#------------------------------------------------------------------------------
#$Date: 2016-03-23 02:30:28 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179183 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/30/4313009.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_4313009
loop_
_publ_author_name
'Takayoshi Suzuki'
'Takashi Kuchiyama'
'Shinobu Kishi'
'Sumio Kaizaki'
'Hideo D. Takagi'
'Masako Kato'
_publ_contact_author
;
      Dr Takayoshi Suzuki
      Department of Chemistry
      Graduate of Science, Osaka University
      Toyonaka, 560-0043
      Japan
;
_publ_contact_author_email       suzuki@chem.sci.osaka-u.ac.jp
_publ_section_title
;
 Ruthenium(II) Complexes Containing 8-(Dimethylphosphino)quinoline
 (Me2Pqn): Preparation, Crystal Structures, and Electrochemical and
 Spectroscopic Properties of [Ru(bpy or phen)3-n(Me2Pqn)n](PF6)2(bpy =
 2,2'-Bipyridine; phen = 1,10-Phenanthroline; n= 1, 2, or 3)
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              785
_journal_page_last               795
_journal_paper_doi               10.1021/ic020344l
_journal_volume                  42
_journal_year                    2003
_chemical_formula_moiety         'C33 H36 N3 P3 Ru 2+, (F6 P 1-)2, C H2 Cl2'
_chemical_formula_sum            'C34 H38 Cl2 F12 N3 P5 Ru'
_chemical_formula_weight         1043.49
_chemical_name_common            '[Ru(Me₂Pqn)₃](PF₆)₂.CH₂Cl₂'
_chemical_name_systematic
;
mer-Tris(8-dimethylphosphinoquinoline)ruthenium(II)
Hexafluorophosphate Dichloromethane Solvate
;
_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                98.45(3)
_cell_angle_beta                 105.95(2)
_cell_angle_gamma                85.06(3)
_cell_formula_units_Z            4
_cell_length_a                   17.811(5)
_cell_length_b                   18.643(7)
_cell_length_c                   13.382(3)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      15.0
_cell_measurement_theta_min      14.9
_cell_volume                     4221(2)
_computing_cell_refinement       'MSC/AFC Diffractometer Control'
_computing_data_collection       'MSC/AFC Diffractometer Control'
_computing_data_reduction        'teXsan Ver. 1.11'
_computing_molecular_graphics    'ORTEP in teXsan Ver. 1.11'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Rigaku AFC5R'
_diffrn_measurement_method       ω-2θ
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'rotating anode'
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0388
_diffrn_reflns_av_sigmaI/netI    0.1303
_diffrn_reflns_limit_h_max       0
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            19979
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         2.55
_diffrn_standards_decay_%        0.79
_diffrn_standards_interval_count 150
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    0.771
_exptl_absorpt_correction_T_max  0.912
_exptl_absorpt_correction_T_min  0.753
_exptl_absorpt_correction_type   integration
_exptl_absorpt_process_details   Coppens_numerical
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.642
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             2096
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.36
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.689
_refine_diff_density_min         -1.114
_refine_diff_density_rms         0.112
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.945
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1039
_refine_ls_number_reflns         19358
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.945
_refine_ls_R_factor_all          0.1926
_refine_ls_R_factor_gt           0.0633
_refine_ls_shift/su_max          0.023
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1544P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1849
_refine_ls_wR_factor_ref         0.2463
_reflns_number_gt                8601
_reflns_number_total             19358
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ic020344l_3.cif
_cod_data_source_block           mertris
_cod_database_code               4313009
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
_atom_site_disorder_assembly
_atom_site_disorder_group
Ru1 Ru 0.29383(3) 0.25492(3) 0.13534(4) 0.03957(15) Uani 1 1 d . . .
Ru2 Ru 0.16859(3) 0.72229(3) 0.47275(4) 0.05096(18) Uani 1 1 d . . .
Cl1 Cl 0.5683(3) 0.1460(6) 0.9270(4) 0.303(5) Uani 1 1 d . . .
Cl2 Cl 0.5665(4) 0.0957(4) 0.7205(4) 0.224(3) Uani 1 1 d . . .
Cl3 Cl 0.7752(2) 0.1427(2) 0.8902(3) 0.1183(10) Uani 1 1 d . . .
Cl4 Cl 0.7459(4) -0.0064(3) 0.8054(5) 0.228(3) Uani 1 1 d . . .
P1 P 0.30677(12) 0.29985(10) -0.00560(13) 0.0518(5) Uani 1 1 d . . .
P2 P 0.19102(12) 0.33547(10) 0.15735(15) 0.0524(5) Uani 1 1 d . . .
P3 P 0.40688(11) 0.17629(10) 0.15154(13) 0.0471(4) Uani 1 1 d . . .
P4 P 0.28223(13) 0.75695(12) 0.45264(16) 0.0608(5) Uani 1 1 d . . .
P5 P 0.22277(13) 0.60692(11) 0.50473(15) 0.0567(5) Uani 1 1 d . . .
P6 P 0.10134(13) 0.83205(12) 0.41910(15) 0.0587(5) Uani 1 1 d . . .
P11 P 0.32334(15) 0.99860(15) 0.7524(2) 0.0863(8) Uani 1 1 d . . .
P12 P -0.0127(2) 0.91711(17) 0.7464(2) 0.0920(9) Uani 1 1 d . . .
P13 P 0.0921(2) 0.50914(16) 0.7867(2) 0.0905(8) Uani 1 1 d . . .
P14 P 0.38769(16) 0.34068(14) -0.36391(18) 0.0721(6) Uani 1 1 d . . .
F11 F 0.3138(4) 1.0813(4) 0.7905(7) 0.143(3) Uani 1 1 d . . .
F12 F 0.2365(4) 0.9936(5) 0.7009(9) 0.202(5) Uani 1 1 d . . .
F13 F 0.3003(6) 0.9829(6) 0.8557(8) 0.178(4) Uani 1 1 d . . .
F14 F 0.3480(8) 1.0111(5) 0.6568(7) 0.199(5) Uani 1 1 d . . .
F15 F 0.4095(4) 0.9981(5) 0.8191(7) 0.150(3) Uani 1 1 d . . .
F16 F 0.3346(4) 0.9134(3) 0.7210(6) 0.128(3) Uani 1 1 d . . .
F21 F -0.0652(4) 0.8635(4) 0.7711(5) 0.130(3) Uani 1 1 d . . .
F22 F -0.0473(6) 0.9798(6) 0.8071(12) 0.231(6) Uani 1 1 d . . .
F23 F -0.0812(7) 0.9324(8) 0.6480(9) 0.235(7) Uani 1 1 d . . .
F24 F 0.0504(5) 0.9084(7) 0.8460(8) 0.207(6) Uani 1 1 d . . .
F25 F 0.0136(10) 0.8583(8) 0.6777(13) 0.281(9) Uani 1 1 d . . .
F26 F 0.0393(6) 0.9725(6) 0.7232(6) 0.188(5) Uani 1 1 d . . .
F31 F 0.1023(6) 0.5925(4) 0.8089(10) 0.187(4) Uani 1 1 d . . .
F32 F 0.0064(8) 0.5210(7) 0.7345(15) 0.290(9) Uani 1 1 d . . .
F33 F 0.0664(9) 0.5135(7) 0.8859(8) 0.220(6) Uani 1 1 d . . .
F34 F 0.1196(13) 0.5060(8) 0.6988(12) 0.326(10) Uani 1 1 d . . .
F35 F 0.1738(6) 0.5033(6) 0.8659(12) 0.219(6) Uani 1 1 d . . .
F36 F 0.0805(5) 0.4264(4) 0.7745(8) 0.143(3) Uani 1 1 d . . .
F41 F 0.4166(7) 0.4118(4) -0.3838(7) 0.174(4) Uani 1 1 d . . .
F42 F 0.3230(6) 0.3447(8) -0.4637(8) 0.217(6) Uani 1 1 d . . .
F43 F 0.3460(9) 0.3841(6) -0.2884(9) 0.235(7) Uani 1 1 d . . .
F44 F 0.4319(7) 0.2972(5) -0.4376(8) 0.187(5) Uani 1 1 d . . .
F45 F 0.4579(5) 0.3305(6) -0.2656(7) 0.181(4) Uani 1 1 d . . .
F46 F 0.3569(6) 0.2700(5) -0.3441(6) 0.154(3) Uani 1 1 d . . .
N11 N 0.3704(3) 0.3362(3) 0.2190(4) 0.0428(12) Uani 1 1 d . . .
N21 N 0.2013(3) 0.1898(3) 0.0439(4) 0.0457(13) Uani 1 1 d . . .
N31 N 0.2890(3) 0.1998(3) 0.2705(4) 0.0416(12) Uani 1 1 d . . .
N41 N 0.1455(4) 0.6832(3) 0.3114(4) 0.0576(16) Uani 1 1 d . . .
N51 N 0.2067(4) 0.7433(3) 0.6391(4) 0.0518(14) Uani 1 1 d . . .
