# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2014

#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
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#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
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#  data retrieval see:
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data_2-1

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C60 H44 N6 O Ru'
_chemical_formula_weight         966.08

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru 0.0552 3.2960 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.840(3)
_cell_length_b                   13.714(4)
_cell_length_c                   16.694(5)
_cell_angle_alpha                110.48(4)
_cell_angle_beta                 92.56(4)
_cell_angle_gamma                113.89(5)
_cell_volume                     2457.6(19)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    3794
_cell_measurement_theta_min      2.89
_cell_measurement_theta_max      77.67

_exptl_crystal_description       needle
_exptl_crystal_colour            'dark brown'
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.04
_exptl_crystal_size_min          0.03
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.305
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             996
_exptl_absorpt_coefficient_mu    2.951
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_correction_T_min  0.752
_exptl_absorpt_correction_T_max  0.930
_exptl_absorpt_process_details   
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.33.66 (release 28-04-2010 CrysAlis171 .NET)
(compiled Apr 28 2010,14:27:37)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     1.54184
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Xcalibur, Onyx'
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            18841
_diffrn_reflns_av_R_equivalents  0.0943
_diffrn_reflns_av_sigmaI/netI    0.1349
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         2.89
_diffrn_reflns_theta_max         67.49
_reflns_number_total             8720
_reflns_number_gt                5380
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0818P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         8720
_refine_ls_number_parameters     616
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0896
_refine_ls_R_factor_gt           0.0630
_refine_ls_wR_factor_ref         0.1570
_refine_ls_wR_factor_gt          0.1501
_refine_ls_goodness_of_fit_ref   0.866
_refine_ls_restrained_S_all      0.866
_refine_ls_shift/su_max          0.009
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ru1 Ru 0.27166(4) 0.03740(4) 0.27558(3) 0.02580(13) Uani 1 1 d . . . . .
N22 N 0.3139(4) 0.2012(4) 0.2809(3) 0.0255(10) Uani 1 1 d . . . . .
N23 N 0.1006(4) -0.0187(4) 0.2105(3) 0.0232(10) Uani 1 1 d . . . . .
N24 N 0.2315(4) -0.1300(4) 0.2599(3) 0.0259(11) Uani 1 1 d . . . . .
C1 C 0.5313(5) 0.2070(5) 0.3660(3) 0.0250(12) Uani 1 1 d . . . . .
C2 C 0.6332(5) 0.2118(5) 0.4118(3) 0.0280(13) Uani 1 1 d . . . . .
C2A C 0.7428(6) 0.3060(6) 0.4522(5) 0.0533(19) Uani 1 1 d . . . . .
H2A H 0.7547 0.3723 0.4406 0.064 Uiso 1 1 calc R U . . .
C2B C 0.8387(7) 0.3207(7) 0.5070(6) 0.062(2) Uani 1 1 d . . . . .
H2B H 0.9061 0.3931 0.5236 0.074 Uiso 1 1 calc R U . . .
C2C C 0.8498(6) 0.2460(6) 0.5404(4) 0.0472(17) Uani 1 1 d . . . . .
H2C H 0.9208 0.2743 0.5802 0.057 Uiso 1 1 calc R U . . .
C3 C 0.6000(5) 0.0962(5) 0.4103(3) 0.0270(12) Uani 1 1 d . . . . .
C3A C 0.6593(5) 0.0660(5) 0.4625(3) 0.0310(13) Uani 1 1 d . . . . .
H3A H 0.6203 -0.0122 0.4570 0.037 Uiso 1 1 calc R U . . .
C3B C 0.7670(6) 0.1336(6) 0.5211(4) 0.0376(14) Uani 1 1 d . . . . .
H3B H 0.7868 0.0962 0.5532 0.045 Uiso 1 1 calc R U . . .
C4 C 0.4837(5) 0.0214(5) 0.3545(3) 0.0259(12) Uani 1 1 d . . . . .
C5 C 0.4245(5) -0.1020(5) 0.3259(3) 0.0290(13) Uani 1 1 d . . . . .
C5A C 0.4905(5) -0.1671(5) 0.3304(4) 0.0307(13) Uani 1 1 d . . . . .
C5B C 0.5706(6) -0.1718(6) 0.2774(4) 0.0406(15) Uani 1 1 d . . . . .
H5B H 0.5806 -0.1341 0.2383 0.049 Uiso 1 1 calc R U . . .
C5C C 0.6360(6) -0.2303(6) 0.2804(5) 0.0471(17) Uani 1 1 d . . . . .
H5C H 0.6903 -0.2315 0.2437 0.057 Uiso 1 1 calc R U . . .
C5D C 0.6230(6) -0.2866(6) 0.3359(4) 0.0429(16) Uani 1 1 d . . . . .
H5D H 0.6683 -0.3261 0.3380 0.052 Uiso 1 1 calc R U . . .
C5E C 0.5422(6) -0.2847(6) 0.3890(4) 0.0435(17) Uani 1 1 d . . . . .
H5E H 0.5338 -0.3217 0.4286 0.052 Uiso 1 1 calc R U . . .
C5F C 0.4743(6) -0.2291(5) 0.3842(4) 0.0362(14) Uani 1 1 d . . . . .
H5F H 0.4160 -0.2329 0.4177 0.043 Uiso 1 1 calc R U . . .
C6 C 0.3060(5) -0.1703(5) 0.2830(3) 0.0261(12) Uani 1 1 d . . . . .
C7 C 0.2456(5) -0.2954(5) 0.2516(4) 0.0326(13) Uani 1 1 d . . . . .
H7 H 0.2776 -0.3448 0.2570 0.039 Uiso 1 1 calc R U . . .
C8 C 0.1353(6) -0.3292(5) 0.2131(4) 0.0349(14) Uani 1 1 d . . . . .
H8 H 0.0747 -0.4068 0.1879 0.042 Uiso 1 1 calc R U . . .
C9 C 0.1255(5) -0.2271(5) 0.2167(3) 0.0298(13) Uani 1 1 d . . . . .
C10 C 0.0249(5) -0.2290(5) 0.1784(3) 0.0297(13) Uani 1 1 d . . . . .
C10A C -0.0815(5) -0.3448(5) 0.1356(3) 0.0309(13) Uani 1 1 d . . . . .
C10B C -0.0891(6) -0.4268(6) 0.0543(4) 0.0424(16) Uani 1 1 d . . . . .
H10B H -0.0251 -0.4110 0.0262 0.051 Uiso 1 1 calc R U . . .
C10C C -0.1896(6) -0.5313(6) 0.0143(4) 0.0460(18) Uani 1 1 d . . . . .
H10C H -0.1945 -0.5855 -0.0418 0.055 Uiso 1 1 calc R U . . .
C10D C -0.2814(6) -0.5576(6) 0.0541(4) 0.0413(16) Uani 1 1 d . . . . .
H10D H -0.3498 -0.6297 0.0265 0.050 Uiso 1 1 calc R U . . .
C10E C -0.2734(6) -0.4774(6) 0.1356(4) 0.0421(16) Uani 1 1 d . . . . .
H10E H -0.3368 -0.4952 0.1640 0.051 Uiso 1 1 calc R U . . .
C10F C -0.1765(6) -0.3739(5) 0.1754(4) 0.0363(14) Uani 1 1 d . . . . .
H10F H -0.1732 -0.3204 0.2313 0.044 Uiso 1 1 calc R U . . .
C11 C 0.0121(5) -0.1318(5) 0.1767(3) 0.0301(13) Uani 1 1 d . . . . .
C12 C -0.0914(5) -0.1338(6) 0.1390(4) 0.0361(15) Uani 1 1 d . . . . .
H12 H -0.1645 -0.2006 0.1112 0.043 Uiso 1 1 calc R U . . .
C13 C -0.0664(5) -0.0233(6) 0.1503(4) 0.0345(14) Uani 1 1 d . . . . .
H13 H -0.1187 0.0021 0.1326 0.041 Uiso 1 1 calc R U . . .
C14 C 0.0552(5) 0.0488(6) 0.1944(4) 0.0330(14) Uani 1 1 d . . . . .
C15 C 0.1180(6) 0.1690(6) 0.2158(4) 0.0334(14) Uani 1 1 d . . . . .
C15A C 0.0511(6) 0.2294(6) 0.1953(4) 0.0412(16) Uani 1 1 d . . . . .
C15B C 0.0143(6) 0.2093(7) 0.1084(5) 0.0519(19) Uani 1 1 d . . . . .
H15B H 0.0312 0.1579 0.0620 0.062 Uiso 1 1 calc R U . . .
C15C C -0.0479(7) 0.2659(8) 0.0904(7) 0.072(3) Uani 1 1 d . . . . .
H15C H -0.0733 0.2522 0.0315 0.086 Uiso 1 1 calc R U . . .
C15D C -0.0725(8) 0.3417(8) 0.1582(8) 0.089(4) Uani 1 1 d . . . . .
H15D H -0.1155 0.3788 0.1454 0.106 Uiso 1 1 calc R U . . .
C15E C -0.0342(8) 0.3632(8) 0.2446(7) 0.077(3) Uani 1 1 d . . . . .
H15E H -0.0495 0.4160 0.2912 0.092 Uiso 1 1 calc R U . . .
C15F C 0.0276(7) 0.3056(7) 0.2622(5) 0.057(2) Uani 1 1 d . . . . .
H15F H 0.0534 0.3196 0.3212 0.068 Uiso 1 1 calc R U . . .
C16 C 0.2380(5) 0.2370(5) 0.2532(3) 0.0300(13) Uani 1 1 d . . . . .
C17 C 0.3015(5) 0.3583(5) 0.2688(4) 0.0324(13) Uani 1 1 d . . . . .
H17 H 0.2701 0.4044 0.2559 0.039 Uiso 1 1 calc R U . . .
C18 C 0.4140(5) 0.3944(5) 0.3051(4) 0.0314(13) Uani 1 1 d . . . . .
H18 H 0.4763 0.4700 0.3212 0.038 Uiso 1 1 calc R U . . .
C19 C 0.4219(5) 0.2969(5) 0.3148(3) 0.0242(12) Uani 1 1 d . . . . .
C20 C 0.5224(5) 0.3030(5) 0.3554(3) 0.0282(13) Uani 1 1 d . . . . .
C20A C 0.6252(5) 0.4225(5) 0.3918(3) 0.0271(13) Uani 1 1 d . . . . .
C20B C 0.7070(6) 0.4601(6) 0.3436(4) 0.0409(16) Uani 1 1 d . . . . .
H20B H 0.6973 0.4096 0.2847 0.049 Uiso 1 1 calc R U . . .
C20C C 0.8009(6) 0.5679(6) 0.3791(4) 0.0423(16) Uani 1 1 d . . . . .
H20C H 0.8556 0.5910 0.3448 0.051 Uiso 1 1 calc R U . . .
C20D C 0.8171(5) 0.6434(5) 0.4641(4) 0.0351(14) Uani 1 1 d . . . . .
H20D H 0.8828 0.7179 0.4894 0.042 Uiso 1 1 calc R U . . .
C20E C 0.7356(6) 0.6077(6) 0.5111(4) 0.0461(18) Uani 1 1 d . . . . .
H20E H 0.7443 0.6591 0.5693 0.055 Uiso 1 1 calc R U . . .
C20F C 0.6429(6) 0.5008(6) 0.4764(4) 0.0429(17) Uani 1 1 d . . . . .
H20F H 0.5885 0.4790 0.5112 0.052 Uiso 1 1 calc R U . . .
C21 C 0.4382(5) 0.0916(5) 0.3326(3) 0.0248(12) Uani 1 1 d . . . . .
C22 C 0.2408(6) 0.0789(5) 0.3855(3) 0.0297(13) Uani 1 1 d . . . . .
O22 O 0.2230(4) 0.1062(4) 0.4554(2) 0.0421(11) Uani 1 1 d . . . . .
C23 C 0.3610(5) -0.0776(5) 0.1177(4) 0.0340(14) Uani 1 1 d . . . . .
H23 H 0.3864 -0.1025 0.1578 0.041 Uiso 1 1 calc R U . . .
C24 C 0.3804(6) -0.1152(5) 0.0332(4) 0.0364(14) Uani 1 1 d . . . . .
H24 H 0.4177 -0.1643 0.0170 0.044 Uiso 1 1 calc R U . . .
C25 C 0.3442(5) -0.0797(5) -0.0280(3) 0.0356(15) Uani 1 1 d . . . . .
C26 C 0.2917(6) -0.0066(6) 0.0024(4) 0.0431(17) Uani 1 1 d . . . . .
H26 H 0.2674 0.0221 -0.0352 0.052 Uiso 1 1 calc R U . . .
C27 C 0.2747(6) 0.0241(6) 0.0864(4) 0.0386(15) Uani 1 1 d . . . . .
H27 H 0.2362 0.0719 0.1040 0.046 Uiso 1 1 calc R U . . .
C28 C 0.4141(7) -0.1915(6) -0.1393(4) 0.050(2) Uani 1 1 d . . . . .
H28A H 0.3628 -0.2664 -0.1379 0.075 Uiso 1 1 calc R U . . .
H28B H 0.4901 -0.1581 -0.1001 0.075 Uiso 1 1 calc R U . . .
H28C H 0.4246 -0.2034 -0.1992 0.075 Uiso 1 1 calc R U . . .
C29 C 0.3238(7) -0.0768(8) -0.1736(4) 0.060(2) Uani 1 1 d . . . . .
H29A H 0.3557 -0.0964 -0.2260 0.090 Uiso 1 1 calc R U . . .
H29B H 0.3507 0.0076 -0.1463 0.090 Uiso 1 1 calc R U . . .
H29C H 0.2383 -0.1166 -0.1903 0.090 Uiso 1 1 calc R U . . .
N1 N 0.3091(4) -0.0092(4) 0.1457(3) 0.0298(11) Uani 1 1 d . . . . .
N2 N 0.3635(5) -0.1144(5) -0.1114(3) 0.0452(15) Uani 1 1 d . . . . .
C30 C 0.9501(6) 0.9192(7) 0.3851(4) 0.0458(17) Uani 1 1 d . . . . .
C31 C 0.9296(7) 1.0144(6) 0.3799(4) 0.0517(19) Uani 1 1 d . . . . .
H31A H 0.9683 1.0387 0.3361 0.078 Uiso 1 1 calc R U . . .
H31B H 0.9613 1.0804 0.4372 0.078 Uiso 1 1 calc R U . . .
H31C H 0.8456 0.9879 0.3630 0.078 Uiso 1 1 calc R U . . .
N3 N 0.9672(5) 0.8501(5) 0.3905(3) 0.0430(14) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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 C22 1.835(5) . ?
Ru1 C21 2.017(6) . ?
Ru1 N24 2.053(5) . ?
Ru1 N22 2.054(5) . ?
Ru1 N23 2.105(5) . ?
Ru1 N1 2.170(4) . ?
N22 C19 1.379(7) . ?
N22 C16 1.382(7) . ?
N23 C14 1.364(7) . ?
N23 C11 1.385(7) . ?
N24 C6 1.384(7) . ?
N24 C9 1.385(7) . ?
C1 C21 1.427(8) . ?
C1 C20 1.435(8) . ?
C1 C2 1.452(8) . ?
C2 C2A 1.392(9) . ?
C2 C3 1.455(8) . ?
C2A C2B 1.401(10) . ?
C2A H2A 0.9500 . ?
C2B C2C 1.375(10) . ?
C2B H2B 0.9500 . ?
C2C C3B 1.380(9) . ?
C2C H2C 0.9500 . ?
C3 C3A 1.399(8) . ?
C3 C4 1.456(8) . ?
C3A C3B 1.391(8) . ?
C3A H3A 0.9500 . ?
C3B H3B 0.9500 . ?
C4 C5 1.425(8) . ?
C4 C21 1.444(8) . ?
C5 C6 1.409(8) . ?
C5 C5A 1.474(8) . ?
C5A C5B 1.392(8) . ?
C5A C5F 1.408(8) . ?
C5B C5C 1.385(9) . ?
C5B H5B 0.9500 . ?
C5C C5D 1.376(9) . ?
C5C H5C 0.9500 . ?
C5D C5E 1.397(9) . ?
C5D H5D 0.9500 . ?
C5E C5F 1.387(9) . ?
C5E H5E 0.9500 . ?
C5F H5F 0.9500 . ?
C6 C7 1.441(8) . ?
C7 C8 1.346(9) . ?
C7 H7 0.9500 . ?
C8 C9 1.437(8) . ?
C8 H8 0.9500 . ?
C9 C10 1.402(8) . ?
C10 C11 1.416(8) . ?
C10 C10A 1.504(8) . ?
C10A C10B 1.396(8) . ?
C10A C10F 1.398(8) . ?
C10B C10C 1.386(9) . ?
C10B H10B 0.9500 . ?
C10C C10D 1.362(9) . ?
C10C H10C 0.9500 . ?
C10D C10E 1.385(9) . ?
C10D H10D 0.9500 . ?
C10E C10F 1.356(9) . ?
C10E H10E 0.9500 . ?
C10F H10F 0.9500 . ?
C11 C12 1.430(8) . ?
C12 C13 1.355(9) . ?
C12 H12 0.9500 . ?
C13 C14 1.447(8) . ?
C13 H13 0.9500 . ?
C14 C15 1.408(9) . ?
C15 C16 1.405(8) . ?
C15 C15A 1.513(9) . ?
C15A C15F 1.379(10) . ?
C15A C15B 1.399(9) . ?
C15B C15C 1.404(11) . ?
C15B H15B 0.9500 . ?
C15C C15D 1.392(14) . ?
C15C H15C 0.9500 . ?
C15D C15E 1.389(13) . ?
C15D H15D 0.9500 . ?
C15E C15F 1.410(11) . ?
C15E H15E 0.9500 . ?
C15F H15F 0.9500 . ?
C16 C17 1.442(8) . ?
C17 C18 1.354(8) . ?
C17 H17 0.9500 . ?
C18 C19 1.443(8) . ?
C18 H18 0.9500 . ?
C19 C20 1.388(8) . ?
C20 C20A 1.509(8) . ?
C20A C20F 1.383(8) . ?
C20A C20B 1.395(8) . ?
C20B C20C 1.368(9) . ?
C20B H20B 0.9500 . ?
C20C C20D 1.379(8) . ?
C20C H20C 0.9500 . ?
C20D C20E 1.370(9) . ?
C20D H20D 0.9500 . ?
C20E C20F 1.354(9) . ?
C20E H20E 0.9500 . ?
C20F H20F 0.9500 . ?
C22 O22 1.158(6) . ?
C23 N1 1.330(8) . ?
C23 C24 1.394(8) . ?
C23 H23 0.9500 . ?
C24 C25 1.410(9) . ?
C24 H24 0.9500 . ?
C25 N2 1.374(7) . ?
C25 C26 1.393(9) . ?
C26 C27 1.370(8) . ?
C26 H26 0.9500 . ?
C27 N1 1.352(7) . ?
C27 H27 0.9500 . ?
C28 N2 1.413(9) . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?
C29 N2 1.464(9) . ?
C29 H29A 0.9800 . ?
C29 H29B 0.9800 . ?
C29 H29C 0.9800 . ?
C30 N3 1.087(9) . ?
C30 C31 1.462(10) . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?

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
C22 Ru1 C21 88.1(2) . . ?
C22 Ru1 N24 94.1(2) . . ?
C21 Ru1 N24 90.5(2) . . ?
C22 Ru1 N22 90.6(2) . . ?
C21 Ru1 N22 90.0(2) . . ?
N24 Ru1 N22 175.27(17) . . ?
C22 Ru1 N23 94.6(2) . . ?
C21 Ru1 N23 177.26(19) . . ?
N24 Ru1 N23 90.2(2) . . ?
N22 Ru1 N23 89.13(19) . . ?
C22 Ru1 N1 179.2(2) . . ?
C21 Ru1 N1 91.83(19) . . ?
N24 Ru1 N1 86.70(18) . . ?
N22 Ru1 N1 88.58(18) . . ?
N23 Ru1 N1 85.55(18) . . ?
C19 N22 C16 107.0(5) . . ?
C19 N22 Ru1 126.8(4) . . ?
C16 N22 Ru1 126.2(4) . . ?
C14 N23 C11 107.0(5) . . ?
C14 N23 Ru1 126.9(4) . . ?
C11 N23 Ru1 126.0(4) . . ?
C6 N24 C9 106.4(5) . . ?
C6 N24 Ru1 127.5(4) . . ?
C9 N24 Ru1 126.0(4) . . ?
C21 C1 C20 123.8(5) . . ?
C21 C1 C2 110.1(5) . . ?
C20 C1 C2 126.1(5) . . ?
C2A C2 C1 128.9(6) . . ?
C2A C2 C3 124.2(6) . . ?
C1 C2 C3 106.9(5) . . ?
C2 C2A C2B 131.6(7) . . ?
C2 C2A H2A 114.2 . . ?
C2B C2A H2A 114.2 . . ?
C2C C2B C2A 129.7(7) . . ?
C2C C2B H2B 115.1 . . ?
C2A C2B H2B 115.1 . . ?
C2B C2C C3B 125.7(7) . . ?
C2B C2C H2C 117.1 . . ?
C3B C2C H2C 117.1 . . ?
C3A C3 C2 127.0(5) . . ?
C3A C3 C4 125.7(5) . . ?
C2 C3 C4 106.6(5) . . ?
C3B C3A C3 129.5(6) . . ?
C3B C3A H3A 115.2 . . ?
C3 C3A H3A 115.2 . . ?
C2C C3B C3A 130.8(6) . . ?
C2C C3B H3B 114.6 . . ?
C3A C3B H3B 114.6 . . ?
C5 C4 C21 125.6(5) . . ?
C5 C4 C3 125.0(5) . . ?
C21 C4 C3 109.4(5) . . ?
C6 C5 C4 123.7(5) . . ?
C6 C5 C5A 115.8(5) . . ?
C4 C5 C5A 120.1(5) . . ?
C5B C5A C5F 117.2(6) . . ?
C5B C5A C5 119.6(5) . . ?
C5F C5A C5 123.2(5) . . ?
C5C C5B C5A 121.6(6) . . ?
C5C C5B H5B 119.2 . . ?
C5A C5B H5B 119.2 . . ?
C5D C5C C5B 120.7(6) . . ?
C5D C5C H5C 119.7 . . ?
C5B C5C H5C 119.7 . . ?
C5C C5D C5E 119.1(6) . . ?
C5C C5D H5D 120.4 . . ?
C5E C5D H5D 120.4 . . ?
C5F C5E C5D 120.2(6) . . ?
C5F C5E H5E 119.9 . . ?
C5D C5E H5E 119.9 . . ?
C5E C5F C5A 121.0(6) . . ?
C5E C5F H5F 119.5 . . ?
C5A C5F H5F 119.5 . . ?
N24 C6 C5 126.1(5) . . ?
N24 C6 C7 109.4(5) . . ?
C5 C6 C7 124.5(5) . . ?
C8 C7 C6 107.2(6) . . ?
C8 C7 H7 126.4 . . ?
C6 C7 H7 126.4 . . ?
C7 C8 C9 108.0(6) . . ?
C7 C8 H8 126.0 . . ?
C9 C8 H8 126.0 . . ?
N24 C9 C10 126.6(6) . . ?
N24 C9 C8 109.1(5) . . ?
C10 C9 C8 124.2(6) . . ?
C9 C10 C11 126.5(6) . . ?
C9 C10 C10A 117.5(6) . . ?
C11 C10 C10A 115.9(5) . . ?
C10B C10A C10F 117.7(6) . . ?
C10B C10A C10 121.1(6) . . ?
C10F C10A C10 121.2(5) . . ?
C10C C10B C10A 120.3(6) . . ?
C10C C10B H10B 119.9 . . ?
C10A C10B H10B 119.9 . . ?
C10D C10C C10B 121.1(6) . . ?
C10D C10C H10C 119.5 . . ?
C10B C10C H10C 119.5 . . ?
C10C C10D C10E 118.9(6) . . ?
C10C C10D H10D 120.6 . . ?
C10E C10D H10D 120.6 . . ?
C10F C10E C10D 121.1(6) . . ?
C10F C10E H10E 119.4 . . ?
C10D C10E H10E 119.4 . . ?
C10E C10F C10A 121.0(6) . . ?
C10E C10F H10F 119.5 . . ?
C10A C10F H10F 119.5 . . ?
N23 C11 C10 124.6(5) . . ?
N23 C11 C12 109.1(5) . . ?
C10 C11 C12 126.3(6) . . ?
C13 C12 C11 107.7(6) . . ?
C13 C12 H12 126.2 . . ?
C11 C12 H12 126.2 . . ?
C12 C13 C14 106.9(6) . . ?
C12 C13 H13 126.5 . . ?
C14 C13 H13 126.5 . . ?
N23 C14 C15 125.1(6) . . ?
N23 C14 C13 109.3(5) . . ?
C15 C14 C13 125.6(6) . . ?
C16 C15 C14 125.4(6) . . ?
C16 C15 C15A 117.4(5) . . ?
C14 C15 C15A 117.2(6) . . ?
C15F C15A C15B 119.7(7) . . ?
C15F C15A C15 120.2(6) . . ?
C15B C15A C15 120.1(6) . . ?
C15A C15B C15C 119.5(8) . . ?
C15A C15B H15B 120.2 . . ?
C15C C15B H15B 120.2 . . ?
C15D C15C C15B 120.5(8) . . ?
C15D C15C H15C 119.7 . . ?
C15B C15C H15C 119.7 . . ?
C15E C15D C15C 120.0(8) . . ?
C15E C15D H15D 120.0 . . ?
C15C C15D H15D 120.0 . . ?
C15D C15E C15F 119.2(9) . . ?
C15D C15E H15E 120.4 . . ?
C15F C15E H15E 120.4 . . ?
C15A C15F C15E 121.1(8) . . ?
C15A C15F H15F 119.5 . . ?
C15E C15F H15F 119.5 . . ?
N22 C16 C15 127.0(6) . . ?
N22 C16 C17 109.0(5) . . ?
C15 C16 C17 124.0(6) . . ?
C18 C17 C16 107.4(5) . . ?
C18 C17 H17 126.3 . . ?
C16 C17 H17 126.3 . . ?
C17 C18 C19 107.5(5) . . ?
C17 C18 H18 126.3 . . ?
C19 C18 H18 126.3 . . ?
N22 C19 C20 126.8(5) . . ?
N22 C19 C18 109.0(5) . . ?
C20 C19 C18 124.1(5) . . ?
C19 C20 C1 124.8(6) . . ?
C19 C20 C20A 114.6(5) . . ?
C1 C20 C20A 120.6(5) . . ?
C20F C20A C20B 116.5(6) . . ?
C20F C20A C20 120.7(5) . . ?
C20B C20A C20 122.8(5) . . ?
C20C C20B C20A 121.5(6) . . ?
C20C C20B H20B 119.3 . . ?
C20A C20B H20B 119.3 . . ?
C20B C20C C20D 120.7(6) . . ?
C20B C20C H20C 119.7 . . ?
C20D C20C H20C 119.7 . . ?
C20E C20D C20C 118.0(6) . . ?
C20E C20D H20D 121.0 . . ?
C20C C20D H20D 121.0 . . ?
C20F C20E C20D 121.6(6) . . ?
C20F C20E H20E 119.2 . . ?
C20D C20E H20E 119.2 . . ?
C20E C20F C20A 121.8(6) . . ?
C20E C20F H20F 119.1 . . ?
C20A C20F H20F 119.1 . . ?
C1 C21 C4 106.4(5) . . ?
C1 C21 Ru1 127.6(4) . . ?
C4 C21 Ru1 125.9(4) . . ?
O22 C22 Ru1 179.0(6) . . ?
N1 C23 C24 124.2(6) . . ?
N1 C23 H23 117.9 . . ?
C24 C23 H23 117.9 . . ?
C23 C24 C25 119.5(6) . . ?
C23 C24 H24 120.3 . . ?
C25 C24 H24 120.3 . . ?
N2 C25 C26 123.6(6) . . ?
N2 C25 C24 120.6(6) . . ?
C26 C25 C24 115.8(5) . . ?
C27 C26 C25 120.4(6) . . ?
C27 C26 H26 119.8 . . ?
C25 C26 H26 119.8 . . ?
N1 C27 C26 124.4(6) . . ?
N1 C27 H27 117.8 . . ?
C26 C27 H27 117.8 . . ?
N2 C28 H28A 109.5 . . ?
N2 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
N2 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
N2 C29 H29A 109.5 . . ?
N2 C29 H29B 109.5 . . ?
H29A C29 H29B 109.5 . . ?
N2 C29 H29C 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
C23 N1 C27 115.7(5) . . ?
C23 N1 Ru1 122.4(4) . . ?
C27 N1 Ru1 121.8(4) . . ?
C25 N2 C28 120.9(6) . . ?
C25 N2 C29 119.2(6) . . ?
C28 N2 C29 119.8(5) . . ?
N3 C30 C31 178.5(8) . . ?
C30 C31 H31A 109.5 . . ?
C30 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
C30 C31 H31C 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?

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
C21 C1 C2 C2A 178.5(6) . . . . ?
C20 C1 C2 C2A -2.2(10) . . . . ?
C21 C1 C2 C3 -2.7(6) . . . . ?
C20 C1 C2 C3 176.6(5) . . . . ?
C1 C2 C2A C2B 170.1(8) . . . . ?
C3 C2 C2A C2B -8.5(13) . . . . ?
C2 C2A C2B C2C -3.5(17) . . . . ?
C2A C2B C2C C3B 4.5(15) . . . . ?
C2A C2 C3 C3A 14.7(10) . . . . ?
C1 C2 C3 C3A -164.2(5) . . . . ?
C2A C2 C3 C4 -174.4(6) . . . . ?
C1 C2 C3 C4 6.8(6) . . . . ?
C2 C3 C3A C3B -6.7(10) . . . . ?
C4 C3 C3A C3B -175.9(5) . . . . ?
C2B C2C C3B C3A 4.3(13) . . . . ?
C3 C3A C3B C2C -5.2(11) . . . . ?
C3A C3 C4 C5 -17.6(9) . . . . ?
C2 C3 C4 C5 171.3(5) . . . . ?
C3A C3 C4 C21 162.6(5) . . . . ?
C2 C3 C4 C21 -8.5(6) . . . . ?
C21 C4 C5 C6 -10.1(8) . . . . ?
C3 C4 C5 C6 170.1(5) . . . . ?
C21 C4 C5 C5A 162.2(5) . . . . ?
C3 C4 C5 C5A -17.6(8) . . . . ?
C6 C5 C5A C5B 106.4(6) . . . . ?
C4 C5 C5A C5B -66.5(7) . . . . ?
C6 C5 C5A C5F -71.5(7) . . . . ?
C4 C5 C5A C5F 115.7(6) . . . . ?
C5F C5A C5B C5C -3.1(10) . . . . ?
C5 C5A C5B C5C 178.9(6) . . . . ?
C5A C5B C5C C5D 0.5(11) . . . . ?
C5B C5C C5D C5E 0.4(11) . . . . ?
C5C C5D C5E C5F 1.5(10) . . . . ?
C5D C5E C5F C5A -4.3(10) . . . . ?
C5B C5A C5F C5E 5.0(9) . . . . ?
C5 C5A C5F C5E -177.1(6) . . . . ?
C9 N24 C6 C5 177.9(5) . . . . ?
Ru1 N24 C6 C5 3.0(7) . . . . ?
C9 N24 C6 C7 1.4(5) . . . . ?
Ru1 N24 C6 C7 -173.5(3) . . . . ?
C4 C5 C6 N24 2.3(8) . . . . ?
C5A C5 C6 N24 -170.2(5) . . . . ?
C4 C5 C6 C7 178.3(5) . . . . ?
C5A C5 C6 C7 5.7(7) . . . . ?
N24 C6 C7 C8 -2.2(6) . . . . ?
C5 C6 C7 C8 -178.7(5) . . . . ?
C6 C7 C8 C9 2.1(6) . . . . ?
C6 N24 C9 C10 -177.4(5) . . . . ?
Ru1 N24 C9 C10 -2.4(7) . . . . ?
C6 N24 C9 C8 -0.1(6) . . . . ?
Ru1 N24 C9 C8 174.9(3) . . . . ?
C7 C8 C9 N24 -1.3(6) . . . . ?
C7 C8 C9 C10 176.1(5) . . . . ?
N24 C9 C10 C11 -0.2(9) . . . . ?
C8 C9 C10 C11 -177.1(5) . . . . ?
N24 C9 C10 C10A -179.3(5) . . . . ?
C8 C9 C10 C10A 3.8(8) . . . . ?
C9 C10 C10A C10B -75.2(8) . . . . ?
C11 C10 C10A C10B 105.6(7) . . . . ?
C9 C10 C10A C10F 105.2(7) . . . . ?
C11 C10 C10A C10F -74.0(7) . . . . ?
C10F C10A C10B C10C 2.1(10) . . . . ?
C10 C10A C10B C10C -177.5(6) . . . . ?
C10A C10B C10C C10D -1.8(11) . . . . ?
C10B C10C C10D C10E 0.5(11) . . . . ?
C10C C10D C10E C10F 0.4(11) . . . . ?
C10D C10E C10F C10A 0.0(11) . . . . ?
C10B C10A C10F C10E -1.2(10) . . . . ?
C10 C10A C10F C10E 178.4(6) . . . . ?
C14 N23 C11 C10 178.4(5) . . . . ?
Ru1 N23 C11 C10 -2.2(7) . . . . ?
C14 N23 C11 C12 -0.4(6) . . . . ?
Ru1 N23 C11 C12 179.0(3) . . . . ?
C9 C10 C11 N23 2.7(9) . . . . ?
C10A C10 C11 N23 -178.2(5) . . . . ?
C9 C10 C11 C12 -178.7(5) . . . . ?
C10A C10 C11 C12 0.4(8) . . . . ?
N23 C11 C12 C13 -0.4(6) . . . . ?
C10 C11 C12 C13 -179.2(5) . . . . ?
C11 C12 C13 C14 0.9(6) . . . . ?
C11 N23 C14 C15 -177.7(5) . . . . ?
Ru1 N23 C14 C15 2.9(8) . . . . ?
C11 N23 C14 C13 1.0(6) . . . . ?
Ru1 N23 C14 C13 -178.4(3) . . . . ?
C12 C13 C14 N23 -1.2(6) . . . . ?
C12 C13 C14 C15 177.5(6) . . . . ?
N23 C14 C15 C16 3.1(9) . . . . ?
C13 C14 C15 C16 -175.4(5) . . . . ?
N23 C14 C15 C15A -178.0(5) . . . . ?
C13 C14 C15 C15A 3.5(9) . . . . ?
C16 C15 C15A C15F -72.2(8) . . . . ?
C14 C15 C15A C15F 108.9(7) . . . . ?
C16 C15 C15A C15B 107.0(7) . . . . ?
C14 C15 C15A C15B -72.0(8) . . . . ?
C15F C15A C15B C15C -0.9(11) . . . . ?
C15 C15A C15B C15C 179.9(7) . . . . ?
C15A C15B C15C C15D 0.2(12) . . . . ?
C15B C15C C15D C15E 0.8(14) . . . . ?
C15C C15D C15E C15F -1.2(14) . . . . ?
C15B C15A C15F C15E 0.6(12) . . . . ?
C15 C15A C15F C15E 179.7(7) . . . . ?
C15D C15E C15F C15A 0.5(13) . . . . ?
C19 N22 C16 C15 -178.7(5) . . . . ?
Ru1 N22 C16 C15 -0.5(8) . . . . ?
C19 N22 C16 C17 1.2(6) . . . . ?
Ru1 N22 C16 C17 179.5(3) . . . . ?
C14 C15 C16 N22 -4.5(9) . . . . ?
C15A C15 C16 N22 176.6(5) . . . . ?
C14 C15 C16 C17 175.5(5) . . . . ?
C15A C15 C16 C17 -3.4(8) . . . . ?
N22 C16 C17 C18 0.1(6) . . . . ?
C15 C16 C17 C18 -179.9(5) . . . . ?
C16 C17 C18 C19 -1.4(6) . . . . ?
C16 N22 C19 C20 175.4(5) . . . . ?
Ru1 N22 C19 C20 -2.9(7) . . . . ?
C16 N22 C19 C18 -2.1(6) . . . . ?
Ru1 N22 C19 C18 179.6(3) . . . . ?
C17 C18 C19 N22 2.2(6) . . . . ?
C17 C18 C19 C20 -175.3(5) . . . . ?
N22 C19 C20 C1 2.5(8) . . . . ?
C18 C19 C20 C1 179.6(5) . . . . ?
N22 C19 C20 C20A -175.6(5) . . . . ?
C18 C19 C20 C20A 1.5(7) . . . . ?
C21 C1 C20 C19 2.5(8) . . . . ?
C2 C1 C20 C19 -176.7(5) . . . . ?
C21 C1 C20 C20A -179.5(4) . . . . ?
C2 C1 C20 C20A 1.3(8) . . . . ?
C19 C20 C20A C20F 89.2(7) . . . . ?
C1 C20 C20A C20F -89.0(7) . . . . ?
C19 C20 C20A C20B -91.0(7) . . . . ?
C1 C20 C20A C20B 90.8(7) . . . . ?
C20F C20A C20B C20C 1.4(10) . . . . ?
C20 C20A C20B C20C -178.4(6) . . . . ?
C20A C20B C20C C20D -0.4(11) . . . . ?
C20B C20C C20D C20E -0.9(11) . . . . ?
C20C C20D C20E C20F 1.4(11) . . . . ?
C20D C20E C20F C20A -0.4(12) . . . . ?
C20B C20A C20F C20E -0.9(11) . . . . ?
C20 C20A C20F C20E 178.9(6) . . . . ?
C20 C1 C21 C4 178.1(4) . . . . ?
C2 C1 C21 C4 -2.5(6) . . . . ?
C20 C1 C21 Ru1 -6.7(7) . . . . ?
C2 C1 C21 Ru1 172.7(4) . . . . ?
C5 C4 C21 C1 -173.0(5) . . . . ?
C3 C4 C21 C1 6.8(5) . . . . ?
C5 C4 C21 Ru1 11.8(7) . . . . ?
C3 C4 C21 Ru1 -168.4(3) . . . . ?
N1 C23 C24 C25 0.2(10) . . . . ?
C23 C24 C25 N2 179.3(6) . . . . ?
C23 C24 C25 C26 0.8(9) . . . . ?
N2 C25 C26 C27 179.7(6) . . . . ?
C24 C25 C26 C27 -1.8(10) . . . . ?
C25 C26 C27 N1 2.1(11) . . . . ?
C24 C23 N1 C27 -0.1(9) . . . . ?
C24 C23 N1 Ru1 176.1(5) . . . . ?
C26 C27 N1 C23 -1.0(10) . . . . ?
C26 C27 N1 Ru1 -177.2(5) . . . . ?
C26 C25 N2 C28 -178.1(6) . . . . ?
C24 C25 N2 C28 3.5(9) . . . . ?
C26 C25 N2 C29 -2.1(10) . . . . ?
C24 C25 N2 C29 179.4(6) . . . . ?

loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.500 0.500 0.000 245 61 ' '
_platon_squeeze_details          
;

;

_diffrn_measured_fraction_theta_max 0.984
_diffrn_reflns_theta_full        67.49
_diffrn_measured_fraction_theta_full 0.984
_refine_diff_density_max         1.341
_refine_diff_density_min         -1.107
_refine_diff_density_rms         0.121
_database_code_depnum_ccdc_archive 'CCDC 1006123'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_2-2

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C53 H34 N4 O Ru'
_chemical_formula_weight         843.91

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru 0.0552 3.2960 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   P-1

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   10.203(5)
_cell_length_b                   13.884(6)
_cell_length_c                   14.858(6)
_cell_angle_alpha                77.68(5)
_cell_angle_beta                 70.21(5)
_cell_angle_gamma                87.94(5)
_cell_volume                     1933.3(15)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    1092
_cell_measurement_theta_min      3
_cell_measurement_theta_max      69

_exptl_crystal_description       Plate
_exptl_crystal_colour            'dark brown'
_exptl_crystal_size_max          0.16
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.03
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.450
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             864
_exptl_absorpt_coefficient_mu    3.650
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_correction_T_min  0.700
_exptl_absorpt_correction_T_max  0.908
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
Analytical numeric absorption correction using a multifaceted crystal
			model based on expressions derived by R.C. Clark & J.S. Reid.
(Clark, R. C. & Reid, J. S. (1995). Acta Cryst. A51, 887-897)
;

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     1.54180
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'Enhance (Cu) X-ray Source'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Goniometer Xcalibur, detector: Onyx'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean 8.1956
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            15999
_diffrn_reflns_av_R_equivalents  0.1753
_diffrn_reflns_av_sigmaI/netI    0.3163
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_theta_min         3.24
_diffrn_reflns_theta_max         68.10
_reflns_number_total             6879
_reflns_number_gt                2348
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         6879
_refine_ls_number_parameters     533
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.1863
_refine_ls_R_factor_gt           0.0855
_refine_ls_wR_factor_ref         0.0982
_refine_ls_wR_factor_gt          0.0843
_refine_ls_goodness_of_fit_ref   0.873
_refine_ls_restrained_S_all      0.873
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000

