) . . . . ?
O1 Ru N1 C9 -178.1(3) . . . . ?
N2 Ru N1 C9 96.1(3) . . . . ?
O2 Ru N1 C9 16.7(3) . . . . ?
C5 Ru N1 C9 -168.7(3) . . . . ?
C1 Ru N1 C9 -62.3(3) . . . . ?
C6 Ru N1 C9 -6.0(5) . . . . ?
C2 Ru N1 C9 -98.8(3) . . . . ?
O1 Ru N1 C17 0.76(18) . . . . ?
N2 Ru N1 C17 -85.0(2) . . . . ?
O2 Ru N1 C17 -164.39(19) . . . . ?
C5 Ru N1 C17 10.2(4) . . . . ?
C1 Ru N1 C17 116.6(2) . . . . ?
C6 Ru N1 C17 172.9(4) . . . . ?
C2 Ru N1 C17 80.1(2) . . . . ?
O1 Ru N2 C18 17.8(2) . . . . ?
O2 Ru N2 C18 -177.5(3) . . . . ?
N1 Ru N2 C18 97.3(3) . . . . ?
C5 Ru N2 C18 -60.8(3) . . . . ?
C1 Ru N2 C18 -166.6(3) . . . . ?
C6 Ru N2 C18 -97.8(3) . . . . ?
C2 Ru N2 C18 -6.6(5) . . . . ?
O1 Ru N2 C26 -162.64(19) . . . . ?
O2 Ru N2 C26 2.14(18) . . . . ?
N1 Ru N2 C26 -83.13(19) . . . . ?
C5 Ru N2 C26 118.8(2) . . . . ?
C1 Ru N2 C26 13.0(4) . . . . ?
C6 Ru N2 C26 81.8(2) . . . . ?
C2 Ru N2 C26 173.0(3) . . . . ?
O1 Ru C1 C2 -13.6(2) . . . . ?
N2 Ru C1 C2 171.3(2) . . . . ?
O2 Ru C1 C2 -177.9(2) . . . . ?
N1 Ru C1 C2 -92.41(19) . . . . ?
C5 Ru C1 C2 66.4(2) . . . . ?
C6 Ru C1 C2 100.5(2) . . . . ?
O1 Ru C1 C8 -135.9(2) . . . . ?
N2 Ru C1 C8 49.0(4) . . . . ?
O2 Ru C1 C8 59.8(2) . . . . ?
N1 Ru C1 C8 145.3(2) . . . . ?
C5 Ru C1 C8 -55.9(3) . . . . ?
C6 Ru C1 C8 -21.8(2) . . . . ?
C2 Ru C1 C8 -122.3(3) . . . . ?
C8 C1 C2 C3 -3.0(5) . . . . ?
Ru C1 C2 C3 -104.5(3) . . . . ?
C8 C1 C2 Ru 101.5(3) . . . . ?
O1 Ru C2 C1 167.6(2) . . . . ?
N2 Ru C2 C1 -167.7(3) . . . . ?
O2 Ru C2 C1 2.3(2) . . . . ?
N1 Ru C2 C1 88.45(19) . . . . ?
C5 Ru C2 C1 -112.4(2) . . . . ?
C6 Ru C2 C1 -76.1(2) . . . . ?
O1 Ru C2 C3 -72.8(2) . . . . ?
N2 Ru C2 C3 -48.1(5) . . . . ?
O2 Ru C2 C3 121.9(2) . . . . ?
N1 Ru C2 C3 -152.0(2) . . . . ?
C5 Ru C2 C3 7.2(2) . . . . ?
C1 Ru C2 C3 119.6(3) . . . . ?
C6 Ru C2 C3 43.5(2) . . . . ?
C1 C2 C3 C4 90.3(4) . . . . ?
Ru C2 C3 C4 8.7(4) . . . . ?
C2 C3 C4 C5 -27.9(4) . . . . ?
C3 C4 C5 C6 -48.5(4) . . . . ?
C3 C4 C5 Ru 33.0(4) . . . . ?
O1 Ru C5 C6 -178.1(2) . . . . ?
N2 Ru C5 C6 -92.09(19) . . . . ?
O2 Ru C5 C6 -13.6(2) . . . . ?
N1 Ru C5 C6 172.4(2) . . . . ?
C1 Ru C5 C6 66.9(2) . . . . ?
C2 Ru C5 C6 100.4(2) . . . . ?
O1 Ru C5 C4 59.8(2) . . . . ?
N2 Ru C5 C4 145.9(2) . . . . ?
O2 Ru C5 C4 -135.6(2) . . . . ?
N1 Ru C5 C4 50.4(4) . . . . ?
C1 Ru C5 C4 -55.2(3) . . . . ?
C6 Ru C5 C4 -122.0(3) . . . . ?