N61 N 0.0517(4) 0.7053(4) 0.4906(5) 0.0551(15) Uani 1 1 d . . .
C1 C 0.2230(6) 0.3249(6) -0.1105(6) 0.085(3) Uani 1 1 d . . .
H1A H 0.1957 0.2822 -0.1457 0.101 Uiso 1 1 calc R . .
H1B H 0.2408 0.3471 -0.1596 0.101 Uiso 1 1 calc R . .
H1C H 0.1883 0.3586 -0.0812 0.101 Uiso 1 1 calc R . .
C2 C 0.1885(6) 0.3704(5) 0.2896(7) 0.084(3) Uani 1 1 d . . .
H2A H 0.1388 0.3952 0.2886 0.101 Uiso 1 1 calc R . .
H2B H 0.2295 0.4036 0.3199 0.101 Uiso 1 1 calc R . .
H2C H 0.1959 0.3309 0.3306 0.101 Uiso 1 1 calc R . .
C3 C 0.4977(4) 0.2178(5) 0.1635(7) 0.067(2) Uani 1 1 d . . .
H3A H 0.5401 0.1820 0.1758 0.082 Uiso 1 1 calc R . .
H3B H 0.5062 0.2562 0.2212 0.082 Uiso 1 1 calc R . .
H3C H 0.4949 0.2373 0.1000 0.082 Uiso 1 1 calc R . .
C4 C 0.2975(7) 0.8523(5) 0.4504(9) 0.095(3) Uani 1 1 d . . .
H4A H 0.3002 0.8790 0.5182 0.110 Uiso 1 1 calc R . .
H4B H 0.2548 0.8720 0.3992 0.110 Uiso 1 1 calc R . .
H4C H 0.3455 0.8561 0.4325 0.110 Uiso 1 1 calc R . .
C5 C 0.1626(7) 0.5276(5) 0.4892(9) 0.091(3) Uani 1 1 d . . .
H5A H 0.1225 0.5262 0.4243 0.107 Uiso 1 1 calc R . .
H5B H 0.1390 0.5318 0.5464 0.107 Uiso 1 1 calc R . .
H5C H 0.1952 0.4839 0.4890 0.107 Uiso 1 1 calc R . .
C6 C 0.1056(6) 0.9229(5) 0.4911(8) 0.081(3) Uani 1 1 d . . .
H6A H 0.1581 0.9385 0.5091 0.100 Uiso 1 1 calc R . .
H6B H 0.0896 0.9224 0.5540 0.100 Uiso 1 1 calc R . .
H6C H 0.0712 0.9557 0.4484 0.100 Uiso 1 1 calc R . .
C11 C 0.3653(6) 0.2513(5) -0.0867(6) 0.080(3) Uani 1 1 d . . .
H11A H 0.3417 0.2066 -0.1206 0.096 Uiso 1 1 calc R . .
H11B H 0.4169 0.2410 -0.0439 0.096 Uiso 1 1 calc R . .
H11C H 0.3684 0.2804 -0.1388 0.096 Uiso 1 1 calc R . .
C12 C 0.3988(4) 0.3445(4) 0.3224(5) 0.0526(17) Uani 1 1 d . . .
H12 H 0.3877 0.3100 0.3591 0.064 Uiso 1 1 calc R . .
C13 C 0.4439(5) 0.4012(4) 0.3792(6) 0.062(2) Uani 1 1 d . . .
H13 H 0.4631 0.4030 0.4515 0.075 Uiso 1 1 calc R . .
C14 C 0.4601(5) 0.4543(4) 0.3294(6) 0.063(2) Uani 1 1 d . . .
H14 H 0.4895 0.4931 0.3671 0.075 Uiso 1 1 calc R . .
C15 C 0.4445(6) 0.5012(5) 0.1600(7) 0.077(3) Uani 1 1 d . . .
H15 H 0.4741 0.5407 0.1943 0.092 Uiso 1 1 calc R . .
C16 C 0.4153(7) 0.4947(5) 0.0556(8) 0.086(3) Uani 1 1 d . . .
H16 H 0.4232 0.5306 0.0186 0.102 Uiso 1 1 calc R . .
C17 C 0.3731(6) 0.4344(5) 0.0022(7) 0.077(3) Uani 1 1 d . . .
H17 H 0.3542 0.4304 -0.0703 0.091 Uiso 1 1 calc R . .
C18 C 0.3591(5) 0.3817(4) 0.0536(5) 0.0559(18) Uani 1 1 d . . .
C19 C 0.3875(4) 0.3886(4) 0.1654(5) 0.0472(16) Uani 1 1 d . . .
C20 C 0.4310(5) 0.4491(4) 0.2183(6) 0.0568(18) Uani 1 1 d . . .
C21 C 0.1653(6) 0.4200(4) 0.1008(9) 0.083(3) Uani 1 1 d . . .
H21A H 0.2082 0.4516 0.1267 0.103 Uiso 1 1 calc R . .
H21B H 0.1200 0.4431 0.1198 0.103 Uiso 1 1 calc R . .
H21C H 0.1541 0.4100 0.0258 0.103 Uiso 1 1 calc R . .
C22 C 0.2126(5) 0.1285(4) -0.0155(6) 0.0587(19) Uani 1 1 d . . .
H22 H 0.2633 0.1145 -0.0186 0.072 Uiso 1 1 calc R . .
C23 C 0.1517(5) 0.0835(4) -0.0742(6) 0.064(2) Uani 1 1 d . . .
H23 H 0.1622 0.0423 -0.1176 0.077 Uiso 1 1 calc R . .
C24 C 0.0790(5) 0.1005(5) -0.0672(6) 0.068(2) Uani 1 1 d . . .
H24 H 0.0389 0.0696 -0.1013 0.080 Uiso 1 1 calc R . .
C25 C -0.0132(5) 0.1869(6) 0.0001(7) 0.074(2) Uani 1 1 d . . .
H25 H -0.0538 0.1561 -0.0320 0.088 Uiso 1 1 calc R . .
C26 C -0.0274(5) 0.2518(6) 0.0540(8) 0.082(3) Uani 1 1 d . . .
H26 H -0.0782 0.2656 0.0573 0.101 Uiso 1 1 calc R . .
C27 C 0.0337(5) 0.2989(5) 0.1052(7) 0.070(2) Uani 1 1 d . . .
H27 H 0.0232 0.3432 0.1420 0.084 Uiso 1 1 calc R . .
C28 C 0.1085(4) 0.2785(4) 0.1001(6) 0.0529(17) Uani 1 1 d . . .
C29 C 0.1249(4) 0.2105(4) 0.0444(5) 0.0467(16) Uani 1 1 d . . .
C30 C 0.0636(5) 0.1660(4) -0.0072(6) 0.0603(19) Uani 1 1 d . . .
C31 C 0.4167(5) 0.0897(4) 0.0725(6) 0.071(2) Uani 1 1 d . . .
H31A H 0.4680 0.0680 0.0983 0.088 Uiso 1 1 calc R . .
H31B H 0.4090 0.0973 0.0009 0.088 Uiso 1 1 calc R . .
H31C H 0.3782 0.0580 0.0766 0.088 Uiso 1 1 calc R . .
C32 C 0.2250(5) 0.1988(4) 0.3027(5) 0.0543(18) Uani 1 1 d . . .
H32 H 0.1789 0.2199 0.2643 0.068 Uiso 1 1 calc R . .
C33 C 0.2226(5) 0.1675(5) 0.3916(6) 0.064(2) Uani 1 1 d . . .
H33 H 0.1756 0.1674 0.4091 0.075 Uiso 1 1 calc R . .
C34 C 0.2882(5) 0.1379(4) 0.4510(6) 0.065(2) Uani 1 1 d . . .
H34 H 0.2882 0.1214 0.5133 0.075 Uiso 1 1 calc R . .
C35 C 0.4262(5) 0.0973(5) 0.4687(7) 0.071(2) Uani 1 1 d . . .
H35 H 0.4290 0.0803 0.5316 0.085 Uiso 1 1 calc R . .
C36 C 0.4898(6) 0.0875(5) 0.4284(7) 0.076(3) Uani 1 1 d . . .
H36 H 0.5356 0.0643 0.4640 0.090 Uiso 1 1 calc R . .
C37 C 0.4854(5) 0.1127(4) 0.3338(6) 0.062(2) Uani 1 1 d . . .
H37 H 0.5281 0.1041 0.3055 0.074 Uiso 1 1 calc R . .
C38 C 0.4198(4) 0.1498(4) 0.2809(5) 0.0464(15) Uani 1 1 d . . .
C39 C 0.3548(4) 0.1622(4) 0.3228(5) 0.0466(16) Uani 1 1 d . . .
C40 C 0.3575(5) 0.1323(4) 0.4167(6) 0.0574(19) Uani 1 1 d . . .
C41 C 0.3777(6) 0.7341(7) 0.5385(8) 0.096(3) Uani 1 1 d . . .