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 0.48790(12) 0.79919(8) 0.24111(10) 0.0452(3) Uani 1 1 d . . .
N22 N 0.4809(10) 0.9352(6) 0.2830(9) 0.057(4) Uani 1 1 d . . .
N23 N 0.6187(9) 0.8606(7) 0.1050(7) 0.043(3) Uani 1 1 d . . .
N24 N 0.5064(8) 0.6596(6) 0.2007(7) 0.044(3) Uani 1 1 d . . .
C1 C 0.3448(11) 0.6295(7) 0.4197(9) 0.041(3) Uani 1 1 d . . .
C2 C 0.3026(12) 0.6122(7) 0.5243(9) 0.046(3) Uani 1 1 d . . .
C2A C 0.2927(12) 0.5223(7) 0.5900(8) 0.043(3) Uani 1 1 d . . .
H2A H 0.3006 0.4665 0.5612 0.052 Uiso 1 1 calc R . .
C2B C 0.2737(12) 0.4984(8) 0.6884(10) 0.060(4) Uani 1 1 d . . .
H2B H 0.2772 0.4301 0.7147 0.072 Uiso 1 1 calc R . .
C2C C 0.2498(11) 0.5595(7) 0.7563(9) 0.054(4) Uani 1 1 d . . .
H2C H 0.2318 0.5292 0.8232 0.065 Uiso 1 1 calc R . .
C3 C 0.2861(12) 0.7103(8) 0.5491(9) 0.049(4) Uani 1 1 d . . .
C3A C 0.2625(12) 0.7288(9) 0.6411(10) 0.061(4) Uani 1 1 d . . .
H3A H 0.2523 0.7964 0.6443 0.074 Uiso 1 1 calc R . .
C3B C 0.2513(11) 0.6652(8) 0.7297(9) 0.052(3) Uani 1 1 d . . .
H3B H 0.2432 0.6973 0.7817 0.063 Uiso 1 1 calc R . .
C4 C 0.3254(12) 0.7840(7) 0.4579(9) 0.042(3) Uani 1 1 d . . .
C5 C 0.3189(11) 0.8841(8) 0.4542(9) 0.043(3) Uani 1 1 d . . .
C5A C 0.2244(12) 0.9259(8) 0.5366(9) 0.044(3) Uani 1 1 d . . .
C5B C 0.0830(10) 0.9107(7) 0.5699(10) 0.054(4) Uani 1 1 d . . .
H5B H 0.0446 0.8723 0.5384 0.064 Uiso 1 1 calc R . .
C5C C -0.0052(11) 0.9463(8) 0.6437(9) 0.054(4) Uani 1 1 d . . .
H5C H -0.1026 0.9327 0.6634 0.065 Uiso 1 1 calc R . .
C5D C 0.0464(12) 1.0037(8) 0.6921(10) 0.057(4) Uani 1 1 d . . .
H5D H -0.0154 1.0305 0.7438 0.069 Uiso 1 1 calc R . .
C5E C 0.1834(12) 1.0202(7) 0.6645(9) 0.053(4) Uani 1 1 d . . .
H5E H 0.2195 1.0563 0.6991 0.064 Uiso 1 1 calc R . .
C5F C 0.2720(11) 0.9865(7) 0.5883(8) 0.048(3) Uani 1 1 d . . .
H5F H 0.3687 1.0031 0.5679 0.057 Uiso 1 1 calc R . .
C6 C 0.3887(12) 0.9563(8) 0.3680(9) 0.042(3) Uani 1 1 d . . .
C7 C 0.3938(12) 1.0641(7) 0.3550(9) 0.049(4) Uani 1 1 d . . .
H7 H 0.3406 1.1003 0.4017 0.059 Uiso 1 1 calc R . .
C8 C 0.4843(12) 1.1027(8) 0.2679(9) 0.045(3) Uani 1 1 d . . .
H8 H 0.5096 1.1708 0.2431 0.054 Uiso 1 1 calc R . .
C9 C 0.5404(11) 1.0225(7) 0.2147(9) 0.040(3) Uani 1 1 d . . .
C10 C 0.6409(11) 1.0315(8) 0.1219(8) 0.033(3) Uani 1 1 d . . .
C10A C 0.7099(11) 1.1325(8) 0.0748(9) 0.036(3) Uani 1 1 d . . .
C10B C 0.8488(13) 1.1475(8) 0.0869(9) 0.064(4) Uani 1 1 d . . .
H10B H 0.8907 1.0967 0.1206 0.076 Uiso 1 1 calc R . .
C10C C 0.9083(13) 1.2386(7) 0.0461(9) 0.058(4) Uani 1 1 d . . .
H10C H 0.9935 1.2522 0.0546 0.069 Uiso 1 1 calc R . .
C10D C 0.8554(13) 1.3132(8) -0.0066(10) 0.066(5) Uani 1 1 d . . .
H10D H 0.9062 1.3745 -0.0356 0.079 Uiso 1 1 calc R . .
C10E C 0.7248(13) 1.2996(8) -0.0184(11) 0.068(5) Uani 1 1 d . . .
H10E H 0.6846 1.3509 -0.0527 0.081 Uiso 1 1 calc R . .
C10F C 0.6590(12) 1.2053(7) 0.0241(9) 0.053(4) Uani 1 1 d . . .
H10F H 0.5731 1.1931 0.0158 0.064 Uiso 1 1 calc R . .
C11 C 0.6766(12) 0.9585(7) 0.0669(9) 0.039(3) Uani 1 1 d . . .
C12 C 0.7784(12) 0.9711(8) -0.0298(9) 0.059(4) Uani 1 1 d . . .
H12 H 0.8299 1.0302 -0.0682 0.071 Uiso 1 1 calc R . .
C13 C 0.7867(12) 0.8840(7) -0.0551(8) 0.049(4) Uani 1 1 d . . .
H13 H 0.8463 0.8683 -0.1144 0.059 Uiso 1 1 calc R . .
C14 C 0.6837(11) 0.8164(7) 0.0282(9) 0.037(3) Uani 1 1 d . . .
C15 C 0.6630(11) 0.7142(8) 0.0245(9) 0.040(3) Uani 1 1 d . . .
C15A C 0.7344(11) 0.6766(8) -0.0592(9) 0.037(3) Uani 1 1 d . . .
C15B C 0.7241(10) 0.7236(8) -0.1510(9) 0.048(4) Uani 1 1 d . . .
H15B H 0.6615 0.7754 -0.1547 0.058 Uiso 1 1 calc R . .
C15C C 0.8053(12) 0.6941(8) -0.2351(9) 0.056(4) Uani 1 1 d . . .
H15C H 0.7967 0.7263 -0.2960 0.067 Uiso 1 1 calc R . .
C15D C 0.8993(11) 0.6188(9) -0.2339(10) 0.060(4) Uani 1 1 d . . .
H15D H 0.9572 0.6009 -0.2925 0.072 Uiso 1 1 calc R . .
C15E C 0.9043(11) 0.5719(8) -0.1441(9) 0.049(4) Uani 1 1 d . . .
H15E H 0.9624 0.5174 -0.1392 0.059 Uiso 1 1 calc R . .
C15F C 0.8271(10) 0.6028(7) -0.0628(9) 0.048(3) Uani 1 1 d . . .
H15F H 0.8382 0.5705 -0.0028 0.058 Uiso 1 1 calc R . .
C16 C 0.5725(10) 0.6470(7) 0.1095(8) 0.031(3) Uani 1 1 d . . .
C17 C 0.5394(11) 0.5472(7) 0.1110(9) 0.045(3) Uani 1 1 d . . .
H17 H 0.5734 0.5153 0.0575 0.055 Uiso 1 1 calc R . .
C18 C 0.4552(11) 0.5075(7) 0.1980(9) 0.041(3) Uani 1 1 d . . .
H18 H 0.4154 0.4424 0.2167 0.049 Uiso 1 1 calc R . .
C19 C 0.4302(11) 0.5765(7) 0.2629(8) 0.038(3) Uani 1 1 d . . .
C20 C 0.3646(11) 0.5581(8) 0.3597(9) 0.043(4) Uani 1 1 d . . .
C20A C 0.2974(12) 0.4567(8) 0.4069(9) 0.045(4) Uani 1 1 d . . .
C20B C 0.1487(10) 0.4446(7) 0.4410(8) 0.044(3) Uani 1 1 d . . .
H20B H 0.0928 0.4992 0.4306 0.053 Uiso 1 1 calc R . .
C20C C 0.0871(12) 0.3510(7) 0.4899(9) 0.054(4) Uani 1 1 d . . .
H20C H -0.0116 0.3425 0.5144 0.065 Uiso 1 1 calc R . .
C20D C 0.1677(11) 0.2711(8) 0.5031(9) 0.051(4) Uani 1 1 d . . .
H20D H 0.1253 0.2074 0.5346 0.061 Uiso 1 1 calc R . .
C20E C 0.3120(13) 0.2847(7) 0.4698(9) 0.053(4) Uani 1 1 d . . .
H20E H 0.3671 0.2298 0.4806 0.064 Uiso 1 1 calc R . .
C20F C 0.3786(13) 0.3773(8) 0.4206(10) 0.053(4) Uani 1 1 d . . .
H20F H 0.4774 0.3850 0.3974 0.064 Uiso 1 1 calc R . .
C21 C 0.3820(10) 0.7377(8) 0.3785(9) 0.040(3) Uani 1 1 d . . .
O22 O 0.2160(9) 0.8369(6) 0.2172(8) 0.075(3) Uani 1 1 d . . .
C22 C 0.3255(10) 0.8241(7) 0.2188(9) 0.035(3) Uani 1 1 d . . .
N25 N 0.6832(10) 0.7698(6) 0.2660(8) 0.050(3) Uani 1 1 d . . .
C23 C 0.7944(14) 0.7532(8) 0.2595(11) 0.052(4) Uani 1 1 d . . .
C24 C 0.9432(12) 0.7270(9) 0.2490(11) 0.086(5) Uani 1 1 d . . .
H24A H 1.0071 0.7776 0.1982 0.129 Uiso 1 1 calc R . .
H24B H 0.9612 0.6629 0.2306 0.129 Uiso 1 1 calc R . .
H24C H 0.9579 0.7237 0.3114 0.129 Uiso 1 1 calc R . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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 C22 1.804(10) . ?
Ru1 C21 1.973(12) . ?
Ru1 N23 2.029(10) . ?
Ru1 N22 2.102(8) . ?
Ru1 N24 2.132(8) . ?
Ru1 N25 2.156(10) . ?
N22 C6 1.379(15) . ?
N22 C9 1.406(14) . ?
N23 C14 1.370(14) . ?
N23 C11 1.421(12) . ?
N24 C16 1.341(13) . ?
N24 C19 1.383(12) . ?
C1 C2 1.432(16) . ?
C1 C20 1.435(12) . ?
C1 C21 1.506(14) . ?
C2 C2A 1.395(15) . ?
C2 C3 1.475(12) . ?
C2A C2B 1.375(16) . ?
C2A H2A 0.9500 . ?
C2B C2C 1.407(15) . ?
C2B H2B 0.9500 . ?
C2C C3B 1.435(14) . ?
C2C H2C 0.9500 . ?
C3 C3A 1.384(16) . ?
C3 C4 1.454(16) . ?
C3A C3B 1.391(17) . ?
C3A H3A 0.9500 . ?
C3B H3B 0.9500 . ?
C4 C5 1.379(13) . ?
C4 C21 1.404(14) . ?
C5 C6 1.427(15) . ?
C5 C5A 1.494(15) . ?
C5A C5B 1.365(14) . ?
C5A C5F 1.446(14) . ?
C5B C5C 1.337(14) . ?
C5B H5B 0.9500 . ?
C5C C5D 1.400(14) . ?
C5C H5C 0.9500 . ?
C5D C5E 1.330(14) . ?
C5D H5D 0.9500 . ?
C5E C5F 1.350(14) . ?
C5E H5E 0.9500 . ?
C5F H5F 0.9500 . ?
C6 C7 1.469(13) . ?
C7 C8 1.321(15) . ?
C7 H7 0.9500 . ?
C8 C9 1.488(13) . ?
C8 H8 0.9500 . ?
C9 C10 1.395(15) . ?
C10 C11 1.397(13) . ?
C10 C10A 1.507(13) . ?
C10A C10F 1.327(16) . ?
C10A C10B 1.515(15) . ?
C10B C10C 1.348(13) . ?
C10B H10B 0.9500 . ?
C10C C10D 1.370(16) . ?
C10C H10C 0.9500 . ?
C10D C10E 1.425(15) . ?
C10D H10D 0.9500 . ?
C10E C10F 1.410(13) . ?
C10E H10E 0.9500 . ?
C10F H10F 0.9500 . ?
C11 C12 1.438(15) . ?
C12 C13 1.333(13) . ?
C12 H12 0.9500 . ?
C13 C14 1.487(14) . ?
C13 H13 0.9500 . ?
C14 C15 1.457(13) . ?
C15 C15A 1.410(14) . ?
C15 C16 1.444(14) . ?
C15A C15F 1.367(15) . ?
C15A C15B 1.417(16) . ?
C15B C15C 1.381(14) . ?
C15B H15B 0.9500 . ?
C15C C15D 1.395(16) . ?
C15C H15C 0.9500 . ?
C15D C15E 1.370(17) . ?
C15D H15D 0.9500 . ?
C15E C15F 1.348(14) . ?
C15E H15E 0.9500 . ?
C15F H15F 0.9500 . ?
C16 C17 1.431(11) . ?
C17 C18 1.300(15) . ?
C17 H17 0.9500 . ?
C18 C19 1.457(12) . ?
C18 H18 0.9500 . ?
C19 C20 1.336(15) . ?
C20 C20A 1.506(14) . ?
C20A C20F 1.377(16) . ?
C20A C20B 1.431(14) . ?
C20B C20C 1.399(13) . ?
C20B H20B 0.9500 . ?
C20C C20D 1.378(15) . ?
C20C H20C 0.9500 . ?
C20D C20E 1.391(15) . ?
C20D H20D 0.9500 . ?
C20E C20F 1.405(15) . ?
C20E H20E 0.9500 . ?
C20F H20F 0.9500 . ?
O22 C22 1.133(11) . ?
N25 C23 1.126(13) . ?
C23 C24 1.512(15) . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?

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
C22 Ru1 C21 89.3(5) . . ?
C22 Ru1 N23 97.9(5) . . ?
C21 Ru1 N23 172.7(5) . . ?
C22 Ru1 N22 89.7(4) . . ?
C21 Ru1 N22 88.7(4) . . ?
N23 Ru1 N22 90.3(4) . . ?
C22 Ru1 N24 93.8(4) . . ?
C21 Ru1 N24 91.2(4) . . ?
N23 Ru1 N24 89.3(3) . . ?
N22 Ru1 N24 176.5(4) . . ?
C22 Ru1 N25 179.4(5) . . ?
C21 Ru1 N25 91.3(5) . . ?
N23 Ru1 N25 81.5(4) . . ?
N22 Ru1 N25 90.5(3) . . ?
N24 Ru1 N25 86.0(3) . . ?
C6 N22 C9 110.8(9) . . ?
C6 N22 Ru1 124.9(8) . . ?
C9 N22 Ru1 121.8(9) . . ?
C14 N23 C11 101.5(9) . . ?
C14 N23 Ru1 129.0(8) . . ?
C11 N23 Ru1 129.3(7) . . ?
C16 N24 C19 113.3(8) . . ?
C16 N24 Ru1 123.8(7) . . ?
C19 N24 Ru1 122.0(7) . . ?
C2 C1 C20 128.1(11) . . ?
C2 C1 C21 108.5(8) . . ?
C20 C1 C21 123.2(11) . . ?
C2A C2 C1 127.7(10) . . ?
C2A C2 C3 125.8(12) . . ?
C1 C2 C3 106.2(10) . . ?
C2B C2A C2 132.6(10) . . ?
C2B C2A H2A 113.7 . . ?
C2 C2A H2A 113.7 . . ?
C2A C2B C2C 130.1(12) . . ?
C2A C2B H2B 115.0 . . ?
C2C C2B H2B 115.0 . . ?
C2B C2C C3B 123.4(12) . . ?
C2B C2C H2C 118.3 . . ?
C3B C2C H2C 118.3 . . ?
C3A C3 C4 125.6(10) . . ?
C3A C3 C2 125.7(13) . . ?
C4 C3 C2 107.7(10) . . ?
C3 C3A C3B 130.9(12) . . ?
C3 C3A H3A 114.5 . . ?
C3B C3A H3A 114.5 . . ?
C3A C3B C2C 131.2(12) . . ?
C3A C3B H3B 114.4 . . ?
C2C C3B H3B 114.4 . . ?
C5 C4 C21 126.9(12) . . ?
C5 C4 C3 123.1(10) . . ?
C21 C4 C3 109.7(9) . . ?
C4 C5 C6 123.1(11) . . ?
C4 C5 C5A 122.3(11) . . ?
C6 C5 C5A 114.2(10) . . ?
C5B C5A C5F 113.4(11) . . ?
C5B C5A C5 122.6(10) . . ?
C5F C5A C5 124.0(10) . . ?
C5C C5B C5A 124.5(11) . . ?
C5C C5B H5B 117.8 . . ?
C5A C5B H5B 117.8 . . ?
C5B C5C C5D 119.8(10) . . ?
C5B C5C H5C 120.1 . . ?
C5D C5C H5C 120.1 . . ?
C5E C5D C5C 118.9(11) . . ?
C5E C5D H5D 120.5 . . ?
C5C C5D H5D 120.5 . . ?
C5D C5E C5F 121.2(11) . . ?
C5D C5E H5E 119.4 . . ?
C5F C5E H5E 119.4 . . ?
C5E C5F C5A 122.0(11) . . ?
C5E C5F H5F 119.0 . . ?
C5A C5F H5F 119.0 . . ?
N22 C6 C5 124.6(10) . . ?
N22 C6 C7 106.3(10) . . ?
C5 C6 C7 128.6(11) . . ?
C8 C7 C6 109.0(10) . . ?
C8 C7 H7 125.5 . . ?
C6 C7 H7 125.5 . . ?
C7 C8 C9 109.3(10) . . ?
C7 C8 H8 125.4 . . ?
C9 C8 H8 125.4 . . ?
C10 C9 N22 127.8(10) . . ?
C10 C9 C8 127.5(10) . . ?
N22 C9 C8 104.4(10) . . ?
C9 C10 C11 126.5(9) . . ?
C9 C10 C10A 115.7(9) . . ?
C11 C10 C10A 117.6(10) . . ?
C10F C10A C10 124.9(11) . . ?
C10F C10A C10B 119.9(10) . . ?
C10 C10A C10B 115.1(11) . . ?
C10C C10B C10A 114.6(13) . . ?
C10C C10B H10B 122.7 . . ?
C10A C10B H10B 122.7 . . ?
C10B C10C C10D 125.1(13) . . ?
C10B C10C H10C 117.5 . . ?
C10D C10C H10C 117.5 . . ?
C10C C10D C10E 120.5(11) . . ?
C10C C10D H10D 119.7 . . ?
C10E C10D H10D 119.7 . . ?
C10F C10E C10D 116.0(12) . . ?
C10F C10E H10E 122.0 . . ?
C10D C10E H10E 122.0 . . ?
C10A C10F C10E 123.8(12) . . ?
C10A C10F H10F 118.1 . . ?
C10E C10F H10F 118.1 . . ?
C10 C11 N23 122.0(10) . . ?
C10 C11 C12 125.1(9) . . ?
N23 C11 C12 112.9(9) . . ?
C13 C12 C11 106.9(10) . . ?
C13 C12 H12 126.6 . . ?
C11 C12 H12 126.6 . . ?
C12 C13 C14 106.1(10) . . ?
C12 C13 H13 127.0 . . ?
C14 C13 H13 127.0 . . ?
N23 C14 C15 126.5(10) . . ?
N23 C14 C13 112.6(9) . . ?
C15 C14 C13 120.9(10) . . ?
C15A C15 C16 118.0(9) . . ?
C15A C15 C14 121.7(10) . . ?
C16 C15 C14 120.2(10) . . ?
C15F C15A C15 125.2(13) . . ?
C15F C15A C15B 114.9(11) . . ?
C15 C15A C15B 119.6(12) . . ?
C15C C15B C15A 120.0(13) . . ?
C15C C15B H15B 120.0 . . ?
C15A C15B H15B 120.0 . . ?
C15B C15C C15D 122.3(14) . . ?
C15B C15C H15C 118.8 . . ?
C15D C15C H15C 118.8 . . ?
C15E C15D C15C 116.9(12) . . ?
C15E C15D H15D 121.6 . . ?
C15C C15D H15D 121.6 . . ?
C15F C15E C15D 120.3(13) . . ?
C15F C15E H15E 119.9 . . ?
C15D C15E H15E 119.9 . . ?
C15E C15F C15A 125.6(14) . . ?
C15E C15F H15F 117.2 . . ?
C15A C15F H15F 117.2 . . ?
N24 C16 C17 105.5(9) . . ?
N24 C16 C15 130.3(8) . . ?
C17 C16 C15 124.2(9) . . ?
C18 C17 C16 108.6(10) . . ?
C18 C17 H17 125.7 . . ?
C16 C17 H17 125.7 . . ?
C17 C18 C19 110.7(9) . . ?
C17 C18 H18 124.6 . . ?
C19 C18 H18 124.6 . . ?
C20 C19 N24 130.0(9) . . ?
C20 C19 C18 127.7(10) . . ?
N24 C19 C18 101.9(9) . . ?
C19 C20 C1 124.9(10) . . ?
C19 C20 C20A 116.7(9) . . ?
C1 C20 C20A 118.2(11) . . ?
C20F C20A C20B 120.6(10) . . ?
C20F C20A C20 120.0(11) . . ?
C20B C20A C20 119.4(11) . . ?
C20C C20B C20A 118.9(11) . . ?
C20C C20B H20B 120.6 . . ?
C20A C20B H20B 120.6 . . ?
C20D C20C C20B 120.8(11) . . ?
C20D C20C H20C 119.6 . . ?
C20B C20C H20C 119.6 . . ?
C20C C20D C20E 119.3(10) . . ?
C20C C20D H20D 120.4 . . ?
C20E C20D H20D 120.4 . . ?
C20D C20E C20F 122.0(12) . . ?
C20D C20E H20E 119.0 . . ?
C20F C20E H20E 119.0 . . ?
C20A C20F C20E 118.5(12) . . ?
C20A C20F H20F 120.8 . . ?
C20E C20F H20F 120.8 . . ?
C4 C21 C1 105.6(10) . . ?
C4 C21 Ru1 128.1(9) . . ?
C1 C21 Ru1 126.3(7) . . ?
O22 C22 Ru1 171.4(12) . . ?
C23 N25 Ru1 165.9(13) . . ?
N25 C23 C24 177.5(13) . . ?
C23 C24 H24A 109.5 . . ?
C23 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C23 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?

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
C20 C1 C2 C2A 11(2) . . . . ?
C21 C1 C2 C2A -162.7(11) . . . . ?
C20 C1 C2 C3 -175.0(12) . . . . ?
C21 C1 C2 C3 11.0(14) . . . . ?
C1 C2 C2A C2B 169.0(14) . . . . ?
C3 C2 C2A C2B -4(2) . . . . ?
C2 C2A C2B C2C 4(2) . . . . ?
C2A C2B C2C C3B -5(2) . . . . ?
C2A C2 C3 C3A 2(2) . . . . ?
C1 C2 C3 C3A -171.8(13) . . . . ?
C2A C2 C3 C4 171.3(12) . . . . ?
C1 C2 C3 C4 -2.6(15) . . . . ?
C4 C3 C3A C3B -165.9(13) . . . . ?
C2 C3 C3A C3B 1(2) . . . . ?
C3 C3A C3B C2C -5(3) . . . . ?
C2B C2C C3B C3A 6(2) . . . . ?
C3A C3 C4 C5 -13(2) . . . . ?
C2 C3 C4 C5 178.3(11) . . . . ?
C3A C3 C4 C21 161.7(13) . . . . ?
C2 C3 C4 C21 -7.5(15) . . . . ?
C21 C4 C5 C6 -9(2) . . . . ?
C3 C4 C5 C6 163.8(12) . . . . ?
C21 C4 C5 C5A 163.0(12) . . . . ?
C3 C4 C5 C5A -24(2) . . . . ?
C4 C5 C5A C5B -59.9(19) . . . . ?
C6 C5 C5A C5B 113.2(13) . . . . ?
C4 C5 C5A C5F 120.6(13) . . . . ?
C6 C5 C5A C5F -66.3(17) . . . . ?
C5F C5A C5B C5C -1(2) . . . . ?
C5 C5A C5B C5C 179.6(13) . . . . ?
C5A C5B C5C C5D 0(2) . . . . ?
C5B C5C C5D C5E -1(2) . . . . ?
C5C C5D C5E C5F 3(2) . . . . ?
C5D C5E C5F C5A -4(2) . . . . ?
C5B C5A C5F C5E 2.7(19) . . . . ?
C5 C5A C5F C5E -177.8(12) . . . . ?
C9 N22 C6 C5 -175.1(11) . . . . ?
C9 N22 C6 C7 -2.5(14) . . . . ?
C4 C5 C6 N22 -7(2) . . . . ?
C5A C5 C6 N22 179.9(11) . . . . ?
C4 C5 C6 C7 -178.0(12) . . . . ?
C5A C5 C6 C7 9.0(19) . . . . ?
N22 C6 C7 C8 -0.4(15) . . . . ?
C5 C6 C7 C8 171.8(13) . . . . ?
C6 C7 C8 C9 2.9(15) . . . . ?
C6 N22 C9 C10 177.9(12) . . . . ?
C6 N22 C9 C8 4.1(13) . . . . ?
C7 C8 C9 C10 -178.1(13) . . . . ?
C7 C8 C9 N22 -4.4(14) . . . . ?
N22 C9 C10 C11 18(2) . . . . ?
C8 C9 C10 C11 -169.3(13) . . . . ?
N22 C9 C10 C10A -166.0(11) . . . . ?
C8 C9 C10 C10A 6(2) . . . . ?
C9 C10 C10A C10F -84.6(16) . . . . ?
C11 C10 C10A C10F 91.5(16) . . . . ?
C9 C10 C10A C10B 96.7(13) . . . . ?
C11 C10 C10A C10B -87.2(14) . . . . ?
C10F C10A C10B C10C 2.4(18) . . . . ?
C10 C10A C10B C10C -178.8(11) . . . . ?
C10A C10B C10C C10D -3(2) . . . . ?
C10B C10C C10D C10E 3(2) . . . . ?
C10C C10D C10E C10F -2(2) . . . . ?
C10 C10A C10F C10E 179.3(12) . . . . ?
C10B C10A C10F C10E -2(2) . . . . ?
C10D C10E C10F C10A 2(2) . . . . ?
C9 C10 C11 N23 -5(2) . . . . ?
C10A C10 C11 N23 179.3(11) . . . . ?
C9 C10 C11 C12 178.3(13) . . . . ?
C10A C10 C11 C12 3(2) . . . . ?
C14 N23 C11 C10 -179.1(13) . . . . ?
C14 N23 C11 C12 -2.1(14) . . . . ?
C10 C11 C12 C13 177.3(13) . . . . ?
N23 C11 C12 C13 0.4(17) . . . . ?
C11 C12 C13 C14 1.4(16) . . . . ?
C11 N23 C14 C15 -178.9(13) . . . . ?
C11 N23 C14 C13 2.9(14) . . . . ?
C12 C13 C14 N23 -2.9(16) . . . . ?
C12 C13 C14 C15 178.8(12) . . . . ?
N23 C14 C15 C15A 179.0(13) . . . . ?
C13 C14 C15 C15A -3(2) . . . . ?
N23 C14 C15 C16 -4(2) . . . . ?
C13 C14 C15 C16 174.1(11) . . . . ?
C16 C15 C15A C15F -60.2(15) . . . . ?
C14 C15 C15A C15F 116.9(14) . . . . ?
C16 C15 C15A C15B 127.1(11) . . . . ?
C14 C15 C15A C15B -55.8(15) . . . . ?
C15F C15A C15B C15C -0.4(12) . . . . ?
C15 C15A C15B C15C 173.0(9) . . . . ?
C15A C15B C15C C15D -0.3(14) . . . . ?
C15B C15C C15D C15E 2.5(14) . . . . ?
C15C C15D C15E C15F -4.0(15) . . . . ?
C15D C15E C15F C15A 3.6(16) . . . . ?
C15 C15A C15F C15E -174.2(9) . . . . ?
C15B C15A C15F C15E -1.3(14) . . . . ?
C19 N24 C16 C17 -0.9(15) . . . . ?
Ru1 N24 C16 C17 -170.0(7) . . . . ?
C19 N24 C16 C15 -179.0(12) . . . . ?
C15A C15 C16 N24 171.1(13) . . . . ?
C14 C15 C16 N24 -6(2) . . . . ?
C15A C15 C16 C17 -6.6(19) . . . . ?
C14 C15 C16 C17 176.2(12) . . . . ?
N24 C16 C17 C18 2.1(15) . . . . ?
C15 C16 C17 C18 -179.6(12) . . . . ?
C16 C17 C18 C19 -2.5(16) . . . . ?
C16 N24 C19 C20 171.8(14) . . . . ?
C16 N24 C19 C18 -0.5(14) . . . . ?
C17 C18 C19 C20 -170.7(13) . . . . ?
C17 C18 C19 N24 1.9(15) . . . . ?
N24 C19 C20 C1 9(2) . . . . ?
C18 C19 C20 C1 179.2(12) . . . . ?
N24 C19 C20 C20A -176.3(12) . . . . ?
C18 C19 C20 C20A -6(2) . . . . ?
C2 C1 C20 C19 -165.9(14) . . . . ?
C21 C1 C20 C19 7(2) . . . . ?
C2 C1 C20 C20A 19(2) . . . . ?
C21 C1 C20 C20A -167.7(11) . . . . ?
C19 C20 C20A C20F 75.1(17) . . . . ?
C1 C20 C20A C20F -109.5(14) . . . . ?
C19 C20 C20A C20B -107.6(14) . . . . ?
C1 C20 C20A C20B 67.7(17) . . . . ?
C20F C20A C20B C20C 1.0(18) . . . . ?
C20 C20A C20B C20C -176.3(11) . . . . ?
C20A C20B C20C C20D -1.6(18) . . . . ?
C20B C20C C20D C20E 2.0(19) . . . . ?
C20C C20D C20E C20F -2(2) . . . . ?
C20B C20A C20F C20E -0.7(19) . . . . ?
C20 C20A C20F C20E 176.5(11) . . . . ?
C20D C20E C20F C20A 1(2) . . . . ?
C5 C4 C21 C1 -172.1(12) . . . . ?
C3 C4 C21 C1 13.9(14) . . . . ?
C5 C4 C21 Ru1 8(2) . . . . ?
C3 C4 C21 Ru1 -166.2(9) . . . . ?
C2 C1 C21 C4 -15.7(14) . . . . ?
C20 C1 C21 C4 170.1(12) . . . . ?
C2 C1 C21 Ru1 164.4(9) . . . . ?
C20 C1 C21 Ru1 -9.8(17) . . . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
C24 H24A O22 0.98 2.44 3.067(13) 121.6 1_655

_diffrn_measured_fraction_theta_max 0.976
_diffrn_reflns_theta_full        68.00
_diffrn_measured_fraction_theta_full 0.976
_refine_diff_density_max         1.04
_refine_diff_density_min         -1.20
_refine_diff_density_rms         0.11
_database_code_depnum_ccdc_archive 'CCDC 1006124'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_3

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C67 H39 N3 O10 Ru5'
_chemical_formula_weight         1551.36

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'

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   10.468(3)
_cell_length_b                   13.376(4)
_cell_length_c                   22.516(7)
_cell_angle_alpha                96.81(5)
_cell_angle_beta                 100.38(5)
_cell_angle_gamma                112.03(6)
_cell_volume                     2814(2)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    7368
_cell_measurement_theta_min      2.96
_cell_measurement_theta_max      28.00

_exptl_crystal_description       block
_exptl_crystal_colour            'dark brown'
_exptl_crystal_size_max          0.44
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.08
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.831
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1524
_exptl_absorpt_coefficient_mu    1.377
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_correction_T_min  0.700
_exptl_absorpt_correction_T_max  0.918
_exptl_absorpt_process_details   
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.33.66 (release 28-04-2010 CrysAlis171 .NET)
(compiled Apr 28 2010,14:27:37)
Analytical numeric absorption correction using a multifaceted crystal model based on expressions derived by R.C. Clark & J.S. Reid.(Clark, R. C. & Reid, J. S. (1995). Acta Cryst. A51, 887-897)
;

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'Enhance (Mo) X-ray Source'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Xcalibur, Sapphire2, large Be window'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean 8.34
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            23250
_diffrn_reflns_av_R_equivalents  0.0694
_diffrn_reflns_av_sigmaI/netI    0.0955
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_theta_min         2.96
_diffrn_reflns_theta_max         26.00
_reflns_number_total             10996
_reflns_number_gt                6906
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.33.66 (release 28-04-2010 CrysAlis171 .NET)
(compiled Apr 28 2010,14:27:37)
;
_computing_cell_refinement       
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.33.66 (release 28-04-2010 CrysAlis171 .NET)
(compiled Apr 28 2010,14:27:37)
;
_computing_data_reduction        
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.33.66 (release 28-04-2010 CrysAlis171 .NET)
(compiled Apr 28 2010,14:27:37)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.1315P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         10996
_refine_ls_number_parameters     771
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.1201
_refine_ls_R_factor_gt           0.0746
_refine_ls_wR_factor_ref         0.2158
_refine_ls_wR_factor_gt          0.1877
_refine_ls_goodness_of_fit_ref   1.022
_refine_ls_restrained_S_all      1.022
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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 0.42217(8) 0.67462(6) 0.72416(3) 0.0278(2) Uani 1 1 d . . .
Ru2 Ru 0.64346(9) 0.61272(6) 0.80987(3) 0.0300(2) Uani 1 1 d . . .
Ru3 Ru 0.71340(9) 0.45177(7) 0.86673(4) 0.0345(2) Uani 1 1 d . . .
Ru4 Ru 0.83885(9) 0.68041(7) 0.93038(4) 0.0337(2) Uani 1 1 d . . .
Ru5 Ru 0.92186(9) 0.61120(7) 0.83316(4) 0.0345(2) Uani 1 1 d . . .
N22 N 0.5394(9) 0.8350(6) 0.7702(4) 0.0328(19) Uani 1 1 d . . .
N23 N 0.4556(9) 0.7246(7) 0.6420(3) 0.0350(19) Uani 1 1 d . . .
N24 N 0.3277(9) 0.5138(7) 0.6777(3) 0.0331(19) Uani 1 1 d . . .
C1 C 0.4137(11) 0.5135(7) 0.8118(4) 0.031(2) Uani 1 1 d . . .
C2 C 0.4977(10) 0.5143(8) 0.8709(4) 0.030(2) Uani 1 1 d . . .
C2A C 0.5077(11) 0.4180(8) 0.8934(4) 0.032(2) Uani 1 1 d . . .
H2A H 0.4371 0.3477 0.8723 0.038 Uiso 1 1 calc R . .
C2B C 0.6113(11) 0.4206(8) 0.9427(5) 0.034(2) Uani 1 1 d . . .
H2B H 0.6013 0.3538 0.9561 0.041 Uiso 1 1 calc R . .
C2C C 0.7332(12) 0.5200(9) 0.9745(5) 0.043(3) Uani 1 1 d . . .
H2C H 0.7892 0.4910 0.9990 0.052 Uiso 1 1 d R . .
C3 C 0.5664(11) 0.6284(9) 0.9038(5) 0.036(2) Uani 1 1 d . . .
C3A C 0.6519(11) 0.6708(8) 0.9672(4) 0.033(2) Uani 1 1 d . . .
H3A H 0.6583 0.7398 0.9872 0.040 Uiso 1 1 calc R . .
C3B C 0.7243(11) 0.6206(8) 1.0009(5) 0.035(2) Uani 1 1 d . . .
H3B H 0.7701 0.6531 1.0431 0.043 Uiso 1 1 calc R . .
C4 C 0.5248(10) 0.6945(7) 0.8627(4) 0.028(2) Uani 1 1 d . . .
C5 C 0.5629(11) 0.8134(8) 0.8777(5) 0.035(2) Uani 1 1 d . . .
C5A C 0.5820(11) 0.8650(8) 0.9430(4) 0.031(2) Uani 1 1 d . . .
C5B C 0.4691(11) 0.8221(8) 0.9713(4) 0.036(2) Uani 1 1 d . . .
H5B H 0.3831 0.7631 0.9483 0.043 Uiso 1 1 calc R . .
C5C C 0.4818(11) 0.8644(8) 1.0317(4) 0.032(2) Uani 1 1 d . . .
H5C H 0.4044 0.8348 1.0500 0.039 Uiso 1 1 calc R . .
C5D C 0.6057(12) 0.9493(8) 1.0658(5) 0.037(2) Uani 1 1 d . . .
H5D H 0.6137 0.9781 1.1076 0.045 Uiso 1 1 calc R . .
C5E C 0.7183(11) 0.9925(9) 1.0393(4) 0.038(2) Uani 1 1 d . . .
H5E H 0.8049 1.0501 1.0629 0.045 Uiso 1 1 calc R . .
C5F C 0.7039(11) 0.9507(8) 0.9775(5) 0.036(2) Uani 1 1 d . . .
H5F H 0.7802 0.9824 0.9589 0.043 Uiso 1 1 calc R . .
C6 C 0.5684(11) 0.8750(7) 0.8333(4) 0.030(2) Uani 1 1 d . . .
C7 C 0.6172(12) 0.9935(9) 0.8441(5) 0.039(3) Uani 1 1 d . . .
H7 H 0.6387 1.0409 0.8828 0.047 Uiso 1 1 calc R . .
C8 C 0.6269(11) 1.0252(8) 0.7906(5) 0.037(2) Uani 1 1 d . . .
H8 H 0.6590 1.0986 0.7842 0.045 Uiso 1 1 calc R . .
C9 C 0.5790(10) 0.9253(7) 0.7439(4) 0.027(2) Uani 1 1 d . . .
C10 C 0.5753(11) 0.9250(8) 0.6798(4) 0.034(2) Uani 1 1 d . . .
C10A C 0.6269(11) 1.0341(8) 0.6618(4) 0.035(2) Uani 1 1 d . . .
C10B C 0.7665(11) 1.1070(8) 0.6829(5) 0.037(2) Uani 1 1 d . . .
H10B H 0.8324 1.0864 0.7077 0.045 Uiso 1 1 calc R . .
C10C C 0.8124(13) 1.2113(8) 0.6681(5) 0.043(3) Uani 1 1 d . . .
H10C H 0.9087 1.2619 0.6839 0.052 Uiso 1 1 calc R . .
C10D C 0.7196(13) 1.2411(9) 0.6311(5) 0.047(3) Uani 1 1 d . . .
H10D H 0.7508 1.3119 0.6209 0.057 Uiso 1 1 calc R . .
C10E C 0.5795(14) 1.1663(9) 0.6086(5) 0.053(3) Uani 1 1 d . . .
H10E H 0.5150 1.1867 0.5828 0.063 Uiso 1 1 calc R . .
C10F C 0.5313(13) 1.0634(9) 0.6227(5) 0.044(3) Uani 1 1 d . . .
H10F H 0.4352 1.0129 0.6064 0.052 Uiso 1 1 calc R . .
C11 C 0.5197(10) 0.8295(7) 0.6331(4) 0.028(2) Uani 1 1 d . . .
C12 C 0.5167(10) 0.8281(8) 0.5695(4) 0.033(2) Uani 1 1 d . . .
H12 H 0.5576 0.8903 0.5520 0.039 Uiso 1 1 calc R . .
C13 C 0.4448(11) 0.7220(8) 0.5384(4) 0.034(2) Uani 1 1 d . . .
H13 H 0.4265 0.6959 0.4953 0.041 Uiso 1 1 calc R . .
C14 C 0.4009(10) 0.6554(8) 0.5842(4) 0.030(2) Uani 1 1 d . . .
C15 C 0.3174(11) 0.5444(8) 0.5708(4) 0.033(2) Uani 1 1 d . . .
C15A C 0.2567(10) 0.4855(8) 0.5049(4) 0.033(2) Uani 1 1 d . . .
C15B C 0.1542(12) 0.5059(9) 0.4667(5) 0.038(2) Uani 1 1 d . . .
H15B H 0.1208 0.5575 0.4832 0.045 Uiso 1 1 calc R . .
C15C C 0.0983(11) 0.4538(8) 0.4051(4) 0.034(2) Uani 1 1 d . . .
H15C H 0.0269 0.4685 0.3799 0.041 Uiso 1 1 calc R . .
C15D C 0.1487(12) 0.3801(8) 0.3810(5) 0.040(3) Uani 1 1 d . . .
H15D H 0.1106 0.3436 0.3390 0.048 Uiso 1 1 calc R . .
C15E C 0.2527(11) 0.3584(8) 0.4165(5) 0.038(2) Uani 1 1 d . . .
H15E H 0.2873 0.3082 0.3994 0.045 Uiso 1 1 calc R . .
C15F C 0.3068(11) 0.4126(8) 0.4790(5) 0.037(2) Uani 1 1 d . . .
H15F H 0.3794 0.3988 0.5040 0.045 Uiso 1 1 calc R . .
C16 C 0.2792(11) 0.4794(8) 0.6161(4) 0.032(2) Uani 1 1 d . . .
C17 C 0.1831(11) 0.3619(8) 0.6001(5) 0.037(2) Uani 1 1 d . . .
H17 H 0.1333 0.3188 0.5600 0.045 Uiso 1 1 calc R . .
C18 C 0.1800(11) 0.3281(8) 0.6532(4) 0.035(2) Uani 1 1 d . . .
H18 H 0.1250 0.2558 0.6576 0.043 Uiso 1 1 calc R . .
C19 C 0.2749(10) 0.4203(7) 0.7037(4) 0.028(2) Uani 1 1 d . . .
C20 C 0.3128(11) 0.4166(8) 0.7643(5) 0.034(2) Uani 1 1 d . . .
C20A C 0.2434(11) 0.3088(8) 0.7838(4) 0.031(2) Uani 1 1 d . . .
C20B C 0.2595(12) 0.2149(9) 0.7616(5) 0.044(3) Uani 1 1 d . . .
H20B H 0.3192 0.2184 0.7340 0.052 Uiso 1 1 calc R . .
C20C C 0.1910(13) 0.1151(9) 0.7783(6) 0.050(3) Uani 1 1 d . . .
H20C H 0.2065 0.0519 0.7639 0.060 Uiso 1 1 calc R . .
C20D C 0.1008(14) 0.1098(9) 0.8162(5) 0.052(3) Uani 1 1 d . . .
H20D H 0.0531 0.0422 0.8278 0.062 Uiso 1 1 calc R . .
C20E C 0.0778(13) 0.2020(9) 0.8378(5) 0.047(3) Uani 1 1 d . . .
H20E H 0.0132 0.1974 0.8631 0.057 Uiso 1 1 calc R . .
C20F C 0.1512(11) 0.3007(9) 0.8216(5) 0.038(2) Uani 1 1 d . . .
H20F H 0.1378 0.3644 0.8369 0.046 Uiso 1 1 calc R . .
C21 C 0.4368(11) 0.6228(8) 0.8057(4) 0.032(2) Uani 1 1 d . . .
C22 C 0.2598(12) 0.6938(8) 0.7168(4) 0.034(2) Uani 1 1 d . . .
O2 O 0.1595(8) 0.7089(7) 0.7132(3) 0.0452(18) Uani 1 1 d . . .
C23 C 0.6433(11) 0.5184(9) 0.7410(5) 0.039(2) Uani 1 1 d . . .
O3 O 0.6233(8) 0.4613(7) 0.6936(4) 0.0490(19) Uani 1 1 d . . .
C24 C 0.6377(11) 0.3322(10) 0.7990(5) 0.041(3) Uani 1 1 d . . .
O4 O 0.5963(10) 0.2595(7) 0.7593(4) 0.057(2) Uani 1 1 d . . .
C25 C 0.8551(12) 0.4033(10) 0.8883(5) 0.047(3) Uani 1 1 d . . .
O5 O 0.9412(10) 0.3708(8) 0.9019(5) 0.072(3) Uani 1 1 d . . .
C26 C 1.0767(13) 0.5951(11) 0.8771(6) 0.063(4) Uani 1 1 d . . .
O6 O 1.1760(11) 0.5897(10) 0.9046(6) 0.105(4) Uani 1 1 d . . .
C27 C 1.0393(12) 0.7534(9) 0.8217(4) 0.037(2) Uani 1 1 d . . .
O7 O 1.1172(8) 0.8378(6) 0.8178(3) 0.0471(19) Uani 1 1 d . . .
C28 C 0.9331(11) 0.5234(8) 0.7617(5) 0.040(3) Uani 1 1 d . . .
O8 O 0.9531(9) 0.4701(6) 0.7237(4) 0.054(2) Uani 1 1 d . . .
C29 C 1.0179(15) 0.7266(13) 0.9805(7) 0.077(5) Uani 1 1 d . . .
O9 O 1.1328(11) 0.7535(11) 1.0092(6) 0.121(5) Uani 1 1 d . . .
C30 C 0.8976(12) 0.8258(10) 0.9171(5) 0.042(3) Uani 1 1 d . . .
O10 O 0.9343(9) 0.9128(6) 0.9082(4) 0.051(2) Uani 1 1 d . . .
C31 C 0.7535(12) 0.7319(10) 0.7788(5) 0.045(3) Uani 1 1 d . . .
O11 O 0.8120(9) 0.8050(6) 0.7571(4) 0.052(2) Uani 1 1 d . . .
C32 C 0.1457(15) 0.8193(10) 0.5669(6) 0.062(4) Uani 1 1 d . . .
H32 H 0.1364 0.7516 0.5789 0.074 Uiso 1 1 calc R . .
C33 C 0.1306(17) 0.9017(14) 0.6057(7) 0.083(5) Uani 1 1 d . . .
H33 H 0.1037 0.8887 0.6431 0.100 Uiso 1 1 calc R . .
C34 C 0.1549(18) 1.0009(14) 0.5893(8) 0.081(5) Uani 1 1 d . . .
H34 H 0.1531 1.0588 0.6175 0.098 Uiso 1 1 calc R . .
C35 C 0.1824(14) 1.0206(10) 0.5321(8) 0.067(4) Uani 1 1 d . . .
C36 C 0.1931(13) 0.9368(10) 0.4932(6) 0.052(3) Uani 1 1 d . . .
H36 H 0.2133 0.9469 0.4543 0.063 Uiso 1 1 calc R . .
C37 C 0.1738(12) 0.8379(9) 0.5121(5) 0.045(3) Uani 1 1 d . . .
H37 H 0.1807 0.7808 0.4851 0.054 Uiso 1 1 calc R . .
C38 C 0.2005(18) 1.1267(14) 0.5142(9) 0.088(5) Uani 1 1 d . . .
H38A H 0.2176 1.1249 0.4728 0.131 Uiso 1 1 calc R . .
H38B H 0.2817 1.1863 0.5436 0.131 Uiso 1 1 calc R . .
H38C H 0.1143 1.1395 0.5143 0.131 Uiso 1 1 calc R . .