C2 Ru C5 C4 -21.6(2) . . . . ?
C4 C5 C6 C7 -2.5(5) . . . . ?
Ru C5 C6 C7 -104.8(3) . . . . ?
C4 C5 C6 Ru 102.3(3) . . . . ?
O1 Ru C6 C5 2.1(2) . . . . ?
N2 Ru C6 C5 88.5(2) . . . . ?
O2 Ru C6 C5 167.6(2) . . . . ?
N1 Ru C6 C5 -169.3(3) . . . . ?
C1 Ru C6 C5 -112.0(2) . . . . ?
C2 Ru C6 C5 -76.2(2) . . . . ?
O1 Ru C6 C7 121.4(2) . . . . ?
N2 Ru C6 C7 -152.1(3) . . . . ?
O2 Ru C6 C7 -73.0(3) . . . . ?
N1 Ru C6 C7 -50.0(5) . . . . ?
C5 Ru C6 C7 119.4(3) . . . . ?
C1 Ru C6 C7 7.4(3) . . . . ?
C2 Ru C6 C7 43.2(3) . . . . ?
C5 C6 C7 C8 90.5(4) . . . . ?
Ru C6 C7 C8 8.8(4) . . . . ?
C6 C7 C8 C1 -28.6(5) . . . . ?
C2 C1 C8 C7 -48.0(5) . . . . ?
Ru C1 C8 C7 33.6(4) . . . . ?
C17 N1 C9 C10 0.1(5) . . . . ?
Ru N1 C9 C10 179.0(2) . . . . ?
N1 C9 C10 C11 0.5(5) . . . . ?
C9 C10 C11 C12 -0.1(5) . . . . ?
C10 C11 C12 C13 179.1(3) . . . . ?
C10 C11 C12 C17 -0.9(5) . . . . ?
C11 C12 C13 C14 -178.9(3) . . . . ?
C17 C12 C13 C14 1.0(5) . . . . ?
C12 C13 C14 C15 -1.7(5) . . . . ?
C13 C14 C15 C16 0.5(5) . . . . ?
Ru O1 C16 C15 -176.8(2) . . . . ?
Ru O1 C16 C17 3.2(3) . . . . ?
C14 C15 C16 O1 -178.8(3) . . . . ?
C14 C15 C16 C17 1.2(4) . . . . ?
C9 N1 C17 C16 179.6(3) . . . . ?
Ru N1 C17 C16 0.6(3) . . . . ?
C9 N1 C17 C12 -1.2(4) . . . . ?
Ru N1 C17 C12 179.8(2) . . . . ?
O1 C16 C17 N1 -2.6(4) . . . . ?
C15 C16 C17 N1 177.4(3) . . . . ?
O1 C16 C17 C12 178.2(3) . . . . ?
C15 C16 C17 C12 -1.8(4) . . . . ?
C13 C12 C17 N1 -178.4(3) . . . . ?
C11 C12 C17 N1 1.5(4) . . . . ?
C13 C12 C17 C16 0.7(4) . . . . ?
C11 C12 C17 C16 -179.3(3) . . . . ?
C26 N2 C18 C19 1.0(4) . . . . ?
Ru N2 C18 C19 -179.4(2) . . . . ?
N2 C18 C19 C20 0.7(5) . . . . ?
C18 C19 C20 C21 -1.0(5) . . . . ?
C19 C20 C21 C22 179.4(3) . . . . ?
C19 C20 C21 C26 -0.3(5) . . . . ?
C20 C21 C22 C23 -178.8(3) . . . . ?
C26 C21 C22 C23 0.8(5) . . . . ?
C21 C22 C23 C24 -2.2(5) . . . . ?
C22 C23 C24 C25 1.5(5) . . . . ?
Ru O2 C25 C24 -175.2(3) . . . . ?
Ru O2 C25 C26 3.7(3) . . . . ?
C23 C24 C25 O2 179.4(3) . . . . ?
C23 C24 C25 C26 0.5(5) . . . . ?
C18 N2 C26 C21 -2.4(4) . . . . ?
Ru N2 C26 C21 177.9(2) . . . . ?
C18 N2 C26 C25 178.7(3) . . . . ?
Ru N2 C26 C25 -1.0(3) . . . . ?
C22 C21 C26 N2 -177.6(3) . . . . ?
C20 C21 C26 N2 2.1(4) . . . . ?
C22 C21 C26 C25 1.2(4) . . . . ?
C20 C21 C26 C25 -179.1(3) . . . . ?
O2 C25 C26 N2 -1.9(4) . . . . ?
C24 C25 C26 N2 177.1(3) . . . . ?
O2 C25 C26 C21 179.3(3) . . . . ?
C24 C25 C26 C21 -1.8(4) . . . . ?