H41A H 0.4173 0.7345 0.5023 0.116 Uiso 1 1 calc R . .
H41B H 0.3774 0.6866 0.5582 0.116 Uiso 1 1 calc R . .
H41C H 0.3886 0.7691 0.6003 0.116 Uiso 1 1 calc R . .
C42 C 0.0848(5) 0.6546(4) 0.2603(7) 0.064(2) Uani 1 1 d . . .
H42 H 0.0458 0.6537 0.2942 0.075 Uiso 1 1 calc R . .
C43 C 0.0686(6) 0.6223(5) 0.1534(7) 0.082(3) Uani 1 1 d . . .
H43 H 0.0202 0.6037 0.1182 0.100 Uiso 1 1 calc R . .
C44 C 0.1277(7) 0.6201(5) 0.1048(7) 0.084(3) Uani 1 1 d . . .
H44 H 0.1202 0.5983 0.0358 0.097 Uiso 1 1 calc R . .
C45 C 0.2611(7) 0.6496(6) 0.1151(8) 0.090(3) Uani 1 1 d . . .
H45 H 0.2558 0.6285 0.0462 0.107 Uiso 1 1 calc R . .
C46 C 0.3284(8) 0.6780(7) 0.1690(9) 0.102(4) Uani 1 1 d . . .
H46 H 0.3694 0.6760 0.1379 0.122 Uiso 1 1 calc R . .
C47 C 0.3385(6) 0.7123(6) 0.2767(8) 0.084(3) Uani 1 1 d . . .
H47 H 0.3854 0.7328 0.3143 0.107 Uiso 1 1 calc R . .
C48 C 0.2783(5) 0.7140(4) 0.3215(6) 0.061(2) Uani 1 1 d . . .
C49 C 0.2062(5) 0.6828(4) 0.2632(6) 0.0573(19) Uani 1 1 d . . .
C50 C 0.1982(5) 0.6502(4) 0.1579(6) 0.063(2) Uani 1 1 d . . .
C51 C 0.2970(6) 0.5636(5) 0.4409(7) 0.080(3) Uani 1 1 d . . .
H51A H 0.3167 0.5190 0.4685 0.096 Uiso 1 1 calc R . .
H51B H 0.3392 0.5955 0.4540 0.096 Uiso 1 1 calc R . .
H51C H 0.2740 0.5538 0.3667 0.096 Uiso 1 1 calc R . .
C52 C 0.1906(6) 0.8042(5) 0.6938(6) 0.083(3) Uani 1 1 d . . .
H52 H 0.1572 0.8383 0.6571 0.095 Uiso 1 1 calc R . .
C53 C 0.2189(7) 0.8226(6) 0.8021(7) 0.101(4) Uani 1 1 d . . .
H53 H 0.2049 0.8671 0.8355 0.119 Uiso 1 1 calc R . .
C54 C 0.2667(6) 0.7743(6) 0.8559(6) 0.083(3) Uani 1 1 d . . .
H54 H 0.2871 0.7852 0.9279 0.096 Uiso 1 1 calc R . .
C55 C 0.3387(7) 0.6525(7) 0.8554(8) 0.103(4) Uani 1 1 d . . .
H55 H 0.3628 0.6623 0.9267 0.125 Uiso 1 1 calc R . .
C56 C 0.3545(9) 0.5866(8) 0.8031(9) 0.127(5) Uani 1 1 d . . .
H56 H 0.3892 0.5524 0.8376 0.144 Uiso 1 1 calc R . .
C57 C 0.3171(7) 0.5725(6) 0.6970(8) 0.103(4) Uani 1 1 d . . .
H57 H 0.3243 0.5266 0.6621 0.119 Uiso 1 1 calc R . .
C58 C 0.2709(5) 0.6222(5) 0.6425(6) 0.064(2) Uani 1 1 d . . .
C59 C 0.2551(4) 0.6917(4) 0.6960(6) 0.0544(18) Uani 1 1 d . . .
C60 C 0.2866(5) 0.7066(5) 0.8047(6) 0.068(2) Uani 1 1 d . . .
C61 C 0.1038(6) 0.8526(5) 0.2902(6) 0.079(3) Uani 1 1 d . . .
H61A H 0.0950 0.8094 0.2406 0.095 Uiso 1 1 calc R . .
H61B H 0.1539 0.8702 0.2950 0.095 Uiso 1 1 calc R . .
H61C H 0.0637 0.8891 0.2675 0.095 Uiso 1 1 calc R . .
C62 C 0.0390(5) 0.6616(4) 0.5381(7) 0.061(2) Uani 1 1 d . . .
H62 H 0.0826 0.6368 0.5760 0.075 Uiso 1 1 calc R . .
C63 C -0.0354(7) 0.6416(6) 0.5450(10) 0.106(4) Uani 1 1 d . . .
H63 H -0.0394 0.6080 0.5879 0.124 Uiso 1 1 calc R . .
C64 C -0.0999(6) 0.6747(6) 0.4851(9) 0.090(3) Uani 1 1 d . . .
H64 H -0.1498 0.6597 0.4784 0.105 Uiso 1 1 calc R . .
C65 C -0.1530(5) 0.7746(6) 0.3811(6) 0.071(2) Uani 1 1 d . . .
H65 H -0.2040 0.7626 0.3740 0.085 Uiso 1 1 calc R . .
C66 C -0.1392(6) 0.8333(6) 0.3411(7) 0.084(3) Uani 1 1 d . . .
H66 H -0.1811 0.8618 0.3069 0.101 Uiso 1 1 calc R . .
C67 C -0.0624(6) 0.8516(5) 0.3504(7) 0.082(3) Uani 1 1 d . . .
H67 H -0.0541 0.8926 0.3236 0.097 Uiso 1 1 calc R . .
C68 C 0.0005(5) 0.8097(4) 0.3986(6) 0.0580(19) Uani 1 1 d . . .
C69 C -0.0127(4) 0.7484(4) 0.4402(5) 0.0533(18) Uani 1 1 d . . .
C70 C -0.0892(5) 0.7319(5) 0.4338(6) 0.063(2) Uani 1 1 d . . .
C71 C 0.5147(8) 0.1482(11) 0.7843(12) 0.195(10) Uani 1 1 d . . .
H71A H 0.4626 0.1307 0.7694 0.222 Uiso 1 1 calc R . .
H71B H 0.5106 0.1972 0.7662 0.222 Uiso 1 1 calc R . .
C72 C 0.7919(12) 0.0510(9) 0.8981(16) 0.210(11) Uani 1 1 d . . .
H72A H 0.8473 0.0400 0.9062 0.223 Uiso 1 1 calc R . .
H72B H 0.7810 0.0419 0.9621 0.223 Uiso 1 1 calc R . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
Cl Cl 0.1484 0.1585 '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
N11 Ru1 N21 169.1(2) . . ?
N11 Ru1 N31 98.15(19) . . ?
N21 Ru1 N31 86.8(2) . . ?
N11 Ru1 P1 83.70(15) . . ?
N21 Ru1 P1 92.36(16) . . ?
N31 Ru1 P1 173.76(15) . . ?
N11 Ru1 P2 87.81(16) . . ?
N21 Ru1 P2 82.38(16) . . ?
N31 Ru1 P2 91.52(15) . . ?
P1 Ru1 P2 94.51(8) . . ?
N11 Ru1 P3 85.97(16) . . ?
N21 Ru1 P3 104.50(15) . . ?
N31 Ru1 P3 79.27(15) . . ?
P1 Ru1 P3 94.96(8) . . ?
P2 Ru1 P3 168.03(7) . . ?
N41 Ru2 N51 168.8(2) . . ?
N41 Ru2 N61 97.0(3) . . ?
N51 Ru2 N61 87.3(2) . . ?
N41 Ru2 P4 84.3(2) . . ?
N51 Ru2 P4 92.97(18) . . ?
N61 Ru2 P4 171.59(18) . . ?
N41 Ru2 P5 87.15(17) . . ?
N51 Ru2 P5 82.11(17) . . ?
N61 Ru2 P5 96.57(19) . . ?
P4 Ru2 P5 91.79(9) . . ?
N41 Ru2 P6 86.16(17) . . ?
N51 Ru2 P6 104.76(17) . . ?
N61 Ru2 P6 80.14(19) . . ?
P4 Ru2 P6 91.68(9) . . ?
P5 Ru2 P6 172.13(8) . . ?
C18 P1 C11 104.2(4) . . ?
C18 P1 C1 107.6(4) . . ?
C11 P1 C1 97.9(4) . . ?
C18 P1 Ru1 102.1(2) . . ?
C11 P1 Ru1 120.8(3) . . ?
C1 P1 Ru1 122.6(4) . . ?
C28 P2 C2 107.9(4) . . ?
C28 P2 C21 106.2(4) . . ?
C2 P2 C21 97.9(5) . . ?
C28 P2 Ru1 100.9(2) . . ?