_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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 C22 1.793(12) . ?
Ru1 C21 2.039(9) . ?
Ru1 N24 2.049(9) . ?
Ru1 N22 2.055(8) . ?
Ru1 N23 2.084(8) . ?
Ru1 Ru2 3.1596(18) . ?
Ru2 C23 1.879(12) . ?
Ru2 C31 1.880(11) . ?
Ru2 C21 2.204(10) . ?
Ru2 C1 2.281(10) . ?
Ru2 C4 2.323(10) . ?
Ru2 C2 2.372(9) . ?
Ru2 C3 2.408(9) . ?
Ru2 Ru5 2.8749(15) . ?
Ru2 Ru3 2.8824(16) . ?
Ru2 Ru4 2.897(2) . ?
Ru3 C25 1.842(11) . ?
Ru3 C24 1.883(13) . ?
Ru3 C2B 2.177(9) . ?
Ru3 C2A 2.236(10) . ?
Ru3 C2C 2.432(11) . ?
Ru3 Ru5 2.714(2) . ?
Ru3 Ru4 2.898(2) . ?
Ru4 C29 1.836(14) . ?
Ru4 C30 1.886(12) . ?
Ru4 C3B 2.206(9) . ?
Ru4 C3A 2.226(10) . ?
Ru4 C2C 2.436(11) . ?
Ru4 Ru5 2.6857(16) . ?
Ru5 C26 1.840(13) . ?
Ru5 C27 1.916(11) . ?
Ru5 C28 1.925(12) . ?
N22 C9 1.366(11) . ?
N22 C6 1.392(12) . ?
N23 C11 1.367(12) . ?
N23 C14 1.387(12) . ?
N24 C16 1.347(12) . ?
N24 C19 1.408(12) . ?
C1 C21 1.418(13) . ?
C1 C2 1.453(13) . ?
C1 C20 1.476(14) . ?
C2 C3 1.452(15) . ?
C2 C2A 1.470(13) . ?
C2A C2B 1.394(14) . ?
C2A H2A 0.9500 . ?
C2B C2C 1.442(15) . ?
C2B H2B 0.9500 . ?
C2C C3B 1.448(15) . ?
C2C H2C 0.9500 . ?
C3 C3A 1.459(14) . ?
C3 C4 1.472(13) . ?
C3A C3B 1.378(14) . ?
C3A H3A 0.9500 . ?
C3B H3B 0.9500 . ?
C4 C21 1.425(13) . ?
C4 C5 1.466(13) . ?
C5 C6 1.364(13) . ?
C5 C5A 1.493(14) . ?
C5A C5F 1.371(14) . ?
C5A C5B 1.407(13) . ?
C5B C5C 1.372(13) . ?
C5B H5B 0.9500 . ?
C5C C5D 1.376(15) . ?
C5C H5C 0.9500 . ?
C5D C5E 1.380(14) . ?
C5D H5D 0.9500 . ?
C5E C5F 1.396(13) . ?
C5E H5E 0.9500 . ?
C5F H5F 0.9500 . ?
C6 C7 1.446(13) . ?
C7 C8 1.332(13) . ?
C7 H7 0.9500 . ?
C8 C9 1.455(14) . ?
C8 H8 0.9500 . ?
C9 C10 1.434(13) . ?
C10 C11 1.408(14) . ?
C10 C10A 1.488(13) . ?
C10A C10B 1.372(15) . ?
C10A C10F 1.410(14) . ?
C10B C10C 1.397(14) . ?
C10B H10B 0.9500 . ?
C10C C10D 1.370(16) . ?
C10C H10C 0.9500 . ?
C10D C10E 1.385(17) . ?
C10D H10D 0.9500 . ?
C10E C10F 1.375(15) . ?
C10E H10E 0.9500 . ?
C10F H10F 0.9500 . ?
C11 C12 1.424(12) . ?
C12 C13 1.359(14) . ?
C12 H12 0.9500 . ?
C13 C14 1.467(13) . ?
C13 H13 0.9500 . ?
C14 C15 1.373(13) . ?
C15 C16 1.432(12) . ?
C15 C15A 1.494(14) . ?
C15A C15B 1.382(14) . ?
C15A C15F 1.387(14) . ?
C15B C15C 1.387(14) . ?
C15B H15B 0.9500 . ?
C15C C15D 1.382(14) . ?
C15C H15C 0.9500 . ?
C15D C15E 1.373(15) . ?
C15D H15D 0.9500 . ?
C15E C15F 1.410(14) . ?
C15E H15E 0.9500 . ?
C15F H15F 0.9500 . ?
C16 C17 1.470(14) . ?
C17 C18 1.327(13) . ?
C17 H17 0.9500 . ?
C18 C19 1.464(13) . ?
C18 H18 0.9500 . ?
C19 C20 1.363(13) . ?
C20 C20A 1.510(13) . ?
C20A C20B 1.377(14) . ?
C20A C20F 1.380(14) . ?
C20B C20C 1.393(14) . ?
C20B H20B 0.9500 . ?
C20C C20D 1.370(17) . ?
C20C H20C 0.9500 . ?
C20D C20E 1.392(17) . ?
C20D H20D 0.9500 . ?
C20E C20F 1.385(14) . ?
C20E H20E 0.9500 . ?
C20F H20F 0.9500 . ?
C22 O2 1.132(12) . ?
C23 O3 1.171(13) . ?
C24 O4 1.127(13) . ?
C25 O5 1.149(13) . ?
C26 O6 1.142(14) . ?
C27 O7 1.143(12) . ?
C28 O8 1.148(13) . ?
C29 O9 1.155(15) . ?
C30 O10 1.136(13) . ?
C31 O11 1.158(12) . ?
C32 C37 1.350(16) . ?
C32 C33 1.40(2) . ?
C32 H32 0.9500 . ?
C33 C34 1.36(2) . ?
C33 H33 0.9500 . ?
C34 C35 1.40(2) . ?
C34 H34 0.9500 . ?
C35 C36 1.390(18) . ?
C35 C38 1.475(19) . ?
C36 C37 1.391(16) . ?
C36 H36 0.9500 . ?
C37 H37 0.9500 . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C38 H38C 0.9800 . ?

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
C22 Ru1 C21 101.1(4) . . ?
C22 Ru1 N24 95.2(4) . . ?
C21 Ru1 N24 89.7(3) . . ?
C22 Ru1 N22 91.5(4) . . ?
C21 Ru1 N22 90.2(4) . . ?
N24 Ru1 N22 173.2(3) . . ?
C22 Ru1 N23 93.2(4) . . ?
C21 Ru1 N23 165.7(4) . . ?
N24 Ru1 N23 89.6(3) . . ?
N22 Ru1 N23 88.8(3) . . ?
C22 Ru1 Ru2 144.9(3) . . ?
C21 Ru1 Ru2 43.9(3) . . ?
N24 Ru1 Ru2 88.2(2) . . ?
N22 Ru1 Ru2 87.0(2) . . ?
N23 Ru1 Ru2 121.8(2) . . ?
C23 Ru2 C31 87.9(5) . . ?
C23 Ru2 C21 113.3(4) . . ?
C31 Ru2 C21 106.8(4) . . ?
C23 Ru2 C1 95.9(4) . . ?
C31 Ru2 C1 141.0(4) . . ?
C21 Ru2 C1 36.8(3) . . ?
C23 Ru2 C4 149.9(4) . . ?
C31 Ru2 C4 100.4(4) . . ?
C21 Ru2 C4 36.6(3) . . ?
C1 Ru2 C4 59.8(3) . . ?
C23 Ru2 C2 111.8(4) . . ?
C31 Ru2 C2 159.7(4) . . ?
C21 Ru2 C2 61.7(3) . . ?
C1 Ru2 C2 36.3(3) . . ?
C4 Ru2 C2 60.2(3) . . ?
C23 Ru2 C3 146.9(4) . . ?
C31 Ru2 C3 125.1(4) . . ?
C21 Ru2 C3 61.1(3) . . ?
C1 Ru2 C3 59.4(4) . . ?
C4 Ru2 C3 36.2(3) . . ?
C2 Ru2 C3 35.4(3) . . ?
C23 Ru2 Ru5 74.1(3) . . ?
C31 Ru2 Ru5 75.2(4) . . ?
C21 Ru2 Ru5 172.1(3) . . ?
C1 Ru2 Ru5 143.0(2) . . ?
C4 Ru2 Ru5 135.9(2) . . ?
C2 Ru2 Ru5 113.9(2) . . ?
C3 Ru2 Ru5 111.4(3) . . ?
C23 Ru2 Ru3 78.5(3) . . ?
C31 Ru2 Ru3 131.4(4) . . ?
C21 Ru2 Ru3 121.4(2) . . ?
C1 Ru2 Ru3 87.1(2) . . ?
C4 Ru2 Ru3 114.5(2) . . ?
C2 Ru2 Ru3 60.9(2) . . ?
C3 Ru2 Ru3 78.6(2) . . ?
Ru5 Ru2 Ru3 56.25(5) . . ?
C23 Ru2 Ru4 126.5(3) . . ?
C31 Ru2 Ru4 94.8(4) . . ?
C21 Ru2 Ru4 116.7(3) . . ?
C1 Ru2 Ru4 113.0(2) . . ?
C4 Ru2 Ru4 81.9(2) . . ?
C2 Ru2 Ru4 77.7(3) . . ?
C3 Ru2 Ru4 57.9(3) . . ?
Ru5 Ru2 Ru4 55.46(5) . . ?
Ru3 Ru2 Ru4 60.20(5) . . ?
C23 Ru2 Ru1 89.3(3) . . ?
C31 Ru2 Ru1 74.7(4) . . ?
C21 Ru2 Ru1 39.9(2) . . ?
C1 Ru2 Ru1 66.7(2) . . ?
C4 Ru2 Ru1 65.7(2) . . ?
C2 Ru2 Ru1 99.8(2) . . ?
C3 Ru2 Ru1 98.8(2) . . ?
Ru5 Ru2 Ru1 145.95(4) . . ?
Ru3 Ru2 Ru1 149.87(5) . . ?
Ru4 Ru2 Ru1 142.77(4) . . ?
C25 Ru3 C24 85.6(5) . . ?
C25 Ru3 C2B 100.3(4) . . ?
C24 Ru3 C2B 113.9(4) . . ?
C25 Ru3 C2A 132.5(4) . . ?
C24 Ru3 C2A 95.3(4) . . ?
C2B Ru3 C2A 36.8(4) . . ?
C25 Ru3 C2C 91.2(5) . . ?
C24 Ru3 C2C 148.4(4) . . ?
C2B Ru3 C2C 35.9(4) . . ?
C2A Ru3 C2C 64.4(4) . . ?
C25 Ru3 Ru5 82.4(4) . . ?
C24 Ru3 Ru5 104.8(3) . . ?
C2B Ru3 Ru5 141.2(3) . . ?
C2A Ru3 Ru5 141.4(2) . . ?
C2C Ru3 Ru5 105.9(3) . . ?
C25 Ru3 Ru2 144.0(4) . . ?
C24 Ru3 Ru2 100.1(3) . . ?
C2B Ru3 Ru2 109.4(3) . . ?
C2A Ru3 Ru2 82.7(2) . . ?
C2C Ru3 Ru2 100.9(2) . . ?
Ru5 Ru3 Ru2 61.73(4) . . ?
C25 Ru3 Ru4 103.9(4) . . ?
C24 Ru3 Ru4 157.1(3) . . ?
C2B Ru3 Ru4 85.2(3) . . ?
C2A Ru3 Ru4 93.4(3) . . ?
C2C Ru3 Ru4 53.5(3) . . ?
Ru5 Ru3 Ru4 57.06(5) . . ?
Ru2 Ru3 Ru4 60.15(5) . . ?
C29 Ru4 C30 85.9(6) . . ?
C29 Ru4 C3B 95.8(5) . . ?
C30 Ru4 C3B 124.3(4) . . ?
C29 Ru4 C3A 122.5(6) . . ?
C30 Ru4 C3A 98.7(4) . . ?
C3B Ru4 C3A 36.2(4) . . ?
C29 Ru4 C2C 95.3(5) . . ?
C30 Ru4 C2C 160.2(4) . . ?
C3B Ru4 C2C 35.9(4) . . ?
C3A Ru4 C2C 64.0(4) . . ?
C29 Ru4 Ru5 91.3(6) . . ?
C30 Ru4 Ru5 93.1(3) . . ?
C3B Ru4 Ru5 142.3(3) . . ?
C3A Ru4 Ru5 144.7(3) . . ?
C2C Ru4 Ru5 106.6(3) . . ?
C29 Ru4 Ru2 151.9(5) . . ?
C30 Ru4 Ru2 87.1(4) . . ?
C3B Ru4 Ru2 110.5(3) . . ?
C3A Ru4 Ru2 85.5(3) . . ?
C2C Ru4 Ru2 100.4(3) . . ?
Ru5 Ru4 Ru2 61.85(4) . . ?
C29 Ru4 Ru3 115.0(6) . . ?
C30 Ru4 Ru3 142.8(3) . . ?
C3B Ru4 Ru3 85.7(3) . . ?
C3A Ru4 Ru3 95.0(3) . . ?
C2C Ru4 Ru3 53.4(3) . . ?
Ru5 Ru4 Ru3 58.01(5) . . ?
Ru2 Ru4 Ru3 59.65(6) . . ?
C26 Ru5 C27 91.7(5) . . ?
C26 Ru5 C28 88.0(6) . . ?
C27 Ru5 C28 98.2(4) . . ?
C26 Ru5 Ru4 97.1(5) . . ?
C27 Ru5 Ru4 97.4(3) . . ?
C28 Ru5 Ru4 163.3(3) . . ?
C26 Ru5 Ru3 98.9(4) . . ?
C27 Ru5 Ru3 160.3(3) . . ?
C28 Ru5 Ru3 98.7(3) . . ?
Ru4 Ru5 Ru3 64.93(6) . . ?
C26 Ru5 Ru2 156.1(4) . . ?
C27 Ru5 Ru2 103.0(3) . . ?
C28 Ru5 Ru2 108.0(3) . . ?
Ru4 Ru5 Ru2 62.69(6) . . ?
Ru3 Ru5 Ru2 62.01(4) . . ?
C9 N22 C6 106.2(8) . . ?
C9 N22 Ru1 126.0(6) . . ?
C6 N22 Ru1 126.6(6) . . ?
C11 N23 C14 107.0(7) . . ?
C11 N23 Ru1 128.0(6) . . ?
C14 N23 Ru1 124.7(6) . . ?
C16 N24 C19 106.8(8) . . ?
C16 N24 Ru1 125.6(6) . . ?
C19 N24 Ru1 126.4(6) . . ?
C21 C1 C2 110.0(9) . . ?
C21 C1 C20 122.4(9) . . ?
C2 C1 C20 127.5(8) . . ?
C21 C1 Ru2 68.6(5) . . ?
C2 C1 Ru2 75.2(6) . . ?
C20 C1 Ru2 124.4(7) . . ?
C3 C2 C1 106.4(8) . . ?
C3 C2 C2A 127.0(9) . . ?
C1 C2 C2A 126.6(9) . . ?
C3 C2 Ru2 73.7(5) . . ?
C1 C2 Ru2 68.4(5) . . ?
C2A C2 Ru2 124.0(6) . . ?
C2B C2A C2 125.9(9) . . ?
C2B C2A Ru3 69.3(6) . . ?
C2 C2A Ru3 91.0(6) . . ?
C2B C2A H2A 117.0 . . ?
C2 C2A H2A 117.0 . . ?
Ru3 C2A H2A 111.7 . . ?
C2A C2B C2C 122.9(9) . . ?
C2A C2B Ru3 73.9(6) . . ?
C2C C2B Ru3 81.7(6) . . ?
C2A C2B H2B 118.5 . . ?
C2C C2B H2B 118.5 . . ?
Ru3 C2B H2B 116.1 . . ?
C2B C2C C3B 123.9(10) . . ?
C2B C2C Ru3 62.4(5) . . ?
C3B C2C Ru3 127.6(7) . . ?
C2B C2C Ru4 125.4(7) . . ?
C3B C2C Ru4 63.4(5) . . ?
Ru3 C2C Ru4 73.1(3) . . ?
C2B C2C H2C 101.1 . . ?
C3B C2C H2C 119.2 . . ?
Ru3 C2C H2C 107.9 . . ?
Ru4 C2C H2C 122.2 . . ?
C2 C3 C3A 127.5(9) . . ?
C2 C3 C4 107.1(8) . . ?
C3A C3 C4 125.2(9) . . ?
C2 C3 Ru2 70.9(5) . . ?
C3A C3 Ru2 128.9(7) . . ?
C4 C3 Ru2 68.7(5) . . ?
C3B C3A C3 126.3(10) . . ?
C3B C3A Ru4 71.1(6) . . ?
C3 C3A Ru4 87.3(6) . . ?
C3B C3A H3A 116.8 . . ?
C3 C3A H3A 116.8 . . ?
Ru4 C3A H3A 114.3 . . ?
C3A C3B C2C 122.5(9) . . ?
C3A C3B Ru4 72.7(6) . . ?
C2C C3B Ru4 80.7(6) . . ?
C3A C3B H3B 118.8 . . ?
C2C C3B H3B 118.8 . . ?
Ru4 C3B H3B 118.5 . . ?
C21 C4 C5 125.2(8) . . ?
C21 C4 C3 108.4(8) . . ?
C5 C4 C3 126.4(9) . . ?
C21 C4 Ru2 67.2(5) . . ?
C5 C4 Ru2 124.8(6) . . ?
C3 C4 Ru2 75.1(5) . . ?
C6 C5 C4 122.0(9) . . ?
C6 C5 C5A 119.7(9) . . ?
C4 C5 C5A 118.0(8) . . ?
C5F C5A C5B 117.9(9) . . ?
C5F C5A C5 123.9(9) . . ?
C5B C5A C5 118.2(9) . . ?
C5C C5B C5A 120.8(10) . . ?
C5C C5B H5B 119.6 . . ?
C5A C5B H5B 119.6 . . ?
C5B C5C C5D 120.5(10) . . ?
C5B C5C H5C 119.7 . . ?
C5D C5C H5C 119.7 . . ?
C5C C5D C5E 119.9(9) . . ?
C5C C5D H5D 120.0 . . ?
C5E C5D H5D 120.0 . . ?
C5D C5E C5F 119.4(10) . . ?
C5D C5E H5E 120.3 . . ?
C5F C5E H5E 120.3 . . ?
C5A C5F C5E 121.5(9) . . ?
C5A C5F H5F 119.3 . . ?
C5E C5F H5F 119.3 . . ?
C5 C6 N22 125.5(9) . . ?
C5 C6 C7 125.8(9) . . ?
N22 C6 C7 108.5(7) . . ?
C8 C7 C6 108.4(9) . . ?
C8 C7 H7 125.8 . . ?
C6 C7 H7 125.8 . . ?
C7 C8 C9 106.7(9) . . ?
C7 C8 H8 126.7 . . ?
C9 C8 H8 126.7 . . ?
N22 C9 C10 126.4(9) . . ?
N22 C9 C8 110.0(8) . . ?
C10 C9 C8 123.6(8) . . ?
C11 C10 C9 124.6(8) . . ?
C11 C10 C10A 118.3(8) . . ?
C9 C10 C10A 116.9(9) . . ?
C10B C10A C10F 119.4(10) . . ?
C10B C10A C10 120.9(9) . . ?
C10F C10A C10 119.7(10) . . ?
C10A C10B C10C 120.4(10) . . ?
C10A C10B H10B 119.8 . . ?
C10C C10B H10B 119.8 . . ?
C10D C10C C10B 120.5(11) . . ?
C10D C10C H10C 119.8 . . ?
C10B C10C H10C 119.8 . . ?
C10C C10D C10E 119.0(10) . . ?
C10C C10D H10D 120.5 . . ?
C10E C10D H10D 120.5 . . ?
C10F C10E C10D 121.7(11) . . ?
C10F C10E H10E 119.1 . . ?
C10D C10E H10E 119.1 . . ?
C10E C10F C10A 119.0(11) . . ?
C10E C10F H10F 120.5 . . ?
C10A C10F H10F 120.5 . . ?
N23 C11 C10 124.6(8) . . ?
N23 C11 C12 110.2(8) . . ?
C10 C11 C12 125.2(8) . . ?
C13 C12 C11 107.8(8) . . ?
C13 C12 H12 126.1 . . ?
C11 C12 H12 126.1 . . ?
C12 C13 C14 106.7(8) . . ?
C12 C13 H13 126.7 . . ?
C14 C13 H13 126.7 . . ?
C15 C14 N23 127.0(9) . . ?
C15 C14 C13 124.8(9) . . ?
N23 C14 C13 108.1(8) . . ?
C14 C15 C16 124.4(9) . . ?
C14 C15 C15A 119.3(8) . . ?
C16 C15 C15A 116.3(9) . . ?
C15B C15A C15F 117.5(9) . . ?
C15B C15A C15 121.3(9) . . ?
C15F C15A C15 121.1(9) . . ?
C15A C15B C15C 122.4(10) . . ?
C15A C15B H15B 118.8 . . ?
C15C C15B H15B 118.8 . . ?
C15D C15C C15B 118.6(9) . . ?
C15D C15C H15C 120.7 . . ?
C15B C15C H15C 120.7 . . ?
C15E C15D C15C 121.5(10) . . ?
C15E C15D H15D 119.2 . . ?
C15C C15D H15D 119.2 . . ?
C15D C15E C15F 118.3(10) . . ?
C15D C15E H15E 120.8 . . ?
C15F C15E H15E 120.8 . . ?
C15A C15F C15E 121.6(9) . . ?
C15A C15F H15F 119.2 . . ?
C15E C15F H15F 119.2 . . ?
N24 C16 C15 126.3(9) . . ?
N24 C16 C17 110.6(8) . . ?
C15 C16 C17 123.1(9) . . ?
C18 C17 C16 106.1(9) . . ?
C18 C17 H17 126.9 . . ?
C16 C17 H17 126.9 . . ?
C17 C18 C19 109.0(9) . . ?
C17 C18 H18 125.5 . . ?
C19 C18 H18 125.5 . . ?
C20 C19 N24 125.6(9) . . ?
C20 C19 C18 127.1(9) . . ?
N24 C19 C18 107.3(8) . . ?
C19 C20 C1 123.2(8) . . ?
C19 C20 C20A 118.0(9) . . ?
C1 C20 C20A 118.7(8) . . ?
C20B C20A C20F 118.0(9) . . ?
C20B C20A C20 122.6(9) . . ?
C20F C20A C20 119.2(9) . . ?
C20A C20B C20C 121.9(11) . . ?
C20A C20B H20B 119.0 . . ?
C20C C20B H20B 119.0 . . ?
C20D C20C C20B 118.6(11) . . ?
C20D C20C H20C 120.7 . . ?
C20B C20C H20C 120.7 . . ?
C20C C20D C20E 121.1(10) . . ?
C20C C20D H20D 119.5 . . ?
C20E C20D H20D 119.5 . . ?
C20F C20E C20D 118.6(11) . . ?
C20F C20E H20E 120.7 . . ?
C20D C20E H20E 120.7 . . ?
C20A C20F C20E 121.7(10) . . ?
C20A C20F H20F 119.1 . . ?
C20E C20F H20F 119.1 . . ?
C1 C21 C4 107.8(8) . . ?
C1 C21 Ru1 124.9(7) . . ?
C4 C21 Ru1 122.7(6) . . ?
C1 C21 Ru2 74.6(6) . . ?
C4 C21 Ru2 76.3(6) . . ?
Ru1 C21 Ru2 96.2(4) . . ?
O2 C22 Ru1 178.0(10) . . ?
O3 C23 Ru2 169.0(9) . . ?
O4 C24 Ru3 177.5(10) . . ?
O5 C25 Ru3 178.4(11) . . ?
O6 C26 Ru5 177.2(12) . . ?
O7 C27 Ru5 175.1(10) . . ?
O8 C28 Ru5 171.8(10) . . ?
O9 C29 Ru4 176.2(17) . . ?
O10 C30 Ru4 178.5(10) . . ?
O11 C31 Ru2 175.0(10) . . ?
C37 C32 C33 118.6(13) . . ?
C37 C32 H32 120.7 . . ?
C33 C32 H32 120.7 . . ?
C34 C33 C32 119.4(14) . . ?
C34 C33 H33 120.3 . . ?
C32 C33 H33 120.3 . . ?
C33 C34 C35 122.3(14) . . ?
C33 C34 H34 118.9 . . ?
C35 C34 H34 118.9 . . ?
C36 C35 C34 117.6(13) . . ?
C36 C35 C38 121.3(15) . . ?
C34 C35 C38 121.1(15) . . ?
C35 C36 C37 119.0(13) . . ?
C35 C36 H36 120.5 . . ?
C37 C36 H36 120.5 . . ?
C32 C37 C36 123.0(11) . . ?
C32 C37 H37 118.5 . . ?
C36 C37 H37 118.5 . . ?
C35 C38 H38A 109.5 . . ?
C35 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
C35 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?

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
C22 Ru1 Ru2 C23 134.3(6) . . . . ?
C21 Ru1 Ru2 C23 129.2(5) . . . . ?
N24 Ru1 Ru2 C23 37.8(4) . . . . ?
N22 Ru1 Ru2 C23 -137.4(4) . . . . ?
N23 Ru1 Ru2 C23 -50.7(4) . . . . ?
C22 Ru1 Ru2 C31 -137.7(7) . . . . ?
C21 Ru1 Ru2 C31 -142.8(5) . . . . ?
N24 Ru1 Ru2 C31 125.8(4) . . . . ?
N22 Ru1 Ru2 C31 -49.4(4) . . . . ?
N23 Ru1 Ru2 C31 37.4(5) . . . . ?
C22 Ru1 Ru2 C21 5.1(7) . . . . ?
N24 Ru1 Ru2 C21 -91.4(5) . . . . ?
N22 Ru1 Ru2 C21 93.4(5) . . . . ?
N23 Ru1 Ru2 C21 -179.8(5) . . . . ?
C22 Ru1 Ru2 C1 37.6(6) . . . . ?
C21 Ru1 Ru2 C1 32.5(5) . . . . ?
N24 Ru1 Ru2 C1 -58.9(3) . . . . ?
N22 Ru1 Ru2 C1 125.9(3) . . . . ?
N23 Ru1 Ru2 C1 -147.4(4) . . . . ?
C22 Ru1 Ru2 C4 -28.5(6) . . . . ?
C21 Ru1 Ru2 C4 -33.6(4) . . . . ?
N24 Ru1 Ru2 C4 -125.0(3) . . . . ?
N22 Ru1 Ru2 C4 59.8(3) . . . . ?
N23 Ru1 Ru2 C4 146.6(4) . . . . ?
C22 Ru1 Ru2 C2 22.3(6) . . . . ?
C21 Ru1 Ru2 C2 17.2(5) . . . . ?
N24 Ru1 Ru2 C2 -74.2(3) . . . . ?
N22 Ru1 Ru2 C2 110.6(3) . . . . ?
N23 Ru1 Ru2 C2 -162.6(4) . . . . ?
C22 Ru1 Ru2 C3 -13.5(6) . . . . ?
C21 Ru1 Ru2 C3 -18.6(5) . . . . ?
N24 Ru1 Ru2 C3 -110.0(3) . . . . ?
N22 Ru1 Ru2 C3 74.7(4) . . . . ?
N23 Ru1 Ru2 C3 161.5(4) . . . . ?
C22 Ru1 Ru2 Ru5 -166.1(6) . . . . ?
C21 Ru1 Ru2 Ru5 -171.2(4) . . . . ?
N24 Ru1 Ru2 Ru5 97.4(2) . . . . ?
N22 Ru1 Ru2 Ru5 -77.8(2) . . . . ?
N23 Ru1 Ru2 Ru5 8.9(3) . . . . ?
C22 Ru1 Ru2 Ru3 68.9(6) . . . . ?
C21 Ru1 Ru2 Ru3 63.8(4) . . . . ?
N24 Ru1 Ru2 Ru3 -27.6(2) . . . . ?
N22 Ru1 Ru2 Ru3 157.2(2) . . . . ?
N23 Ru1 Ru2 Ru3 -116.0(3) . . . . ?
C22 Ru1 Ru2 Ru4 -60.2(6) . . . . ?
C21 Ru1 Ru2 Ru4 -65.3(4) . . . . ?
N24 Ru1 Ru2 Ru4 -156.7(2) . . . . ?
N22 Ru1 Ru2 Ru4 28.0(2) . . . . ?
N23 Ru1 Ru2 Ru4 114.8(3) . . . . ?
C23 Ru2 Ru3 C25 73.2(8) . . . . ?
C31 Ru2 Ru3 C25 -3.6(8) . . . . ?
C21 Ru2 Ru3 C25 -176.3(8) . . . . ?
C1 Ru2 Ru3 C25 169.8(7) . . . . ?
C4 Ru2 Ru3 C25 -135.4(7) . . . . ?
C2 Ru2 Ru3 C25 -163.7(7) . . . . ?
C3 Ru2 Ru3 C25 -130.8(7) . . . . ?
Ru5 Ru2 Ru3 C25 -5.2(7) . . . . ?
Ru4 Ru2 Ru3 C25 -71.4(7) . . . . ?
Ru1 Ru2 Ru3 C25 141.3(7) . . . . ?
C23 Ru2 Ru3 C24 -23.1(5) . . . . ?
C31 Ru2 Ru3 C24 -99.9(6) . . . . ?
C21 Ru2 Ru3 C24 87.4(5) . . . . ?
C1 Ru2 Ru3 C24 73.5(4) . . . . ?
C4 Ru2 Ru3 C24 128.3(4) . . . . ?
C2 Ru2 Ru3 C24 100.0(4) . . . . ?
C3 Ru2 Ru3 C24 132.9(4) . . . . ?
Ru5 Ru2 Ru3 C24 -101.5(4) . . . . ?
Ru4 Ru2 Ru3 C24 -167.8(3) . . . . ?
Ru1 Ru2 Ru3 C24 45.0(4) . . . . ?
C23 Ru2 Ru3 C2B -143.0(4) . . . . ?
C31 Ru2 Ru3 C2B 140.2(6) . . . . ?
C21 Ru2 Ru3 C2B -32.5(4) . . . . ?
C1 Ru2 Ru3 C2B -46.4(4) . . . . ?
C4 Ru2 Ru3 C2B 8.4(4) . . . . ?
C2 Ru2 Ru3 C2B -19.9(4) . . . . ?
C3 Ru2 Ru3 C2B 13.0(4) . . . . ?
Ru5 Ru2 Ru3 C2B 138.6(3) . . . . ?
Ru4 Ru2 Ru3 C2B 72.3(3) . . . . ?
Ru1 Ru2 Ru3 C2B -74.9(3) . . . . ?
C23 Ru2 Ru3 C2A -117.2(4) . . . . ?
C31 Ru2 Ru3 C2A 166.0(5) . . . . ?
C21 Ru2 Ru3 C2A -6.7(4) . . . . ?
C1 Ru2 Ru3 C2A -20.6(3) . . . . ?
C4 Ru2 Ru3 C2A 34.2(4) . . . . ?
C2 Ru2 Ru3 C2A 5.9(4) . . . . ?
C3 Ru2 Ru3 C2A 38.8(4) . . . . ?
Ru5 Ru2 Ru3 C2A 164.4(3) . . . . ?
Ru4 Ru2 Ru3 C2A 98.1(3) . . . . ?
Ru1 Ru2 Ru3 C2A -49.1(3) . . . . ?
C23 Ru2 Ru3 C2C -179.2(4) . . . . ?
C31 Ru2 Ru3 C2C 103.9(6) . . . . ?
C21 Ru2 Ru3 C2C -68.8(4) . . . . ?
C1 Ru2 Ru3 C2C -82.6(4) . . . . ?
C4 Ru2 Ru3 C2C -27.8(4) . . . . ?
C2 Ru2 Ru3 C2C -56.1(4) . . . . ?
C3 Ru2 Ru3 C2C -23.3(4) . . . . ?
Ru5 Ru2 Ru3 C2C 102.3(3) . . . . ?
Ru4 Ru2 Ru3 C2C 36.1(3) . . . . ?
Ru1 Ru2 Ru3 C2C -111.2(3) . . . . ?
C23 Ru2 Ru3 Ru5 78.5(3) . . . . ?
C31 Ru2 Ru3 Ru5 1.7(5) . . . . ?
C21 Ru2 Ru3 Ru5 -171.1(3) . . . . ?
C1 Ru2 Ru3 Ru5 175.1(2) . . . . ?
C4 Ru2 Ru3 Ru5 -130.1(2) . . . . ?
C2 Ru2 Ru3 Ru5 -158.4(3) . . . . ?
C3 Ru2 Ru3 Ru5 -125.6(3) . . . . ?
Ru4 Ru2 Ru3 Ru5 -66.22(6) . . . . ?
Ru1 Ru2 Ru3 Ru5 146.52(8) . . . . ?
C23 Ru2 Ru3 Ru4 144.7(3) . . . . ?
C31 Ru2 Ru3 Ru4 67.9(5) . . . . ?
C21 Ru2 Ru3 Ru4 -104.8(3) . . . . ?
C1 Ru2 Ru3 Ru4 -118.7(2) . . . . ?
C4 Ru2 Ru3 Ru4 -63.9(2) . . . . ?
C2 Ru2 Ru3 Ru4 -92.2(3) . . . . ?
C3 Ru2 Ru3 Ru4 -59.4(3) . . . . ?
Ru5 Ru2 Ru3 Ru4 66.22(6) . . . . ?
Ru1 Ru2 Ru3 Ru4 -147.26(8) . . . . ?
C23 Ru2 Ru4 C29 41.9(11) . . . . ?
C31 Ru2 Ru4 C29 -49.1(11) . . . . ?
C21 Ru2 Ru4 C29 -160.6(11) . . . . ?
C1 Ru2 Ru4 C29 158.8(11) . . . . ?
C4 Ru2 Ru4 C29 -148.9(10) . . . . ?
C2 Ru2 Ru4 C29 150.0(11) . . . . ?
C3 Ru2 Ru4 C29 -178.1(11) . . . . ?
Ru5 Ru2 Ru4 C29 19.3(10) . . . . ?
Ru3 Ru2 Ru4 C29 86.7(10) . . . . ?
Ru1 Ru2 Ru4 C29 -119.9(10) . . . . ?
C23 Ru2 Ru4 C30 117.7(5) . . . . ?
C31 Ru2 Ru4 C30 26.7(5) . . . . ?
C21 Ru2 Ru4 C30 -84.9(4) . . . . ?
C1 Ru2 Ru4 C30 -125.4(4) . . . . ?
C4 Ru2 Ru4 C30 -73.1(4) . . . . ?
C2 Ru2 Ru4 C30 -134.2(4) . . . . ?
C3 Ru2 Ru4 C30 -102.3(4) . . . . ?
Ru5 Ru2 Ru4 C30 95.0(3) . . . . ?
Ru3 Ru2 Ru4 C30 162.5(3) . . . . ?
Ru1 Ru2 Ru4 C30 -44.1(3) . . . . ?
C23 Ru2 Ru4 C3B -116.6(5) . . . . ?
C31 Ru2 Ru4 C3B 152.4(4) . . . . ?
C21 Ru2 Ru4 C3B 40.8(4) . . . . ?
C1 Ru2 Ru4 C3B 0.3(4) . . . . ?
C4 Ru2 Ru4 C3B 52.6(4) . . . . ?
C2 Ru2 Ru4 C3B -8.5(4) . . . . ?
C3 Ru2 Ru4 C3B 23.4(4) . . . . ?
Ru5 Ru2 Ru4 C3B -139.3(3) . . . . ?
Ru3 Ru2 Ru4 C3B -71.8(3) . . . . ?
Ru1 Ru2 Ru4 C3B 81.5(3) . . . . ?
C23 Ru2 Ru4 C3A -143.3(5) . . . . ?
C31 Ru2 Ru4 C3A 125.7(4) . . . . ?
C21 Ru2 Ru4 C3A 14.1(4) . . . . ?
C1 Ru2 Ru4 C3A -26.4(4) . . . . ?
C4 Ru2 Ru4 C3A 25.9(3) . . . . ?
C2 Ru2 Ru4 C3A -35.2(3) . . . . ?
C3 Ru2 Ru4 C3A -3.3(4) . . . . ?
Ru5 Ru2 Ru4 C3A -166.0(3) . . . . ?
Ru3 Ru2 Ru4 C3A -98.5(3) . . . . ?
Ru1 Ru2 Ru4 C3A 54.9(3) . . . . ?
C23 Ru2 Ru4 C2C -80.8(5) . . . . ?
C31 Ru2 Ru4 C2C -171.8(4) . . . . ?
C21 Ru2 Ru4 C2C 76.7(4) . . . . ?
C1 Ru2 Ru4 C2C 36.2(4) . . . . ?
C4 Ru2 Ru4 C2C 88.4(3) . . . . ?
C2 Ru2 Ru4 C2C 27.4(4) . . . . ?
C3 Ru2 Ru4 C2C 59.3(4) . . . . ?
Ru5 Ru2 Ru4 C2C -103.4(3) . . . . ?
Ru3 Ru2 Ru4 C2C -35.9(3) . . . . ?
Ru1 Ru2 Ru4 C2C 117.4(3) . . . . ?
C23 Ru2 Ru4 Ru5 22.7(4) . . . . ?
C31 Ru2 Ru4 Ru5 -68.3(3) . . . . ?
C21 Ru2 Ru4 Ru5 -179.9(3) . . . . ?
C1 Ru2 Ru4 Ru5 139.6(3) . . . . ?
C4 Ru2 Ru4 Ru5 -168.1(2) . . . . ?
C2 Ru2 Ru4 Ru5 130.8(2) . . . . ?
C3 Ru2 Ru4 Ru5 162.7(3) . . . . ?
Ru3 Ru2 Ru4 Ru5 67.49(5) . . . . ?
Ru1 Ru2 Ru4 Ru5 -139.18(7) . . . . ?
C23 Ru2 Ru4 Ru3 -44.8(4) . . . . ?
C31 Ru2 Ru4 Ru3 -135.8(3) . . . . ?
C21 Ru2 Ru4 Ru3 112.6(3) . . . . ?
C1 Ru2 Ru4 Ru3 72.1(3) . . . . ?
C4 Ru2 Ru4 Ru3 124.4(2) . . . . ?
C2 Ru2 Ru4 Ru3 63.3(2) . . . . ?
C3 Ru2 Ru4 Ru3 95.2(3) . . . . ?
Ru5 Ru2 Ru4 Ru3 -67.49(5) . . . . ?
Ru1 Ru2 Ru4 Ru3 153.34(6) . . . . ?
C25 Ru3 Ru4 C29 -3.7(6) . . . . ?
C24 Ru3 Ru4 C29 -116.2(10) . . . . ?
C2B Ru3 Ru4 C29 95.7(5) . . . . ?
C2A Ru3 Ru4 C29 131.6(5) . . . . ?
C2C Ru3 Ru4 C29 77.3(6) . . . . ?
Ru5 Ru3 Ru4 C29 -74.9(5) . . . . ?
Ru2 Ru3 Ru4 C29 -148.7(5) . . . . ?
C25 Ru3 Ru4 C30 115.2(7) . . . . ?
C24 Ru3 Ru4 C30 2.8(10) . . . . ?
C2B Ru3 Ru4 C30 -145.3(6) . . . . ?
C2A Ru3 Ru4 C30 -109.4(6) . . . . ?
C2C Ru3 Ru4 C30 -163.7(7) . . . . ?
Ru5 Ru3 Ru4 C30 44.1(6) . . . . ?
Ru2 Ru3 Ru4 C30 -29.7(6) . . . . ?
C25 Ru3 Ru4 C3B -98.2(4) . . . . ?
C24 Ru3 Ru4 C3B 149.4(9) . . . . ?
C2B Ru3 Ru4 C3B 1.3(4) . . . . ?
C2A Ru3 Ru4 C3B 37.2(4) . . . . ?
C2C Ru3 Ru4 C3B -17.2(4) . . . . ?
Ru5 Ru3 Ru4 C3B -169.3(3) . . . . ?
Ru2 Ru3 Ru4 C3B 116.8(3) . . . . ?
C25 Ru3 Ru4 C3A -133.2(4) . . . . ?
C24 Ru3 Ru4 C3A 114.3(9) . . . . ?
C2B Ru3 Ru4 C3A -33.7(4) . . . . ?
C2A Ru3 Ru4 C3A 2.2(3) . . . . ?
C2C Ru3 Ru4 C3A -52.2(4) . . . . ?
Ru5 Ru3 Ru4 C3A 155.6(2) . . . . ?
Ru2 Ru3 Ru4 C3A 81.8(2) . . . . ?
C25 Ru3 Ru4 C2C -81.0(5) . . . . ?
C24 Ru3 Ru4 C2C 166.5(9) . . . . ?
C2B Ru3 Ru4 C2C 18.4(4) . . . . ?
C2A Ru3 Ru4 C2C 54.4(4) . . . . ?
Ru5 Ru3 Ru4 C2C -152.2(3) . . . . ?
Ru2 Ru3 Ru4 C2C 134.0(3) . . . . ?
C25 Ru3 Ru4 Ru5 71.2(3) . . . . ?
C24 Ru3 Ru4 Ru5 -41.3(8) . . . . ?
C2B Ru3 Ru4 Ru5 170.6(3) . . . . ?
C2A Ru3 Ru4 Ru5 -153.5(2) . . . . ?
C2C Ru3 Ru4 Ru5 152.2(3) . . . . ?
Ru2 Ru3 Ru4 Ru5 -73.81(4) . . . . ?
C25 Ru3 Ru4 Ru2 145.0(3) . . . . ?
C24 Ru3 Ru4 Ru2 32.5(8) . . . . ?
C2B Ru3 Ru4 Ru2 -115.6(3) . . . . ?
C2A Ru3 Ru4 Ru2 -79.6(2) . . . . ?
C2C Ru3 Ru4 Ru2 -134.0(3) . . . . ?
Ru5 Ru3 Ru4 Ru2 73.81(4) . . . . ?
C29 Ru4 Ru5 C26 22.4(6) . . . . ?
C30 Ru4 Ru5 C26 108.4(5) . . . . ?
C3B Ru4 Ru5 C26 -79.0(6) . . . . ?
C3A Ru4 Ru5 C26 -141.8(6) . . . . ?
C2C Ru4 Ru5 C26 -73.5(5) . . . . ?
Ru2 Ru4 Ru5 C26 -166.6(4) . . . . ?
Ru3 Ru4 Ru5 C26 -96.5(4) . . . . ?
C29 Ru4 Ru5 C27 -70.2(5) . . . . ?
C30 Ru4 Ru5 C27 15.7(5) . . . . ?
C3B Ru4 Ru5 C27 -171.6(5) . . . . ?
C3A Ru4 Ru5 C27 125.5(5) . . . . ?
C2C Ru4 Ru5 C27 -166.2(4) . . . . ?
Ru2 Ru4 Ru5 C27 100.8(3) . . . . ?
Ru3 Ru4 Ru5 C27 170.8(3) . . . . ?
C29 Ru4 Ru5 C28 129.7(12) . . . . ?
C30 Ru4 Ru5 C28 -144.3(12) . . . . ?
C3B Ru4 Ru5 C28 28.4(12) . . . . ?
C3A Ru4 Ru5 C28 -34.5(12) . . . . ?
C2C Ru4 Ru5 C28 33.8(12) . . . . ?
Ru2 Ru4 Ru5 C28 -59.2(12) . . . . ?
Ru3 Ru4 Ru5 C28 10.8(12) . . . . ?
C29 Ru4 Ru5 Ru3 118.9(4) . . . . ?
C30 Ru4 Ru5 Ru3 -155.1(4) . . . . ?
C3B Ru4 Ru5 Ru3 17.6(4) . . . . ?
C3A Ru4 Ru5 Ru3 -45.3(4) . . . . ?
C2C Ru4 Ru5 Ru3 23.0(3) . . . . ?
Ru2 Ru4 Ru5 Ru3 -70.03(6) . . . . ?
C29 Ru4 Ru5 Ru2 -171.1(4) . . . . ?
C30 Ru4 Ru5 Ru2 -85.1(4) . . . . ?
C3B Ru4 Ru5 Ru2 87.6(4) . . . . ?
C3A Ru4 Ru5 Ru2 24.7(4) . . . . ?
C2C Ru4 Ru5 Ru2 93.0(3) . . . . ?
Ru3 Ru4 Ru5 Ru2 70.03(6) . . . . ?
C25 Ru3 Ru5 C26 -18.3(6) . . . . ?
C24 Ru3 Ru5 C26 -101.6(6) . . . . ?
C2B Ru3 Ru5 C26 78.7(7) . . . . ?
C2A Ru3 Ru5 C26 139.4(6) . . . . ?
C2C Ru3 Ru5 C26 70.8(6) . . . . ?
Ru2 Ru3 Ru5 C26 164.8(5) . . . . ?
Ru4 Ru3 Ru5 C26 93.8(5) . . . . ?
C25 Ru3 Ru5 C27 -140.0(10) . . . . ?
C24 Ru3 Ru5 C27 136.7(10) . . . . ?
C2B Ru3 Ru5 C27 -43.0(10) . . . . ?
C2A Ru3 Ru5 C27 17.7(10) . . . . ?
C2C Ru3 Ru5 C27 -50.9(10) . . . . ?
Ru2 Ru3 Ru5 C27 43.1(9) . . . . ?
Ru4 Ru3 Ru5 C27 -28.0(9) . . . . ?
C25 Ru3 Ru5 C28 71.1(5) . . . . ?
C24 Ru3 Ru5 C28 -12.3(5) . . . . ?
C2B Ru3 Ru5 C28 168.1(5) . . . . ?
C2A Ru3 Ru5 C28 -131.2(5) . . . . ?
C2C Ru3 Ru5 C28 160.2(4) . . . . ?
Ru2 Ru3 Ru5 C28 -105.8(3) . . . . ?
Ru4 Ru3 Ru5 C28 -176.9(3) . . . . ?
C25 Ru3 Ru5 Ru4 -112.1(4) . . . . ?
C24 Ru3 Ru5 Ru4 164.6(3) . . . . ?
C2B Ru3 Ru5 Ru4 -15.0(4) . . . . ?
C2A Ru3 Ru5 Ru4 45.7(4) . . . . ?
C2C Ru3 Ru5 Ru4 -23.0(3) . . . . ?
Ru2 Ru3 Ru5 Ru4 71.04(5) . . . . ?
C25 Ru3 Ru5 Ru2 176.9(4) . . . . ?
C24 Ru3 Ru5 Ru2 93.6(3) . . . . ?
C2B Ru3 Ru5 Ru2 -86.1(4) . . . . ?
C2A Ru3 Ru5 Ru2 -25.4(4) . . . . ?
C2C Ru3 Ru5 Ru2 -94.0(3) . . . . ?
Ru4 Ru3 Ru5 Ru2 -71.04(5) . . . . ?
C23 Ru2 Ru5 C26 -126.5(11) . . . . ?
C31 Ru2 Ru5 C26 141.4(12) . . . . ?
C1 Ru2 Ru5 C26 -48.1(12) . . . . ?
C4 Ru2 Ru5 C26 51.8(11) . . . . ?
C2 Ru2 Ru5 C26 -19.3(11) . . . . ?
C3 Ru2 Ru5 C26 19.1(11) . . . . ?
Ru3 Ru2 Ru5 C26 -39.8(11) . . . . ?
Ru4 Ru2 Ru5 C26 34.8(11) . . . . ?
Ru1 Ru2 Ru5 C26 169.8(11) . . . . ?
C23 Ru2 Ru5 C27 107.0(4) . . . . ?
C31 Ru2 Ru5 C27 14.9(5) . . . . ?
C1 Ru2 Ru5 C27 -174.6(5) . . . . ?
C4 Ru2 Ru5 C27 -74.7(4) . . . . ?
C2 Ru2 Ru5 C27 -145.8(4) . . . . ?
C3 Ru2 Ru5 C27 -107.5(4) . . . . ?
Ru3 Ru2 Ru5 C27 -166.3(3) . . . . ?
Ru4 Ru2 Ru5 C27 -91.8(3) . . . . ?
Ru1 Ru2 Ru5 C27 43.3(3) . . . . ?
C23 Ru2 Ru5 C28 3.7(4) . . . . ?
C31 Ru2 Ru5 C28 -88.3(5) . . . . ?
C1 Ru2 Ru5 C28 82.2(5) . . . . ?
C4 Ru2 Ru5 C28 -178.0(4) . . . . ?
C2 Ru2 Ru5 C28 110.9(4) . . . . ?
C3 Ru2 Ru5 C28 149.3(4) . . . . ?
Ru3 Ru2 Ru5 C28 90.4(3) . . . . ?
Ru4 Ru2 Ru5 C28 165.0(3) . . . . ?
Ru1 Ru2 Ru5 C28 -60.0(3) . . . . ?
C23 Ru2 Ru5 Ru4 -161.2(3) . . . . ?
C31 Ru2 Ru5 Ru4 106.7(4) . . . . ?
C1 Ru2 Ru5 Ru4 -82.8(4) . . . . ?
C4 Ru2 Ru5 Ru4 17.0(3) . . . . ?
C2 Ru2 Ru5 Ru4 -54.0(3) . . . . ?
C3 Ru2 Ru5 Ru4 -15.7(3) . . . . ?
Ru3 Ru2 Ru5 Ru4 -74.59(6) . . . . ?
Ru1 Ru2 Ru5 Ru4 135.06(7) . . . . ?
C23 Ru2 Ru5 Ru3 -86.6(3) . . . . ?
C31 Ru2 Ru5 Ru3 -178.7(4) . . . . ?
C1 Ru2 Ru5 Ru3 -8.2(4) . . . . ?
C4 Ru2 Ru5 Ru3 91.6(3) . . . . ?
C2 Ru2 Ru5 Ru3 20.6(3) . . . . ?
C3 Ru2 Ru5 Ru3 58.9(3) . . . . ?
Ru4 Ru2 Ru5 Ru3 74.59(6) . . . . ?
Ru1 Ru2 Ru5 Ru3 -150.35(7) . . . . ?
C22 Ru1 N22 C9 -80.0(8) . . . . ?
C21 Ru1 N22 C9 178.9(8) . . . . ?
N23 Ru1 N22 C9 13.2(8) . . . . ?
Ru2 Ru1 N22 C9 135.1(8) . . . . ?
C22 Ru1 N22 C6 85.8(9) . . . . ?
C21 Ru1 N22 C6 -15.2(8) . . . . ?
N23 Ru1 N22 C6 179.0(8) . . . . ?
Ru2 Ru1 N22 C6 -59.1(8) . . . . ?
C22 Ru1 N23 C11 85.3(9) . . . . ?
C21 Ru1 N23 C11 -92.3(16) . . . . ?
N24 Ru1 N23 C11 -179.5(8) . . . . ?
N22 Ru1 N23 C11 -6.1(8) . . . . ?
Ru2 Ru1 N23 C11 -91.9(8) . . . . ?
C22 Ru1 N23 C14 -87.1(8) . . . . ?
C21 Ru1 N23 C14 95.3(16) . . . . ?
N24 Ru1 N23 C14 8.1(8) . . . . ?
N22 Ru1 N23 C14 -178.5(8) . . . . ?
Ru2 Ru1 N23 C14 95.7(8) . . . . ?
C22 Ru1 N24 C16 76.6(9) . . . . ?
C21 Ru1 N24 C16 177.7(8) . . . . ?
N23 Ru1 N24 C16 -16.5(8) . . . . ?
Ru2 Ru1 N24 C16 -138.4(8) . . . . ?
C22 Ru1 N24 C19 -89.1(8) . . . . ?
C21 Ru1 N24 C19 12.0(8) . . . . ?
N23 Ru1 N24 C19 177.7(8) . . . . ?
Ru2 Ru1 N24 C19 55.9(8) . . . . ?
C23 Ru2 C1 C21 -121.8(6) . . . . ?
C31 Ru2 C1 C21 -27.8(9) . . . . ?
C4 Ru2 C1 C21 39.3(5) . . . . ?
C2 Ru2 C1 C21 118.9(8) . . . . ?
C3 Ru2 C1 C21 81.5(6) . . . . ?
Ru5 Ru2 C1 C21 166.9(4) . . . . ?
Ru3 Ru2 C1 C21 160.0(5) . . . . ?
Ru4 Ru2 C1 C21 104.3(5) . . . . ?
Ru1 Ru2 C1 C21 -35.1(5) . . . . ?
C23 Ru2 C1 C2 119.3(6) . . . . ?
C31 Ru2 C1 C2 -146.7(7) . . . . ?
C21 Ru2 C1 C2 -118.9(8) . . . . ?
C4 Ru2 C1 C2 -79.6(6) . . . . ?
C3 Ru2 C1 C2 -37.3(5) . . . . ?
Ru5 Ru2 C1 C2 48.0(7) . . . . ?
Ru3 Ru2 C1 C2 41.2(5) . . . . ?
Ru4 Ru2 C1 C2 -14.6(6) . . . . ?
Ru1 Ru2 C1 C2 -154.0(6) . . . . ?
C23 Ru2 C1 C20 -6.4(8) . . . . ?
C31 Ru2 C1 C20 87.6(10) . . . . ?
C21 Ru2 C1 C20 115.5(10) . . . . ?
C4 Ru2 C1 C20 154.8(9) . . . . ?
C2 Ru2 C1 C20 -125.7(10) . . . . ?
C3 Ru2 C1 C20 -163.0(9) . . . . ?
Ru5 Ru2 C1 C20 -77.7(8) . . . . ?
Ru3 Ru2 C1 C20 -84.5(7) . . . . ?
Ru4 Ru2 C1 C20 -140.3(7) . . . . ?
Ru1 Ru2 C1 C20 80.3(7) . . . . ?
C21 C1 C2 C3 4.3(11) . . . . ?
C20 C1 C2 C3 -173.2(9) . . . . ?
Ru2 C1 C2 C3 64.5(6) . . . . ?
C21 C1 C2 C2A -177.2(9) . . . . ?
C20 C1 C2 C2A 5.2(16) . . . . ?
Ru2 C1 C2 C2A -117.0(9) . . . . ?
C21 C1 C2 Ru2 -60.2(7) . . . . ?
C20 C1 C2 Ru2 122.3(10) . . . . ?
C23 Ru2 C2 C3 175.3(6) . . . . ?
C31 Ru2 C2 C3 -19.4(15) . . . . ?
C21 Ru2 C2 C3 -79.0(6) . . . . ?
C1 Ru2 C2 C3 -115.6(8) . . . . ?
C4 Ru2 C2 C3 -37.0(5) . . . . ?
Ru5 Ru2 C2 C3 93.7(5) . . . . ?
Ru3 Ru2 C2 C3 113.2(6) . . . . ?
Ru4 Ru2 C2 C3 50.7(5) . . . . ?
Ru1 Ru2 C2 C3 -91.5(5) . . . . ?
C23 Ru2 C2 C1 -69.1(7) . . . . ?
C31 Ru2 C2 C1 96.1(13) . . . . ?
C21 Ru2 C2 C1 36.6(6) . . . . ?
C4 Ru2 C2 C1 78.6(6) . . . . ?
C3 Ru2 C2 C1 115.6(8) . . . . ?
Ru5 Ru2 C2 C1 -150.7(5) . . . . ?
Ru3 Ru2 C2 C1 -131.2(6) . . . . ?
Ru4 Ru2 C2 C1 166.2(6) . . . . ?
Ru1 Ru2 C2 C1 24.1(5) . . . . ?
C23 Ru2 C2 C2A 51.3(9) . . . . ?
C31 Ru2 C2 C2A -143.5(12) . . . . ?
C21 Ru2 C2 C2A 157.0(10) . . . . ?
C1 Ru2 C2 C2A 120.4(11) . . . . ?
C4 Ru2 C2 C2A -161.0(10) . . . . ?
C3 Ru2 C2 C2A -124.0(11) . . . . ?
Ru5 Ru2 C2 C2A -30.3(9) . . . . ?
Ru3 Ru2 C2 C2A -10.8(7) . . . . ?
Ru4 Ru2 C2 C2A -73.3(8) . . . . ?
Ru1 Ru2 C2 C2A 144.5(8) . . . . ?
C3 C2 C2A C2B -17.7(15) . . . . ?
C1 C2 C2A C2B 164.1(10) . . . . ?
Ru2 C2 C2A C2B 77.1(12) . . . . ?
C3 C2 C2A Ru3 -82.6(9) . . . . ?
C1 C2 C2A Ru3 99.2(9) . . . . ?
Ru2 C2 C2A Ru3 12.2(8) . . . . ?
C25 Ru3 C2A C2B 35.0(9) . . . . ?
C24 Ru3 C2A C2B 123.8(6) . . . . ?
C2C Ru3 C2A C2B -30.9(6) . . . . ?
Ru5 Ru3 C2A C2B -114.3(6) . . . . ?
Ru2 Ru3 C2A C2B -136.7(6) . . . . ?
Ru4 Ru3 C2A C2B -77.4(6) . . . . ?
C25 Ru3 C2A C2 163.4(7) . . . . ?
C24 Ru3 C2A C2 -107.8(6) . . . . ?
C2B Ru3 C2A C2 128.4(9) . . . . ?
C2C Ru3 C2A C2 97.4(6) . . . . ?
Ru5 Ru3 C2A C2 14.0(8) . . . . ?
Ru2 Ru3 C2A C2 -8.4(5) . . . . ?
Ru4 Ru3 C2A C2 51.0(6) . . . . ?
C2 C2A C2B C2C -6.9(15) . . . . ?
Ru3 C2A C2B C2C 68.6(9) . . . . ?
C2 C2A C2B Ru3 -75.5(9) . . . . ?
C25 Ru3 C2B C2A -154.5(7) . . . . ?
C24 Ru3 C2B C2A -64.9(7) . . . . ?
C2C Ru3 C2B C2A 127.8(9) . . . . ?
Ru5 Ru3 C2B C2A 114.8(6) . . . . ?
Ru2 Ru3 C2B C2A 46.1(6) . . . . ?
Ru4 Ru3 C2B C2A 102.2(6) . . . . ?
C25 Ru3 C2B C2C 77.6(7) . . . . ?
C24 Ru3 C2B C2C 167.3(6) . . . . ?
C2A Ru3 C2B C2C -127.8(9) . . . . ?
Ru5 Ru3 C2B C2C -13.1(8) . . . . ?
Ru2 Ru3 C2B C2C -81.7(6) . . . . ?
Ru4 Ru3 C2B C2C -25.7(5) . . . . ?
C2A C2B C2C C3B 53.8(14) . . . . ?
Ru3 C2B C2C C3B 118.5(9) . . . . ?
C2A C2B C2C Ru3 -64.7(9) . . . . ?
C2A C2B C2C Ru4 -25.6(14) . . . . ?
Ru3 C2B C2C Ru4 39.1(8) . . . . ?
C25 Ru3 C2C C2B -106.0(7) . . . . ?
C24 Ru3 C2C C2B -22.5(11) . . . . ?
C2A Ru3 C2C C2B 31.6(6) . . . . ?
Ru5 Ru3 C2C C2B 171.5(5) . . . . ?
Ru2 Ru3 C2C C2B 108.1(5) . . . . ?
Ru4 Ru3 C2C C2B 147.5(7) . . . . ?
C25 Ru3 C2C C3B 140.9(10) . . . . ?
C24 Ru3 C2C C3B -135.6(9) . . . . ?
C2B Ru3 C2C C3B -113.1(12) . . . . ?
C2A Ru3 C2C C3B -81.4(10) . . . . ?
Ru5 Ru3 C2C C3B 58.5(10) . . . . ?
Ru2 Ru3 C2C C3B -5.0(10) . . . . ?
Ru4 Ru3 C2C C3B 34.4(8) . . . . ?
C25 Ru3 C2C Ru4 106.5(4) . . . . ?
C24 Ru3 C2C Ru4 -170.1(6) . . . . ?
C2B Ru3 C2C Ru4 -147.5(7) . . . . ?
C2A Ru3 C2C Ru4 -115.9(4) . . . . ?
Ru5 Ru3 C2C Ru4 24.0(3) . . . . ?
Ru2 Ru3 C2C Ru4 -39.4(2) . . . . ?
C29 Ru4 C2C C2B -153.1(10) . . . . ?
C30 Ru4 C2C C2B 114.2(14) . . . . ?
C3B Ru4 C2C C2B 114.2(12) . . . . ?
C3A Ru4 C2C C2B 83.2(9) . . . . ?
Ru5 Ru4 C2C C2B -60.1(9) . . . . ?
Ru2 Ru4 C2C C2B 3.4(9) . . . . ?
Ru3 Ru4 C2C C2B -35.7(8) . . . . ?
C29 Ru4 C2C C3B 92.7(8) . . . . ?
C30 Ru4 C2C C3B 0.1(16) . . . . ?
C3A Ru4 C2C C3B -31.0(6) . . . . ?
Ru5 Ru4 C2C C3B -174.3(5) . . . . ?
Ru2 Ru4 C2C C3B -110.8(6) . . . . ?
Ru3 Ru4 C2C C3B -149.9(7) . . . . ?
C29 Ru4 C2C Ru3 -117.4(6) . . . . ?
C30 Ru4 C2C Ru3 150.0(12) . . . . ?
C3B Ru4 C2C Ru3 149.9(7) . . . . ?
C3A Ru4 C2C Ru3 118.9(4) . . . . ?
Ru5 Ru4 C2C Ru3 -24.4(3) . . . . ?
Ru2 Ru4 C2C Ru3 39.1(2) . . . . ?
C1 C2 C3 C3A 174.1(9) . . . . ?
C2A C2 C3 C3A -4.4(16) . . . . ?
Ru2 C2 C3 C3A -124.9(10) . . . . ?
C1 C2 C3 C4 -1.5(10) . . . . ?
C2A C2 C3 C4 -180.0(9) . . . . ?
Ru2 C2 C3 C4 59.5(6) . . . . ?
C1 C2 C3 Ru2 -61.0(6) . . . . ?
C2A C2 C3 Ru2 120.5(10) . . . . ?
C23 Ru2 C3 C2 -7.9(10) . . . . ?
C31 Ru2 C3 C2 171.9(6) . . . . ?
C21 Ru2 C3 C2 81.0(6) . . . . ?
C1 Ru2 C3 C2 38.4(5) . . . . ?
C4 Ru2 C3 C2 118.0(8) . . . . ?
Ru5 Ru2 C3 C2 -101.6(5) . . . . ?
Ru3 Ru2 C3 C2 -55.0(5) . . . . ?
Ru4 Ru2 C3 C2 -116.8(6) . . . . ?
Ru1 Ru2 C3 C2 94.5(5) . . . . ?
C23 Ru2 C3 C3A 115.3(10) . . . . ?
C31 Ru2 C3 C3A -64.9(10) . . . . ?
C21 Ru2 C3 C3A -155.8(10) . . . . ?
C1 Ru2 C3 C3A 161.6(10) . . . . ?
C4 Ru2 C3 C3A -118.8(11) . . . . ?
C2 Ru2 C3 C3A 123.2(11) . . . . ?
Ru5 Ru2 C3 C3A 21.7(10) . . . . ?
Ru3 Ru2 C3 C3A 68.2(9) . . . . ?
Ru4 Ru2 C3 C3A 6.4(8) . . . . ?
Ru1 Ru2 C3 C3A -142.3(9) . . . . ?
C23 Ru2 C3 C4 -125.9(8) . . . . ?
C31 Ru2 C3 C4 53.9(7) . . . . ?
C21 Ru2 C3 C4 -37.0(5) . . . . ?
C1 Ru2 C3 C4 -79.6(6) . . . . ?
C2 Ru2 C3 C4 -118.0(8) . . . . ?
Ru5 Ru2 C3 C4 140.5(5) . . . . ?
Ru3 Ru2 C3 C4 -173.0(5) . . . . ?
Ru4 Ru2 C3 C4 125.2(6) . . . . ?
Ru1 Ru2 C3 C4 -23.5(5) . . . . ?
C2 C3 C3A C3B 24.0(16) . . . . ?
C4 C3 C3A C3B -161.1(10) . . . . ?
Ru2 C3 C3A C3B -71.2(13) . . . . ?
C2 C3 C3A Ru4 88.1(10) . . . . ?
C4 C3 C3A Ru4 -97.1(9) . . . . ?
Ru2 C3 C3A Ru4 -7.1(8) . . . . ?
C29 Ru4 C3A C3B -48.3(9) . . . . ?
C30 Ru4 C3A C3B -139.0(7) . . . . ?
C2C Ru4 C3A C3B 30.8(6) . . . . ?
Ru5 Ru4 C3A C3B 112.9(6) . . . . ?
Ru2 Ru4 C3A C3B 134.6(6) . . . . ?
Ru3 Ru4 C3A C3B 75.6(6) . . . . ?
C29 Ru4 C3A C3 -178.3(7) . . . . ?
C30 Ru4 C3A C3 91.0(7) . . . . ?
C3B Ru4 C3A C3 -130.0(9) . . . . ?
C2C Ru4 C3A C3 -99.2(7) . . . . ?
Ru5 Ru4 C3A C3 -17.1(8) . . . . ?
Ru2 Ru4 C3A C3 4.6(5) . . . . ?
Ru3 Ru4 C3A C3 -54.4(6) . . . . ?
C3 C3A C3B C2C 5.2(16) . . . . ?
Ru4 C3A C3B C2C -66.5(9) . . . . ?
C3 C3A C3B Ru4 71.7(9) . . . . ?
C2B C2C C3B C3A -53.9(14) . . . . ?
Ru3 C2C C3B C3A 25.2(15) . . . . ?
Ru4 C2C C3B C3A 62.5(9) . . . . ?
C2B C2C C3B Ru4 -116.4(9) . . . . ?
Ru3 C2C C3B Ru4 -37.2(8) . . . . ?
C29 Ru4 C3B C3A 140.7(8) . . . . ?
C30 Ru4 C3B C3A 51.6(8) . . . . ?
C2C Ru4 C3B C3A -128.4(9) . . . . ?
Ru5 Ru4 C3B C3A -119.4(6) . . . . ?
Ru2 Ru4 C3B C3A -49.3(6) . . . . ?
Ru3 Ru4 C3B C3A -104.6(6) . . . . ?
C29 Ru4 C3B C2C -90.9(8) . . . . ?
C30 Ru4 C3B C2C -180.0(6) . . . . ?
C3A Ru4 C3B C2C 128.4(9) . . . . ?
Ru5 Ru4 C3B C2C 8.9(8) . . . . ?
Ru2 Ru4 C3B C2C 79.1(6) . . . . ?
Ru3 Ru4 C3B C2C 23.8(6) . . . . ?
C2 C3 C4 C21 -1.7(10) . . . . ?
C3A C3 C4 C21 -177.4(9) . . . . ?
Ru2 C3 C4 C21 59.2(7) . . . . ?
C2 C3 C4 C5 176.6(9) . . . . ?
C3A C3 C4 C5 0.9(16) . . . . ?
Ru2 C3 C4 C5 -122.5(10) . . . . ?
C2 C3 C4 Ru2 -60.9(6) . . . . ?
C3A C3 C4 Ru2 123.4(9) . . . . ?
C23 Ru2 C4 C21 0.3(9) . . . . ?
C31 Ru2 C4 C21 104.4(6) . . . . ?
C1 Ru2 C4 C21 -39.6(5) . . . . ?
C2 Ru2 C4 C21 -81.7(6) . . . . ?
C3 Ru2 C4 C21 -117.9(7) . . . . ?
Ru5 Ru2 C4 C21 -176.3(4) . . . . ?
Ru3 Ru2 C4 C21 -110.3(5) . . . . ?
Ru4 Ru2 C4 C21 -162.2(5) . . . . ?
Ru1 Ru2 C4 C21 36.6(4) . . . . ?
C23 Ru2 C4 C5 -117.6(9) . . . . ?
C31 Ru2 C4 C5 -13.6(9) . . . . ?
C21 Ru2 C4 C5 -118.0(10) . . . . ?
C1 Ru2 C4 C5 -157.5(9) . . . . ?
C2 Ru2 C4 C5 160.3(9) . . . . ?
C3 Ru2 C4 C5 124.2(10) . . . . ?
Ru5 Ru2 C4 C5 65.8(8) . . . . ?
Ru3 Ru2 C4 C5 131.8(7) . . . . ?
Ru4 Ru2 C4 C5 79.8(8) . . . . ?
Ru1 Ru2 C4 C5 -81.4(7) . . . . ?
C23 Ru2 C4 C3 118.2(8) . . . . ?
C31 Ru2 C4 C3 -137.8(6) . . . . ?
C21 Ru2 C4 C3 117.9(8) . . . . ?
C1 Ru2 C4 C3 78.3(6) . . . . ?
C2 Ru2 C4 C3 36.1(6) . . . . ?
Ru5 Ru2 C4 C3 -58.4(6) . . . . ?
Ru3 Ru2 C4 C3 7.6(6) . . . . ?
Ru4 Ru2 C4 C3 -44.3(5) . . . . ?
Ru1 Ru2 C4 C3 154.4(6) . . . . ?
C21 C4 C5 C6 -27.3(15) . . . . ?
C3 C4 C5 C6 154.6(10) . . . . ?
Ru2 C4 C5 C6 57.6(12) . . . . ?
C21 C4 C5 C5A 146.6(9) . . . . ?
C3 C4 C5 C5A -31.4(14) . . . . ?
Ru2 C4 C5 C5A -128.4(8) . . . . ?
C6 C5 C5A C5F -62.6(14) . . . . ?
C4 C5 C5A C5F 123.4(10) . . . . ?
C6 C5 C5A C5B 118.5(10) . . . . ?
C4 C5 C5A C5B -55.6(12) . . . . ?
C5F C5A C5B C5C -0.6(14) . . . . ?
C5 C5A C5B C5C 178.4(9) . . . . ?
C5A C5B C5C C5D -0.4(14) . . . . ?
C5B C5C C5D C5E 0.0(14) . . . . ?
C5C C5D C5E C5F 1.3(15) . . . . ?
C5B C5A C5F C5E 2.0(14) . . . . ?
C5 C5A C5F C5E -177.0(9) . . . . ?
C5D C5E C5F C5A -2.4(15) . . . . ?
C4 C5 C6 N22 0.2(16) . . . . ?
C5A C5 C6 N22 -173.7(9) . . . . ?
C4 C5 C6 C7 -174.0(10) . . . . ?
C5A C5 C6 C7 12.2(16) . . . . ?
C9 N22 C6 C5 -170.6(10) . . . . ?
Ru1 N22 C6 C5 21.3(15) . . . . ?
C9 N22 C6 C7 4.4(11) . . . . ?
Ru1 N22 C6 C7 -163.7(7) . . . . ?
C5 C6 C7 C8 170.9(11) . . . . ?
N22 C6 C7 C8 -4.0(12) . . . . ?
C6 C7 C8 C9 2.0(12) . . . . ?
C6 N22 C9 C10 176.8(10) . . . . ?
Ru1 N22 C9 C10 -15.1(14) . . . . ?
C6 N22 C9 C8 -3.2(11) . . . . ?
Ru1 N22 C9 C8 164.9(7) . . . . ?
C7 C8 C9 N22 0.8(12) . . . . ?
C7 C8 C9 C10 -179.2(10) . . . . ?
N22 C9 C10 C11 4.9(16) . . . . ?
C8 C9 C10 C11 -175.1(10) . . . . ?
N22 C9 C10 C10A -178.6(9) . . . . ?
C8 C9 C10 C10A 1.4(14) . . . . ?
C11 C10 C10A C10B -118.2(11) . . . . ?
C9 C10 C10A C10B 65.0(13) . . . . ?
C11 C10 C10A C10F 61.9(14) . . . . ?
C9 C10 C10A C10F -114.8(11) . . . . ?
C10F C10A C10B C10C 2.9(15) . . . . ?
C10 C10A C10B C10C -176.9(10) . . . . ?
C10A C10B C10C C10D -1.8(16) . . . . ?
C10B C10C C10D C10E 0.2(17) . . . . ?
C10C C10D C10E C10F 0.2(18) . . . . ?
C10D C10E C10F C10A 0.9(18) . . . . ?
C10B C10A C10F C10E -2.5(16) . . . . ?
C10 C10A C10F C10E 177.3(10) . . . . ?
C14 N23 C11 C10 173.0(9) . . . . ?
Ru1 N23 C11 C10 -0.4(14) . . . . ?
C14 N23 C11 C12 -4.5(11) . . . . ?
Ru1 N23 C11 C12 -178.0(7) . . . . ?
C9 C10 C11 N23 3.4(16) . . . . ?
C10A C10 C11 N23 -173.0(9) . . . . ?
C9 C10 C11 C12 -179.4(10) . . . . ?
C10A C10 C11 C12 4.2(15) . . . . ?
N23 C11 C12 C13 2.5(12) . . . . ?
C10 C11 C12 C13 -175.0(10) . . . . ?
C11 C12 C13 C14 0.4(11) . . . . ?
C11 N23 C14 C15 -173.9(10) . . . . ?
Ru1 N23 C14 C15 -0.2(14) . . . . ?
C11 N23 C14 C13 4.7(10) . . . . ?
Ru1 N23 C14 C13 178.4(6) . . . . ?
C12 C13 C14 C15 175.5(10) . . . . ?
C12 C13 C14 N23 -3.2(11) . . . . ?
N23 C14 C15 C16 -3.9(16) . . . . ?
C13 C14 C15 C16 177.7(10) . . . . ?
N23 C14 C15 C15A 174.1(9) . . . . ?
C13 C14 C15 C15A -4.3(15) . . . . ?
C14 C15 C15A C15B -67.8(13) . . . . ?
C16 C15 C15A C15B 110.3(11) . . . . ?
C14 C15 C15A C15F 108.7(11) . . . . ?
C16 C15 C15A C15F -73.1(12) . . . . ?
C15F C15A C15B C15C 2.1(15) . . . . ?
C15 C15A C15B C15C 178.7(9) . . . . ?
C15A C15B C15C C15D -0.9(16) . . . . ?
C15B C15C C15D C15E -0.5(15) . . . . ?
C15C C15D C15E C15F 0.7(16) . . . . ?
C15B C15A C15F C15E -1.9(15) . . . . ?
C15 C15A C15F C15E -178.5(9) . . . . ?
C15D C15E C15F C15A 0.5(16) . . . . ?
C19 N24 C16 C15 -173.6(10) . . . . ?
Ru1 N24 C16 C15 18.4(14) . . . . ?
C19 N24 C16 C17 4.3(11) . . . . ?
Ru1 N24 C16 C17 -163.7(7) . . . . ?
C14 C15 C16 N24 -5.9(17) . . . . ?
C15A C15 C16 N24 176.0(9) . . . . ?
C14 C15 C16 C17 176.5(10) . . . . ?
C15A C15 C16 C17 -1.6(14) . . . . ?
N24 C16 C17 C18 -1.8(12) . . . . ?
C15 C16 C17 C18 176.1(10) . . . . ?
C16 C17 C18 C19 -1.4(11) . . . . ?
C16 N24 C19 C20 171.6(10) . . . . ?
Ru1 N24 C19 C20 -20.5(14) . . . . ?
C16 N24 C19 C18 -5.0(11) . . . . ?
Ru1 N24 C19 C18 162.9(7) . . . . ?
C17 C18 C19 C20 -172.5(10) . . . . ?
C17 C18 C19 N24 4.0(11) . . . . ?
N24 C19 C20 C1 1.7(16) . . . . ?
C18 C19 C20 C1 177.7(10) . . . . ?
N24 C19 C20 C20A 179.4(9) . . . . ?
C18 C19 C20 C20A -4.7(15) . . . . ?
C21 C1 C20 C19 25.5(15) . . . . ?
C2 C1 C20 C19 -157.3(10) . . . . ?
Ru2 C1 C20 C19 -59.4(13) . . . . ?
C21 C1 C20 C20A -152.1(9) . . . . ?
C2 C1 C20 C20A 25.1(15) . . . . ?
Ru2 C1 C20 C20A 122.9(8) . . . . ?
C19 C20 C20A C20B 62.6(14) . . . . ?
C1 C20 C20A C20B -119.7(11) . . . . ?
C19 C20 C20A C20F -112.3(11) . . . . ?
C1 C20 C20A C20F 65.4(13) . . . . ?
C20F C20A C20B C20C -2.9(16) . . . . ?
C20 C20A C20B C20C -177.8(10) . . . . ?
C20A C20B C20C C20D 2.6(17) . . . . ?
C20B C20C C20D C20E -0.2(18) . . . . ?
C20C C20D C20E C20F -1.7(18) . . . . ?
C20B C20A C20F C20E 0.8(15) . . . . ?
C20 C20A C20F C20E 175.9(10) . . . . ?
C20D C20E C20F C20A 1.4(16) . . . . ?
C2 C1 C21 C4 -5.4(11) . . . . ?
C20 C1 C21 C4 172.3(9) . . . . ?
Ru2 C1 C21 C4 -69.7(7) . . . . ?
C2 C1 C21 Ru1 151.1(7) . . . . ?
C20 C1 C21 Ru1 -31.3(14) . . . . ?
Ru2 C1 C21 Ru1 86.8(7) . . . . ?
C2 C1 C21 Ru2 64.3(7) . . . . ?
C20 C1 C21 Ru2 -118.0(9) . . . . ?
C5 C4 C21 C1 -174.0(9) . . . . ?
C3 C4 C21 C1 4.3(11) . . . . ?
Ru2 C4 C21 C1 68.5(7) . . . . ?
C5 C4 C21 Ru1 28.9(13) . . . . ?
C3 C4 C21 Ru1 -152.7(7) . . . . ?
Ru2 C4 C21 Ru1 -88.5(7) . . . . ?
C5 C4 C21 Ru2 117.5(9) . . . . ?
C3 C4 C21 Ru2 -64.2(7) . . . . ?
C22 Ru1 C21 C1 107.5(9) . . . . ?
N24 Ru1 C21 C1 12.3(9) . . . . ?
N22 Ru1 C21 C1 -161.0(9) . . . . ?
N23 Ru1 C21 C1 -74.9(18) . . . . ?
Ru2 Ru1 C21 C1 -75.5(8) . . . . ?
C22 Ru1 C21 C4 -99.4(9) . . . . ?
N24 Ru1 C21 C4 165.4(8) . . . . ?
N22 Ru1 C21 C4 -7.9(8) . . . . ?
N23 Ru1 C21 C4 78.2(17) . . . . ?
Ru2 Ru1 C21 C4 77.6(8) . . . . ?
C22 Ru1 C21 Ru2 -177.0(4) . . . . ?
N24 Ru1 C21 Ru2 87.7(4) . . . . ?
N22 Ru1 C21 Ru2 -85.5(4) . . . . ?
N23 Ru1 C21 Ru2 0.5(17) . . . . ?
C23 Ru2 C21 C1 67.0(6) . . . . ?
C31 Ru2 C21 C1 162.1(6) . . . . ?
C4 Ru2 C21 C1 -113.2(7) . . . . ?
C2 Ru2 C21 C1 -36.1(5) . . . . ?
C3 Ru2 C21 C1 -76.6(6) . . . . ?
Ru3 Ru2 C21 C1 -23.6(6) . . . . ?
Ru4 Ru2 C21 C1 -93.4(5) . . . . ?
Ru1 Ru2 C21 C1 124.6(7) . . . . ?
C23 Ru2 C21 C4 -179.8(5) . . . . ?
C31 Ru2 C21 C4 -84.7(6) . . . . ?
C1 Ru2 C21 C4 113.2(7) . . . . ?
C2 Ru2 C21 C4 77.1(5) . . . . ?
C3 Ru2 C21 C4 36.6(5) . . . . ?
Ru3 Ru2 C21 C4 89.6(5) . . . . ?
Ru4 Ru2 C21 C4 19.8(5) . . . . ?
Ru1 Ru2 C21 C4 -122.2(6) . . . . ?
C23 Ru2 C21 Ru1 -57.6(5) . . . . ?
C31 Ru2 C21 Ru1 37.6(5) . . . . ?
C1 Ru2 C21 Ru1 -124.6(7) . . . . ?
C4 Ru2 C21 Ru1 122.2(6) . . . . ?
C2 Ru2 C21 Ru1 -160.7(5) . . . . ?
C3 Ru2 C21 Ru1 158.9(5) . . . . ?
Ru3 Ru2 C21 Ru1 -148.14(19) . . . . ?
Ru4 Ru2 C21 Ru1 142.0(2) . . . . ?
C33 C34 C35 C38 176.6(16) . . . . ?
C38 C35 C36 C37 -179.4(13) . . . . ?