C2 P2 Ru1 117.7(3) . . ?
C21 P2 Ru1 125.2(3) . . ?
C38 P3 C31 102.5(4) . . ?
C38 P3 C3 103.2(4) . . ?
C31 P3 C3 102.8(4) . . ?
C38 P3 Ru1 101.6(2) . . ?
C31 P3 Ru1 126.9(3) . . ?
C3 P3 Ru1 116.5(3) . . ?
C48 P4 C41 108.4(5) . . ?
C48 P4 C4 104.7(5) . . ?
C41 P4 C4 97.8(5) . . ?
C48 P4 Ru2 100.9(3) . . ?
C41 P4 Ru2 122.6(4) . . ?
C4 P4 Ru2 121.1(4) . . ?
C58 P5 C51 106.1(4) . . ?
C58 P5 C5 104.9(5) . . ?
C51 P5 C5 98.9(5) . . ?
C58 P5 Ru2 101.6(3) . . ?
C51 P5 Ru2 120.8(3) . . ?
C5 P5 Ru2 122.8(4) . . ?
C68 P6 C6 103.3(4) . . ?
C68 P6 C61 103.3(4) . . ?
C6 P6 C61 100.4(5) . . ?
C68 P6 Ru2 100.9(3) . . ?
C6 P6 Ru2 129.3(3) . . ?
C61 P6 Ru2 116.4(3) . . ?
F12 P11 F14 97.7(7) . . ?
F12 P11 F15 170.9(7) . . ?
F14 P11 F15 91.0(7) . . ?
F12 P11 F11 92.1(4) . . ?
F14 P11 F11 93.9(5) . . ?
F15 P11 F11 89.8(4) . . ?
F12 P11 F16 89.3(5) . . ?
F14 P11 F16 89.1(5) . . ?
F15 P11 F16 88.3(4) . . ?
F11 P11 F16 176.5(5) . . ?
F12 P11 F13 84.1(7) . . ?
F14 P11 F13 177.6(7) . . ?
F15 P11 F13 87.1(6) . . ?
F11 P11 F13 87.6(5) . . ?
F16 P11 F13 89.3(5) . . ?
F25 P12 F22 173.6(10) . . ?
F25 P12 F24 98.6(10) . . ?
F22 P12 F24 87.8(8) . . ?
F25 P12 F21 88.9(6) . . ?
F22 P12 F21 90.9(6) . . ?
F24 P12 F21 92.1(4) . . ?
F25 P12 F26 92.5(7) . . ?
F22 P12 F26 87.7(6) . . ?
F24 P12 F26 87.8(5) . . ?
F21 P12 F26 178.6(6) . . ?
F25 P12 F23 86.5(9) . . ?
F22 P12 F23 87.1(9) . . ?
F24 P12 F23 174.9(9) . . ?
F21 P12 F23 88.4(4) . . ?
F26 P12 F23 91.6(5) . . ?
F34 P13 F32 97.9(12) . . ?
F34 P13 F33 177.0(11) . . ?
F32 P13 F33 84.8(10) . . ?
F34 P13 F35 96.0(11) . . ?
F32 P13 F35 165.5(10) . . ?
F33 P13 F35 81.2(8) . . ?
F34 P13 F31 89.9(7) . . ?
F32 P13 F31 90.8(6) . . ?
F33 P13 F31 88.9(6) . . ?
F35 P13 F31 85.4(6) . . ?
F34 P13 F36 95.3(7) . . ?
F32 P13 F36 89.4(6) . . ?
F33 P13 F36 85.8(6) . . ?
F35 P13 F36 93.2(5) . . ?
F31 P13 F36 174.7(6) . . ?
F42 P14 F43 98.1(8) . . ?
F42 P14 F44 83.5(7) . . ?
F43 P14 F44 178.4(9) . . ?
F42 P14 F41 87.5(6) . . ?
F43 P14 F41 89.8(6) . . ?
F44 P14 F41 89.9(5) . . ?
F42 P14 F46 91.7(5) . . ?
F43 P14 F46 89.4(6) . . ?
F44 P14 F46 91.0(5) . . ?
F41 P14 F46 178.8(7) . . ?
F42 P14 F45 174.9(8) . . ?
F43 P14 F45 86.7(7) . . ?
F44 P14 F45 91.8(7) . . ?
F41 P14 F45 94.3(6) . . ?
F46 P14 F45 86.4(5) . . ?
C12 N11 C19 116.9(6) . . ?
C12 N11 Ru1 123.8(5) . . ?
C19 N11 Ru1 119.1(4) . . ?
C22 N21 C29 116.9(6) . . ?
C22 N21 Ru1 123.0(5) . . ?
C29 N21 Ru1 120.1(4) . . ?
C32 N31 C39 116.8(6) . . ?
C32 N31 Ru1 123.7(5) . . ?
C39 N31 Ru1 119.4(4) . . ?
C42 N41 C49 118.1(7) . . ?
C42 N41 Ru2 123.7(6) . . ?
C49 N41 Ru2 117.9(5) . . ?
C52 N51 C59 116.2(6) . . ?
C52 N51 Ru2 124.0(5) . . ?
C59 N51 Ru2 119.7(5) . . ?
C62 N61 C69 117.1(7) . . ?
C62 N61 Ru2 124.4(6) . . ?
C69 N61 Ru2 118.5(5) . . ?
P1 C1 H1A 109.5 . . ?
P1 C1 H1B 109.5 . . ?
H1A C1 H1B 109.5 . . ?
P1 C1 H1C 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
P2 C2 H2A 109.5 . . ?
P2 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
P2 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
P3 C3 H3A 109.5 . . ?
P3 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
P3 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
P4 C4 H4A 109.5 . . ?
P4 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
P4 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
P5 C5 H5A 109.5 . . ?
P5 C5 H5B 109.5 . . ?
H5A C5 H5B 109.5 . . ?
P5 C5 H5C 109.5 . . ?
H5A C5 H5C 109.5 . . ?
H5B C5 H5C 109.5 . . ?
P6 C6 H6A 109.5 . . ?
P6 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
P6 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
P1 C11 H11A 109.5 . . ?
P1 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
P1 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
N11 C12 C13 124.4(7) . . ?
N11 C12 H12 117.8 . . ?
C13 C12 H12 117.8 . . ?
C14 C13 C12 120.1(7) . . ?
C14 C13 H13 120.0 . . ?
C12 C13 H13 119.9 . . ?
C13 C14 C20 118.5(7) . . ?
C13 C14 H14 120.7 . . ?
C20 C14 H14 120.7 . . ?
C16 C15 C20 120.9(8) . . ?
C16 C15 H15 119.5 . . ?
C20 C15 H15 119.5 . . ?
C15 C16 C17 120.4(8) . . ?
C15 C16 H16 119.8 . . ?
C17 C16 H16 119.8 . . ?
C18 C17 C16 121.6(8) . . ?
C18 C17 H17 119.2 . . ?
C16 C17 H17 119.2 . . ?
C17 C18 C19 118.9(7) . . ?
C17 C18 P1 126.4(6) . . ?
C19 C18 P1 114.7(5) . . ?
N11 C19 C20 121.9(6) . . ?
N11 C19 C18 119.2(6) . . ?
C20 C19 C18 119.0(6) . . ?
C19 C20 C15 119.1(7) . . ?
C19 C20 C14 118.1(7) . . ?
C15 C20 C14 122.7(8) . . ?
P2 C21 H21A 109.5 . . ?
P2 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
P2 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
N21 C22 C23 123.6(8) . . ?
N21 C22 H22 118.2 . . ?
C23 C22 H22 118.2 . . ?
C24 C23 C22 119.4(8) . . ?
C24 C23 H23 120.3 . . ?
C22 C23 H23 120.3 . . ?
C23 C24 C30 119.1(8) . . ?
C23 C24 H24 120.4 . . ?
C30 C24 H24 120.4 . . ?
C26 C25 C30 119.9(8) . . ?
C26 C25 H25 120.1 . . ?
C30 C25 H25 120.1 . . ?
C25 C26 C27 121.1(9) . . ?
C25 C26 H26 119.4 . . ?
C27 C26 H26 119.4 . . ?
C28 C27 C26 119.4(9) . . ?
C28 C27 H27 120.3 . . ?
C26 C27 H27 120.3 . . ?
C27 C28 C29 120.5(7) . . ?
C27 C28 P2 123.7(6) . . ?
C29 C28 P2 115.8(5) . . ?
C30 C29 N21 121.6(7) . . ?
C30 C29 C28 119.0(7) . . ?
N21 C29 C28 119.5(6) . . ?
C29 C30 C25 120.1(8) . . ?
C29 C30 C24 119.1(8) . . ?
C25 C30 C24 120.8(8) . . ?
P3 C31 H31A 109.5 . . ?
P3 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
P3 C31 H31C 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
N31 C32 C33 124.0(7) . . ?
N31 C32 H32 118.0 . . ?
C33 C32 H32 118.0 . . ?