_diffrn_measured_fraction_theta_max 0.994
_diffrn_reflns_theta_full        25.50
_diffrn_measured_fraction_theta_full 0.995
_refine_diff_density_max         2.379
_refine_diff_density_min         -1.226
_refine_diff_density_rms         0.220
_database_code_depnum_ccdc_archive 'CCDC 1006125'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_4

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C59 H31 N3 Ni O9 Ru4'
_chemical_formula_weight         1388.86

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'
Ni Ni 0.3393 1.1124 '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'

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   9.461(3)
_cell_length_b                   12.465(3)
_cell_length_c                   22.653(5)
_cell_angle_alpha                98.26(3)
_cell_angle_beta                 100.04(3)
_cell_angle_gamma                105.21(4)
_cell_volume                     2487.5(13)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      2.96
_cell_measurement_theta_max      36.81

_exptl_crystal_description       block
_exptl_crystal_colour            'dark brown'
_exptl_crystal_size_max          0.66
_exptl_crystal_size_mid          0.23
_exptl_crystal_size_min          0.16
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.854
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1364
_exptl_absorpt_coefficient_mu    1.622
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_correction_T_min  0.531
_exptl_absorpt_correction_T_max  0.813
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
Analytical numeric absorption correction using a multifaceted crystal
			model based on expressions derived by R.C. Clark & J.S. Reid.
(Clark, R. C. & Reid, J. S. (1995). Acta Cryst. A51, 887-897)
;

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'Enhance (Mo) X-ray Source'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Xcalibur, Sapphire2, large Be window'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean 8.34
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            22724
_diffrn_reflns_av_R_equivalents  0.0259
_diffrn_reflns_av_sigmaI/netI    0.0317
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         2.96
_diffrn_reflns_theta_max         26.00
_reflns_number_total             9759
_reflns_number_gt                8976
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0488P)²+3.9967P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         9759
_refine_ls_number_parameters     685
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0352
_refine_ls_R_factor_gt           0.0320
_refine_ls_wR_factor_ref         0.0873
_refine_ls_wR_factor_gt          0.0844
_refine_ls_goodness_of_fit_ref   1.039
_refine_ls_restrained_S_all      1.039
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
Ni1 Ni 0.51622(4) 0.90208(3) 0.316619(17) 0.01360(9) Uani 1 1 d . . .
Ru1 Ru 0.72795(3) 0.96381(2) 0.216996(11) 0.01303(7) Uani 1 1 d . . .
Ru2 Ru 0.87970(3) 1.13873(2) 0.159775(11) 0.01590(7) Uani 1 1 d . . .
Ru3 Ru 0.78234(3) 0.90426(2) 0.098678(11) 0.01560(7) Uani 1 1 d . . .
Ru4 Ru 1.02227(3) 0.98835(2) 0.192625(12) 0.01792(7) Uani 1 1 d . . .
N22 N 0.4039(3) 0.7501(2) 0.27488(12) 0.0150(5) Uani 1 1 d . . .
N23 N 0.5516(3) 0.8496(2) 0.39363(12) 0.0172(5) Uani 1 1 d . . .
N24 N 0.6115(3) 1.0562(2) 0.35943(12) 0.0159(5) Uani 1 1 d . . .
C1 C 0.5631(3) 1.0652(2) 0.23033(14) 0.0139(6) Uani 1 1 d . . .
C2 C 0.5883(3) 1.0652(3) 0.16833(14) 0.0156(6) Uani 1 1 d . . .
C2A C 0.6472(4) 1.1645(3) 0.14356(14) 0.0161(6) Uani 1 1 d . . .
H2A H 0.6480 1.2358 0.1653 0.019 Uiso 1 1 calc R . .
C2B C 0.7029(4) 1.1636(3) 0.09051(15) 0.0188(7) Uani 1 1 d . . .
H2B H 0.7251 1.2322 0.0756 0.023 Uiso 1 1 calc R . .
C2C C 0.7293(4) 1.0661(3) 0.05655(14) 0.0182(6) Uani 1 1 d . . .
H2C H 0.7857 1.0811 0.0262 0.022 Uiso 1 1 d R . .
C3 C 0.5352(3) 0.9466(3) 0.13658(14) 0.0153(6) Uani 1 1 d . . .
C3A C 0.5358(4) 0.8996(3) 0.07371(14) 0.0161(6) Uani 1 1 d . . .
H3A H 0.4738 0.8242 0.0570 0.019 Uiso 1 1 calc R . .
C3B C 0.6187(4) 0.9549(3) 0.03621(14) 0.0171(6) Uani 1 1 d . . .
H3B H 0.6021 0.9179 -0.0052 0.021 Uiso 1 1 calc R . .
C4 C 0.4763(3) 0.8801(3) 0.17995(14) 0.0146(6) Uani 1 1 d . . .
C5 C 0.3905(3) 0.7618(3) 0.16596(14) 0.0148(6) Uani 1 1 d . . .
C5A C 0.3207(4) 0.6975(3) 0.10201(14) 0.0170(6) Uani 1 1 d . . .
C5B C 0.2007(4) 0.7215(3) 0.06718(15) 0.0213(7) Uani 1 1 d . . .
H5B H 0.1655 0.7816 0.0833 0.026 Uiso 1 1 calc R . .
C5C C 0.1327(4) 0.6577(3) 0.00905(16) 0.0260(8) Uani 1 1 d . . .
H5C H 0.0499 0.6737 -0.0144 0.031 Uiso 1 1 calc R . .
C5D C 0.1842(5) 0.5704(3) -0.01529(16) 0.0299(8) Uani 1 1 d . . .
H5D H 0.1386 0.5281 -0.0556 0.036 Uiso 1 1 calc R . .
C5E C 0.3021(5) 0.5454(3) 0.01931(17) 0.0336(9) Uani 1 1 d . . .
H5E H 0.3372 0.4853 0.0029 0.040 Uiso 1 1 calc R . .
C5F C 0.3698(4) 0.6076(3) 0.07795(16) 0.0245(7) Uani 1 1 d . . .
H5F H 0.4497 0.5891 0.1018 0.029 Uiso 1 1 calc R . .
C6 C 0.3522(4) 0.7079(3) 0.21191(14) 0.0163(6) Uani 1 1 d . . .
C7 C 0.2488(4) 0.5944(3) 0.20118(15) 0.0194(7) Uani 1 1 d . . .
H7 H 0.1959 0.5482 0.1625 0.023 Uiso 1 1 calc R . .
C8 C 0.2418(4) 0.5670(3) 0.25583(15) 0.0195(7) Uani 1 1 d . . .
H8 H 0.1823 0.4982 0.2633 0.023 Uiso 1 1 calc R . .
C9 C 0.3429(4) 0.6628(3) 0.30153(15) 0.0172(6) Uani 1 1 d . . .
C10 C 0.3810(4) 0.6570(3) 0.36283(15) 0.0193(7) Uani 1 1 d . . .
C10A C 0.3055(4) 0.5527(3) 0.38446(15) 0.0230(7) Uani 1 1 d . . .
C10B C 0.3639(5) 0.4599(3) 0.38113(17) 0.0300(8) Uani 1 1 d . . .
H10B H 0.4498 0.4621 0.3644 0.036 Uiso 1 1 calc R . .
C10C C 0.2952(5) 0.3650(3) 0.40241(18) 0.0370(10) Uani 1 1 d . . .
H10C H 0.3351 0.3025 0.4009 0.044 Uiso 1 1 calc R . .
C10D C 0.1692(6) 0.3611(3) 0.42573(18) 0.0429(11) Uani 1 1 d . . .
H10D H 0.1225 0.2957 0.4401 0.051 Uiso 1 1 calc R . .
C10E C 0.1105(5) 0.4513(4) 0.42840(19) 0.0419(11) Uani 1 1 d . . .
H10E H 0.0233 0.4478 0.4443 0.050 Uiso 1 1 calc R . .
C10F C 0.1790(5) 0.5477(3) 0.40768(16) 0.0311(8) Uani 1 1 d . . .
H10F H 0.1386 0.6099 0.4096 0.037 Uiso 1 1 calc R . .
C11 C 0.4899(4) 0.7441(3) 0.40432(15) 0.0195(7) Uani 1 1 d . . .
C12 C 0.5537(4) 0.7355(3) 0.46605(15) 0.0230(7) Uani 1 1 d . . .
H12 H 0.5290 0.6710 0.4843 0.028 Uiso 1 1 calc R . .
C13 C 0.6545(4) 0.8365(3) 0.49226(15) 0.0222(7) Uani 1 1 d . . .
H13 H 0.7180 0.8564 0.5320 0.027 Uiso 1 1 calc R . .
C14 C 0.6475(4) 0.9093(3) 0.44808(14) 0.0189(7) Uani 1 1 d . . .
C15 C 0.7106(4) 1.0255(3) 0.46154(15) 0.0185(7) Uani 1 1 d . . .
C15A C 0.8084(4) 1.0840(3) 0.52317(14) 0.0190(7) Uani 1 1 d . . .
C15B C 0.7493(4) 1.0841(3) 0.57512(15) 0.0229(7) Uani 1 1 d . . .
H15B H 0.6476 1.0428 0.5720 0.027 Uiso 1 1 calc R . .
C15C C 0.8388(5) 1.1444(3) 0.63166(16) 0.0291(8) Uani 1 1 d . . .
H15C H 0.7980 1.1440 0.6671 0.035 Uiso 1 1 calc R . .
C15D C 0.9858(5) 1.2045(3) 0.63647(16) 0.0303(8) Uani 1 1 d . . .
H15D H 1.0458 1.2470 0.6750 0.036 Uiso 1 1 calc R . .
C15E C 1.0465(4) 1.2032(3) 0.58515(18) 0.0332(9) Uani 1 1 d . . .
H15E H 1.1488 1.2436 0.5886 0.040 Uiso 1 1 calc R . .
C15F C 0.9578(4) 1.1428(3) 0.52855(16) 0.0265(8) Uani 1 1 d . . .
H15F H 0.9998 1.1418 0.4934 0.032 Uiso 1 1 calc R . .
C16 C 0.6767(4) 1.0933(3) 0.42002(14) 0.0174(6) Uani 1 1 d . . .
C17 C 0.7025(4) 1.2142(3) 0.43792(15) 0.0204(7) Uani 1 1 d . . .
H17 H 0.7455 1.2587 0.4779 0.024 Uiso 1 1 calc R . .
C18 C 0.6550(4) 1.2517(3) 0.38825(15) 0.0202(7) Uani 1 1 d . . .
H18 H 0.6523 1.3268 0.3866 0.024 Uiso 1 1 calc R . .
C19 C 0.6084(4) 1.1564(3) 0.33735(14) 0.0160(6) Uani 1 1 d . . .
C20 C 0.5908(3) 1.1653(3) 0.27738(14) 0.0150(6) Uani 1 1 d . . .
C20A C 0.5891(4) 1.2771(3) 0.26143(14) 0.0169(6) Uani 1 1 d . . .
C20B C 0.4593(4) 1.2867(3) 0.22585(16) 0.0221(7) Uani 1 1 d . . .
H20B H 0.3733 1.2222 0.2120 0.027 Uiso 1 1 calc R . .
C20C C 0.4537(4) 1.3893(3) 0.21035(18) 0.0314(9) Uani 1 1 d . . .
H20C H 0.3645 1.3949 0.1858 0.038 Uiso 1 1 calc R . .
C20D C 0.5776(5) 1.4830(3) 0.2306(2) 0.0427(11) Uani 1 1 d . . .
H20D H 0.5737 1.5535 0.2201 0.051 Uiso 1 1 calc R . .
C20E C 0.7076(5) 1.4755(3) 0.2661(2) 0.0374(10) Uani 1 1 d . . .
H20E H 0.7928 1.5407 0.2798 0.045 Uiso 1 1 calc R . .
C20F C 0.7143(4) 1.3726(3) 0.28165(16) 0.0248(7) Uani 1 1 d . . .
H20F H 0.8039 1.3676 0.3060 0.030 Uiso 1 1 calc R . .
C21 C 0.5044(3) 0.9518(3) 0.23994(14) 0.0152(6) Uani 1 1 d . . .
C22 C 0.8711(4) 1.0354(3) 0.29086(15) 0.0195(7) Uani 1 1 d . . .
O22 O 0.9397(3) 1.0782(2) 0.33924(11) 0.0278(6) Uani 1 1 d . . .
C23 C 0.9713(4) 1.2385(3) 0.23454(15) 0.0223(7) Uani 1 1 d . . .
O23 O 1.0319(3) 1.3018(2) 0.27936(12) 0.0311(6) Uani 1 1 d . . .
C24 C 1.0312(4) 1.2270(3) 0.13058(15) 0.0249(8) Uani 1 1 d . . .
O24 O 1.1254(3) 1.2853(3) 0.11431(12) 0.0387(7) Uani 1 1 d . . .
C25 C 0.8944(4) 0.8862(3) 0.04080(15) 0.0223(7) Uani 1 1 d . . .
O25 O 0.9639(3) 0.8727(2) 0.00523(12) 0.0334(6) Uani 1 1 d . . .
C26 C 0.7562(4) 0.7509(3) 0.09865(15) 0.0229(7) Uani 1 1 d . . .
O26 O 0.7462(3) 0.6570(2) 0.09834(12) 0.0332(6) Uani 1 1 d . . .
C27 C 0.7599(4) 0.8258(3) 0.22761(15) 0.0217(7) Uani 1 1 d . . .
O27 O 0.7609(3) 0.7373(2) 0.23541(12) 0.0276(6) Uani 1 1 d . . .
C28 C 1.1671(4) 1.0706(3) 0.26615(16) 0.0244(7) Uani 1 1 d . . .
O28 O 1.2557(3) 1.1152(2) 0.30956(12) 0.0338(6) Uani 1 1 d . . .
C29 C 1.1520(4) 1.0201(3) 0.14027(16) 0.0247(8) Uani 1 1 d . . .
O29 O 1.2349(3) 1.0385(2) 0.10859(12) 0.0303(6) Uani 1 1 d . . .
C30 C 1.0514(4) 0.8455(3) 0.20129(16) 0.0240(7) Uani 1 1 d . . .
O30 O 1.0645(3) 0.7585(2) 0.20553(14) 0.0367(7) Uani 1 1 d . . .


_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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
Ni1 N22 1.921(3) . ?
Ni1 C21 1.921(3) . ?
Ni1 N24 1.922(3) . ?
Ni1 N23 1.955(3) . ?
Ru1 C27 1.864(3) . ?
Ru1 C22 1.891(3) . ?
Ru1 C21 2.237(3) . ?
Ru1 C4 2.283(3) . ?
Ru1 C1 2.283(3) . ?
Ru1 C3 2.284(3) . ?
Ru1 C2 2.308(3) . ?
Ru1 Ru3 2.8477(7) . ?
Ru1 Ru4 2.8792(10) . ?
Ru1 Ru2 2.8833(11) . ?
Ru2 C24 1.848(4) . ?
Ru2 C23 1.867(4) . ?
Ru2 C2B 2.203(3) . ?
Ru2 C2A 2.280(3) . ?
Ru2 C2C 2.422(3) . ?
Ru2 Ru4 2.6952(9) . ?
Ru2 Ru3 2.8786(12) . ?
Ru3 C25 1.849(4) . ?
Ru3 C26 1.862(4) . ?
Ru3 C3B 2.192(3) . ?
Ru3 C3A 2.285(3) . ?
Ru3 C2C 2.480(3) . ?
Ru3 Ru4 2.6845(13) . ?
Ru4 C29 1.860(4) . ?
Ru4 C30 1.904(4) . ?
Ru4 C28 1.918(4) . ?
N22 C9 1.365(4) . ?
N22 C6 1.399(4) . ?
N23 C11 1.367(4) . ?
N23 C14 1.375(4) . ?
N24 C16 1.360(4) . ?
N24 C19 1.416(4) . ?
C1 C21 1.440(4) . ?
C1 C20 1.452(4) . ?
C1 C2 1.465(4) . ?
C2 C2A 1.451(4) . ?
C2 C3 1.460(4) . ?
C2A C2B 1.394(5) . ?
C2A H2A 0.9500 . ?
C2B C2C 1.445(5) . ?
C2B H2B 0.9500 . ?
C2C C3B 1.455(5) . ?
C2C H2C 0.9501 . ?
C3 C3A 1.462(4) . ?
C3 C4 1.465(4) . ?
C3A C3B 1.388(5) . ?
C3A H3A 0.9500 . ?
C3B H3B 0.9500 . ?
C4 C5 1.443(4) . ?
C4 C21 1.455(4) . ?
C5 C6 1.368(4) . ?
C5 C5A 1.494(4) . ?
C5A C5B 1.391(5) . ?
C5A C5F 1.397(5) . ?
C5B C5C 1.384(5) . ?
C5B H5B 0.9500 . ?
C5C C5D 1.388(6) . ?
C5C H5C 0.9500 . ?
C5D C5E 1.379(6) . ?
C5D H5D 0.9500 . ?
C5E C5F 1.387(5) . ?
C5E H5E 0.9500 . ?
C5F H5F 0.9500 . ?
C6 C7 1.452(4) . ?
C7 C8 1.339(5) . ?
C7 H7 0.9500 . ?
C8 C9 1.453(4) . ?
C8 H8 0.9500 . ?
C9 C10 1.390(5) . ?
C10 C11 1.381(5) . ?
C10 C10A 1.502(5) . ?
C10A C10F 1.379(6) . ?
C10A C10B 1.405(5) . ?
C10B C10C 1.386(5) . ?
C10B H10B 0.9500 . ?
C10C C10D 1.378(7) . ?
C10C H10C 0.9500 . ?
C10D C10E 1.376(7) . ?
C10D H10D 0.9500 . ?
C10E C10F 1.395(6) . ?
C10E H10E 0.9500 . ?
C10F H10F 0.9500 . ?
C11 C12 1.454(5) . ?
C12 C13 1.344(5) . ?
C12 H12 0.9500 . ?
C13 C14 1.449(5) . ?
C13 H13 0.9500 . ?
C14 C15 1.379(5) . ?
C15 C16 1.403(5) . ?
C15 C15A 1.497(4) . ?
C15A C15F 1.386(5) . ?
C15A C15B 1.388(5) . ?
C15B C15C 1.390(5) . ?
C15B H15B 0.9500 . ?
C15C C15D 1.373(6) . ?
C15C H15C 0.9500 . ?
C15D C15E 1.383(6) . ?
C15D H15D 0.9500 . ?
C15E C15F 1.389(5) . ?
C15E H15E 0.9500 . ?
C15F H15F 0.9500 . ?
C16 C17 1.446(4) . ?
C17 C18 1.331(5) . ?
C17 H17 0.9500 . ?
C18 C19 1.446(4) . ?
C18 H18 0.9500 . ?
C19 C20 1.364(4) . ?
C20 C20A 1.493(4) . ?
C20A C20B 1.390(5) . ?
C20A C20F 1.395(5) . ?
C20B C20C 1.385(5) . ?
C20B H20B 0.9500 . ?
C20C C20D 1.374(6) . ?
C20C H20C 0.9500 . ?
C20D C20E 1.380(6) . ?
C20D H20D 0.9500 . ?
C20E C20F 1.392(5) . ?
C20E H20E 0.9500 . ?
C20F H20F 0.9500 . ?
C22 O22 1.144(4) . ?
C23 O23 1.145(4) . ?
C24 O24 1.145(4) . ?
C25 O25 1.146(4) . ?
C26 O26 1.148(4) . ?
C27 O27 1.145(4) . ?
C28 O28 1.136(4) . ?
C29 O29 1.154(5) . ?
C30 O30 1.138(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
N22 Ni1 C21 90.39(12) . . ?
N22 Ni1 N24 174.76(11) . . ?
C21 Ni1 N24 90.00(12) . . ?
N22 Ni1 N23 90.28(11) . . ?
C21 Ni1 N23 173.16(12) . . ?
N24 Ni1 N23 89.96(11) . . ?
C27 Ru1 C22 89.10(15) . . ?
C27 Ru1 C21 103.94(14) . . ?
C22 Ru1 C21 105.30(13) . . ?
C27 Ru1 C4 91.95(14) . . ?
C22 Ru1 C4 141.55(13) . . ?
C21 Ru1 C4 37.54(11) . . ?
C27 Ru1 C1 140.79(14) . . ?
C22 Ru1 C1 96.95(13) . . ?
C21 Ru1 C1 37.13(11) . . ?
C4 Ru1 C1 60.09(11) . . ?
C27 Ru1 C3 113.50(13) . . ?
C22 Ru1 C3 156.45(13) . . ?
C21 Ru1 C3 64.22(11) . . ?
C4 Ru1 C3 37.43(11) . . ?
C1 Ru1 C3 61.57(11) . . ?
C27 Ru1 C2 150.31(13) . . ?
C22 Ru1 C2 119.72(13) . . ?
C21 Ru1 C2 63.83(12) . . ?
C4 Ru1 C2 61.47(11) . . ?
C1 Ru1 C2 37.22(11) . . ?
C3 Ru1 C2 37.08(11) . . ?
C27 Ru1 Ru3 83.92(11) . . ?
C22 Ru1 Ru3 127.81(11) . . ?
C21 Ru1 Ru3 126.61(9) . . ?
C4 Ru1 Ru3 90.47(8) . . ?
C1 Ru1 Ru3 120.12(8) . . ?
C3 Ru1 Ru3 64.39(8) . . ?
C2 Ru1 Ru3 83.36(8) . . ?
C27 Ru1 Ru4 77.29(12) . . ?
C22 Ru1 Ru4 72.08(11) . . ?
C21 Ru1 Ru4 177.16(8) . . ?
C4 Ru1 Ru4 145.25(8) . . ?
C1 Ru1 Ru4 141.33(8) . . ?
C3 Ru1 Ru4 117.77(8) . . ?
C2 Ru1 Ru4 116.31(8) . . ?
Ru3 Ru1 Ru4 55.90(3) . . ?
C27 Ru1 Ru2 131.20(11) . . ?
C22 Ru1 Ru2 88.54(11) . . ?
C21 Ru1 Ru2 123.59(9) . . ?
C4 Ru1 Ru2 118.21(9) . . ?
C1 Ru1 Ru2 87.79(8) . . ?
C3 Ru1 Ru2 81.49(9) . . ?
C2 Ru1 Ru2 62.00(8) . . ?
Ru3 Ru1 Ru2 60.30(3) . . ?
Ru4 Ru1 Ru2 55.77(3) . . ?
C24 Ru2 C23 85.02(15) . . ?
C24 Ru2 C2B 92.46(14) . . ?
C23 Ru2 C2B 124.17(14) . . ?
C24 Ru2 C2A 120.14(14) . . ?
C23 Ru2 C2A 100.72(14) . . ?
C2B Ru2 C2A 36.17(12) . . ?
C24 Ru2 C2C 90.43(13) . . ?
C23 Ru2 C2C 159.59(13) . . ?
C2B Ru2 C2C 36.03(12) . . ?
C2A Ru2 C2C 64.61(11) . . ?
C24 Ru2 Ru4 97.30(12) . . ?
C23 Ru2 Ru4 91.18(11) . . ?
C2B Ru2 Ru4 144.07(9) . . ?
C2A Ru2 Ru4 141.34(8) . . ?
C2C Ru2 Ru4 109.14(8) . . ?
C24 Ru2 Ru3 112.96(11) . . ?
C23 Ru2 Ru3 144.47(11) . . ?
C2B Ru2 Ru3 86.88(9) . . ?
C2A Ru2 Ru3 96.06(9) . . ?
C2C Ru2 Ru3 54.98(8) . . ?
Ru4 Ru2 Ru3 57.47(3) . . ?
C24 Ru2 Ru1 159.22(12) . . ?
C23 Ru2 Ru1 92.87(11) . . ?
C2B Ru2 Ru1 105.65(9) . . ?
C2A Ru2 Ru1 80.59(9) . . ?
C2C Ru2 Ru1 98.21(9) . . ?
Ru4 Ru2 Ru1 62.04(2) . . ?
Ru3 Ru2 Ru1 59.24(2) . . ?
C25 Ru3 C26 85.52(15) . . ?
C25 Ru3 C3B 93.04(14) . . ?
C26 Ru3 C3B 119.47(15) . . ?
C25 Ru3 C3A 122.94(13) . . ?
C26 Ru3 C3A 99.00(14) . . ?
C3B Ru3 C3A 36.05(12) . . ?
C25 Ru3 C2C 88.93(13) . . ?
C26 Ru3 C2C 154.16(13) . . ?
C3B Ru3 C2C 35.62(12) . . ?
C3A Ru3 C2C 63.39(12) . . ?
C25 Ru3 Ru4 94.45(11) . . ?
C26 Ru3 Ru4 97.86(12) . . ?
C3B Ru3 Ru4 142.38(9) . . ?
C3A Ru3 Ru4 139.87(8) . . ?
C2C Ru3 Ru4 107.74(8) . . ?
C25 Ru3 Ru1 157.09(11) . . ?
C26 Ru3 Ru1 97.06(10) . . ?
C3B Ru3 Ru1 105.20(9) . . ?
C3A Ru3 Ru1 79.29(8) . . ?
C2C Ru3 Ru1 97.80(8) . . ?
Ru4 Ru3 Ru1 62.64(3) . . ?
C25 Ru3 Ru2 108.67(11) . . ?
C26 Ru3 Ru2 151.80(10) . . ?
C3B Ru3 Ru2 84.87(9) . . ?
C3A Ru3 Ru2 93.44(9) . . ?
C2C Ru3 Ru2 53.12(8) . . ?
Ru4 Ru3 Ru2 57.83(4) . . ?
Ru1 Ru3 Ru2 60.46(3) . . ?
C29 Ru4 C30 95.73(15) . . ?
C29 Ru4 C28 95.68(15) . . ?
C30 Ru4 C28 94.46(16) . . ?
C29 Ru4 Ru3 92.02(11) . . ?
C30 Ru4 Ru3 95.58(11) . . ?
C28 Ru4 Ru3 166.67(11) . . ?
C29 Ru4 Ru2 92.90(11) . . ?
C30 Ru4 Ru2 158.76(11) . . ?
C28 Ru4 Ru2 103.96(11) . . ?
Ru3 Ru4 Ru2 64.70(3) . . ?
C29 Ru4 Ru1 148.90(11) . . ?
C30 Ru4 Ru1 102.38(11) . . ?
C28 Ru4 Ru1 107.73(11) . . ?
Ru3 Ru4 Ru1 61.45(3) . . ?
Ru2 Ru4 Ru1 62.19(3) . . ?
C9 N22 C6 105.0(3) . . ?
C9 N22 Ni1 126.2(2) . . ?
C6 N22 Ni1 128.4(2) . . ?
C11 N23 C14 105.1(3) . . ?
C11 N23 Ni1 127.3(2) . . ?
C14 N23 Ni1 127.6(2) . . ?
C16 N24 C19 104.3(3) . . ?
C16 N24 Ni1 127.5(2) . . ?
C19 N24 Ni1 127.5(2) . . ?
C21 C1 C20 122.6(3) . . ?
C21 C1 C2 111.7(3) . . ?
C20 C1 C2 125.7(3) . . ?
C21 C1 Ru1 69.71(17) . . ?
C20 C1 Ru1 125.8(2) . . ?
C2 C1 Ru1 72.31(17) . . ?
C2A C2 C3 127.7(3) . . ?
C2A C2 C1 126.1(3) . . ?
C3 C2 C1 106.1(3) . . ?
C2A C2 Ru1 125.9(2) . . ?
C3 C2 Ru1 70.57(17) . . ?
C1 C2 Ru1 70.47(17) . . ?
C2B C2A C2 125.3(3) . . ?
C2B C2A Ru2 68.92(18) . . ?
C2 C2A Ru2 90.78(19) . . ?
C2B C2A H2A 117.4 . . ?
C2 C2A H2A 117.4 . . ?
Ru2 C2A H2A 112.1 . . ?
C2A C2B C2C 124.8(3) . . ?
C2A C2B Ru2 74.91(19) . . ?
C2C C2B Ru2 80.28(19) . . ?
C2A C2B H2B 117.6 . . ?
C2C C2B H2B 117.6 . . ?
Ru2 C2B H2B 117.6 . . ?
C2B C2C C3B 124.2(3) . . ?
C2B C2C Ru2 63.69(17) . . ?
C3B C2C Ru2 124.3(2) . . ?
C2B C2C Ru3 126.0(2) . . ?
C3B C2C Ru3 61.31(17) . . ?
Ru2 C2C Ru3 71.90(9) . . ?
C2B C2C H2C 115.6 . . ?
C3B C2C H2C 109.6 . . ?
Ru2 C2C H2C 112.9 . . ?
Ru3 C2C H2C 108.8 . . ?
C2 C3 C3A 128.4(3) . . ?
C2 C3 C4 106.6(3) . . ?
C3A C3 C4 125.0(3) . . ?
C2 C3 Ru1 72.35(18) . . ?
C3A C3 Ru1 122.2(2) . . ?
C4 C3 Ru1 71.24(17) . . ?
C3B C3A C3 126.1(3) . . ?
C3B C3A Ru3 68.30(18) . . ?
C3 C3A Ru3 92.95(19) . . ?
C3B C3A H3A 117.0 . . ?
C3 C3A H3A 117.0 . . ?
Ru3 C3A H3A 110.5 . . ?
C3A C3B C2C 123.9(3) . . ?
C3A C3B Ru3 75.64(18) . . ?
C2C C3B Ru3 83.06(19) . . ?
C3A C3B H3B 118.1 . . ?
C2C C3B H3B 118.1 . . ?
Ru3 C3B H3B 113.1 . . ?
C5 C4 C21 122.8(3) . . ?
C5 C4 C3 126.3(3) . . ?
C21 C4 C3 110.8(3) . . ?
C5 C4 Ru1 130.1(2) . . ?
C21 C4 Ru1 69.53(17) . . ?
C3 C4 Ru1 71.33(17) . . ?
C6 C5 C4 120.0(3) . . ?
C6 C5 C5A 116.6(3) . . ?
C4 C5 C5A 122.8(3) . . ?
C5B C5A C5F 119.2(3) . . ?
C5B C5A C5 120.7(3) . . ?
C5F C5A C5 120.0(3) . . ?
C5C C5B C5A 120.0(3) . . ?
C5C C5B H5B 120.0 . . ?
C5A C5B H5B 120.0 . . ?
C5B C5C C5D 120.5(4) . . ?
C5B C5C H5C 119.7 . . ?
C5D C5C H5C 119.7 . . ?
C5E C5D C5C 119.7(3) . . ?
C5E C5D H5D 120.2 . . ?
C5C C5D H5D 120.2 . . ?
C5D C5E C5F 120.3(3) . . ?
C5D C5E H5E 119.8 . . ?
C5F C5E H5E 119.8 . . ?
C5E C5F C5A 120.2(4) . . ?
C5E C5F H5F 119.9 . . ?
C5A C5F H5F 119.9 . . ?
C5 C6 N22 127.0(3) . . ?
C5 C6 C7 123.4(3) . . ?
N22 C6 C7 109.6(3) . . ?
C8 C7 C6 107.5(3) . . ?
C8 C7 H7 126.3 . . ?
C6 C7 H7 126.3 . . ?
C7 C8 C9 106.8(3) . . ?
C7 C8 H8 126.6 . . ?
C9 C8 H8 126.6 . . ?
N22 C9 C10 126.4(3) . . ?
N22 C9 C8 111.0(3) . . ?
C10 C9 C8 122.2(3) . . ?
C11 C10 C9 121.4(3) . . ?
C11 C10 C10A 118.9(3) . . ?
C9 C10 C10A 119.6(3) . . ?
C10F C10A C10B 119.8(3) . . ?
C10F C10A C10 120.3(3) . . ?
C10B C10A C10 120.0(3) . . ?
C10C C10B C10A 119.5(4) . . ?
C10C C10B H10B 120.3 . . ?
C10A C10B H10B 120.3 . . ?
C10D C10C C10B 120.2(4) . . ?
C10D C10C H10C 119.9 . . ?
C10B C10C H10C 119.9 . . ?
C10E C10D C10C 120.5(4) . . ?
C10E C10D H10D 119.8 . . ?
C10C C10D H10D 119.8 . . ?
C10D C10E C10F 120.0(4) . . ?
C10D C10E H10E 120.0 . . ?
C10F C10E H10E 120.0 . . ?
C10A C10F C10E 120.0(4) . . ?
C10A C10F H10F 120.0 . . ?
C10E C10F H10F 120.0 . . ?
N23 C11 C10 125.2(3) . . ?
N23 C11 C12 110.7(3) . . ?
C10 C11 C12 124.0(3) . . ?
C13 C12 C11 106.6(3) . . ?
C13 C12 H12 126.7 . . ?
C11 C12 H12 126.7 . . ?
C12 C13 C14 106.6(3) . . ?
C12 C13 H13 126.7 . . ?
C14 C13 H13 126.7 . . ?
N23 C14 C15 124.3(3) . . ?
N23 C14 C13 110.7(3) . . ?
C15 C14 C13 124.4(3) . . ?
C14 C15 C16 121.4(3) . . ?
C14 C15 C15A 120.7(3) . . ?
C16 C15 C15A 117.7(3) . . ?
C15F C15A C15B 119.3(3) . . ?
C15F C15A C15 120.1(3) . . ?
C15B C15A C15 120.5(3) . . ?
C15A C15B C15C 120.1(4) . . ?
C15A C15B H15B 119.9 . . ?
C15C C15B H15B 119.9 . . ?
C15D C15C C15B 120.3(4) . . ?
C15D C15C H15C 119.8 . . ?
C15B C15C H15C 119.8 . . ?
C15C C15D C15E 120.0(3) . . ?
C15C C15D H15D 120.0 . . ?
C15E C15D H15D 120.0 . . ?
C15D C15E C15F 120.0(4) . . ?
C15D C15E H15E 120.0 . . ?
C15F C15E H15E 120.0 . . ?
C15A C15F C15E 120.3(3) . . ?
C15A C15F H15F 119.9 . . ?
C15E C15F H15F 119.9 . . ?
N24 C16 C15 126.0(3) . . ?
N24 C16 C17 111.0(3) . . ?
C15 C16 C17 123.0(3) . . ?
C18 C17 C16 107.6(3) . . ?
C18 C17 H17 126.2 . . ?
C16 C17 H17 126.2 . . ?
C17 C18 C19 107.0(3) . . ?
C17 C18 H18 126.5 . . ?
C19 C18 H18 126.5 . . ?
C20 C19 N24 125.0(3) . . ?
C20 C19 C18 124.5(3) . . ?
N24 C19 C18 109.5(3) . . ?
C19 C20 C1 119.9(3) . . ?
C19 C20 C20A 118.5(3) . . ?
C1 C20 C20A 121.4(3) . . ?
C20B C20A C20F 119.0(3) . . ?
C20B C20A C20 119.3(3) . . ?
C20F C20A C20 121.7(3) . . ?
C20C C20B C20A 120.8(3) . . ?
C20C C20B H20B 119.6 . . ?
C20A C20B H20B 119.6 . . ?
C20D C20C C20B 119.7(4) . . ?
C20D C20C H20C 120.1 . . ?
C20B C20C H20C 120.1 . . ?
C20C C20D C20E 120.5(4) . . ?
C20C C20D H20D 119.8 . . ?
C20E C20D H20D 119.8 . . ?
C20D C20E C20F 120.2(4) . . ?
C20D C20E H20E 119.9 . . ?
C20F C20E H20E 119.9 . . ?
C20E C20F C20A 119.9(3) . . ?
C20E C20F H20F 120.1 . . ?
C20A C20F H20F 120.1 . . ?
C1 C21 C4 104.3(3) . . ?
C1 C21 Ni1 127.4(2) . . ?
C4 C21 Ni1 126.0(2) . . ?
C1 C21 Ru1 73.16(17) . . ?
C4 C21 Ru1 72.92(17) . . ?
Ni1 C21 Ru1 105.30(14) . . ?
O22 C22 Ru1 169.9(3) . . ?
O23 C23 Ru2 177.3(3) . . ?
O24 C24 Ru2 177.3(3) . . ?
O25 C25 Ru3 178.4(3) . . ?
O26 C26 Ru3 177.1(3) . . ?
O27 C27 Ru1 171.1(3) . . ?
O28 C28 Ru4 176.8(3) . . ?
O29 C29 Ru4 178.3(3) . . ?
O30 C30 Ru4 177.9(3) . . ?

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
C27 Ru1 Ru2 C24 -24.6(3) . . . . ?
C22 Ru1 Ru2 C24 62.9(3) . . . . ?
C21 Ru1 Ru2 C24 170.3(3) . . . . ?
C4 Ru1 Ru2 C24 -146.0(3) . . . . ?
C1 Ru1 Ru2 C24 159.9(3) . . . . ?
C3 Ru1 Ru2 C24 -138.5(3) . . . . ?
C2 Ru1 Ru2 C24 -172.0(3) . . . . ?
Ru3 Ru1 Ru2 C24 -73.2(3) . . . . ?
Ru4 Ru1 Ru2 C24 -6.3(3) . . . . ?
C27 Ru1 Ru2 C23 -108.12(18) . . . . ?
C22 Ru1 Ru2 C23 -20.60(15) . . . . ?
C21 Ru1 Ru2 C23 86.85(15) . . . . ?
C4 Ru1 Ru2 C23 130.47(14) . . . . ?
C1 Ru1 Ru2 C23 76.41(14) . . . . ?
C3 Ru1 Ru2 C23 137.99(14) . . . . ?
C2 Ru1 Ru2 C23 104.51(14) . . . . ?
Ru3 Ru1 Ru2 C23 -156.71(11) . . . . ?
Ru4 Ru1 Ru2 C23 -89.82(11) . . . . ?
C27 Ru1 Ru2 C2B 125.14(16) . . . . ?
C22 Ru1 Ru2 C2B -147.34(14) . . . . ?
C21 Ru1 Ru2 C2B -39.89(13) . . . . ?
C4 Ru1 Ru2 C2B 3.74(13) . . . . ?
C1 Ru1 Ru2 C2B -50.32(12) . . . . ?
C3 Ru1 Ru2 C2B 11.25(12) . . . . ?
C2 Ru1 Ru2 C2B -22.22(13) . . . . ?
Ru3 Ru1 Ru2 C2B 76.56(10) . . . . ?
Ru4 Ru1 Ru2 C2B 143.45(9) . . . . ?
C27 Ru1 Ru2 C2A 151.48(16) . . . . ?
C22 Ru1 Ru2 C2A -121.00(13) . . . . ?
C21 Ru1 Ru2 C2A -13.55(12) . . . . ?
C4 Ru1 Ru2 C2A 30.08(12) . . . . ?
C1 Ru1 Ru2 C2A -23.98(11) . . . . ?
C3 Ru1 Ru2 C2A 37.59(11) . . . . ?
C2 Ru1 Ru2 C2A 4.12(12) . . . . ?
Ru3 Ru1 Ru2 C2A 102.90(9) . . . . ?
Ru4 Ru1 Ru2 C2A 169.79(8) . . . . ?
C27 Ru1 Ru2 C2C 89.11(16) . . . . ?
C22 Ru1 Ru2 C2C 176.63(13) . . . . ?
C21 Ru1 Ru2 C2C -75.92(13) . . . . ?
C4 Ru1 Ru2 C2C -32.29(12) . . . . ?
C1 Ru1 Ru2 C2C -86.35(11) . . . . ?
C3 Ru1 Ru2 C2C -24.78(11) . . . . ?
C2 Ru1 Ru2 C2C -58.25(12) . . . . ?
Ru3 Ru1 Ru2 C2C 40.53(8) . . . . ?
Ru4 Ru1 Ru2 C2C 107.42(8) . . . . ?
C27 Ru1 Ru2 Ru4 -18.30(13) . . . . ?
C22 Ru1 Ru2 Ru4 69.22(10) . . . . ?
C21 Ru1 Ru2 Ru4 176.67(9) . . . . ?
C4 Ru1 Ru2 Ru4 -139.71(9) . . . . ?
C1 Ru1 Ru2 Ru4 166.23(8) . . . . ?
C3 Ru1 Ru2 Ru4 -132.19(8) . . . . ?
C2 Ru1 Ru2 Ru4 -165.67(9) . . . . ?
Ru3 Ru1 Ru2 Ru4 -66.89(3) . . . . ?
C27 Ru1 Ru2 Ru3 48.59(14) . . . . ?
C22 Ru1 Ru2 Ru3 136.11(10) . . . . ?
C21 Ru1 Ru2 Ru3 -116.44(10) . . . . ?
C4 Ru1 Ru2 Ru3 -72.82(9) . . . . ?
C1 Ru1 Ru2 Ru3 -126.88(8) . . . . ?
C3 Ru1 Ru2 Ru3 -65.30(8) . . . . ?
C2 Ru1 Ru2 Ru3 -98.78(9) . . . . ?
Ru4 Ru1 Ru2 Ru3 66.89(3) . . . . ?
C27 Ru1 Ru3 C25 -78.7(3) . . . . ?
C22 Ru1 Ru3 C25 5.4(3) . . . . ?
C21 Ru1 Ru3 C25 178.4(3) . . . . ?
C4 Ru1 Ru3 C25 -170.6(3) . . . . ?
C1 Ru1 Ru3 C25 134.3(3) . . . . ?
C3 Ru1 Ru3 C25 161.6(3) . . . . ?
C2 Ru1 Ru3 C25 128.2(3) . . . . ?
Ru4 Ru1 Ru3 C25 0.1(3) . . . . ?
Ru2 Ru1 Ru3 C25 66.7(3) . . . . ?
C27 Ru1 Ru3 C26 16.47(16) . . . . ?
C22 Ru1 Ru3 C26 100.58(17) . . . . ?
C21 Ru1 Ru3 C26 -86.40(16) . . . . ?
C4 Ru1 Ru3 C26 -75.44(14) . . . . ?
C1 Ru1 Ru3 C26 -130.56(15) . . . . ?
C3 Ru1 Ru3 C26 -103.25(15) . . . . ?
C2 Ru1 Ru3 C26 -136.64(14) . . . . ?
Ru4 Ru1 Ru3 C26 95.22(12) . . . . ?
Ru2 Ru1 Ru3 C26 161.90(11) . . . . ?
C27 Ru1 Ru3 C3B 139.66(14) . . . . ?
C22 Ru1 Ru3 C3B -136.24(16) . . . . ?
C21 Ru1 Ru3 C3B 36.79(14) . . . . ?
C4 Ru1 Ru3 C3B 47.75(12) . . . . ?
C1 Ru1 Ru3 C3B -7.38(13) . . . . ?
C3 Ru1 Ru3 C3B 19.93(13) . . . . ?
C2 Ru1 Ru3 C3B -13.45(12) . . . . ?
Ru4 Ru1 Ru3 C3B -141.59(9) . . . . ?
Ru2 Ru1 Ru3 C3B -74.91(10) . . . . ?
C27 Ru1 Ru3 C3A 114.35(14) . . . . ?
C22 Ru1 Ru3 C3A -161.55(15) . . . . ?
C21 Ru1 Ru3 C3A 11.48(13) . . . . ?
C4 Ru1 Ru3 C3A 22.44(11) . . . . ?
C1 Ru1 Ru3 C3A -32.69(12) . . . . ?
C3 Ru1 Ru3 C3A -5.38(12) . . . . ?
C2 Ru1 Ru3 C3A -38.77(12) . . . . ?
Ru4 Ru1 Ru3 C3A -166.91(8) . . . . ?
Ru2 Ru1 Ru3 C3A -100.22(9) . . . . ?
C27 Ru1 Ru3 C2C 175.24(13) . . . . ?
C22 Ru1 Ru3 C2C -100.66(15) . . . . ?
C21 Ru1 Ru3 C2C 72.37(13) . . . . ?
C4 Ru1 Ru3 C2C 83.33(12) . . . . ?
C1 Ru1 Ru3 C2C 28.20(12) . . . . ?
C3 Ru1 Ru3 C2C 55.51(12) . . . . ?
C2 Ru1 Ru3 C2C 22.12(11) . . . . ?
Ru4 Ru1 Ru3 C2C -106.02(9) . . . . ?
Ru2 Ru1 Ru3 C2C -39.33(8) . . . . ?
C27 Ru1 Ru3 Ru4 -78.75(11) . . . . ?
C22 Ru1 Ru3 Ru4 5.36(13) . . . . ?
C21 Ru1 Ru3 Ru4 178.38(10) . . . . ?
C4 Ru1 Ru3 Ru4 -170.66(8) . . . . ?
C1 Ru1 Ru3 Ru4 134.21(9) . . . . ?
C3 Ru1 Ru3 Ru4 161.52(9) . . . . ?
C2 Ru1 Ru3 Ru4 128.14(8) . . . . ?
Ru2 Ru1 Ru3 Ru4 66.68(4) . . . . ?
C27 Ru1 Ru3 Ru2 -145.43(11) . . . . ?
C22 Ru1 Ru3 Ru2 -61.33(13) . . . . ?
C21 Ru1 Ru3 Ru2 111.70(11) . . . . ?
C4 Ru1 Ru3 Ru2 122.66(9) . . . . ?
C1 Ru1 Ru3 Ru2 67.53(9) . . . . ?
C3 Ru1 Ru3 Ru2 94.84(10) . . . . ?
C2 Ru1 Ru3 Ru2 61.46(8) . . . . ?
Ru4 Ru1 Ru3 Ru2 -66.68(4) . . . . ?
C24 Ru2 Ru3 C25 0.54(16) . . . . ?
C23 Ru2 Ru3 C25 -115.0(2) . . . . ?
C2B Ru2 Ru3 C25 91.89(14) . . . . ?
C2A Ru2 Ru3 C25 126.94(14) . . . . ?
C2C Ru2 Ru3 C25 73.93(15) . . . . ?
Ru4 Ru2 Ru3 C25 -83.34(11) . . . . ?
Ru1 Ru2 Ru3 C25 -157.81(11) . . . . ?
C24 Ru2 Ru3 C26 117.6(3) . . . . ?
C23 Ru2 Ru3 C26 2.1(3) . . . . ?
C2B Ru2 Ru3 C26 -151.0(2) . . . . ?
C2A Ru2 Ru3 C26 -116.0(2) . . . . ?
C2C Ru2 Ru3 C26 -169.0(3) . . . . ?
Ru4 Ru2 Ru3 C26 33.8(2) . . . . ?
Ru1 Ru2 Ru3 C26 -40.7(2) . . . . ?
C24 Ru2 Ru3 C3B -90.96(15) . . . . ?
C23 Ru2 Ru3 C3B 153.5(2) . . . . ?
C2B Ru2 Ru3 C3B 0.40(12) . . . . ?
C2A Ru2 Ru3 C3B 35.44(12) . . . . ?
C2C Ru2 Ru3 C3B -17.57(13) . . . . ?
Ru4 Ru2 Ru3 C3B -174.83(9) . . . . ?
Ru1 Ru2 Ru3 C3B 110.69(9) . . . . ?
C24 Ru2 Ru3 C3A -126.02(14) . . . . ?
C23 Ru2 Ru3 C3A 118.4(2) . . . . ?
C2B Ru2 Ru3 C3A -34.67(12) . . . . ?
C2A Ru2 Ru3 C3A 0.38(11) . . . . ?
C2C Ru2 Ru3 C3A -52.63(12) . . . . ?
Ru4 Ru2 Ru3 C3A 150.11(8) . . . . ?
Ru1 Ru2 Ru3 C3A 75.63(8) . . . . ?
C24 Ru2 Ru3 C2C -73.39(15) . . . . ?
C23 Ru2 Ru3 C2C 171.1(2) . . . . ?
C2B Ru2 Ru3 C2C 17.96(13) . . . . ?
C2A Ru2 Ru3 C2C 53.01(12) . . . . ?
Ru4 Ru2 Ru3 C2C -157.26(10) . . . . ?
Ru1 Ru2 Ru3 C2C 128.26(10) . . . . ?
C24 Ru2 Ru3 Ru4 83.87(12) . . . . ?
C23 Ru2 Ru3 Ru4 -31.66(19) . . . . ?
C2B Ru2 Ru3 Ru4 175.23(9) . . . . ?
C2A Ru2 Ru3 Ru4 -149.72(8) . . . . ?
C2C Ru2 Ru3 Ru4 157.26(10) . . . . ?
Ru1 Ru2 Ru3 Ru4 -74.48(2) . . . . ?
C24 Ru2 Ru3 Ru1 158.35(12) . . . . ?
C23 Ru2 Ru3 Ru1 42.82(19) . . . . ?
C2B Ru2 Ru3 Ru1 -110.29(9) . . . . ?
C2A Ru2 Ru3 Ru1 -75.25(8) . . . . ?
C2C Ru2 Ru3 Ru1 -128.26(10) . . . . ?
Ru4 Ru2 Ru3 Ru1 74.48(2) . . . . ?
C25 Ru3 Ru4 C29 17.05(16) . . . . ?
C26 Ru3 Ru4 C29 103.12(15) . . . . ?
C3B Ru3 Ru4 C29 -83.80(18) . . . . ?
C3A Ru3 Ru4 C29 -142.77(17) . . . . ?
C2C Ru3 Ru4 C29 -73.31(14) . . . . ?
Ru1 Ru3 Ru4 C29 -162.97(11) . . . . ?
Ru2 Ru3 Ru4 C29 -92.25(11) . . . . ?
C25 Ru3 Ru4 C30 -78.91(15) . . . . ?
C26 Ru3 Ru4 C30 7.16(15) . . . . ?
C3B Ru3 Ru4 C30 -179.76(17) . . . . ?
C3A Ru3 Ru4 C30 121.27(17) . . . . ?
C2C Ru3 Ru4 C30 -169.27(13) . . . . ?
Ru1 Ru3 Ru4 C30 101.07(11) . . . . ?
Ru2 Ru3 Ru4 C30 171.79(11) . . . . ?
C25 Ru3 Ru4 C28 142.4(5) . . . . ?
C26 Ru3 Ru4 C28 -131.5(5) . . . . ?
C3B Ru3 Ru4 C28 41.5(5) . . . . ?
C3A Ru3 Ru4 C28 -17.4(5) . . . . ?
C2C Ru3 Ru4 C28 52.0(5) . . . . ?
Ru1 Ru3 Ru4 C28 -37.6(5) . . . . ?
Ru2 Ru3 Ru4 C28 33.1(5) . . . . ?
C25 Ru3 Ru4 Ru2 109.30(11) . . . . ?
C26 Ru3 Ru4 Ru2 -164.62(11) . . . . ?
C3B Ru3 Ru4 Ru2 8.45(14) . . . . ?
C3A Ru3 Ru4 Ru2 -50.51(13) . . . . ?
C2C Ru3 Ru4 Ru2 18.94(8) . . . . ?
Ru1 Ru3 Ru4 Ru2 -70.72(3) . . . . ?
C25 Ru3 Ru4 Ru1 -179.98(11) . . . . ?
C26 Ru3 Ru4 Ru1 -93.91(11) . . . . ?
C3B Ru3 Ru4 Ru1 79.17(14) . . . . ?
C3A Ru3 Ru4 Ru1 20.20(12) . . . . ?
C2C Ru3 Ru4 Ru1 89.66(8) . . . . ?
Ru2 Ru3 Ru4 Ru1 70.72(3) . . . . ?
C24 Ru2 Ru4 C29 -21.78(15) . . . . ?
C23 Ru2 Ru4 C29 -106.89(15) . . . . ?
C2B Ru2 Ru4 C29 82.73(19) . . . . ?
C2A Ru2 Ru4 C29 144.23(17) . . . . ?
C2C Ru2 Ru4 C29 71.28(14) . . . . ?
Ru3 Ru2 Ru4 C29 90.86(11) . . . . ?
Ru1 Ru2 Ru4 C29 160.49(11) . . . . ?
C24 Ru2 Ru4 C30 -135.8(3) . . . . ?
C23 Ru2 Ru4 C30 139.1(3) . . . . ?
C2B Ru2 Ru4 C30 -31.2(3) . . . . ?
C2A Ru2 Ru4 C30 30.3(3) . . . . ?
C2C Ru2 Ru4 C30 -42.7(3) . . . . ?
Ru3 Ru2 Ru4 C30 -23.1(3) . . . . ?
Ru1 Ru2 Ru4 C30 46.5(3) . . . . ?
C24 Ru2 Ru4 C28 74.81(15) . . . . ?
C23 Ru2 Ru4 C28 -10.31(15) . . . . ?
C2B Ru2 Ru4 C28 179.31(18) . . . . ?
C2A Ru2 Ru4 C28 -119.18(17) . . . . ?
C2C Ru2 Ru4 C28 167.87(14) . . . . ?
Ru3 Ru2 Ru4 C28 -172.55(11) . . . . ?
Ru1 Ru2 Ru4 C28 -102.93(11) . . . . ?
C24 Ru2 Ru4 Ru3 -112.64(11) . . . . ?
C23 Ru2 Ru4 Ru3 162.24(11) . . . . ?
C2B Ru2 Ru4 Ru3 -8.14(15) . . . . ?
C2A Ru2 Ru4 Ru3 53.36(13) . . . . ?
C2C Ru2 Ru4 Ru3 -19.58(8) . . . . ?
Ru1 Ru2 Ru4 Ru3 69.62(3) . . . . ?
C24 Ru2 Ru4 Ru1 177.74(11) . . . . ?
C23 Ru2 Ru4 Ru1 92.62(11) . . . . ?
C2B Ru2 Ru4 Ru1 -77.76(15) . . . . ?
C2A Ru2 Ru4 Ru1 -16.26(13) . . . . ?
C2C Ru2 Ru4 Ru1 -89.20(9) . . . . ?
Ru3 Ru2 Ru4 Ru1 -69.62(3) . . . . ?
C27 Ru1 Ru4 C29 125.8(2) . . . . ?
C22 Ru1 Ru4 C29 -141.0(2) . . . . ?
C4 Ru1 Ru4 C29 51.1(3) . . . . ?
C1 Ru1 Ru4 C29 -62.6(2) . . . . ?
C3 Ru1 Ru4 C29 15.7(2) . . . . ?
C2 Ru1 Ru4 C29 -26.1(2) . . . . ?
Ru3 Ru1 Ru4 C29 34.5(2) . . . . ?
Ru2 Ru1 Ru4 C29 -40.2(2) . . . . ?
C27 Ru1 Ru4 C30 1.59(15) . . . . ?
C22 Ru1 Ru4 C30 94.80(15) . . . . ?
C4 Ru1 Ru4 C30 -73.10(18) . . . . ?
C1 Ru1 Ru4 C30 173.23(16) . . . . ?
C3 Ru1 Ru4 C30 -108.49(14) . . . . ?
C2 Ru1 Ru4 C30 -150.28(14) . . . . ?
Ru3 Ru1 Ru4 C30 -89.65(11) . . . . ?
Ru2 Ru1 Ru4 C30 -164.39(11) . . . . ?
C27 Ru1 Ru4 C28 -97.26(16) . . . . ?
C22 Ru1 Ru4 C28 -4.05(15) . . . . ?
C4 Ru1 Ru4 C28 -171.95(18) . . . . ?
C1 Ru1 Ru4 C28 74.38(17) . . . . ?
C3 Ru1 Ru4 C28 152.66(15) . . . . ?
C2 Ru1 Ru4 C28 110.87(15) . . . . ?
Ru3 Ru1 Ru4 C28 171.50(12) . . . . ?
Ru2 Ru1 Ru4 C28 96.76(12) . . . . ?
C27 Ru1 Ru4 Ru3 91.24(11) . . . . ?
C22 Ru1 Ru4 Ru3 -175.56(11) . . . . ?
C4 Ru1 Ru4 Ru3 16.54(14) . . . . ?
C1 Ru1 Ru4 Ru3 -97.12(13) . . . . ?
C3 Ru1 Ru4 Ru3 -18.84(9) . . . . ?
C2 Ru1 Ru4 Ru3 -60.64(9) . . . . ?
Ru2 Ru1 Ru4 Ru3 -74.74(3) . . . . ?
C27 Ru1 Ru4 Ru2 165.98(10) . . . . ?
C22 Ru1 Ru4 Ru2 -100.81(11) . . . . ?
C4 Ru1 Ru4 Ru2 91.29(14) . . . . ?
C1 Ru1 Ru4 Ru2 -22.38(12) . . . . ?
C3 Ru1 Ru4 Ru2 55.90(9) . . . . ?
C2 Ru1 Ru4 Ru2 14.11(9) . . . . ?
Ru3 Ru1 Ru4 Ru2 74.74(3) . . . . ?
C21 Ni1 N22 C9 -168.6(3) . . . . ?
N23 Ni1 N22 C9 18.2(3) . . . . ?
C21 Ni1 N22 C6 3.4(3) . . . . ?
N23 Ni1 N22 C6 -169.8(3) . . . . ?
N22 Ni1 N23 C11 -7.7(3) . . . . ?
N24 Ni1 N23 C11 167.0(3) . . . . ?
N22 Ni1 N23 C14 169.8(3) . . . . ?
N24 Ni1 N23 C14 -15.4(3) . . . . ?
C21 Ni1 N24 C16 -170.7(3) . . . . ?
N23 Ni1 N24 C16 2.5(3) . . . . ?
C21 Ni1 N24 C19 20.3(3) . . . . ?
N23 Ni1 N24 C19 -166.6(3) . . . . ?
C27 Ru1 C1 C21 -9.1(3) . . . . ?
C22 Ru1 C1 C21 -106.2(2) . . . . ?
C4 Ru1 C1 C21 40.91(18) . . . . ?
C3 Ru1 C1 C21 84.01(19) . . . . ?
C2 Ru1 C1 C21 122.1(3) . . . . ?
Ru3 Ru1 C1 C21 112.08(17) . . . . ?
Ru4 Ru1 C1 C21 -176.12(13) . . . . ?
Ru2 Ru1 C1 C21 165.52(17) . . . . ?
C27 Ru1 C1 C20 107.2(3) . . . . ?
C22 Ru1 C1 C20 10.0(3) . . . . ?
C21 Ru1 C1 C20 116.2(3) . . . . ?
C4 Ru1 C1 C20 157.1(3) . . . . ?
C3 Ru1 C1 C20 -159.8(3) . . . . ?
C2 Ru1 C1 C20 -121.7(3) . . . . ?
Ru3 Ru1 C1 C20 -131.7(2) . . . . ?
Ru4 Ru1 C1 C20 -59.9(3) . . . . ?
Ru2 Ru1 C1 C20 -78.2(3) . . . . ?
C27 Ru1 C1 C2 -131.2(2) . . . . ?
C22 Ru1 C1 C2 131.70(19) . . . . ?
C21 Ru1 C1 C2 -122.1(3) . . . . ?
C4 Ru1 C1 C2 -81.17(19) . . . . ?
C3 Ru1 C1 C2 -38.07(17) . . . . ?
Ru3 Ru1 C1 C2 -10.0(2) . . . . ?
Ru4 Ru1 C1 C2 61.8(2) . . . . ?
Ru2 Ru1 C1 C2 43.43(17) . . . . ?
C21 C1 C2 C2A -179.6(3) . . . . ?
C20 C1 C2 C2A 1.0(5) . . . . ?
Ru1 C1 C2 C2A -120.8(3) . . . . ?
C21 C1 C2 C3 3.2(3) . . . . ?
C20 C1 C2 C3 -176.2(3) . . . . ?
Ru1 C1 C2 C3 62.0(2) . . . . ?
C21 C1 C2 Ru1 -58.8(2) . . . . ?
C20 C1 C2 Ru1 121.9(3) . . . . ?
C27 Ru1 C2 C2A -132.9(3) . . . . ?
C22 Ru1 C2 C2A 62.4(3) . . . . ?
C21 Ru1 C2 C2A 155.7(3) . . . . ?
C4 Ru1 C2 C2A -161.9(3) . . . . ?
C1 Ru1 C2 C2A 121.0(3) . . . . ?
C3 Ru1 C2 C2A -123.1(3) . . . . ?
Ru3 Ru1 C2 C2A -67.7(3) . . . . ?
Ru4 Ru1 C2 C2A -21.1(3) . . . . ?
Ru2 Ru1 C2 C2A -7.9(2) . . . . ?
C27 Ru1 C2 C3 -9.8(4) . . . . ?
C22 Ru1 C2 C3 -174.49(19) . . . . ?
C21 Ru1 C2 C3 -81.16(19) . . . . ?
C4 Ru1 C2 C3 -38.77(18) . . . . ?
C1 Ru1 C2 C3 -115.9(3) . . . . ?
Ru3 Ru1 C2 C3 55.40(17) . . . . ?
Ru4 Ru1 C2 C3 101.99(17) . . . . ?
Ru2 Ru1 C2 C3 115.19(19) . . . . ?
C27 Ru1 C2 C1 106.1(3) . . . . ?
C22 Ru1 C2 C1 -58.6(2) . . . . ?
C21 Ru1 C2 C1 34.73(17) . . . . ?
C4 Ru1 C2 C1 77.13(19) . . . . ?
C3 Ru1 C2 C1 115.9(3) . . . . ?
Ru3 Ru1 C2 C1 171.29(17) . . . . ?
Ru4 Ru1 C2 C1 -142.11(15) . . . . ?
Ru2 Ru1 C2 C1 -128.91(19) . . . . ?
C3 C2 C2A C2B -19.1(5) . . . . ?
C1 C2 C2A C2B 164.3(3) . . . . ?
Ru1 C2 C2A C2B 73.3(4) . . . . ?
C3 C2 C2A Ru2 -83.5(3) . . . . ?
C1 C2 C2A Ru2 99.8(3) . . . . ?
Ru1 C2 C2A Ru2 8.8(2) . . . . ?
C24 Ru2 C2A C2B 44.8(2) . . . . ?
C23 Ru2 C2A C2B 135.2(2) . . . . ?
C2C Ru2 C2A C2B -29.82(19) . . . . ?
Ru4 Ru2 C2A C2B -119.12(18) . . . . ?
Ru3 Ru2 C2A C2B -76.25(19) . . . . ?
Ru1 Ru2 C2A C2B -133.64(19) . . . . ?
C24 Ru2 C2A C2 172.62(19) . . . . ?
C23 Ru2 C2A C2 -96.9(2) . . . . ?
C2B Ru2 C2A C2 127.8(3) . . . . ?
C2C Ru2 C2A C2 98.0(2) . . . . ?
Ru4 Ru2 C2A C2 8.7(3) . . . . ?
Ru3 Ru2 C2A C2 51.60(18) . . . . ?
Ru1 Ru2 C2A C2 -5.79(16) . . . . ?
C2 C2A C2B C2C -8.8(5) . . . . ?
Ru2 C2A C2B C2C 66.5(3) . . . . ?
C2 C2A C2B Ru2 -75.2(3) . . . . ?
C24 Ru2 C2B C2A -142.4(2) . . . . ?
C23 Ru2 C2B C2A -56.8(2) . . . . ?
C2C Ru2 C2B C2A 130.1(3) . . . . ?
Ru4 Ru2 C2B C2A 111.5(2) . . . . ?
Ru3 Ru2 C2B C2A 104.68(18) . . . . ?
Ru1 Ru2 C2B C2A 47.86(19) . . . . ?
C24 Ru2 C2B C2C 87.4(2) . . . . ?
C23 Ru2 C2B C2C 173.05(19) . . . . ?
C2A Ru2 C2B C2C -130.1(3) . . . . ?
Ru4 Ru2 C2B C2C -18.6(3) . . . . ?
Ru3 Ru2 C2B C2C -25.47(18) . . . . ?
Ru1 Ru2 C2B C2C -82.29(18) . . . . ?
C2A C2B C2C C3B 51.3(5) . . . . ?
Ru2 C2B C2C C3B 115.2(3) . . . . ?
C2A C2B C2C Ru2 -63.9(3) . . . . ?
C2A C2B C2C Ru3 -25.9(5) . . . . ?
Ru2 C2B C2C Ru3 38.0(2) . . . . ?
C24 Ru2 C2C C2B -93.5(2) . . . . ?
C23 Ru2 C2C C2B -16.7(5) . . . . ?
C2A Ru2 C2C C2B 29.98(19) . . . . ?
Ru4 Ru2 C2C C2B 168.57(17) . . . . ?
Ru3 Ru2 C2C C2B 148.4(2) . . . . ?
Ru1 Ru2 C2C C2B 105.41(18) . . . . ?
C24 Ru2 C2C C3B 151.4(3) . . . . ?
C23 Ru2 C2C C3B -131.8(4) . . . . ?
C2B Ru2 C2C C3B -115.1(3) . . . . ?
C2A Ru2 C2C C3B -85.1(3) . . . . ?
Ru4 Ru2 C2C C3B 53.5(3) . . . . ?
Ru3 Ru2 C2C C3B 33.3(2) . . . . ?
Ru1 Ru2 C2C C3B -9.7(3) . . . . ?
C24 Ru2 C2C Ru3 118.07(13) . . . . ?
C23 Ru2 C2C Ru3 -165.0(3) . . . . ?
C2B Ru2 C2C Ru3 -148.4(2) . . . . ?
C2A Ru2 C2C Ru3 -118.41(12) . . . . ?
Ru4 Ru2 C2C Ru3 20.18(8) . . . . ?
Ru1 Ru2 C2C Ru3 -42.98(7) . . . . ?
C25 Ru3 C2C C2B -150.0(3) . . . . ?
C26 Ru3 C2C C2B 132.5(3) . . . . ?
C3B Ru3 C2C C2B 113.4(4) . . . . ?
C3A Ru3 C2C C2B 81.9(3) . . . . ?
Ru4 Ru3 C2C C2B -55.6(3) . . . . ?
Ru1 Ru3 C2C C2B 8.1(3) . . . . ?
Ru2 Ru3 C2C C2B -35.5(2) . . . . ?
C25 Ru3 C2C C3B 96.7(2) . . . . ?
C26 Ru3 C2C C3B 19.1(4) . . . . ?
C3A Ru3 C2C C3B -31.48(18) . . . . ?
Ru4 Ru3 C2C C3B -169.00(16) . . . . ?
Ru1 Ru3 C2C C3B -105.32(18) . . . . ?
Ru2 Ru3 C2C C3B -148.9(2) . . . . ?
C25 Ru3 C2C Ru2 -114.43(12) . . . . ?
C26 Ru3 C2C Ru2 168.0(3) . . . . ?
C3B Ru3 C2C Ru2 148.9(2) . . . . ?
C3A Ru3 C2C Ru2 117.43(12) . . . . ?
Ru4 Ru3 C2C Ru2 -20.09(8) . . . . ?
Ru1 Ru3 C2C Ru2 43.59(7) . . . . ?
C2A C2 C3 C3A 3.4(5) . . . . ?
C1 C2 C3 C3A -179.4(3) . . . . ?
Ru1 C2 C3 C3A -117.5(3) . . . . ?
C2A C2 C3 C4 -175.6(3) . . . . ?
C1 C2 C3 C4 1.5(3) . . . . ?
Ru1 C2 C3 C4 63.4(2) . . . . ?
C2A C2 C3 Ru1 120.9(3) . . . . ?
C1 C2 C3 Ru1 -61.9(2) . . . . ?
C27 Ru1 C3 C2 174.72(19) . . . . ?
C22 Ru1 C3 C2 12.0(4) . . . . ?
C21 Ru1 C3 C2 80.03(19) . . . . ?
C4 Ru1 C3 C2 115.2(2) . . . . ?
C1 Ru1 C3 C2 38.22(18) . . . . ?
Ru3 Ru1 C3 C2 -114.95(18) . . . . ?
Ru4 Ru1 C3 C2 -97.70(17) . . . . ?
Ru2 Ru1 C3 C2 -53.89(17) . . . . ?
C27 Ru1 C3 C3A -60.5(3) . . . . ?
C22 Ru1 C3 C3A 136.8(3) . . . . ?
C21 Ru1 C3 C3A -155.2(3) . . . . ?
C4 Ru1 C3 C3A -120.1(3) . . . . ?
C1 Ru1 C3 C3A 163.0(3) . . . . ?
C2 Ru1 C3 C3A 124.8(3) . . . . ?
Ru3 Ru1 C3 C3A 9.8(2) . . . . ?
Ru4 Ru1 C3 C3A 27.1(3) . . . . ?
Ru2 Ru1 C3 C3A 70.9(2) . . . . ?
C27 Ru1 C3 C4 59.5(2) . . . . ?
C22 Ru1 C3 C4 -103.1(3) . . . . ?
C21 Ru1 C3 C4 -35.15(17) . . . . ?
C1 Ru1 C3 C4 -76.96(18) . . . . ?
C2 Ru1 C3 C4 -115.2(2) . . . . ?
Ru3 Ru1 C3 C4 129.86(18) . . . . ?
Ru4 Ru1 C3 C4 147.12(14) . . . . ?
Ru2 Ru1 C3 C4 -169.07(16) . . . . ?
C2 C3 C3A C3B 16.2(5) . . . . ?
C4 C3 C3A C3B -164.8(3) . . . . ?
Ru1 C3 C3A C3B -76.2(4) . . . . ?
C2 C3 C3A Ru3 81.4(3) . . . . ?
C4 C3 C3A Ru3 -99.7(3) . . . . ?
Ru1 C3 C3A Ru3 -11.0(2) . . . . ?
C25 Ru3 C3A C3B -38.5(2) . . . . ?
C26 Ru3 C3A C3B -129.0(2) . . . . ?
C2C Ru3 C3A C3B 31.09(18) . . . . ?
Ru4 Ru3 C3A C3B 117.30(18) . . . . ?
Ru1 Ru3 C3A C3B 135.49(18) . . . . ?
Ru2 Ru3 C3A C3B 76.42(18) . . . . ?
C25 Ru3 C3A C3 -166.4(2) . . . . ?
C26 Ru3 C3A C3 103.1(2) . . . . ?
C3B Ru3 C3A C3 -127.9(3) . . . . ?
C2C Ru3 C3A C3 -96.8(2) . . . . ?
Ru4 Ru3 C3A C3 -10.6(3) . . . . ?
Ru1 Ru3 C3A C3 7.60(17) . . . . ?
Ru2 Ru3 C3A C3 -51.46(18) . . . . ?
C3 C3A C3B C2C 5.9(5) . . . . ?
Ru3 C3A C3B C2C -71.3(3) . . . . ?
C3 C3A C3B Ru3 77.2(3) . . . . ?
C2B C2C C3B C3A -48.4(5) . . . . ?
Ru2 C2C C3B C3A 31.1(4) . . . . ?
Ru3 C2C C3B C3A 67.6(3) . . . . ?
C2B C2C C3B Ru3 -116.0(3) . . . . ?
Ru2 C2C C3B Ru3 -36.5(2) . . . . ?
C25 Ru3 C3B C3A 148.5(2) . . . . ?
C26 Ru3 C3B C3A 61.9(2) . . . . ?
C2C Ru3 C3B C3A -127.5(3) . . . . ?
Ru4 Ru3 C3B C3A -110.22(19) . . . . ?
Ru1 Ru3 C3B C3A -45.54(19) . . . . ?
Ru2 Ru3 C3B C3A -103.04(18) . . . . ?
C25 Ru3 C3B C2C -84.0(2) . . . . ?
C26 Ru3 C3B C2C -170.56(19) . . . . ?
C3A Ru3 C3B C2C 127.5(3) . . . . ?
Ru4 Ru3 C3B C2C 17.3(3) . . . . ?
Ru1 Ru3 C3B C2C 82.01(18) . . . . ?
Ru2 Ru3 C3B C2C 24.50(17) . . . . ?
C2 C3 C4 C5 169.3(3) . . . . ?
C3A C3 C4 C5 -9.8(5) . . . . ?
Ru1 C3 C4 C5 -126.5(3) . . . . ?
C2 C3 C4 C21 -5.7(3) . . . . ?
C3A C3 C4 C21 175.2(3) . . . . ?
Ru1 C3 C4 C21 58.5(2) . . . . ?
C2 C3 C4 Ru1 -64.2(2) . . . . ?
C3A C3 C4 Ru1 116.7(3) . . . . ?
C27 Ru1 C4 C5 -5.6(3) . . . . ?
C22 Ru1 C4 C5 -96.6(3) . . . . ?
C21 Ru1 C4 C5 -116.2(4) . . . . ?
C1 Ru1 C4 C5 -156.6(3) . . . . ?
C3 Ru1 C4 C5 122.1(4) . . . . ?
C2 Ru1 C4 C5 160.5(3) . . . . ?
Ru3 Ru1 C4 C5 78.3(3) . . . . ?
Ru4 Ru1 C4 C5 64.7(3) . . . . ?
Ru2 Ru1 C4 C5 134.4(3) . . . . ?
C27 Ru1 C4 C21 110.6(2) . . . . ?
C22 Ru1 C4 C21 19.6(3) . . . . ?
C1 Ru1 C4 C21 -40.45(18) . . . . ?
C3 Ru1 C4 C21 -121.7(2) . . . . ?
C2 Ru1 C4 C21 -83.31(19) . . . . ?
Ru3 Ru1 C4 C21 -165.50(17) . . . . ?
Ru4 Ru1 C4 C21 -179.14(13) . . . . ?
Ru2 Ru1 C4 C21 -109.41(17) . . . . ?
C27 Ru1 C4 C3 -127.74(19) . . . . ?
C22 Ru1 C4 C3 141.3(2) . . . . ?
C21 Ru1 C4 C3 121.7(2) . . . . ?
C1 Ru1 C4 C3 81.25(18) . . . . ?
C2 Ru1 C4 C3 38.38(17) . . . . ?
Ru3 Ru1 C4 C3 -43.80(16) . . . . ?
Ru4 Ru1 C4 C3 -57.4(2) . . . . ?
Ru2 Ru1 C4 C3 12.28(18) . . . . ?
C21 C4 C5 C6 -10.5(5) . . . . ?
C3 C4 C5 C6 175.1(3) . . . . ?
Ru1 C4 C5 C6 79.4(4) . . . . ?
C21 C4 C5 C5A 160.3(3) . . . . ?
C3 C4 C5 C5A -14.2(5) . . . . ?
Ru1 C4 C5 C5A -109.8(3) . . . . ?
C6 C5 C5A C5B 102.3(4) . . . . ?
C4 C5 C5A C5B -68.8(4) . . . . ?
C6 C5 C5A C5F -73.7(4) . . . . ?
C4 C5 C5A C5F 115.2(4) . . . . ?
C5F C5A C5B C5C -0.9(5) . . . . ?
C5 C5A C5B C5C -177.0(3) . . . . ?
C5A C5B C5C C5D -0.8(5) . . . . ?
C5B C5C C5D C5E 1.5(6) . . . . ?
C5C C5D C5E C5F -0.5(6) . . . . ?
C5D C5E C5F C5A -1.2(6) . . . . ?
C5B C5A C5F C5E 1.9(5) . . . . ?
C5 C5A C5F C5E 178.0(3) . . . . ?
C4 C5 C6 N22 -9.4(5) . . . . ?
C5A C5 C6 N22 179.2(3) . . . . ?
C4 C5 C6 C7 171.0(3) . . . . ?
C5A C5 C6 C7 -0.3(5) . . . . ?
C9 N22 C6 C5 -175.6(3) . . . . ?
Ni1 N22 C6 C5 11.1(5) . . . . ?
C9 N22 C6 C7 4.0(3) . . . . ?
Ni1 N22 C6 C7 -169.3(2) . . . . ?
C5 C6 C7 C8 177.7(3) . . . . ?
N22 C6 C7 C8 -2.0(4) . . . . ?
C6 C7 C8 C9 -0.9(4) . . . . ?
C6 N22 C9 C10 168.7(3) . . . . ?
Ni1 N22 C9 C10 -17.8(5) . . . . ?
C6 N22 C9 C8 -4.6(3) . . . . ?
Ni1 N22 C9 C8 168.9(2) . . . . ?
C7 C8 C9 N22 3.5(4) . . . . ?
C7 C8 C9 C10 -170.1(3) . . . . ?
N22 C9 C10 C11 0.0(5) . . . . ?
C8 C9 C10 C11 172.6(3) . . . . ?
N22 C9 C10 C10A -178.3(3) . . . . ?
C8 C9 C10 C10A -5.8(5) . . . . ?
C11 C10 C10A C10F 88.3(4) . . . . ?
C9 C10 C10A C10F -93.3(4) . . . . ?
C11 C10 C10A C10B -91.7(4) . . . . ?
C9 C10 C10A C10B 86.7(4) . . . . ?
C10F C10A C10B C10C -1.3(5) . . . . ?
C10 C10A C10B C10C 178.6(3) . . . . ?
C10A C10B C10C C10D 1.0(6) . . . . ?
C10B C10C C10D C10E -0.2(6) . . . . ?
C10C C10D C10E C10F -0.3(6) . . . . ?
C10B C10A C10F C10E 0.7(5) . . . . ?
C10 C10A C10F C10E -179.2(3) . . . . ?
C10D C10E C10F C10A 0.1(6) . . . . ?
C14 N23 C11 C10 176.8(3) . . . . ?
Ni1 N23 C11 C10 -5.2(5) . . . . ?
C14 N23 C11 C12 -2.8(4) . . . . ?
Ni1 N23 C11 C12 175.2(2) . . . . ?
C9 C10 C11 N23 11.9(5) . . . . ?
C10A C10 C11 N23 -169.8(3) . . . . ?
C9 C10 C11 C12 -168.6(3) . . . . ?
C10A C10 C11 C12 9.7(5) . . . . ?
N23 C11 C12 C13 -0.2(4) . . . . ?
C10 C11 C12 C13 -179.7(3) . . . . ?
C11 C12 C13 C14 2.9(4) . . . . ?
C11 N23 C14 C15 -166.6(3) . . . . ?
Ni1 N23 C14 C15 15.4(5) . . . . ?
C11 N23 C14 C13 4.6(4) . . . . ?
Ni1 N23 C14 C13 -173.4(2) . . . . ?
C12 C13 C14 N23 -4.9(4) . . . . ?
C12 C13 C14 C15 166.3(3) . . . . ?
N23 C14 C15 C16 2.1(5) . . . . ?
C13 C14 C15 C16 -167.9(3) . . . . ?
N23 C14 C15 C15A 177.2(3) . . . . ?
C13 C14 C15 C15A 7.2(5) . . . . ?
C14 C15 C15A C15F 117.5(4) . . . . ?
C16 C15 C15A C15F -67.2(4) . . . . ?
C14 C15 C15A C15B -65.2(4) . . . . ?
C16 C15 C15A C15B 110.1(4) . . . . ?
C15F C15A C15B C15C 1.2(5) . . . . ?
C15 C15A C15B C15C -176.2(3) . . . . ?
C15A C15B C15C C15D 0.2(5) . . . . ?
C15B C15C C15D C15E -1.5(6) . . . . ?
C15C C15D C15E C15F 1.2(6) . . . . ?
C15B C15A C15F C15E -1.4(5) . . . . ?
C15 C15A C15F C15E 176.0(3) . . . . ?
C15D C15E C15F C15A 0.2(6) . . . . ?
C19 N24 C16 C15 -177.1(3) . . . . ?
Ni1 N24 C16 C15 11.9(5) . . . . ?
C19 N24 C16 C17 5.3(4) . . . . ?
Ni1 N24 C16 C17 -165.8(2) . . . . ?
C14 C15 C16 N24 -16.3(5) . . . . ?
C15A C15 C16 N24 168.5(3) . . . . ?
C14 C15 C16 C17 161.1(3) . . . . ?
C15A C15 C16 C17 -14.1(5) . . . . ?
N24 C16 C17 C18 -0.8(4) . . . . ?
C15 C16 C17 C18 -178.5(3) . . . . ?
C16 C17 C18 C19 -4.0(4) . . . . ?
C16 N24 C19 C20 161.5(3) . . . . ?
Ni1 N24 C19 C20 -27.4(5) . . . . ?
C16 N24 C19 C18 -7.7(3) . . . . ?
Ni1 N24 C19 C18 163.3(2) . . . . ?
C17 C18 C19 C20 -161.8(3) . . . . ?
C17 C18 C19 N24 7.5(4) . . . . ?
N24 C19 C20 C1 4.2(5) . . . . ?
C18 C19 C20 C1 171.8(3) . . . . ?
N24 C19 C20 C20A 179.6(3) . . . . ?
C18 C19 C20 C20A -12.7(5) . . . . ?
C21 C1 C20 C19 21.1(5) . . . . ?
C2 C1 C20 C19 -159.6(3) . . . . ?
Ru1 C1 C20 C19 -66.3(4) . . . . ?
C21 C1 C20 C20A -154.2(3) . . . . ?
C2 C1 C20 C20A 25.1(5) . . . . ?
Ru1 C1 C20 C20A 118.4(3) . . . . ?
C19 C20 C20A C20B -115.8(4) . . . . ?
C1 C20 C20A C20B 59.5(4) . . . . ?
C19 C20 C20A C20F 63.8(4) . . . . ?
C1 C20 C20A C20F -120.9(4) . . . . ?
C20F C20A C20B C20C 0.2(5) . . . . ?
C20 C20A C20B C20C 179.8(3) . . . . ?
C20A C20B C20C C20D -0.3(6) . . . . ?
C20B C20C C20D C20E 0.3(7) . . . . ?
C20C C20D C20E C20F -0.1(7) . . . . ?
C20D C20E C20F C20A -0.1(7) . . . . ?
C20B C20A C20F C20E 0.0(5) . . . . ?
C20 C20A C20F C20E -179.6(3) . . . . ?
C20 C1 C21 C4 172.9(3) . . . . ?
C2 C1 C21 C4 -6.5(3) . . . . ?
Ru1 C1 C21 C4 -66.8(2) . . . . ?
C20 C1 C21 Ni1 -23.7(4) . . . . ?
C2 C1 C21 Ni1 156.9(2) . . . . ?
Ru1 C1 C21 Ni1 96.6(2) . . . . ?
C20 C1 C21 Ru1 -120.3(3) . . . . ?
C2 C1 C21 Ru1 60.3(2) . . . . ?
C5 C4 C21 C1 -167.8(3) . . . . ?
C3 C4 C21 C1 7.4(3) . . . . ?
Ru1 C4 C21 C1 67.0(2) . . . . ?
C5 C4 C21 Ni1 28.5(4) . . . . ?
C3 C4 C21 Ni1 -156.3(2) . . . . ?
Ru1 C4 C21 Ni1 -96.8(2) . . . . ?
C5 C4 C21 Ru1 125.2(3) . . . . ?
C3 C4 C21 Ru1 -59.5(2) . . . . ?
N22 Ni1 C21 C1 178.5(3) . . . . ?
N24 Ni1 C21 C1 3.7(3) . . . . ?
N22 Ni1 C21 C4 -21.5(3) . . . . ?
N24 Ni1 C21 C4 163.8(3) . . . . ?
N22 Ni1 C21 Ru1 -101.24(14) . . . . ?
N24 Ni1 C21 Ru1 83.99(14) . . . . ?
C27 Ru1 C21 C1 174.10(19) . . . . ?
C22 Ru1 C21 C1 81.2(2) . . . . ?
C4 Ru1 C21 C1 -111.3(3) . . . . ?
C3 Ru1 C21 C1 -76.24(19) . . . . ?
C2 Ru1 C21 C1 -34.82(17) . . . . ?
Ru3 Ru1 C21 C1 -93.12(18) . . . . ?
Ru2 Ru1 C21 C1 -17.5(2) . . . . ?
C27 Ru1 C21 C4 -74.6(2) . . . . ?
C22 Ru1 C21 C4 -167.53(19) . . . . ?
C1 Ru1 C21 C4 111.3(3) . . . . ?
C3 Ru1 C21 C4 35.06(17) . . . . ?
C2 Ru1 C21 C4 76.48(19) . . . . ?
Ru3 Ru1 C21 C4 18.2(2) . . . . ?
Ru2 Ru1 C21 C4 93.85(17) . . . . ?
C27 Ru1 C21 Ni1 49.01(17) . . . . ?
C22 Ru1 C21 Ni1 -43.92(17) . . . . ?
C4 Ru1 C21 Ni1 123.6(2) . . . . ?
C1 Ru1 C21 Ni1 -125.1(2) . . . . ?
C3 Ru1 C21 Ni1 158.67(17) . . . . ?
C2 Ru1 C21 Ni1 -159.91(17) . . . . ?
Ru3 Ru1 C21 Ni1 141.79(8) . . . . ?
Ru2 Ru1 C21 Ni1 -142.54(8) . . . . ?
C27 Ru1 C22 O22 -101.3(17) . . . . ?
C21 Ru1 C22 O22 2.9(17) . . . . ?
C4 Ru1 C22 O22 -9.3(18) . . . . ?
C1 Ru1 C22 O22 39.8(17) . . . . ?
C3 Ru1 C22 O22 62.8(18) . . . . ?
C2 Ru1 C22 O22 71.2(17) . . . . ?
Ru3 Ru1 C22 O22 177.1(17) . . . . ?
Ru4 Ru1 C22 O22 -178.2(17) . . . . ?
Ru2 Ru1 C22 O22 127.4(17) . . . . ?