C34 C33 C32 120.2(8) . . ?
C34 C33 H33 119.9 . . ?
C32 C33 H33 119.9 . . ?
C33 C34 C40 118.6(7) . . ?
C33 C34 H34 120.7 . . ?
C40 C34 H34 120.7 . . ?
C36 C35 C40 120.9(8) . . ?
C36 C35 H35 119.6 . . ?
C40 C35 H35 119.6 . . ?
C35 C36 C37 119.5(8) . . ?
C35 C36 H36 120.2 . . ?
C37 C36 H36 120.2 . . ?
C38 C37 C36 121.9(8) . . ?
C38 C37 H37 119.0 . . ?
C36 C37 H37 119.0 . . ?
C37 C38 C39 119.2(7) . . ?
C37 C38 P3 123.9(6) . . ?
C39 C38 P3 116.5(5) . . ?
N31 C39 C38 119.5(6) . . ?
N31 C39 C40 121.7(7) . . ?
C38 C39 C40 118.7(6) . . ?
C35 C40 C39 119.5(8) . . ?
C35 C40 C34 122.5(8) . . ?
C39 C40 C34 118.0(7) . . ?
P4 C41 H41A 109.5 . . ?
P4 C41 H41B 109.5 . . ?
H41A C41 H41B 109.5 . . ?
P4 C41 H41C 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
N41 C42 C43 126.0(8) . . ?
N41 C42 H42 117.0 . . ?
C43 C42 H42 117.0 . . ?
C44 C43 C42 117.0(9) . . ?
C44 C43 H43 121.5 . . ?
C42 C43 H43 121.5 . . ?
C50 C44 C43 120.3(8) . . ?
C50 C44 H44 119.8 . . ?
C43 C44 H44 119.8 . . ?
C46 C45 C50 122.4(9) . . ?
C46 C45 H45 118.8 . . ?
C50 C45 H45 118.8 . . ?
C45 C46 C47 120.3(9) . . ?
C45 C46 H46 119.8 . . ?
C47 C46 H46 119.8 . . ?
C48 C47 C46 119.1(10) . . ?
C48 C47 H47 120.5 . . ?
C46 C47 H47 120.5 . . ?
C47 C48 C49 120.2(8) . . ?
C47 C48 P4 123.5(7) . . ?
C49 C48 P4 116.3(6) . . ?
C50 C49 N41 121.4(7) . . ?
C50 C49 C48 119.2(7) . . ?
N41 C49 C48 119.5(6) . . ?
C44 C50 C49 117.2(8) . . ?
C44 C50 C45 124.0(9) . . ?
C49 C50 C45 118.8(9) . . ?
P5 C51 H51A 109.5 . . ?
P5 C51 H51B 109.5 . . ?
H51A C51 H51B 109.5 . . ?
P5 C51 H51C 109.5 . . ?
H51A C51 H51C 109.5 . . ?
H51B C51 H51C 109.5 . . ?
N51 C52 C53 126.1(8) . . ?
N51 C52 H52 116.9 . . ?
C53 C52 H52 116.9 . . ?
C54 C53 C52 117.6(9) . . ?
C54 C53 H53 121.2 . . ?
C52 C53 H53 121.2 . . ?
C53 C54 C60 120.7(8) . . ?
C53 C54 H54 119.7 . . ?
C60 C54 H54 119.7 . . ?
C56 C55 C60 122.5(10) . . ?
C56 C55 H55 118.8 . . ?
C60 C55 H55 118.8 . . ?
C57 C56 C55 117.9(10) . . ?
C57 C56 H56 121.0 . . ?
C55 C56 H56 121.0 . . ?
C58 C57 C56 123.0(11) . . ?
C58 C57 H57 118.5 . . ?
C56 C57 H57 118.5 . . ?
C57 C58 C59 119.3(8) . . ?
C57 C58 P5 124.6(8) . . ?
C59 C58 P5 116.0(6) . . ?
N51 C59 C60 120.9(7) . . ?
N51 C59 C58 119.3(6) . . ?
C60 C59 C58 119.8(7) . . ?
C59 C60 C55 117.1(9) . . ?
C59 C60 C54 118.4(8) . . ?
C55 C60 C54 124.5(9) . . ?
P6 C61 H61A 109.5 . . ?
P6 C61 H61B 109.5 . . ?
H61A C61 H61B 109.5 . . ?
P6 C61 H61C 109.5 . . ?
H61A C61 H61C 109.5 . . ?
H61B C61 H61C 109.5 . . ?
N61 C62 C63 128.2(8) . . ?
N61 C62 H62 115.9 . . ?
C63 C62 H62 115.9 . . ?
C64 C63 C62 116.4(9) . . ?
C64 C63 H63 121.8 . . ?
C62 C63 H63 121.8 . . ?
C63 C64 C70 118.3(9) . . ?
C63 C64 H64 120.9 . . ?
C70 C64 H64 120.9 . . ?
C66 C65 C70 119.3(9) . . ?
C66 C65 H65 120.3 . . ?
C70 C65 H65 120.3 . . ?
C65 C66 C67 120.9(9) . . ?
C65 C66 H66 119.6 . . ?
C67 C66 H66 119.6 . . ?
C68 C67 C66 120.8(9) . . ?
C68 C67 H67 119.6 . . ?
C66 C67 H67 119.6 . . ?
C67 C68 C69 119.0(8) . . ?
C67 C68 P6 123.4(7) . . ?
C69 C68 P6 117.5(6) . . ?
C70 C69 N61 120.8(7) . . ?
C70 C69 C68 119.9(7) . . ?
N61 C69 C68 119.3(7) . . ?
C69 C70 C64 118.3(8) . . ?
C69 C70 C65 120.0(8) . . ?
C64 C70 C65 121.6(9) . . ?
Cl2 C71 Cl1 105.0(11) . . ?
Cl2 C71 H71A 110.7 . . ?
Cl1 C71 H71A 110.7 . . ?
Cl2 C71 H71B 110.7 . . ?
Cl1 C71 H71B 110.7 . . ?
H71A C71 H71B 108.8 . . ?
Cl4 C72 Cl3 120.0(10) . . ?
Cl4 C72 H72A 107.3 . . ?
Cl3 C72 H72A 107.3 . . ?
Cl4 C72 H72B 107.3 . . ?
Cl3 C72 H72B 107.3 . . ?
H72A C72 H72B 106.9 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ru1 N11 2.103(5) . ?
Ru1 N21 2.118(6) . ?
Ru1 N31 2.232(5) . ?
Ru1 P1 2.2469(19) . ?
Ru1 P2 2.321(2) . ?
Ru1 P3 2.365(2) . ?
Ru2 N41 2.112(6) . ?
Ru2 N51 2.128(6) . ?
Ru2 N61 2.213(6) . ?
Ru2 P4 2.272(2) . ?
Ru2 P5 2.330(2) . ?
Ru2 P6 2.382(2) . ?
Cl1 C71 1.889(18) . ?
Cl2 C71 1.603(14) . ?
Cl3 C72 1.724(16) . ?
Cl4 C72 1.599(18) . ?
P1 C18 1.819(8) . ?
P1 C11 1.804(9) . ?
P1 C1 1.827(8) . ?
P2 C28 1.813(8) . ?
P2 C2 1.805(8) . ?
P2 C21 1.818(8) . ?
P3 C38 1.818(7) . ?
P3 C31 1.819(7) . ?
P3 C3 1.810(8) . ?
P4 C48 1.804(8) . ?
P4 C41 1.827(10) . ?
P4 C4 1.828(10) . ?
P5 C58 1.798(8) . ?
P5 C51 1.834(8) . ?
P5 C5 1.854(9) . ?
P6 C68 1.816(8) . ?
P6 C6 1.818(9) . ?
P6 C61 1.834(8) . ?
P11 F12 1.515(8) . ?
P11 F14 1.516(9) . ?
P11 F15 1.548(7) . ?
P11 F11 1.561(7) . ?
P11 F16 1.592(6) . ?
P11 F13 1.617(10) . ?
P12 F25 1.456(11) . ?
P12 F22 1.509(11) . ?
P12 F24 1.509(8) . ?
P12 F21 1.554(6) . ?
P12 F26 1.561(7) . ?
P12 F23 1.572(10) . ?
P13 F34 1.385(9) . ?
P13 F32 1.506(11) . ?
P13 F33 1.508(10) . ?
P13 F35 1.552(11) . ?
P13 F31 1.555(9) . ?
P13 F36 1.552(8) . ?
P14 F42 1.512(8) . ?
P14 F43 1.515(8) . ?
P14 F44 1.526(8) . ?
P14 F41 1.547(7) . ?
P14 F46 1.555(7) . ?
P14 F45 1.568(9) . ?
N11 C12 1.327(8) . ?
N11 C19 1.393(8) . ?
N21 C22 1.325(9) . ?
N21 C29 1.384(9) . ?
N31 C32 1.327(9) . ?
N31 C39 1.381(8) . ?