_diffrn_measured_fraction_theta_max 0.997
_diffrn_reflns_theta_full        25.50
_diffrn_measured_fraction_theta_full 0.997
_refine_diff_density_max         0.712
_refine_diff_density_min         -0.672
_refine_diff_density_rms         0.123
_database_code_depnum_ccdc_archive 'CCDC 1006126'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_5

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C59 H31 N3 O9 Pd Ru4'
_chemical_formula_weight         1436.55

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'
Pd Pd -0.9988 1.0072 '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'

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   9.344(2)
_cell_length_b                   12.595(3)
_cell_length_c                   22.998(4)
_cell_angle_alpha                76.21(2)
_cell_angle_beta                 79.06(3)
_cell_angle_gamma                73.79(2)
_cell_volume                     2501.9(10)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    7715
_cell_measurement_theta_min      2.70
_cell_measurement_theta_max      28.84

_exptl_crystal_description       block
_exptl_crystal_colour            'dark brown'
_exptl_crystal_size_max          0.69
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.15
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.907
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1400
_exptl_absorpt_coefficient_mu    1.596
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_correction_T_min  0.503
_exptl_absorpt_correction_T_max  0.840
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
Analytical numeric absorption correction using a multifaceted crystal
			model based on expressions derived by R.C. Clark & J.S. Reid.
(Clark, R. C. & Reid, J. S. (1995). Acta Cryst. A51, 887-897)
;

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'Enhance (Mo) X-ray Source'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Xcalibur, Ruby'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean 10.35
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            26833
_diffrn_reflns_av_R_equivalents  0.0500
_diffrn_reflns_av_sigmaI/netI    0.0638
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_theta_min         2.70
_diffrn_reflns_theta_max         26.00
_reflns_number_total             9836
_reflns_number_gt                8050
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0306P)²+31.0897P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         9836
_refine_ls_number_parameters     685
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0753
_refine_ls_R_factor_gt           0.0590
_refine_ls_wR_factor_ref         0.1397
_refine_ls_wR_factor_gt          0.1319
_refine_ls_goodness_of_fit_ref   1.128
_refine_ls_restrained_S_all      1.128
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
Pd1 Pd 0.28109(6) 0.40628(5) 0.68414(3) 0.01707(15) Uani 1 1 d . . .
Ru1 Ru -0.03301(7) 0.46554(5) 0.78545(3) 0.01608(15) Uani 1 1 d . . .
Ru2 Ru -0.24572(7) 0.63333(5) 0.84371(3) 0.01986(16) Uani 1 1 d . . .
Ru3 Ru -0.18997(7) 0.39980(6) 0.90231(3) 0.01881(16) Uani 1 1 d . . .
Ru4 Ru -0.35154(7) 0.48268(6) 0.80929(3) 0.02152(16) Uani 1 1 d . . .
N22 N 0.3499(7) 0.2444(5) 0.7262(3) 0.0168(14) Uani 1 1 d . . .
N23 N 0.3340(7) 0.3572(6) 0.6025(3) 0.0201(14) Uani 1 1 d . . .
N24 N 0.2163(7) 0.5683(5) 0.6413(3) 0.0196(14) Uani 1 1 d . . .
C1 C 0.1409(8) 0.5666(6) 0.7731(4) 0.0161(16) Uani 1 1 d . . .
C2 C 0.0616(8) 0.5631(7) 0.8345(4) 0.0187(17) Uani 1 1 d . . .
C2A C -0.0264(9) 0.6618(7) 0.8598(4) 0.0195(17) Uani 1 1 d . . .
H2A H -0.0034 0.7361 0.8402 0.023 Uiso 1 1 calc R . .
C2B C -0.1294(9) 0.6584(7) 0.9124(4) 0.0223(18) Uani 1 1 d . . .
H2B H -0.1705 0.7295 0.9286 0.027 Uiso 1 1 calc R . .
C2C C -0.1802(9) 0.5599(7) 0.9455(4) 0.0231(18) Uani 1 1 d . . .
H2C H -0.2678 0.5790 0.9734 0.028 Uiso 1 1 d R . .
C3 C 0.0920(9) 0.4456(7) 0.8647(4) 0.0218(18) Uani 1 1 d . . .
C3A C 0.0373(9) 0.3966(7) 0.9267(4) 0.0194(17) Uani 1 1 d . . .
H3A H 0.0986 0.3217 0.9453 0.023 Uiso 1 1 calc R . .
C3B C -0.0824(8) 0.4507(7) 0.9645(4) 0.0204(17) Uani 1 1 d . . .
H3B H -0.0956 0.4143 1.0081 0.025 Uiso 1 1 calc R . .
C4 C 0.1928(8) 0.3799(6) 0.8211(4) 0.0176(16) Uani 1 1 d . . .
C5 C 0.2671(8) 0.2605(7) 0.8330(4) 0.0203(17) Uani 1 1 d . . .
C5A C 0.2799(9) 0.1964(7) 0.8965(4) 0.0208(17) Uani 1 1 d . . .
C5B C 0.3690(9) 0.2194(7) 0.9315(4) 0.0243(18) Uani 1 1 d . . .
H5B H 0.4201 0.2776 0.9153 0.029 Uiso 1 1 calc R . .
C5C C 0.3847(10) 0.1593(7) 0.9893(4) 0.031(2) Uani 1 1 d . . .
H5C H 0.4474 0.1753 1.0124 0.037 Uiso 1 1 calc R . .
C5D C 0.3086(10) 0.0752(8) 1.0137(4) 0.034(2) Uani 1 1 d . . .
H5D H 0.3174 0.0346 1.0539 0.040 Uiso 1 1 calc R . .
C5E C 0.2197(11) 0.0508(7) 0.9791(4) 0.034(2) Uani 1 1 d . . .
H5E H 0.1671 -0.0064 0.9959 0.041 Uiso 1 1 calc R . .
C5F C 0.2071(10) 0.1090(7) 0.9207(4) 0.0258(19) Uani 1 1 d . . .
H5F H 0.1491 0.0898 0.8968 0.031 Uiso 1 1 calc R . .
C6 C 0.3407(8) 0.2037(6) 0.7881(4) 0.0167(16) Uani 1 1 d . . .
C7 C 0.4287(9) 0.0866(6) 0.7977(4) 0.0222(18) Uani 1 1 d . . .
H7 H 0.4447 0.0384 0.8357 0.027 Uiso 1 1 calc R . .
C8 C 0.4824(9) 0.0593(7) 0.7440(4) 0.0220(18) Uani 1 1 d . . .
H8 H 0.5434 -0.0118 0.7368 0.026 Uiso 1 1 calc R . .
C9 C 0.4309(9) 0.1579(7) 0.6983(4) 0.0226(18) Uani 1 1 d . . .
C10 C 0.4578(9) 0.1593(7) 0.6368(4) 0.0214(17) Uani 1 1 d . . .
C10A C 0.5490(10) 0.0532(7) 0.6160(4) 0.028(2) Uani 1 1 d . . .
C10B C 0.4885(12) -0.0376(8) 0.6202(4) 0.036(2) Uani 1 1 d . . .
H10B H 0.3865 -0.0335 0.6370 0.043 Uiso 1 1 calc R . .
C10C C 0.5739(14) -0.1335(8) 0.6004(5) 0.044(3) Uani 1 1 d . . .
H10C H 0.5306 -0.1944 0.6026 0.052 Uiso 1 1 calc R . .
C10D C 0.7235(14) -0.1408(9) 0.5773(5) 0.048(3) Uani 1 1 d . . .
H10D H 0.7828 -0.2076 0.5643 0.058 Uiso 1 1 calc R . .
C10E C 0.7867(13) -0.0543(9) 0.5729(5) 0.046(3) Uani 1 1 d . . .
H10E H 0.8896 -0.0608 0.5569 0.056 Uiso 1 1 calc R . .
C10F C 0.7000(11) 0.0455(9) 0.5921(5) 0.039(2) Uani 1 1 d . . .
H10F H 0.7437 0.1067 0.5888 0.047 Uiso 1 1 calc R . .
C11 C 0.4044(9) 0.2498(7) 0.5929(4) 0.0242(18) Uani 1 1 d . . .
C12 C 0.4116(10) 0.2482(8) 0.5297(4) 0.028(2) Uani 1 1 d . . .
H12 H 0.4561 0.1847 0.5112 0.034 Uiso 1 1 calc R . .
C13 C 0.3453(9) 0.3510(8) 0.5017(4) 0.0256(19) Uani 1 1 d . . .
H13 H 0.3304 0.3739 0.4604 0.031 Uiso 1 1 calc R . .
C14 C 0.3000(9) 0.4212(8) 0.5474(4) 0.0259(19) Uani 1 1 d . . .
C15 C 0.2447(8) 0.5379(7) 0.5364(4) 0.0212(18) Uani 1 1 d . . .
C15A C 0.2094(10) 0.5984(7) 0.4755(4) 0.0267(19) Uani 1 1 d . . .
C15B C 0.3182(9) 0.6031(7) 0.4257(4) 0.0268(19) Uani 1 1 d . . .
H15B H 0.4193 0.5636 0.4304 0.032 Uiso 1 1 calc R . .
C15C C 0.2846(13) 0.6634(9) 0.3694(4) 0.042(3) Uani 1 1 d . . .
H15C H 0.3615 0.6641 0.3358 0.050 Uiso 1 1 calc R . .
C15D C 0.1382(13) 0.7228(8) 0.3623(4) 0.042(3) Uani 1 1 d . . .
H15D H 0.1148 0.7680 0.3243 0.050 Uiso 1 1 calc R . .
C15E C 0.0272(13) 0.7159(9) 0.4104(5) 0.049(3) Uani 1 1 d . . .
H15E H -0.0742 0.7531 0.4049 0.059 Uiso 1 1 calc R . .
C15F C 0.0609(11) 0.6556(8) 0.4667(4) 0.036(2) Uani 1 1 d . . .
H15F H -0.0172 0.6528 0.4997 0.043 Uiso 1 1 calc R . .
C16 C 0.2205(8) 0.6029(7) 0.5809(4) 0.0220(18) Uani 1 1 d . . .
C17 C 0.2011(9) 0.7254(7) 0.5660(4) 0.0265(19) Uani 1 1 d . . .
H17 H 0.1999 0.7712 0.5267 0.032 Uiso 1 1 calc R . .
C18 C 0.1852(9) 0.7612(7) 0.6177(4) 0.0259(19) Uani 1 1 d . . .
H18 H 0.1753 0.8365 0.6215 0.031 Uiso 1 1 calc R . .
C19 C 0.1857(8) 0.6646(7) 0.6669(4) 0.0205(18) Uani 1 1 d . . .
C20 C 0.1498(8) 0.6677(7) 0.7263(4) 0.0196(17) Uani 1 1 d . . .
C20A C 0.1288(9) 0.7776(7) 0.7447(4) 0.0235(18) Uani 1 1 d . . .
C20B C 0.2269(10) 0.7881(7) 0.7797(4) 0.028(2) Uani 1 1 d . . .
H20B H 0.3086 0.7262 0.7908 0.033 Uiso 1 1 calc R . .
C20C C 0.2070(14) 0.8888(8) 0.7988(5) 0.050(3) Uani 1 1 d . . .
H20C H 0.2752 0.8957 0.8227 0.060 Uiso 1 1 calc R . .
C20D C 0.0886(17) 0.9782(9) 0.7830(6) 0.069(4) Uani 1 1 d . . .
H20D H 0.0744 1.0465 0.7965 0.083 Uiso 1 1 calc R . .
C20E C -0.0101(15) 0.9695(8) 0.7476(6) 0.056(3) Uani 1 1 d . . .
H20E H -0.0918 1.0316 0.7367 0.067 Uiso 1 1 calc R . .
C20F C 0.0110(10) 0.8687(7) 0.7278(4) 0.031(2) Uani 1 1 d . . .
H20F H -0.0553 0.8627 0.7028 0.037 Uiso 1 1 calc R . .
C21 C 0.2159(8) 0.4532(7) 0.7635(3) 0.0182(16) Uani 1 1 d . . .
C22 C -0.1051(9) 0.5320(7) 0.7093(4) 0.0217(18) Uani 1 1 d . . .
O22 O -0.1317(6) 0.5719(5) 0.6622(3) 0.0282(14) Uani 1 1 d . . .
C23 C -0.2763(9) 0.7285(7) 0.7694(4) 0.0245(19) Uani 1 1 d . . .
O23 O -0.2984(7) 0.7893(5) 0.7246(3) 0.0340(15) Uani 1 1 d . . .
C24 C -0.4232(11) 0.7255(8) 0.8730(4) 0.030(2) Uani 1 1 d . . .
O24 O -0.5333(7) 0.7865(6) 0.8887(3) 0.0401(17) Uani 1 1 d . . .
C25 C -0.3587(9) 0.3859(8) 0.9581(4) 0.0271(19) Uani 1 1 d . . .
O25 O -0.4582(7) 0.3738(5) 0.9937(3) 0.0360(16) Uani 1 1 d . . .
C26 C -0.1638(9) 0.2463(7) 0.9047(4) 0.0237(18) Uani 1 1 d . . .
O26 O -0.1542(7) 0.1541(5) 0.9063(3) 0.0361(16) Uani 1 1 d . . .
C27 C -0.0587(9) 0.3273(7) 0.7783(4) 0.0230(18) Uani 1 1 d . . .
O27 O -0.0511(7) 0.2390(5) 0.7721(3) 0.0299(14) Uani 1 1 d . . .
C28 C -0.4311(9) 0.5655(8) 0.7363(4) 0.027(2) Uani 1 1 d . . .
O28 O -0.4793(7) 0.6112(6) 0.6929(3) 0.0365(16) Uani 1 1 d . . .
C29 C -0.5293(9) 0.5199(7) 0.8604(4) 0.0258(19) Uani 1 1 d . . .
O29 O -0.6416(6) 0.5399(5) 0.8918(3) 0.0317(15) Uani 1 1 d . . .
C30 C -0.3720(9) 0.3417(8) 0.7997(4) 0.028(2) Uani 1 1 d . . .
O30 O -0.3804(7) 0.2563(6) 0.7947(3) 0.0402(17) Uani 1 1 d . . .


_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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
Pd1 C21 1.986(8) . ?
Pd1 N22 2.017(6) . ?
Pd1 N24 2.020(7) . ?
Pd1 N23 2.046(7) . ?
Ru1 C27 1.871(8) . ?
Ru1 C22 1.911(9) . ?
Ru1 C21 2.254(7) . ?
Ru1 C1 2.269(7) . ?
Ru1 C3 2.274(8) . ?
Ru1 C2 2.282(8) . ?
Ru1 C4 2.292(8) . ?
Ru1 Ru3 2.8602(11) . ?
Ru1 Ru2 2.8646(12) . ?
Ru1 Ru4 2.8782(11) . ?
Ru2 C24 1.851(10) . ?
Ru2 C23 1.859(9) . ?
Ru2 C2B 2.205(8) . ?
Ru2 C2A 2.286(8) . ?
Ru2 C2C 2.431(9) . ?
Ru2 Ru4 2.6954(11) . ?
Ru2 Ru3 2.8740(12) . ?
Ru3 C25 1.856(8) . ?
Ru3 C26 1.869(9) . ?
Ru3 C3B 2.193(8) . ?
Ru3 C3A 2.285(7) . ?
Ru3 C2C 2.481(8) . ?
Ru3 Ru4 2.6883(12) . ?
Ru4 C29 1.857(9) . ?
Ru4 C30 1.906(9) . ?
Ru4 C28 1.915(9) . ?
N22 C9 1.364(10) . ?
N22 C6 1.388(10) . ?
N23 C14 1.370(11) . ?
N23 C11 1.378(10) . ?
N24 C16 1.350(10) . ?
N24 C19 1.408(10) . ?
C1 C21 1.453(11) . ?
C1 C2 1.462(11) . ?
C1 C20 1.469(11) . ?
C2 C3 1.450(11) . ?
C2 C2A 1.468(11) . ?
C2A C2B 1.395(11) . ?
C2A H2A 1.0000 . ?
C2B C2C 1.444(11) . ?
C2B H2B 1.0000 . ?
C2C C3B 1.443(12) . ?
C2C H2C 0.9500 . ?
C3 C3A 1.469(11) . ?
C3 C4 1.476(11) . ?
C3A C3B 1.398(11) . ?
C3A H3A 1.0000 . ?
C3B H3B 1.0000 . ?
C4 C21 1.440(11) . ?
C4 C5 1.453(11) . ?
C5 C6 1.362(11) . ?
C5 C5A 1.501(11) . ?
C5A C5B 1.386(12) . ?
C5A C5F 1.403(11) . ?
C5B C5C 1.376(12) . ?
C5B H5B 0.9500 . ?
C5C C5D 1.388(13) . ?
C5C H5C 0.9500 . ?
C5D C5E 1.388(14) . ?
C5D H5D 0.9500 . ?
C5E C5F 1.379(12) . ?
C5E H5E 0.9500 . ?
C5F H5F 0.9500 . ?
C6 C7 1.462(11) . ?
C7 C8 1.329(12) . ?
C7 H7 0.9500 . ?
C8 C9 1.454(11) . ?
C8 H8 0.9500 . ?
C9 C10 1.386(12) . ?
C10 C11 1.375(12) . ?
C10 C10A 1.502(11) . ?
C10A C10B 1.388(13) . ?
C10A C10F 1.399(13) . ?
C10B C10C 1.374(13) . ?
C10B H10B 0.9500 . ?
C10C C10D 1.384(16) . ?
C10C H10C 0.9500 . ?
C10D C10E 1.352(16) . ?
C10D H10D 0.9500 . ?
C10E C10F 1.411(13) . ?
C10E H10E 0.9500 . ?
C10F H10F 0.9500 . ?
C11 C12 1.448(12) . ?
C12 C13 1.334(12) . ?
C12 H12 0.9500 . ?
C13 C14 1.460(12) . ?
C13 H13 0.9500 . ?
C14 C15 1.393(12) . ?
C15 C16 1.405(12) . ?
C15 C15A 1.476(12) . ?
C15A C15B 1.381(11) . ?
C15A C15F 1.401(13) . ?
C15B C15C 1.380(13) . ?
C15B H15B 0.9500 . ?
C15C C15D 1.383(15) . ?
C15C H15C 0.9500 . ?
C15D C15E 1.370(15) . ?
C15D H15D 0.9500 . ?
C15E C15F 1.380(14) . ?
C15E H15E 0.9500 . ?
C15F H15F 0.9500 . ?
C16 C17 1.465(12) . ?
C17 C18 1.337(12) . ?
C17 H17 0.9500 . ?
C18 C19 1.450(11) . ?
C18 H18 0.9500 . ?
C19 C20 1.351(12) . ?
C20 C20A 1.493(11) . ?
C20A C20B 1.380(12) . ?
C20A C20F 1.387(12) . ?
C20B C20C 1.393(12) . ?
C20B H20B 0.9500 . ?
C20C C20D 1.373(16) . ?
C20C H20C 0.9500 . ?
C20D C20E 1.382(15) . ?
C20D H20D 0.9500 . ?
C20E C20F 1.400(13) . ?
C20E H20E 0.9500 . ?
C20F H20F 0.9500 . ?
C22 O22 1.123(10) . ?
C23 O23 1.144(10) . ?
C24 O24 1.153(11) . ?
C25 O25 1.134(10) . ?
C26 O26 1.131(10) . ?
C27 O27 1.136(10) . ?
C28 O28 1.133(10) . ?
C29 O29 1.157(10) . ?
C30 O30 1.134(11) . ?

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
C21 Pd1 N22 90.3(3) . . ?
C21 Pd1 N24 90.2(3) . . ?
N22 Pd1 N24 178.9(3) . . ?
C21 Pd1 N23 176.2(3) . . ?
N22 Pd1 N23 90.0(3) . . ?
N24 Pd1 N23 89.6(3) . . ?
C27 Ru1 C22 89.1(4) . . ?
C27 Ru1 C21 106.0(3) . . ?
C22 Ru1 C21 103.2(3) . . ?
C27 Ru1 C1 143.3(3) . . ?
C22 Ru1 C1 96.4(3) . . ?
C21 Ru1 C1 37.5(3) . . ?
C27 Ru1 C3 111.5(3) . . ?
C22 Ru1 C3 157.6(3) . . ?
C21 Ru1 C3 63.6(3) . . ?
C1 Ru1 C3 61.9(3) . . ?
C27 Ru1 C2 148.6(3) . . ?
C22 Ru1 C2 121.7(3) . . ?
C21 Ru1 C2 63.7(3) . . ?
C1 Ru1 C2 37.5(3) . . ?
C3 Ru1 C2 37.1(3) . . ?
C27 Ru1 C4 91.6(3) . . ?
C22 Ru1 C4 138.0(3) . . ?
C21 Ru1 C4 36.9(3) . . ?
C1 Ru1 C4 60.7(3) . . ?
C3 Ru1 C4 37.7(3) . . ?
C2 Ru1 C4 61.9(3) . . ?
C27 Ru1 Ru3 79.7(3) . . ?
C22 Ru1 Ru3 130.8(2) . . ?
C21 Ru1 Ru3 126.0(2) . . ?
C1 Ru1 Ru3 120.7(2) . . ?
C3 Ru1 Ru3 64.59(19) . . ?
C2 Ru1 Ru3 83.7(2) . . ?
C4 Ru1 Ru3 90.4(2) . . ?
C27 Ru1 Ru2 127.1(3) . . ?
C22 Ru1 Ru2 92.4(3) . . ?
C21 Ru1 Ru2 124.9(2) . . ?
C1 Ru1 Ru2 88.98(19) . . ?
C3 Ru1 Ru2 82.4(2) . . ?
C2 Ru1 Ru2 63.2(2) . . ?
C4 Ru1 Ru2 119.55(19) . . ?
Ru3 Ru1 Ru2 60.27(3) . . ?
C27 Ru1 Ru4 73.7(3) . . ?
C22 Ru1 Ru4 75.0(2) . . ?
C21 Ru1 Ru4 178.1(2) . . ?
C1 Ru1 Ru4 142.71(19) . . ?
C3 Ru1 Ru4 118.3(2) . . ?
C2 Ru1 Ru4 117.6(2) . . ?
C4 Ru1 Ru4 144.70(19) . . ?
Ru3 Ru1 Ru4 55.87(3) . . ?
Ru2 Ru1 Ru4 55.98(3) . . ?
C24 Ru2 C23 85.2(4) . . ?
C24 Ru2 C2B 90.5(3) . . ?
C23 Ru2 C2B 126.0(3) . . ?
C24 Ru2 C2A 117.1(3) . . ?
C23 Ru2 C2A 101.6(3) . . ?
C2B Ru2 C2A 36.1(3) . . ?
C24 Ru2 C2C 90.6(3) . . ?
C23 Ru2 C2C 161.5(3) . . ?
C2B Ru2 C2C 35.9(3) . . ?
C2A Ru2 C2C 64.5(3) . . ?
C24 Ru2 Ru4 100.8(3) . . ?
C23 Ru2 Ru4 88.9(3) . . ?
C2B Ru2 Ru4 144.2(2) . . ?
C2A Ru2 Ru4 141.12(19) . . ?
C2C Ru2 Ru4 109.53(19) . . ?
C24 Ru2 Ru1 162.8(3) . . ?
C23 Ru2 Ru1 90.8(3) . . ?
C2B Ru2 Ru1 105.3(2) . . ?
C2A Ru2 Ru1 80.10(19) . . ?
C2C Ru2 Ru1 98.25(19) . . ?
Ru4 Ru2 Ru1 62.26(3) . . ?
C24 Ru2 Ru3 115.6(3) . . ?
C23 Ru2 Ru3 142.3(3) . . ?
C2B Ru2 Ru3 86.8(2) . . ?
C2A Ru2 Ru3 96.1(2) . . ?
C2C Ru2 Ru3 55.01(19) . . ?
Ru4 Ru2 Ru3 57.61(3) . . ?
Ru1 Ru2 Ru3 59.79(3) . . ?
C25 Ru3 C26 84.8(4) . . ?
C25 Ru3 C3B 93.4(3) . . ?
C26 Ru3 C3B 119.0(3) . . ?
C25 Ru3 C3A 124.3(3) . . ?
C26 Ru3 C3A 99.9(3) . . ?
C3B Ru3 C3A 36.3(3) . . ?
C25 Ru3 C2C 87.7(3) . . ?
C26 Ru3 C2C 152.7(3) . . ?
C3B Ru3 C2C 35.3(3) . . ?
C3A Ru3 C2C 63.4(3) . . ?
C25 Ru3 Ru4 92.9(3) . . ?
C26 Ru3 Ru4 98.4(3) . . ?
C3B Ru3 Ru4 142.4(2) . . ?
C3A Ru3 Ru4 139.6(2) . . ?
C2C Ru3 Ru4 108.2(2) . . ?
C25 Ru3 Ru1 155.2(3) . . ?
C26 Ru3 Ru1 100.6(2) . . ?
C3B Ru3 Ru1 104.6(2) . . ?
C3A Ru3 Ru1 78.9(2) . . ?
C2C Ru3 Ru1 97.2(2) . . ?
Ru4 Ru3 Ru1 62.41(3) . . ?
C25 Ru3 Ru2 105.9(3) . . ?
C26 Ru3 Ru2 153.7(3) . . ?
C3B Ru3 Ru2 84.8(2) . . ?
C3A Ru3 Ru2 93.7(2) . . ?
C2C Ru3 Ru2 53.4(2) . . ?
Ru4 Ru3 Ru2 57.86(3) . . ?
Ru1 Ru3 Ru2 59.94(3) . . ?
C29 Ru4 C30 97.7(4) . . ?
C29 Ru4 C28 95.9(4) . . ?
C30 Ru4 C28 94.4(4) . . ?
C29 Ru4 Ru3 92.2(3) . . ?
C30 Ru4 Ru3 96.6(3) . . ?
C28 Ru4 Ru3 165.4(2) . . ?
C29 Ru4 Ru2 89.8(3) . . ?
C30 Ru4 Ru2 160.1(3) . . ?
C28 Ru4 Ru2 103.2(3) . . ?
Ru3 Ru4 Ru2 64.53(3) . . ?
C29 Ru4 Ru1 147.0(3) . . ?
C30 Ru4 Ru1 104.7(3) . . ?
C28 Ru4 Ru1 106.1(2) . . ?
Ru3 Ru4 Ru1 61.73(3) . . ?
Ru2 Ru4 Ru1 61.75(3) . . ?
C9 N22 C6 107.8(6) . . ?
C9 N22 Pd1 125.1(5) . . ?
C6 N22 Pd1 126.7(5) . . ?
C14 N23 C11 106.4(7) . . ?
C14 N23 Pd1 127.6(6) . . ?
C11 N23 Pd1 126.0(6) . . ?
C16 N24 C19 107.9(7) . . ?
C16 N24 Pd1 124.8(5) . . ?
C19 N24 Pd1 126.4(5) . . ?
C21 C1 C2 110.4(7) . . ?
C21 C1 C20 122.7(7) . . ?
C2 C1 C20 126.9(7) . . ?
C21 C1 Ru1 70.7(4) . . ?
C2 C1 Ru1 71.7(4) . . ?
C20 C1 Ru1 125.1(5) . . ?
C3 C2 C1 106.7(7) . . ?
C3 C2 C2A 127.9(7) . . ?
C1 C2 C2A 125.3(7) . . ?
C3 C2 Ru1 71.2(4) . . ?
C1 C2 Ru1 70.8(4) . . ?
C2A C2 Ru1 124.8(5) . . ?
C2B C2A C2 125.1(7) . . ?
C2B C2A Ru2 68.7(4) . . ?
C2 C2A Ru2 91.1(5) . . ?
C2B C2A H2A 117.3 . . ?
C2 C2A H2A 117.3 . . ?
Ru2 C2A H2A 117.3 . . ?
C2A C2B C2C 125.0(7) . . ?
C2A C2B Ru2 75.1(5) . . ?
C2C C2B Ru2 80.6(5) . . ?
C2A C2B H2B 117.5 . . ?
C2C C2B H2B 117.5 . . ?
Ru2 C2B H2B 117.5 . . ?
C3B C2C C2B 124.6(7) . . ?
C3B C2C Ru2 124.2(6) . . ?
C2B C2C Ru2 63.5(4) . . ?
C3B C2C Ru3 61.4(4) . . ?
C2B C2C Ru3 125.7(6) . . ?
Ru2 C2C Ru3 71.6(2) . . ?
C3B C2C H2C 114.4 . . ?
C2B C2C H2C 111.7 . . ?
Ru2 C2C H2C 108.5 . . ?
Ru3 C2C H2C 110.2 . . ?
C2 C3 C3A 128.4(7) . . ?
C2 C3 C4 107.1(7) . . ?
C3A C3 C4 124.5(7) . . ?
C2 C3 Ru1 71.7(4) . . ?
C3A C3 Ru1 122.2(5) . . ?
C4 C3 Ru1 71.8(4) . . ?
C3B C3A C3 125.9(8) . . ?
C3B C3A Ru3 68.3(4) . . ?
C3 C3A Ru3 93.3(5) . . ?
C3B C3A H3A 116.9 . . ?
C3 C3A H3A 116.9 . . ?
Ru3 C3A H3A 116.9 . . ?
C3A C3B C2C 124.2(8) . . ?
C3A C3B Ru3 75.4(5) . . ?
C2C C3B Ru3 83.4(5) . . ?
C3A C3B H3B 117.8 . . ?
C2C C3B H3B 117.8 . . ?
Ru3 C3B H3B 117.8 . . ?
C21 C4 C5 123.1(7) . . ?
C21 C4 C3 109.9(7) . . ?
C5 C4 C3 127.0(7) . . ?
C21 C4 Ru1 70.1(4) . . ?
C5 C4 Ru1 128.4(5) . . ?
C3 C4 Ru1 70.5(4) . . ?
C6 C5 C4 122.6(7) . . ?
C6 C5 C5A 116.5(7) . . ?
C4 C5 C5A 120.6(7) . . ?
C5B C5A C5F 118.9(8) . . ?
C5B C5A C5 120.6(7) . . ?
C5F C5A C5 120.5(7) . . ?
C5C C5B C5A 121.1(8) . . ?
C5C C5B H5B 119.4 . . ?
C5A C5B H5B 119.4 . . ?
C5B C5C C5D 119.8(9) . . ?
C5B C5C H5C 120.1 . . ?
C5D C5C H5C 120.1 . . ?
C5C C5D C5E 119.7(9) . . ?
C5C C5D H5D 120.1 . . ?
C5E C5D H5D 120.1 . . ?
C5F C5E C5D 120.5(8) . . ?
C5F C5E H5E 119.8 . . ?
C5D C5E H5E 119.8 . . ?
C5E C5F C5A 119.9(9) . . ?
C5E C5F H5F 120.0 . . ?
C5A C5F H5F 120.0 . . ?
C5 C6 N22 127.7(7) . . ?
C5 C6 C7 124.9(8) . . ?
N22 C6 C7 107.4(7) . . ?
C8 C7 C6 108.2(7) . . ?
C8 C7 H7 125.9 . . ?
C6 C7 H7 125.9 . . ?
C7 C8 C9 107.5(7) . . ?
C7 C8 H8 126.3 . . ?
C9 C8 H8 126.3 . . ?
N22 C9 C10 126.9(7) . . ?
N22 C9 C8 109.0(7) . . ?
C10 C9 C8 124.0(7) . . ?
C11 C10 C9 125.2(8) . . ?
C11 C10 C10A 116.9(8) . . ?
C9 C10 C10A 117.9(7) . . ?
C10B C10A C10F 119.0(9) . . ?
C10B C10A C10 122.0(8) . . ?
C10F C10A C10 118.9(8) . . ?
C10C C10B C10A 120.9(10) . . ?
C10C C10B H10B 119.5 . . ?
C10A C10B H10B 119.5 . . ?
C10B C10C C10D 119.6(10) . . ?
C10B C10C H10C 120.2 . . ?
C10D C10C H10C 120.2 . . ?
C10E C10D C10C 121.1(10) . . ?
C10E C10D H10D 119.4 . . ?
C10C C10D H10D 119.4 . . ?
C10D C10E C10F 120.1(11) . . ?
C10D C10E H10E 120.0 . . ?
C10F C10E H10E 120.0 . . ?
C10A C10F C10E 119.2(10) . . ?
C10A C10F H10F 120.4 . . ?
C10E C10F H10F 120.4 . . ?
C10 C11 N23 125.1(8) . . ?
C10 C11 C12 126.0(8) . . ?
N23 C11 C12 108.9(7) . . ?
C13 C12 C11 108.4(8) . . ?
C13 C12 H12 125.8 . . ?
C11 C12 H12 125.8 . . ?
C12 C13 C14 106.2(8) . . ?
C12 C13 H13 126.9 . . ?
C14 C13 H13 126.9 . . ?
N23 C14 C15 124.1(8) . . ?
N23 C14 C13 110.0(8) . . ?
C15 C14 C13 125.6(8) . . ?
C14 C15 C16 123.1(8) . . ?
C14 C15 C15A 119.6(8) . . ?
C16 C15 C15A 117.3(7) . . ?
C15B C15A C15F 117.5(8) . . ?
C15B C15A C15 122.6(8) . . ?
C15F C15A C15 120.0(8) . . ?
C15C C15B C15A 122.1(9) . . ?
C15C C15B H15B 119.0 . . ?
C15A C15B H15B 119.0 . . ?
C15B C15C C15D 119.5(9) . . ?
C15B C15C H15C 120.3 . . ?
C15D C15C H15C 120.3 . . ?
C15E C15D C15C 119.6(9) . . ?
C15E C15D H15D 120.2 . . ?
C15C C15D H15D 120.2 . . ?
C15D C15E C15F 120.8(10) . . ?
C15D C15E H15E 119.6 . . ?
C15F C15E H15E 119.6 . . ?
C15E C15F C15A 120.5(9) . . ?
C15E C15F H15F 119.7 . . ?
C15A C15F H15F 119.7 . . ?
N24 C16 C15 128.9(7) . . ?
N24 C16 C17 108.7(7) . . ?
C15 C16 C17 122.4(8) . . ?
C18 C17 C16 107.8(8) . . ?
C18 C17 H17 126.1 . . ?
C16 C17 H17 126.1 . . ?
C17 C18 C19 107.8(8) . . ?
C17 C18 H18 126.1 . . ?
C19 C18 H18 126.1 . . ?
C20 C19 N24 126.0(7) . . ?
C20 C19 C18 126.1(8) . . ?
N24 C19 C18 107.6(7) . . ?
C19 C20 C1 122.7(7) . . ?
C19 C20 C20A 117.9(7) . . ?
C1 C20 C20A 119.3(7) . . ?
C20B C20A C20F 119.6(8) . . ?
C20B C20A C20 119.5(8) . . ?
C20F C20A C20 121.0(8) . . ?
C20A C20B C20C 120.4(9) . . ?
C20A C20B H20B 119.8 . . ?
C20C C20B H20B 119.8 . . ?
C20D C20C C20B 119.9(10) . . ?
C20D C20C H20C 120.1 . . ?
C20B C20C H20C 120.1 . . ?
C20C C20D C20E 120.5(10) . . ?
C20C C20D H20D 119.7 . . ?
C20E C20D H20D 119.7 . . ?
C20D C20E C20F 119.6(10) . . ?
C20D C20E H20E 120.2 . . ?
C20F C20E H20E 120.2 . . ?
C20A C20F C20E 120.0(9) . . ?
C20A C20F H20F 120.0 . . ?
C20E C20F H20F 120.0 . . ?
C4 C21 C1 105.6(7) . . ?
C4 C21 Pd1 126.0(6) . . ?
C1 C21 Pd1 126.1(6) . . ?
C4 C21 Ru1 73.0(4) . . ?
C1 C21 Ru1 71.8(4) . . ?
Pd1 C21 Ru1 106.8(3) . . ?
O22 C22 Ru1 172.4(7) . . ?
O23 C23 Ru2 177.9(8) . . ?
O24 C24 Ru2 176.8(8) . . ?
O25 C25 Ru3 177.2(9) . . ?
O26 C26 Ru3 177.1(8) . . ?
O27 C27 Ru1 169.6(7) . . ?
O28 C28 Ru4 177.6(8) . . ?
O29 C29 Ru4 177.5(7) . . ?
O30 C30 Ru4 178.0(8) . . ?