N41 C42 1.228(10) . ?
N41 C49 1.403(10) . ?
N51 C52 1.312(9) . ?
N51 C59 1.400(9) . ?
N61 C62 1.176(10) . ?
N61 C69 1.412(9) . ?
C1 H1A 0.9600 . ?
C1 H1B 0.9600 . ?
C1 H1C 0.9600 . ?
C2 H2A 0.9600 . ?
C2 H2B 0.9600 . ?
C2 H2C 0.9600 . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C3 H3C 0.9600 . ?
C4 H4A 0.9600 . ?
C4 H4B 0.9600 . ?
C4 H4C 0.9600 . ?
C5 H5A 0.9600 . ?
C5 H5B 0.9600 . ?
C5 H5C 0.9600 . ?
C6 H6A 0.9600 . ?
C6 H6B 0.9600 . ?
C6 H6C 0.9600 . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C12 C13 1.382(10) . ?
C12 H12 0.9300 . ?
C13 C14 1.363(11) . ?
C13 H13 0.9300 . ?
C14 C20 1.425(10) . ?
C14 H14 0.9300 . ?
C15 C16 1.341(12) . ?
C15 C20 1.406(11) . ?
C15 H15 0.9300 . ?
C16 C17 1.397(13) . ?
C16 H16 0.9300 . ?
C17 C18 1.356(10) . ?
C17 H17 0.9300 . ?
C18 C19 1.431(9) . ?
C19 C20 1.409(10) . ?
C21 H21A 0.9600 . ?
C21 H21B 0.9600 . ?
C21 H21C 0.9600 . ?
C22 C23 1.412(10) . ?
C22 H22 0.9300 . ?
C23 C24 1.331(12) . ?
C23 H23 0.9300 . ?
C24 C30 1.409(12) . ?
C24 H24 0.9300 . ?
C25 C26 1.357(13) . ?
C25 C30 1.414(12) . ?
C25 H25 0.9300 . ?
C26 C27 1.414(13) . ?
C26 H26 0.9300 . ?
C27 C28 1.370(11) . ?
C27 H27 0.9300 . ?
C28 C29 1.424(10) . ?
C29 C30 1.388(10) . ?
C31 H31A 0.9600 . ?
C31 H31B 0.9600 . ?
C31 H31C 0.9600 . ?
C32 C33 1.411(10) . ?
C32 H32 0.9300 . ?
C33 C34 1.345(12) . ?
C33 H33 0.9300 . ?
C34 C40 1.422(12) . ?
C34 H34 0.9300 . ?
C35 C36 1.370(13) . ?
C35 C40 1.392(11) . ?
C35 H35 0.9300 . ?
C36 C37 1.394(12) . ?
C36 H36 0.9300 . ?
C37 C38 1.377(10) . ?
C37 H37 0.9300 . ?
C38 C39 1.408(10) . ?
C39 C40 1.435(10) . ?
C41 H41A 0.9600 . ?
C41 H41B 0.9600 . ?
C41 H41C 0.9600 . ?
C42 C43 1.429(11) . ?
C42 H42 0.9300 . ?
C43 C44 1.377(14) . ?
C43 H43 0.9300 . ?
C44 C50 1.382(13) . ?
C44 H44 0.9300 . ?
C45 C46 1.328(15) . ?
C45 C50 1.389(13) . ?
C45 H45 0.9300 . ?
C46 C47 1.458(14) . ?
C46 H46 0.9300 . ?
C47 C48 1.361(12) . ?
C47 H47 0.9300 . ?
C48 C49 1.429(11) . ?
C49 C50 1.424(10) . ?
C51 H51A 0.9600 . ?
C51 H51B 0.9600 . ?
C51 H51C 0.9600 . ?
C52 C53 1.399(11) . ?
C52 H52 0.9300 . ?
C53 C54 1.333(13) . ?
C53 H53 0.9300 . ?
C54 C60 1.410(13) . ?
C54 H54 0.9300 . ?
C55 C56 1.369(16) . ?
C55 C60 1.426(13) . ?
C55 H55 0.9300 . ?
C56 C57 1.389(15) . ?
C56 H56 0.9300 . ?
C57 C58 1.343(12) . ?
C57 H57 0.9300 . ?
C58 C59 1.430(11) . ?
C59 C60 1.403(11) . ?
C61 H61A 0.9600 . ?
C61 H61B 0.9600 . ?
C61 H61C 0.9600 . ?
C62 C63 1.437(13) . ?
C62 H62 0.9300 . ?
C63 C64 1.364(14) . ?
C63 H63 0.9300 . ?
C64 C70 1.402(13) . ?
C64 H64 0.9300 . ?
C65 C66 1.355(13) . ?
C65 C70 1.411(11) . ?
C65 H65 0.9300 . ?
C66 C67 1.407(14) . ?
C66 H66 0.9300 . ?
C67 C68 1.372(11) . ?
C67 H67 0.9300 . ?
C68 C69 1.406(11) . ?
C69 C70 1.399(11) . ?
C71 H71A 0.9700 . ?
C71 H71B 0.9700 . ?
C72 H72A 0.9700 . ?
C72 H72B 0.9700 . ?
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
N11 Ru1 P1 C18 -9.2(3) . . . . ?
N21 Ru1 P1 C18 160.6(3) . . . . ?
N31 Ru1 P1 C18 -116.8(13) . . . . ?
P2 Ru1 P1 C18 78.1(3) . . . . ?
P3 Ru1 P1 C18 -94.6(3) . . . . ?
N11 Ru1 P1 C11 105.6(4) . . . . ?
N21 Ru1 P1 C11 -84.5(4) . . . . ?
N31 Ru1 P1 C11 -2.0(14) . . . . ?
P2 Ru1 P1 C11 -167.1(4) . . . . ?
P3 Ru1 P1 C11 20.2(4) . . . . ?
N11 Ru1 P1 C1 -129.4(4) . . . . ?
N21 Ru1 P1 C1 40.4(4) . . . . ?
N31 Ru1 P1 C1 122.9(14) . . . . ?
P2 Ru1 P1 C1 -42.2(4) . . . . ?
P3 Ru1 P1 C1 145.2(4) . . . . ?
N11 Ru1 P2 C28 -175.5(3) . . . . ?
N21 Ru1 P2 C28 9.2(3) . . . . ?
N31 Ru1 P2 C28 -77.4(3) . . . . ?
P1 Ru1 P2 C28 101.0(2) . . . . ?
P3 Ru1 P2 C28 -116.7(4) . . . . ?
N11 Ru1 P2 C2 -58.4(4) . . . . ?
N21 Ru1 P2 C2 126.3(4) . . . . ?
N31 Ru1 P2 C2 39.7(4) . . . . ?
P1 Ru1 P2 C2 -141.9(4) . . . . ?
P3 Ru1 P2 C2 0.3(6) . . . . ?
N11 Ru1 P2 C21 65.6(5) . . . . ?
N21 Ru1 P2 C21 -109.7(5) . . . . ?
N31 Ru1 P2 C21 163.7(5) . . . . ?
P1 Ru1 P2 C21 -17.9(4) . . . . ?
P3 Ru1 P2 C21 124.3(5) . . . . ?
N11 Ru1 P3 C38 83.9(3) . . . . ?
N21 Ru1 P3 C38 -99.1(3) . . . . ?
N31 Ru1 P3 C38 -15.2(3) . . . . ?
P1 Ru1 P3 C38 167.2(2) . . . . ?
P2 Ru1 P3 C38 25.0(5) . . . . ?
N11 Ru1 P3 C31 -160.6(4) . . . . ?
N21 Ru1 P3 C31 16.4(4) . . . . ?
N31 Ru1 P3 C31 100.3(4) . . . . ?
P1 Ru1 P3 C31 -77.3(4) . . . . ?
P2 Ru1 P3 C31 140.5(5) . . . . ?
N11 Ru1 P3 C3 -27.4(3) . . . . ?
N21 Ru1 P3 C3 149.7(4) . . . . ?
N31 Ru1 P3 C3 -126.4(3) . . . . ?
P1 Ru1 P3 C3 56.0(3) . . . . ?
P2 Ru1 P3 C3 -86.2(5) . . . . ?
N41 Ru2 P4 C48 -8.8(3) . . . . ?
N51 Ru2 P4 C48 160.4(3) . . . . ?
N61 Ru2 P4 C48 -108.3(11) . . . . ?
P5 Ru2 P4 C48 78.2(3) . . . . ?
P6 Ru2 P4 C48 -94.8(3) . . . . ?
N41 Ru2 P4 C41 -129.1(5) . . . . ?
N51 Ru2 P4 C41 40.0(5) . . . . ?
N61 Ru2 P4 C41 131.4(12) . . . . ?
P5 Ru2 P4 C41 -42.2(5) . . . . ?
P6 Ru2 P4 C41 144.9(5) . . . . ?
N41 Ru2 P4 C4 105.8(5) . . . . ?
N51 Ru2 P4 C4 -85.0(5) . . . . ?
N61 Ru2 P4 C4 6.3(12) . . . . ?
P5 Ru2 P4 C4 -167.2(4) . . . . ?
P6 Ru2 P4 C4 19.9(4) . . . . ?
N41 Ru2 P5 C58 168.2(3) . . . . ?
N51 Ru2 P5 C58 -8.8(3) . . . . ?
N61 Ru2 P5 C58 -95.1(3) . . . . ?
P4 Ru2 P5 C58 84.0(3) . . . . ?
P6 Ru2 P5 C58 -159.9(6) . . . . ?
N41 Ru2 P5 C51 51.4(5) . . . . ?
N51 Ru2 P5 C51 -125.6(4) . . . . ?
N61 Ru2 P5 C51 148.1(4) . . . . ?
P4 Ru2 P5 C51 -32.9(4) . . . . ?
P6 Ru2 P5 C51 83.3(7) . . . . ?
N41 Ru2 P5 C5 -75.4(4) . . . . ?
N51 Ru2 P5 C5 107.6(4) . . . . ?
N61 Ru2 P5 C5 21.3(4) . . . . ?
P4 Ru2 P5 C5 -159.6(4) . . . . ?
P6 Ru2 P5 C5 -43.5(7) . . . . ?
N41 Ru2 P6 C68 83.0(3) . . . . ?
N51 Ru2 P6 C68 -99.2(3) . . . . ?
N61 Ru2 P6 C68 -14.7(3) . . . . ?
P4 Ru2 P6 C68 167.2(3) . . . . ?
P5 Ru2 P6 C68 51.1(6) . . . . ?
N41 Ru2 P6 C6 -159.6(5) . . . . ?
N51 Ru2 P6 C6 18.2(5) . . . . ?
N61 Ru2 P6 C6 102.7(5) . . . . ?
P4 Ru2 P6 C6 -75.4(4) . . . . ?
P5 Ru2 P6 C6 168.5(6) . . . . ?
N41 Ru2 P6 C61 -27.8(4) . . . . ?
N51 Ru2 P6 C61 149.9(4) . . . . ?
N61 Ru2 P6 C61 -125.6(4) . . . . ?
P4 Ru2 P6 C61 56.4(4) . . . . ?
P5 Ru2 P6 C61 -59.8(7) . . . . ?
N21 Ru1 N11 C12 114.8(11) . . . . ?
N31 Ru1 N11 C12 -1.9(6) . . . . ?
P1 Ru1 N11 C12 -175.9(6) . . . . ?
P2 Ru1 N11 C12 89.3(5) . . . . ?
P3 Ru1 N11 C12 -80.5(5) . . . . ?
N21 Ru1 N11 C19 -59.3(13) . . . . ?
N31 Ru1 N11 C19 -176.1(5) . . . . ?
P1 Ru1 N11 C19 10.0(5) . . . . ?
P2 Ru1 N11 C19 -84.8(5) . . . . ?
P3 Ru1 N11 C19 105.4(5) . . . . ?
N11 Ru1 N21 C22 144.9(10) . . . . ?
N31 Ru1 N21 C22 -97.3(6) . . . . ?
P1 Ru1 N21 C22 76.5(6) . . . . ?
P2 Ru1 N21 C22 170.7(6) . . . . ?
P3 Ru1 N21 C22 -19.3(6) . . . . ?
N11 Ru1 N21 C29 -35.0(13) . . . . ?
N31 Ru1 N21 C29 82.7(5) . . . . ?
P1 Ru1 N21 C29 -103.5(5) . . . . ?
P2 Ru1 N21 C29 -9.3(5) . . . . ?
P3 Ru1 N21 C29 160.8(4) . . . . ?
N11 Ru1 N31 C32 114.0(5) . . . . ?
N21 Ru1 N31 C32 -56.2(5) . . . . ?
P1 Ru1 N31 C32 -139.1(12) . . . . ?
P2 Ru1 N31 C32 26.0(5) . . . . ?
P3 Ru1 N31 C32 -161.7(5) . . . . ?
N11 Ru1 N31 C39 -68.3(5) . . . . ?
N21 Ru1 N31 C39 121.4(5) . . . . ?
P1 Ru1 N31 C39 38.6(16) . . . . ?
P2 Ru1 N31 C39 -156.3(4) . . . . ?
P3 Ru1 N31 C39 16.0(4) . . . . ?
N51 Ru2 N41 C42 105.2(14) . . . . ?
N61 Ru2 N41 C42 -6.7(7) . . . . ?
P4 Ru2 N41 C42 -178.3(7) . . . . ?
P5 Ru2 N41 C42 89.6(7) . . . . ?
P6 Ru2 N41 C42 -86.3(7) . . . . ?
N51 Ru2 N41 C49 -67.4(15) . . . . ?
N61 Ru2 N41 C49 -179.3(5) . . . . ?
P4 Ru2 N41 C49 9.1(5) . . . . ?
P5 Ru2 N41 C49 -83.0(5) . . . . ?
P6 Ru2 N41 C49 101.1(5) . . . . ?
N41 Ru2 N51 C52 171.0(13) . . . . ?
N61 Ru2 N51 C52 -76.3(8) . . . . ?
P4 Ru2 N51 C52 95.3(7) . . . . ?
P5 Ru2 N51 C52 -173.3(8) . . . . ?
P6 Ru2 N51 C52 2.8(8) . . . . ?
N41 Ru2 N51 C59 -5.8(17) . . . . ?
N61 Ru2 N51 C59 107.0(5) . . . . ?
P4 Ru2 N51 C59 -81.4(5) . . . . ?
P5 Ru2 N51 C59 9.9(5) . . . . ?
P6 Ru2 N51 C59 -174.0(5) . . . . ?
N41 Ru2 N61 C62 110.9(7) . . . . ?
N51 Ru2 N61 C62 -58.8(7) . . . . ?
P4 Ru2 N61 C62 -150.6(9) . . . . ?
P5 Ru2 N61 C62 22.9(7) . . . . ?
P6 Ru2 N61 C62 -164.3(7) . . . . ?
N41 Ru2 N61 C69 -67.7(5) . . . . ?
N51 Ru2 N61 C69 122.6(5) . . . . ?
P4 Ru2 N61 C69 30.8(14) . . . . ?
P5 Ru2 N61 C69 -155.7(5) . . . . ?
P6 Ru2 N61 C69 17.1(5) . . . . ?
C19 N11 C12 C13 -0.1(11) . . . . ?
Ru1 N11 C12 C13 -174.4(6) . . . . ?
N11 C12 C13 C14 1.7(13) . . . . ?
C12 C13 C14 C20 -1.2(13) . . . . ?
C20 C15 C16 C17 -2.4(17) . . . . ?
C15 C16 C17 C18 1.3(17) . . . . ?
C16 C17 C18 C19 0.8(14) . . . . ?
C16 C17 C18 P1 -178.9(8) . . . . ?
C11 P1 C18 C17 62.7(9) . . . . ?
C1 P1 C18 C17 -40.6(9) . . . . ?
Ru1 P1 C18 C17 -170.8(8) . . . . ?
C11 P1 C18 C19 -117.1(6) . . . . ?
C1 P1 C18 C19 139.7(6) . . . . ?
Ru1 P1 C18 C19 9.4(6) . . . . ?
C12 N11 C19 C20 -1.8(10) . . . . ?
Ru1 N11 C19 C20 172.7(5) . . . . ?
C12 N11 C19 C18 179.1(7) . . . . ?
Ru1 N11 C19 C18 -6.4(8) . . . . ?
C17 C18 C19 N11 177.2(8) . . . . ?
P1 C18 C19 N11 -3.0(9) . . . . ?
C17 C18 C19 C20 -1.8(12) . . . . ?
P1 C18 C19 C20 178.0(6) . . . . ?
N11 C19 C20 C15 -178.2(7) . . . . ?
C18 C19 C20 C15 0.8(11) . . . . ?
N11 C19 C20 C14 2.2(11) . . . . ?
C18 C19 C20 C14 -178.8(7) . . . . ?
C16 C15 C20 C19 1.3(14) . . . . ?
C16 C15 C20 C14 -179.2(9) . . . . ?
C13 C14 C20 C19 -0.6(12) . . . . ?
C13 C14 C20 C15 179.8(8) . . . . ?
C29 N21 C22 C23 -2.0(11) . . . . ?
Ru1 N21 C22 C23 178.0(6) . . . . ?
N21 C22 C23 C24 -3.3(13) . . . . ?
C22 C23 C24 C30 4.7(13) . . . . ?
C30 C25 C26 C27 -1.3(14) . . . . ?
C25 C26 C27 C28 0.1(14) . . . . ?
C26 C27 C28 C29 -0.4(12) . . . . ?
C26 C27 C28 P2 177.2(6) . . . . ?
C2 P2 C28 C27 47.8(8) . . . . ?
C21 P2 C28 C27 -56.3(8) . . . . ?
Ru1 P2 C28 C27 171.8(6) . . . . ?
C2 P2 C28 C29 -134.5(6) . . . . ?
C21 P2 C28 C29 121.4(6) . . . . ?
Ru1 P2 C28 C29 -10.4(5) . . . . ?
C22 N21 C29 C30 5.8(10) . . . . ?
Ru1 N21 C29 C30 -174.3(5) . . . . ?
C22 N21 C29 C28 -175.1(6) . . . . ?
Ru1 N21 C29 C28 4.9(8) . . . . ?
C27 C28 C29 C30 1.8(10) . . . . ?
P2 C28 C29 C30 -176.0(5) . . . . ?
C27 C28 C29 N21 -177.3(7) . . . . ?
P2 C28 C29 N21 4.9(8) . . . . ?
N21 C29 C30 C25 176.2(7) . . . . ?
C28 C29 C30 C25 -3.0(11) . . . . ?
N21 C29 C30 C24 -4.3(11) . . . . ?
C28 C29 C30 C24 176.5(7) . . . . ?
C26 C25 C30 C29 2.7(13) . . . . ?
C26 C25 C30 C24 -176.8(8) . . . . ?
C23 C24 C30 C29 -1.1(12) . . . . ?
C23 C24 C30 C25 178.4(8) . . . . ?
C39 N31 C32 C33 5.9(10) . . . . ?
Ru1 N31 C32 C33 -176.4(6) . . . . ?
N31 C32 C33 C34 1.7(12) . . . . ?
C32 C33 C34 C40 -6.2(12) . . . . ?
C40 C35 C36 C37 -0.3(14) . . . . ?
C35 C36 C37 C38 2.6(13) . . . . ?
C36 C37 C38 C39 -0.7(11) . . . . ?
C36 C37 C38 P3 -173.9(6) . . . . ?
C31 P3 C38 C37 58.2(7) . . . . ?
C3 P3 C38 C37 -48.4(7) . . . . ?
Ru1 P3 C38 C37 -169.5(6) . . . . ?
C31 P3 C38 C39 -115.1(6) . . . . ?
C3 P3 C38 C39 138.3(6) . . . . ?
Ru1 P3 C38 C39 17.2(5) . . . . ?
C32 N31 C39 C38 168.3(6) . . . . ?
Ru1 N31 C39 C38 -9.5(8) . . . . ?
C32 N31 C39 C40 -8.8(9) . . . . ?
Ru1 N31 C39 C40 173.4(5) . . . . ?
C37 C38 C39 N31 179.6(6) . . . . ?
P3 C38 C39 N31 -6.8(8) . . . . ?
C37 C38 C39 C40 -3.3(10) . . . . ?
P3 C38 C39 C40 170.4(5) . . . . ?
C36 C35 C40 C39 -3.7(13) . . . . ?
C36 C35 C40 C34 174.4(8) . . . . ?
N31 C39 C40 C35 -177.5(7) . . . . ?
C38 C39 C40 C35 5.4(10) . . . . ?
N31 C39 C40 C34 4.4(10) . . . . ?
C38 C39 C40 C34 -172.7(7) . . . . ?
C33 C34 C40 C35 -174.8(8) . . . . ?
C33 C34 C40 C39 3.3(11) . . . . ?
C49 N41 C42 C43 -2.3(13) . . . . ?
Ru2 N41 C42 C43 -174.9(7) . . . . ?
N41 C42 C43 C44 3.3(14) . . . . ?
C42 C43 C44 C50 -1.9(14) . . . . ?
C50 C45 C46 C47 -0.8(19) . . . . ?
C45 C46 C47 C48 0.8(17) . . . . ?
C46 C47 C48 C49 -0.4(14) . . . . ?
C46 C47 C48 P4 -178.2(8) . . . . ?
C41 P4 C48 C47 -42.7(9) . . . . ?
C4 P4 C48 C47 60.9(9) . . . . ?
Ru2 P4 C48 C47 -172.7(7) . . . . ?
C41 P4 C48 C49 139.4(7) . . . . ?
C4 P4 C48 C49 -117.0(7) . . . . ?
Ru2 P4 C48 C49 9.4(6) . . . . ?
C42 N41 C49 C50 0.1(11) . . . . ?
Ru2 N41 C49 C50 173.1(6) . . . . ?
C42 N41 C49 C48 -178.3(8) . . . . ?
Ru2 N41 C49 C48 -5.3(9) . . . . ?
C47 C48 C49 C50 -0.1(12) . . . . ?
P4 C48 C49 C50 177.8(6) . . . . ?
C47 C48 C49 N41 178.4(8) . . . . ?
P4 C48 C49 N41 -3.7(10) . . . . ?
C43 C44 C50 C49 0.0(13) . . . . ?
C43 C44 C50 C45 179.3(9) . . . . ?
N41 C49 C50 C44 1.0(12) . . . . ?
C48 C49 C50 C44 179.5(8) . . . . ?
N41 C49 C50 C45 -178.3(8) . . . . ?
C48 C49 C50 C45 0.2(12) . . . . ?
C46 C45 C50 C44 -179.0(11) . . . . ?
C46 C45 C50 C49 0.3(16) . . . . ?
C59 N51 C52 C53 1.9(15) . . . . ?
Ru2 N51 C52 C53 -175.0(9) . . . . ?
N51 C52 C53 C54 -0.1(19) . . . . ?
C52 C53 C54 C60 -0.9(17) . . . . ?
C60 C55 C56 C57 -1(2) . . . . ?
C55 C56 C57 C58 5(2) . . . . ?
C56 C57 C58 C59 -3.9(18) . . . . ?
C56 C57 C58 P5 178.8(10) . . . . ?
C51 P5 C58 C57 -46.8(10) . . . . ?
C5 P5 C58 C57 57.2(10) . . . . ?
Ru2 P5 C58 C57 -173.9(9) . . . . ?
C51 P5 C58 C59 135.8(7) . . . . ?
C5 P5 C58 C59 -120.1(7) . . . . ?
Ru2 P5 C58 C59 8.7(7) . . . . ?
C52 N51 C59 C60 -2.6(11) . . . . ?
Ru2 N51 C59 C60 174.4(6) . . . . ?
C52 N51 C59 C58 175.9(8) . . . . ?
Ru2 N51 C59 C58 -7.1(9) . . . . ?
C57 C58 C59 N51 -179.7(9) . . . . ?
P5 C58 C59 N51 -2.2(10) . . . . ?
C57 C58 C59 C60 -1.2(13) . . . . ?
P5 C58 C59 C60 176.3(6) . . . . ?
N51 C59 C60 C55 -176.7(8) . . . . ?
C58 C59 C60 C55 4.8(13) . . . . ?
N51 C59 C60 C54 1.7(12) . . . . ?
C58 C59 C60 C54 -176.8(8) . . . . ?
C56 C55 C60 C59 -3.8(17) . . . . ?
C56 C55 C60 C54 178.0(12) . . . . ?
C53 C54 C60 C59 0.2(15) . . . . ?
C53 C54 C60 C55 178.4(11) . . . . ?
C69 N61 C62 C63 5.7(14) . . . . ?
Ru2 N61 C62 C63 -172.9(8) . . . . ?
N61 C62 C63 C64 3.6(17) . . . . ?
C62 C63 C64 C70 -8.7(16) . . . . ?
C70 C65 C66 C67 0.7(14) . . . . ?
C65 C66 C67 C68 1.2(15) . . . . ?
C66 C67 C68 C69 -0.9(13) . . . . ?
C66 C67 C68 P6 -177.0(7) . . . . ?
C6 P6 C68 C67 55.9(8) . . . . ?
C61 P6 C68 C67 -48.3(8) . . . . ?
Ru2 P6 C68 C67 -169.0(7) . . . . ?
C6 P6 C68 C69 -120.2(6) . . . . ?
C61 P6 C68 C69 135.5(6) . . . . ?
Ru2 P6 C68 C69 14.8(6) . . . . ?
C62 N61 C69 C70 -9.7(10) . . . . ?
Ru2 N61 C69 C70 169.0(5) . . . . ?
C62 N61 C69 C68 168.6(7) . . . . ?
Ru2 N61 C69 C68 -12.7(8) . . . . ?
C67 C68 C69 C70 -1.2(11) . . . . ?
P6 C68 C69 C70 175.1(5) . . . . ?
C67 C68 C69 N61 -179.6(7) . . . . ?
P6 C68 C69 N61 -3.2(9) . . . . ?
N61 C69 C70 C64 4.5(11) . . . . ?
C68 C69 C70 C64 -173.8(8) . . . . ?
N61 C69 C70 C65 -178.6(7) . . . . ?
C68 C69 C70 C65 3.1(11) . . . . ?
C63 C64 C70 C69 4.8(14) . . . . ?
C63 C64 C70 C65 -172.1(10) . . . . ?
C66 C65 C70 C69 -2.8(12) . . . . ?
C66 C65 C70 C64 174.0(9) . . . . ?