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
C27 Ru1 Ru2 C24 -32.8(10) . . . . ?
C22 Ru1 Ru2 C24 57.8(10) . . . . ?
C21 Ru1 Ru2 C24 165.7(10) . . . . ?
C1 Ru1 Ru2 C24 154.2(10) . . . . ?
C3 Ru1 Ru2 C24 -144.0(10) . . . . ?
C2 Ru1 Ru2 C24 -177.5(10) . . . . ?
C4 Ru1 Ru2 C24 -150.7(10) . . . . ?
Ru3 Ru1 Ru2 C24 -79.0(9) . . . . ?
Ru4 Ru1 Ru2 C24 -12.2(9) . . . . ?
C27 Ru1 Ru2 C23 -109.0(4) . . . . ?
C22 Ru1 Ru2 C23 -18.3(3) . . . . ?
C21 Ru1 Ru2 C23 89.6(4) . . . . ?
C1 Ru1 Ru2 C23 78.0(3) . . . . ?
C3 Ru1 Ru2 C23 139.8(3) . . . . ?
C2 Ru1 Ru2 C23 106.3(3) . . . . ?
C4 Ru1 Ru2 C23 133.1(3) . . . . ?
Ru3 Ru1 Ru2 C23 -155.2(3) . . . . ?
Ru4 Ru1 Ru2 C23 -88.4(3) . . . . ?
C27 Ru1 Ru2 C2B 123.2(4) . . . . ?
C22 Ru1 Ru2 C2B -146.2(3) . . . . ?
C21 Ru1 Ru2 C2B -38.3(3) . . . . ?
C1 Ru1 Ru2 C2B -49.8(3) . . . . ?
C3 Ru1 Ru2 C2B 12.0(3) . . . . ?
C2 Ru1 Ru2 C2B -21.5(3) . . . . ?
C4 Ru1 Ru2 C2B 5.2(3) . . . . ?
Ru3 Ru1 Ru2 C2B 77.0(2) . . . . ?
Ru4 Ru1 Ru2 C2B 143.8(2) . . . . ?
C27 Ru1 Ru2 C2A 149.3(4) . . . . ?
C22 Ru1 Ru2 C2A -120.0(3) . . . . ?
C21 Ru1 Ru2 C2A -12.1(3) . . . . ?
C1 Ru1 Ru2 C2A -23.7(3) . . . . ?
C3 Ru1 Ru2 C2A 38.1(3) . . . . ?
C2 Ru1 Ru2 C2A 4.6(3) . . . . ?
C4 Ru1 Ru2 C2A 31.4(3) . . . . ?
Ru3 Ru1 Ru2 C2A 103.1(2) . . . . ?
Ru4 Ru1 Ru2 C2A 169.9(2) . . . . ?
C27 Ru1 Ru2 C2C 87.2(4) . . . . ?
C22 Ru1 Ru2 C2C 177.9(3) . . . . ?
C21 Ru1 Ru2 C2C -74.2(3) . . . . ?
C1 Ru1 Ru2 C2C -85.8(3) . . . . ?
C3 Ru1 Ru2 C2C -24.0(3) . . . . ?
C2 Ru1 Ru2 C2C -57.5(3) . . . . ?
C4 Ru1 Ru2 C2C -30.7(3) . . . . ?
Ru3 Ru1 Ru2 C2C 41.00(19) . . . . ?
Ru4 Ru1 Ru2 C2C 107.79(19) . . . . ?
C27 Ru1 Ru2 Ru4 -20.6(3) . . . . ?
C22 Ru1 Ru2 Ru4 70.1(2) . . . . ?
C21 Ru1 Ru2 Ru4 178.0(2) . . . . ?
C1 Ru1 Ru2 Ru4 166.4(2) . . . . ?
C3 Ru1 Ru2 Ru4 -131.81(19) . . . . ?
C2 Ru1 Ru2 Ru4 -165.3(2) . . . . ?
C4 Ru1 Ru2 Ru4 -138.5(2) . . . . ?
Ru3 Ru1 Ru2 Ru4 -66.79(3) . . . . ?
C27 Ru1 Ru2 Ru3 46.2(3) . . . . ?
C22 Ru1 Ru2 Ru3 136.9(2) . . . . ?
C21 Ru1 Ru2 Ru3 -115.3(2) . . . . ?
C1 Ru1 Ru2 Ru3 -126.8(2) . . . . ?
C3 Ru1 Ru2 Ru3 -65.02(19) . . . . ?
C2 Ru1 Ru2 Ru3 -98.5(2) . . . . ?
C4 Ru1 Ru2 Ru3 -71.7(2) . . . . ?
Ru4 Ru1 Ru2 Ru3 66.79(3) . . . . ?
C27 Ru1 Ru3 C25 -84.0(7) . . . . ?
C22 Ru1 Ru3 C25 -4.3(7) . . . . ?
C21 Ru1 Ru3 C25 173.7(7) . . . . ?
C1 Ru1 Ru3 C25 128.9(7) . . . . ?
C3 Ru1 Ru3 C25 156.1(7) . . . . ?
C2 Ru1 Ru3 C25 122.8(7) . . . . ?
C4 Ru1 Ru3 C25 -175.5(7) . . . . ?
Ru2 Ru1 Ru3 C25 60.2(7) . . . . ?
Ru4 Ru1 Ru3 C25 -6.8(7) . . . . ?
C27 Ru1 Ru3 C26 16.8(4) . . . . ?
C22 Ru1 Ru3 C26 96.5(4) . . . . ?
C21 Ru1 Ru3 C26 -85.5(4) . . . . ?
C1 Ru1 Ru3 C26 -130.3(3) . . . . ?
C3 Ru1 Ru3 C26 -103.1(4) . . . . ?
C2 Ru1 Ru3 C26 -136.4(3) . . . . ?
C4 Ru1 Ru3 C26 -74.7(3) . . . . ?
Ru2 Ru1 Ru3 C26 161.0(3) . . . . ?
Ru4 Ru1 Ru3 C26 94.0(3) . . . . ?
C27 Ru1 Ru3 C3B 140.8(3) . . . . ?
C22 Ru1 Ru3 C3B -139.5(4) . . . . ?
C21 Ru1 Ru3 C3B 38.5(3) . . . . ?
C1 Ru1 Ru3 C3B -6.4(3) . . . . ?
C3 Ru1 Ru3 C3B 20.9(3) . . . . ?
C2 Ru1 Ru3 C3B -12.4(3) . . . . ?
C4 Ru1 Ru3 C3B 49.3(3) . . . . ?
Ru2 Ru1 Ru3 C3B -75.0(2) . . . . ?
Ru4 Ru1 Ru3 C3B -142.0(2) . . . . ?
C27 Ru1 Ru3 C3A 114.9(3) . . . . ?
C22 Ru1 Ru3 C3A -165.4(4) . . . . ?
C21 Ru1 Ru3 C3A 12.6(3) . . . . ?
C1 Ru1 Ru3 C3A -32.2(3) . . . . ?
C3 Ru1 Ru3 C3A -5.0(3) . . . . ?
C2 Ru1 Ru3 C3A -38.3(3) . . . . ?
C4 Ru1 Ru3 C3A 23.4(3) . . . . ?
Ru2 Ru1 Ru3 C3A -100.9(2) . . . . ?
Ru4 Ru1 Ru3 C3A -167.9(2) . . . . ?
C27 Ru1 Ru3 C2C 175.9(3) . . . . ?
C22 Ru1 Ru3 C2C -104.4(4) . . . . ?
C21 Ru1 Ru3 C2C 73.6(3) . . . . ?
C1 Ru1 Ru3 C2C 28.8(3) . . . . ?
C3 Ru1 Ru3 C2C 56.0(3) . . . . ?
C2 Ru1 Ru3 C2C 22.7(3) . . . . ?
C4 Ru1 Ru3 C2C 84.4(3) . . . . ?
Ru2 Ru1 Ru3 C2C -39.9(2) . . . . ?
Ru4 Ru1 Ru3 C2C -106.8(2) . . . . ?
C27 Ru1 Ru3 Ru4 -77.2(3) . . . . ?
C22 Ru1 Ru3 Ru4 2.5(3) . . . . ?
C21 Ru1 Ru3 Ru4 -179.5(2) . . . . ?
C1 Ru1 Ru3 Ru4 135.6(2) . . . . ?
C3 Ru1 Ru3 Ru4 162.9(2) . . . . ?
C2 Ru1 Ru3 Ru4 129.6(2) . . . . ?
C4 Ru1 Ru3 Ru4 -168.73(19) . . . . ?
Ru2 Ru1 Ru3 Ru4 66.97(3) . . . . ?
C27 Ru1 Ru3 Ru2 -144.2(3) . . . . ?
C22 Ru1 Ru3 Ru2 -64.5(3) . . . . ?
C21 Ru1 Ru3 Ru2 113.5(3) . . . . ?
C1 Ru1 Ru3 Ru2 68.7(2) . . . . ?
C3 Ru1 Ru3 Ru2 95.9(2) . . . . ?
C2 Ru1 Ru3 Ru2 62.6(2) . . . . ?
C4 Ru1 Ru3 Ru2 124.29(19) . . . . ?
Ru4 Ru1 Ru3 Ru2 -66.97(3) . . . . ?
C24 Ru2 Ru3 C25 3.4(4) . . . . ?
C23 Ru2 Ru3 C25 -114.4(5) . . . . ?
C2B Ru2 Ru3 C25 92.5(4) . . . . ?
C2A Ru2 Ru3 C25 127.5(3) . . . . ?
C2C Ru2 Ru3 C25 74.7(4) . . . . ?
Ru4 Ru2 Ru3 C25 -83.3(3) . . . . ?
Ru1 Ru2 Ru3 C25 -157.7(3) . . . . ?
C24 Ru2 Ru3 C26 114.9(6) . . . . ?
C23 Ru2 Ru3 C26 -3.0(7) . . . . ?
C2B Ru2 Ru3 C26 -156.1(6) . . . . ?
C2A Ru2 Ru3 C26 -121.1(6) . . . . ?
C2C Ru2 Ru3 C26 -173.9(6) . . . . ?
Ru4 Ru2 Ru3 C26 28.1(6) . . . . ?
Ru1 Ru2 Ru3 C26 -46.3(6) . . . . ?
C24 Ru2 Ru3 C3B -88.6(4) . . . . ?
C23 Ru2 Ru3 C3B 153.5(4) . . . . ?
C2B Ru2 Ru3 C3B 0.4(3) . . . . ?
C2A Ru2 Ru3 C3B 35.4(3) . . . . ?
C2C Ru2 Ru3 C3B -17.4(3) . . . . ?
Ru4 Ru2 Ru3 C3B -175.4(2) . . . . ?
Ru1 Ru2 Ru3 C3B 110.2(2) . . . . ?
C24 Ru2 Ru3 C3A -123.9(4) . . . . ?
C23 Ru2 Ru3 C3A 118.3(4) . . . . ?
C2B Ru2 Ru3 C3A -34.8(3) . . . . ?
C2A Ru2 Ru3 C3A 0.2(3) . . . . ?
C2C Ru2 Ru3 C3A -52.6(3) . . . . ?
Ru4 Ru2 Ru3 C3A 149.4(2) . . . . ?
Ru1 Ru2 Ru3 C3A 74.9(2) . . . . ?
C24 Ru2 Ru3 C2C -71.2(4) . . . . ?
C23 Ru2 Ru3 C2C 170.9(5) . . . . ?
C2B Ru2 Ru3 C2C 17.8(3) . . . . ?
C2A Ru2 Ru3 C2C 52.8(3) . . . . ?
Ru4 Ru2 Ru3 C2C -158.0(2) . . . . ?
Ru1 Ru2 Ru3 C2C 127.6(2) . . . . ?
C24 Ru2 Ru3 Ru4 86.8(3) . . . . ?
C23 Ru2 Ru3 Ru4 -31.1(4) . . . . ?
C2B Ru2 Ru3 Ru4 175.8(2) . . . . ?
C2A Ru2 Ru3 Ru4 -149.2(2) . . . . ?
C2C Ru2 Ru3 Ru4 158.0(2) . . . . ?
Ru1 Ru2 Ru3 Ru4 -74.43(3) . . . . ?
C24 Ru2 Ru3 Ru1 161.2(3) . . . . ?
C23 Ru2 Ru3 Ru1 43.3(4) . . . . ?
C2B Ru2 Ru3 Ru1 -109.8(2) . . . . ?
C2A Ru2 Ru3 Ru1 -74.8(2) . . . . ?
C2C Ru2 Ru3 Ru1 -127.6(2) . . . . ?
Ru4 Ru2 Ru3 Ru1 74.43(3) . . . . ?
C25 Ru3 Ru4 C29 18.3(4) . . . . ?
C26 Ru3 Ru4 C29 103.5(4) . . . . ?
C3B Ru3 Ru4 C29 -81.1(4) . . . . ?
C3A Ru3 Ru4 C29 -140.3(4) . . . . ?
C2C Ru3 Ru4 C29 -70.2(3) . . . . ?
Ru1 Ru3 Ru4 C29 -158.9(3) . . . . ?
Ru2 Ru3 Ru4 C29 -88.7(3) . . . . ?
C25 Ru3 Ru4 C30 -79.7(4) . . . . ?
C26 Ru3 Ru4 C30 5.5(4) . . . . ?
C3B Ru3 Ru4 C30 -179.1(4) . . . . ?
C3A Ru3 Ru4 C30 121.6(4) . . . . ?
C2C Ru3 Ru4 C30 -168.3(3) . . . . ?
Ru1 Ru3 Ru4 C30 103.1(3) . . . . ?
Ru2 Ru3 Ru4 C30 173.3(3) . . . . ?
C25 Ru3 Ru4 C28 141.7(12) . . . . ?
C26 Ru3 Ru4 C28 -133.1(12) . . . . ?
C3B Ru3 Ru4 C28 42.3(12) . . . . ?
C3A Ru3 Ru4 C28 -16.9(12) . . . . ?
C2C Ru3 Ru4 C28 53.2(11) . . . . ?
Ru1 Ru3 Ru4 C28 -35.4(11) . . . . ?
Ru2 Ru3 Ru4 C28 34.8(11) . . . . ?
C25 Ru3 Ru4 Ru2 107.0(3) . . . . ?
C26 Ru3 Ru4 Ru2 -167.8(2) . . . . ?
C3B Ru3 Ru4 Ru2 7.6(3) . . . . ?
C3A Ru3 Ru4 Ru2 -51.6(3) . . . . ?
C2C Ru3 Ru4 Ru2 18.4(2) . . . . ?
Ru1 Ru3 Ru4 Ru2 -70.18(3) . . . . ?
C25 Ru3 Ru4 Ru1 177.1(3) . . . . ?
C26 Ru3 Ru4 Ru1 -97.6(2) . . . . ?
C3B Ru3 Ru4 Ru1 77.8(3) . . . . ?
C3A Ru3 Ru4 Ru1 18.5(3) . . . . ?
C2C Ru3 Ru4 Ru1 88.6(2) . . . . ?
Ru2 Ru3 Ru4 Ru1 70.18(3) . . . . ?
C24 Ru2 Ru4 C29 -21.0(4) . . . . ?
C23 Ru2 Ru4 C29 -105.9(4) . . . . ?
C2B Ru2 Ru4 C29 85.3(5) . . . . ?
C2A Ru2 Ru4 C29 146.7(4) . . . . ?
C2C Ru2 Ru4 C29 73.5(3) . . . . ?
Ru1 Ru2 Ru4 C29 162.7(3) . . . . ?
Ru3 Ru2 Ru4 C29 92.5(3) . . . . ?
C24 Ru2 Ru4 C30 -133.5(8) . . . . ?
C23 Ru2 Ru4 C30 141.6(8) . . . . ?
C2B Ru2 Ru4 C30 -27.1(8) . . . . ?
C2A Ru2 Ru4 C30 34.2(8) . . . . ?
C2C Ru2 Ru4 C30 -38.9(8) . . . . ?
Ru1 Ru2 Ru4 C30 50.2(8) . . . . ?
Ru3 Ru2 Ru4 C30 -19.9(8) . . . . ?
C24 Ru2 Ru4 C28 75.0(4) . . . . ?
C23 Ru2 Ru4 C28 -9.9(4) . . . . ?
C2B Ru2 Ru4 C28 -178.7(5) . . . . ?
C2A Ru2 Ru4 C28 -117.3(4) . . . . ?
C2C Ru2 Ru4 C28 169.5(3) . . . . ?
Ru1 Ru2 Ru4 C28 -101.4(3) . . . . ?
Ru3 Ru2 Ru4 C28 -171.5(3) . . . . ?
C24 Ru2 Ru4 Ru3 -113.5(3) . . . . ?
C23 Ru2 Ru4 Ru3 161.6(3) . . . . ?
C2B Ru2 Ru4 Ru3 -7.2(4) . . . . ?
C2A Ru2 Ru4 Ru3 54.2(3) . . . . ?
C2C Ru2 Ru4 Ru3 -19.0(2) . . . . ?
Ru1 Ru2 Ru4 Ru3 70.14(3) . . . . ?
C24 Ru2 Ru4 Ru1 176.3(3) . . . . ?
C23 Ru2 Ru4 Ru1 91.4(3) . . . . ?
C2B Ru2 Ru4 Ru1 -77.3(4) . . . . ?
C2A Ru2 Ru4 Ru1 -16.0(3) . . . . ?
C2C Ru2 Ru4 Ru1 -89.1(2) . . . . ?
Ru3 Ru2 Ru4 Ru1 -70.14(3) . . . . ?
C27 Ru1 Ru4 C29 129.8(6) . . . . ?
C22 Ru1 Ru4 C29 -136.6(6) . . . . ?
C1 Ru1 Ru4 C29 -56.0(6) . . . . ?
C3 Ru1 Ru4 C29 23.8(6) . . . . ?
C2 Ru1 Ru4 C29 -18.4(5) . . . . ?
C4 Ru1 Ru4 C29 61.2(6) . . . . ?
Ru3 Ru1 Ru4 C29 41.4(5) . . . . ?
Ru2 Ru1 Ru4 C29 -33.2(5) . . . . ?
C27 Ru1 Ru4 C30 -1.3(4) . . . . ?
C22 Ru1 Ru4 C30 92.2(4) . . . . ?
C1 Ru1 Ru4 C30 172.9(4) . . . . ?
C3 Ru1 Ru4 C30 -107.3(4) . . . . ?
C2 Ru1 Ru4 C30 -149.5(4) . . . . ?
C4 Ru1 Ru4 C30 -70.0(4) . . . . ?
Ru3 Ru1 Ru4 C30 -89.7(3) . . . . ?
Ru2 Ru1 Ru4 C30 -164.3(3) . . . . ?
C27 Ru1 Ru4 C28 -100.4(4) . . . . ?
C22 Ru1 Ru4 C28 -6.8(4) . . . . ?
C1 Ru1 Ru4 C28 73.8(4) . . . . ?
C3 Ru1 Ru4 C28 153.6(4) . . . . ?
C2 Ru1 Ru4 C28 111.4(4) . . . . ?
C4 Ru1 Ru4 C28 -169.0(4) . . . . ?
Ru3 Ru1 Ru4 C28 171.2(3) . . . . ?
Ru2 Ru1 Ru4 C28 96.6(3) . . . . ?
C27 Ru1 Ru4 Ru3 88.4(3) . . . . ?
C22 Ru1 Ru4 Ru3 -178.1(3) . . . . ?
C1 Ru1 Ru4 Ru3 -97.4(3) . . . . ?
C3 Ru1 Ru4 Ru3 -17.6(2) . . . . ?
C2 Ru1 Ru4 Ru3 -59.8(2) . . . . ?
C4 Ru1 Ru4 Ru3 19.8(3) . . . . ?
Ru2 Ru1 Ru4 Ru3 -74.61(3) . . . . ?
C27 Ru1 Ru4 Ru2 163.0(3) . . . . ?
C22 Ru1 Ru4 Ru2 -103.4(3) . . . . ?
C1 Ru1 Ru4 Ru2 -22.8(3) . . . . ?
C3 Ru1 Ru4 Ru2 57.0(2) . . . . ?
C2 Ru1 Ru4 Ru2 14.8(2) . . . . ?
C4 Ru1 Ru4 Ru2 94.4(3) . . . . ?
Ru3 Ru1 Ru4 Ru2 74.61(3) . . . . ?
C21 Pd1 N22 C9 -170.8(6) . . . . ?
N23 Pd1 N22 C9 13.0(6) . . . . ?
C21 Pd1 N22 C6 0.6(6) . . . . ?
N23 Pd1 N22 C6 -175.7(6) . . . . ?
N22 Pd1 N23 C14 170.3(7) . . . . ?
N24 Pd1 N23 C14 -10.8(7) . . . . ?
N22 Pd1 N23 C11 -5.7(6) . . . . ?
N24 Pd1 N23 C11 173.2(7) . . . . ?
C21 Pd1 N24 C16 -176.2(6) . . . . ?
N23 Pd1 N24 C16 0.0(6) . . . . ?
C21 Pd1 N24 C19 16.0(6) . . . . ?
N23 Pd1 N24 C19 -167.8(6) . . . . ?
C27 Ru1 C1 C21 -6.3(7) . . . . ?
C22 Ru1 C1 C21 -103.4(5) . . . . ?
C3 Ru1 C1 C21 82.4(5) . . . . ?
C2 Ru1 C1 C21 120.3(6) . . . . ?
C4 Ru1 C1 C21 39.2(4) . . . . ?
Ru3 Ru1 C1 C21 110.3(4) . . . . ?
Ru2 Ru1 C1 C21 164.3(4) . . . . ?
Ru4 Ru1 C1 C21 -176.9(3) . . . . ?
C27 Ru1 C1 C2 -126.6(6) . . . . ?
C22 Ru1 C1 C2 136.3(5) . . . . ?
C21 Ru1 C1 C2 -120.3(6) . . . . ?
C3 Ru1 C1 C2 -37.9(4) . . . . ?
C4 Ru1 C1 C2 -81.1(5) . . . . ?
Ru3 Ru1 C1 C2 -10.0(5) . . . . ?
Ru2 Ru1 C1 C2 44.0(4) . . . . ?
Ru4 Ru1 C1 C2 62.8(6) . . . . ?
C27 Ru1 C1 C20 110.6(7) . . . . ?
C22 Ru1 C1 C20 13.6(7) . . . . ?
C21 Ru1 C1 C20 117.0(8) . . . . ?
C3 Ru1 C1 C20 -160.6(8) . . . . ?
C2 Ru1 C1 C20 -122.7(8) . . . . ?
C4 Ru1 C1 C20 156.2(8) . . . . ?
Ru3 Ru1 C1 C20 -132.7(6) . . . . ?
Ru2 Ru1 C1 C20 -78.7(6) . . . . ?
Ru4 Ru1 C1 C20 -59.9(8) . . . . ?
C21 C1 C2 C3 2.1(8) . . . . ?
C20 C1 C2 C3 -176.8(7) . . . . ?
Ru1 C1 C2 C3 62.5(5) . . . . ?
C21 C1 C2 C2A -179.9(7) . . . . ?
C20 C1 C2 C2A 1.1(12) . . . . ?
Ru1 C1 C2 C2A -119.5(7) . . . . ?
C21 C1 C2 Ru1 -60.4(5) . . . . ?
C20 C1 C2 Ru1 120.7(7) . . . . ?
C27 Ru1 C2 C3 -3.1(8) . . . . ?
C22 Ru1 C2 C3 -170.0(5) . . . . ?
C21 Ru1 C2 C3 -80.3(5) . . . . ?
C1 Ru1 C2 C3 -116.2(6) . . . . ?
C4 Ru1 C2 C3 -38.6(4) . . . . ?
Ru3 Ru1 C2 C3 55.2(4) . . . . ?
Ru2 Ru1 C2 C3 115.0(5) . . . . ?
Ru4 Ru1 C2 C3 101.3(4) . . . . ?
C27 Ru1 C2 C1 113.1(7) . . . . ?
C22 Ru1 C2 C1 -53.8(6) . . . . ?
C21 Ru1 C2 C1 35.9(4) . . . . ?
C3 Ru1 C2 C1 116.2(6) . . . . ?
C4 Ru1 C2 C1 77.5(5) . . . . ?
Ru3 Ru1 C2 C1 171.4(4) . . . . ?
Ru2 Ru1 C2 C1 -128.8(5) . . . . ?
Ru4 Ru1 C2 C1 -142.6(4) . . . . ?
C27 Ru1 C2 C2A -126.7(8) . . . . ?
C22 Ru1 C2 C2A 66.4(8) . . . . ?
C21 Ru1 C2 C2A 156.1(8) . . . . ?
C1 Ru1 C2 C2A 120.2(9) . . . . ?
C3 Ru1 C2 C2A -123.6(9) . . . . ?
C4 Ru1 C2 C2A -162.2(8) . . . . ?
Ru3 Ru1 C2 C2A -68.4(6) . . . . ?
Ru2 Ru1 C2 C2A -8.6(6) . . . . ?
Ru4 Ru1 C2 C2A -22.3(7) . . . . ?
C3 C2 C2A C2B -18.2(13) . . . . ?
C1 C2 C2A C2B 164.3(8) . . . . ?
Ru1 C2 C2A C2B 74.2(10) . . . . ?
C3 C2 C2A Ru2 -82.8(8) . . . . ?
C1 C2 C2A Ru2 99.7(7) . . . . ?
Ru1 C2 C2A Ru2 9.6(6) . . . . ?
C24 Ru2 C2A C2B 46.8(6) . . . . ?
C23 Ru2 C2A C2B 137.3(5) . . . . ?
C2C Ru2 C2A C2B -29.7(5) . . . . ?
Ru4 Ru2 C2A C2B -119.6(4) . . . . ?
Ru1 Ru2 C2A C2B -133.9(5) . . . . ?
Ru3 Ru2 C2A C2B -76.1(5) . . . . ?
C24 Ru2 C2A C2 174.3(5) . . . . ?
C23 Ru2 C2A C2 -95.1(5) . . . . ?
C2B Ru2 C2A C2 127.5(7) . . . . ?
C2C Ru2 C2A C2 97.8(5) . . . . ?
Ru4 Ru2 C2A C2 7.9(7) . . . . ?
Ru1 Ru2 C2A C2 -6.4(4) . . . . ?
Ru3 Ru2 C2A C2 51.4(5) . . . . ?
C2 C2A C2B C2C -8.7(13) . . . . ?
Ru2 C2A C2B C2C 66.9(8) . . . . ?
C2 C2A C2B Ru2 -75.7(8) . . . . ?
C24 Ru2 C2B C2A -139.5(5) . . . . ?
C23 Ru2 C2B C2A -55.1(6) . . . . ?
C2C Ru2 C2B C2A 130.2(7) . . . . ?
Ru4 Ru2 C2B C2A 110.9(5) . . . . ?
Ru1 Ru2 C2B C2A 47.4(5) . . . . ?
Ru3 Ru2 C2B C2A 104.9(4) . . . . ?
C24 Ru2 C2B C2C 90.3(5) . . . . ?
C23 Ru2 C2B C2C 174.7(5) . . . . ?
C2A Ru2 C2B C2C -130.2(7) . . . . ?
Ru4 Ru2 C2B C2C -19.3(7) . . . . ?
Ru1 Ru2 C2B C2C -82.8(5) . . . . ?
Ru3 Ru2 C2B C2C -25.3(4) . . . . ?
C2A C2B C2C C3B 50.5(13) . . . . ?
Ru2 C2B C2C C3B 114.9(8) . . . . ?
C2A C2B C2C Ru2 -64.3(8) . . . . ?
C2A C2B C2C Ru3 -26.8(12) . . . . ?
Ru2 C2B C2C Ru3 37.6(6) . . . . ?
C24 Ru2 C2C C3B 154.5(7) . . . . ?
C23 Ru2 C2C C3B -129.1(10) . . . . ?
C2B Ru2 C2C C3B -115.4(9) . . . . ?
C2A Ru2 C2C C3B -85.5(7) . . . . ?
Ru4 Ru2 C2C C3B 52.8(7) . . . . ?
Ru1 Ru2 C2C C3B -10.6(6) . . . . ?
Ru3 Ru2 C2C C3B 33.2(5) . . . . ?
C24 Ru2 C2C C2B -90.1(5) . . . . ?
C23 Ru2 C2C C2B -13.6(12) . . . . ?
C2A Ru2 C2C C2B 30.0(5) . . . . ?
Ru4 Ru2 C2C C2B 168.2(4) . . . . ?
Ru1 Ru2 C2C C2B 104.8(4) . . . . ?
Ru3 Ru2 C2C C2B 148.6(5) . . . . ?
C24 Ru2 C2C Ru3 121.3(3) . . . . ?
C23 Ru2 C2C Ru3 -162.2(9) . . . . ?
C2B Ru2 C2C Ru3 -148.6(5) . . . . ?
C2A Ru2 C2C Ru3 -118.6(3) . . . . ?
Ru4 Ru2 C2C Ru3 19.6(2) . . . . ?
Ru1 Ru2 C2C Ru3 -43.79(16) . . . . ?
C25 Ru3 C2C C3B 99.2(5) . . . . ?
C26 Ru3 C2C C3B 25.1(9) . . . . ?
C3A Ru3 C2C C3B -31.5(5) . . . . ?
Ru4 Ru3 C2C C3B -168.5(4) . . . . ?
Ru1 Ru3 C2C C3B -105.3(4) . . . . ?
Ru2 Ru3 C2C C3B -149.0(5) . . . . ?
C25 Ru3 C2C C2B -146.9(7) . . . . ?
C26 Ru3 C2C C2B 139.0(8) . . . . ?
C3B Ru3 C2C C2B 113.9(9) . . . . ?
C3A Ru3 C2C C2B 82.4(7) . . . . ?
Ru4 Ru3 C2C C2B -54.6(7) . . . . ?
Ru1 Ru3 C2C C2B 8.6(7) . . . . ?
Ru2 Ru3 C2C C2B -35.1(6) . . . . ?
C25 Ru3 C2C Ru2 -111.8(3) . . . . ?
C26 Ru3 C2C Ru2 174.1(6) . . . . ?
C3B Ru3 C2C Ru2 149.0(5) . . . . ?
C3A Ru3 C2C Ru2 117.5(3) . . . . ?
Ru4 Ru3 C2C Ru2 -19.5(2) . . . . ?
Ru1 Ru3 C2C Ru2 43.74(16) . . . . ?
C1 C2 C3 C3A -179.2(7) . . . . ?
C2A C2 C3 C3A 2.9(13) . . . . ?
Ru1 C2 C3 C3A -117.0(8) . . . . ?
C1 C2 C3 C4 1.3(8) . . . . ?
C2A C2 C3 C4 -176.6(7) . . . . ?
Ru1 C2 C3 C4 63.5(5) . . . . ?
C1 C2 C3 Ru1 -62.2(5) . . . . ?
C2A C2 C3 Ru1 119.9(8) . . . . ?
C27 Ru1 C3 C2 178.3(5) . . . . ?
C22 Ru1 C3 C2 22.9(11) . . . . ?
C21 Ru1 C3 C2 80.6(5) . . . . ?
C1 Ru1 C3 C2 38.2(4) . . . . ?
C4 Ru1 C3 C2 115.7(6) . . . . ?
Ru3 Ru1 C3 C2 -115.3(5) . . . . ?
Ru2 Ru1 C3 C2 -54.7(4) . . . . ?
Ru4 Ru1 C3 C2 -99.2(4) . . . . ?
C27 Ru1 C3 C3A -57.3(7) . . . . ?
C22 Ru1 C3 C3A 147.3(8) . . . . ?
C21 Ru1 C3 C3A -155.0(8) . . . . ?
C1 Ru1 C3 C3A 162.6(8) . . . . ?
C2 Ru1 C3 C3A 124.4(9) . . . . ?
C4 Ru1 C3 C3A -119.9(8) . . . . ?
Ru3 Ru1 C3 C3A 9.1(6) . . . . ?
Ru2 Ru1 C3 C3A 69.7(6) . . . . ?
Ru4 Ru1 C3 C3A 25.2(7) . . . . ?
C27 Ru1 C3 C4 62.5(5) . . . . ?
C22 Ru1 C3 C4 -92.9(9) . . . . ?
C21 Ru1 C3 C4 -35.2(4) . . . . ?
C1 Ru1 C3 C4 -77.5(4) . . . . ?
C2 Ru1 C3 C4 -115.7(6) . . . . ?
Ru3 Ru1 C3 C4 128.9(4) . . . . ?
Ru2 Ru1 C3 C4 -170.4(4) . . . . ?
Ru4 Ru1 C3 C4 145.0(4) . . . . ?
C2 C3 C3A C3B 15.8(13) . . . . ?
C4 C3 C3A C3B -164.8(7) . . . . ?
Ru1 C3 C3A C3B -75.7(9) . . . . ?
C2 C3 C3A Ru3 81.2(8) . . . . ?
C4 C3 C3A Ru3 -99.4(7) . . . . ?
Ru1 C3 C3A Ru3 -10.3(6) . . . . ?
C25 Ru3 C3A C3B -36.0(6) . . . . ?
C26 Ru3 C3A C3B -126.5(5) . . . . ?
C2C Ru3 C3A C3B 30.6(5) . . . . ?
Ru4 Ru3 C3A C3B 117.8(5) . . . . ?
Ru1 Ru3 C3A C3B 134.5(5) . . . . ?
Ru2 Ru3 C3A C3B 76.1(5) . . . . ?
C25 Ru3 C3A C3 -163.5(5) . . . . ?
C26 Ru3 C3A C3 106.1(5) . . . . ?
C3B Ru3 C3A C3 -127.5(7) . . . . ?
C2C Ru3 C3A C3 -96.8(5) . . . . ?
Ru4 Ru3 C3A C3 -9.6(7) . . . . ?
Ru1 Ru3 C3A C3 7.0(4) . . . . ?
Ru2 Ru3 C3A C3 -51.4(5) . . . . ?
C3 C3A C3B C2C 6.6(12) . . . . ?
Ru3 C3A C3B C2C -71.3(7) . . . . ?
C3 C3A C3B Ru3 77.8(7) . . . . ?
C2B C2C C3B C3A -48.3(12) . . . . ?
Ru2 C2C C3B C3A 31.1(10) . . . . ?
Ru3 C2C C3B C3A 67.3(7) . . . . ?
C2B C2C C3B Ru3 -115.6(8) . . . . ?
Ru2 C2C C3B Ru3 -36.3(5) . . . . ?
C25 Ru3 C3B C3A 150.9(5) . . . . ?
C26 Ru3 C3B C3A 64.9(6) . . . . ?
C2C Ru3 C3B C3A -127.9(7) . . . . ?
Ru4 Ru3 C3B C3A -109.8(5) . . . . ?
Ru1 Ru3 C3B C3A -46.3(5) . . . . ?
Ru2 Ru3 C3B C3A -103.4(5) . . . . ?
C25 Ru3 C3B C2C -81.2(5) . . . . ?
C26 Ru3 C3B C2C -167.1(5) . . . . ?
C3A Ru3 C3B C2C 127.9(7) . . . . ?
Ru4 Ru3 C3B C2C 18.1(6) . . . . ?
Ru1 Ru3 C3B C2C 81.6(4) . . . . ?
Ru2 Ru3 C3B C2C 24.5(4) . . . . ?
C2 C3 C4 C21 -4.3(8) . . . . ?
C3A C3 C4 C21 176.2(7) . . . . ?
Ru1 C3 C4 C21 59.2(5) . . . . ?
C2 C3 C4 C5 172.6(7) . . . . ?
C3A C3 C4 C5 -6.9(12) . . . . ?
Ru1 C3 C4 C5 -123.9(7) . . . . ?
C2 C3 C4 Ru1 -63.5(5) . . . . ?
C3A C3 C4 Ru1 117.0(7) . . . . ?
C27 Ru1 C4 C21 114.9(5) . . . . ?
C22 Ru1 C4 C21 24.6(7) . . . . ?
C1 Ru1 C4 C21 -39.8(4) . . . . ?
C3 Ru1 C4 C21 -120.7(6) . . . . ?
C2 Ru1 C4 C21 -82.7(5) . . . . ?
Ru3 Ru1 C4 C21 -165.4(4) . . . . ?
Ru2 Ru1 C4 C21 -109.8(4) . . . . ?
Ru4 Ru1 C4 C21 178.4(3) . . . . ?
C27 Ru1 C4 C5 -2.0(7) . . . . ?
C22 Ru1 C4 C5 -92.4(8) . . . . ?
C21 Ru1 C4 C5 -117.0(9) . . . . ?
C1 Ru1 C4 C5 -156.8(8) . . . . ?
C3 Ru1 C4 C5 122.3(9) . . . . ?
C2 Ru1 C4 C5 160.3(8) . . . . ?
Ru3 Ru1 C4 C5 77.6(7) . . . . ?
Ru2 Ru1 C4 C5 133.2(6) . . . . ?
Ru4 Ru1 C4 C5 61.4(8) . . . . ?
C27 Ru1 C4 C3 -124.3(5) . . . . ?
C22 Ru1 C4 C3 145.3(5) . . . . ?
C21 Ru1 C4 C3 120.7(6) . . . . ?
C1 Ru1 C4 C3 80.9(5) . . . . ?
C2 Ru1 C4 C3 38.0(4) . . . . ?
Ru3 Ru1 C4 C3 -44.6(4) . . . . ?
Ru2 Ru1 C4 C3 10.9(5) . . . . ?
Ru4 Ru1 C4 C3 -60.9(5) . . . . ?
C21 C4 C5 C6 -13.2(12) . . . . ?
C3 C4 C5 C6 170.3(7) . . . . ?
Ru1 C4 C5 C6 76.7(9) . . . . ?
C21 C4 C5 C5A 160.2(7) . . . . ?
C3 C4 C5 C5A -16.3(11) . . . . ?
Ru1 C4 C5 C5A -110.0(8) . . . . ?
C6 C5 C5A C5B 106.4(9) . . . . ?
C4 C5 C5A C5B -67.4(10) . . . . ?
C6 C5 C5A C5F -70.8(10) . . . . ?
C4 C5 C5A C5F 115.4(9) . . . . ?
C5F C5A C5B C5C -1.0(12) . . . . ?
C5 C5A C5B C5C -178.3(8) . . . . ?
C5A C5B C5C C5D -1.0(13) . . . . ?
C5B C5C C5D C5E 1.4(13) . . . . ?
C5C C5D C5E C5F 0.4(14) . . . . ?
C5D C5E C5F C5A -2.4(13) . . . . ?
C5B C5A C5F C5E 2.8(12) . . . . ?
C5 C5A C5F C5E -180.0(8) . . . . ?
C4 C5 C6 N22 -4.5(12) . . . . ?
C5A C5 C6 N22 -178.1(7) . . . . ?
C4 C5 C6 C7 174.1(7) . . . . ?
C5A C5 C6 C7 0.5(11) . . . . ?
C9 N22 C6 C5 -178.1(8) . . . . ?
Pd1 N22 C6 C5 9.3(11) . . . . ?
C9 N22 C6 C7 3.1(8) . . . . ?
Pd1 N22 C6 C7 -169.5(5) . . . . ?
C5 C6 C7 C8 179.2(7) . . . . ?
N22 C6 C7 C8 -1.9(9) . . . . ?
C6 C7 C8 C9 0.1(9) . . . . ?
C6 N22 C9 C10 174.9(8) . . . . ?
Pd1 N22 C9 C10 -12.3(11) . . . . ?
C6 N22 C9 C8 -3.0(8) . . . . ?
Pd1 N22 C9 C8 169.7(5) . . . . ?
C7 C8 C9 N22 1.8(9) . . . . ?
C7 C8 C9 C10 -176.2(8) . . . . ?
N22 C9 C10 C11 -0.9(13) . . . . ?
C8 C9 C10 C11 176.8(8) . . . . ?
N22 C9 C10 C10A -179.3(8) . . . . ?
C8 C9 C10 C10A -1.6(12) . . . . ?
C11 C10 C10A C10B -101.3(10) . . . . ?
C9 C10 C10A C10B 77.2(11) . . . . ?
C11 C10 C10A C10F 79.3(11) . . . . ?
C9 C10 C10A C10F -102.2(10) . . . . ?
C10F C10A C10B C10C -1.0(14) . . . . ?
C10 C10A C10B C10C 179.5(9) . . . . ?
C10A C10B C10C C10D 1.6(15) . . . . ?
C10B C10C C10D C10E -1.1(16) . . . . ?
C10C C10D C10E C10F 0.0(17) . . . . ?
C10B C10A C10F C10E 0.0(14) . . . . ?
C10 C10A C10F C10E 179.4(9) . . . . ?
C10D C10E C10F C10A 0.5(16) . . . . ?
C9 C10 C11 N23 9.5(13) . . . . ?
C10A C10 C11 N23 -172.1(7) . . . . ?
C9 C10 C11 C12 -170.1(8) . . . . ?
C10A C10 C11 C12 8.3(12) . . . . ?
C14 N23 C11 C10 179.6(8) . . . . ?
Pd1 N23 C11 C10 -3.7(11) . . . . ?
C14 N23 C11 C12 -0.8(9) . . . . ?
Pd1 N23 C11 C12 175.9(5) . . . . ?
C10 C11 C12 C13 178.5(8) . . . . ?
N23 C11 C12 C13 -1.1(10) . . . . ?
C11 C12 C13 C14 2.3(9) . . . . ?
C11 N23 C14 C15 -171.8(7) . . . . ?
Pd1 N23 C14 C15 11.6(11) . . . . ?
C11 N23 C14 C13 2.2(9) . . . . ?
Pd1 N23 C14 C13 -174.4(5) . . . . ?
C12 C13 C14 N23 -2.9(9) . . . . ?
C12 C13 C14 C15 171.0(8) . . . . ?
N23 C14 C15 C16 1.2(12) . . . . ?
C13 C14 C15 C16 -171.8(7) . . . . ?
N23 C14 C15 C15A -179.0(7) . . . . ?
C13 C14 C15 C15A 8.0(12) . . . . ?
C14 C15 C15A C15B -65.1(11) . . . . ?
C16 C15 C15A C15B 114.7(9) . . . . ?
C14 C15 C15A C15F 116.0(9) . . . . ?
C16 C15 C15A C15F -64.2(11) . . . . ?
C15F C15A C15B C15C 1.4(14) . . . . ?
C15 C15A C15B C15C -177.5(9) . . . . ?
C15A C15B C15C C15D 1.1(15) . . . . ?
C15B C15C C15D C15E -3.6(15) . . . . ?
C15C C15D C15E C15F 3.7(16) . . . . ?
C15D C15E C15F C15A -1.2(16) . . . . ?
C15B C15A C15F C15E -1.4(14) . . . . ?
C15 C15A C15F C15E 177.6(9) . . . . ?
C19 N24 C16 C15 -178.8(7) . . . . ?
Pd1 N24 C16 C15 11.4(11) . . . . ?
C19 N24 C16 C17 3.5(8) . . . . ?
Pd1 N24 C16 C17 -166.2(5) . . . . ?
C14 C15 C16 N24 -13.9(12) . . . . ?
C15A C15 C16 N24 166.3(7) . . . . ?
C14 C15 C16 C17 163.5(7) . . . . ?
C15A C15 C16 C17 -16.3(11) . . . . ?
N24 C16 C17 C18 -0.3(9) . . . . ?
C15 C16 C17 C18 -178.1(7) . . . . ?
C16 C17 C18 C19 -3.0(9) . . . . ?
C16 N24 C19 C20 169.1(7) . . . . ?
Pd1 N24 C19 C20 -21.3(11) . . . . ?
C16 N24 C19 C18 -5.3(8) . . . . ?
Pd1 N24 C19 C18 164.2(5) . . . . ?
C17 C18 C19 C20 -169.3(8) . . . . ?
C17 C18 C19 N24 5.2(9) . . . . ?
N24 C19 C20 C1 1.2(12) . . . . ?
C18 C19 C20 C1 174.7(7) . . . . ?
N24 C19 C20 C20A 177.0(7) . . . . ?
C18 C19 C20 C20A -9.5(12) . . . . ?
C21 C1 C20 C19 21.2(11) . . . . ?
C2 C1 C20 C19 -160.0(7) . . . . ?
Ru1 C1 C20 C19 -67.1(9) . . . . ?
C21 C1 C20 C20A -154.5(7) . . . . ?
C2 C1 C20 C20A 24.3(11) . . . . ?
Ru1 C1 C20 C20A 117.2(7) . . . . ?
C19 C20 C20A C20B -114.8(9) . . . . ?
C1 C20 C20A C20B 61.1(10) . . . . ?
C19 C20 C20A C20F 66.1(10) . . . . ?
C1 C20 C20A C20F -118.1(9) . . . . ?
C20F C20A C20B C20C 0.9(14) . . . . ?
C20 C20A C20B C20C -178.2(9) . . . . ?
C20A C20B C20C C20D 0.3(17) . . . . ?
C20B C20C C20D C20E -1(2) . . . . ?
C20C C20D C20E C20F 0(2) . . . . ?
C20B C20A C20F C20E -1.7(14) . . . . ?
C20 C20A C20F C20E 177.4(9) . . . . ?
C20D C20E C20F C20A 1.2(18) . . . . ?
C5 C4 C21 C1 -171.6(7) . . . . ?
C3 C4 C21 C1 5.4(8) . . . . ?
Ru1 C4 C21 C1 64.9(5) . . . . ?
C5 C4 C21 Pd1 24.9(11) . . . . ?
C3 C4 C21 Pd1 -158.2(6) . . . . ?
Ru1 C4 C21 Pd1 -98.7(6) . . . . ?
C5 C4 C21 Ru1 123.5(7) . . . . ?
C3 C4 C21 Ru1 -59.5(5) . . . . ?
C2 C1 C21 C4 -4.6(8) . . . . ?
C20 C1 C21 C4 174.3(7) . . . . ?
Ru1 C1 C21 C4 -65.7(5) . . . . ?
C2 C1 C21 Pd1 158.9(5) . . . . ?
C20 C1 C21 Pd1 -22.1(10) . . . . ?
Ru1 C1 C21 Pd1 97.9(5) . . . . ?
C2 C1 C21 Ru1 61.0(5) . . . . ?
C20 C1 C21 Ru1 -120.0(7) . . . . ?
N22 Pd1 C21 C4 -16.3(7) . . . . ?
N24 Pd1 C21 C4 164.7(7) . . . . ?
N22 Pd1 C21 C1 -176.6(6) . . . . ?
N24 Pd1 C21 C1 4.4(6) . . . . ?
N22 Pd1 C21 Ru1 -97.1(3) . . . . ?
N24 Pd1 C21 Ru1 83.9(3) . . . . ?
C27 Ru1 C21 C4 -70.5(5) . . . . ?
C22 Ru1 C21 C4 -163.4(5) . . . . ?
C1 Ru1 C21 C4 113.4(6) . . . . ?
C3 Ru1 C21 C4 35.9(4) . . . . ?
C2 Ru1 C21 C4 77.5(5) . . . . ?
Ru3 Ru1 C21 C4 18.2(5) . . . . ?
Ru2 Ru1 C21 C4 94.2(4) . . . . ?
C27 Ru1 C21 C1 176.1(5) . . . . ?
C22 Ru1 C21 C1 83.2(5) . . . . ?
C3 Ru1 C21 C1 -77.5(5) . . . . ?
C2 Ru1 C21 C1 -35.9(4) . . . . ?
C4 Ru1 C21 C1 -113.4(6) . . . . ?
Ru3 Ru1 C21 C1 -95.2(4) . . . . ?
Ru2 Ru1 C21 C1 -19.2(5) . . . . ?
C27 Ru1 C21 Pd1 52.8(4) . . . . ?
C22 Ru1 C21 Pd1 -40.1(4) . . . . ?
C1 Ru1 C21 Pd1 -123.3(6) . . . . ?
C3 Ru1 C21 Pd1 159.3(5) . . . . ?
C2 Ru1 C21 Pd1 -159.1(5) . . . . ?
C4 Ru1 C21 Pd1 123.3(6) . . . . ?
Ru3 Ru1 C21 Pd1 141.5(2) . . . . ?
Ru2 Ru1 C21 Pd1 -142.5(2) . . . . ?

_diffrn_measured_fraction_theta_max 0.998
_diffrn_reflns_theta_full        26.00
_diffrn_measured_fraction_theta_full 0.998
_refine_diff_density_max         2.218
_refine_diff_density_min         -1.093
_refine_diff_density_rms         0.180
_database_code_depnum_ccdc_archive 'CCDC 1006127'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_6

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C59 H31 N3 O9 Pt Ru4'
_chemical_formula_weight         1525.24

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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   10.192(4)
_cell_length_b                   13.967(5)
_cell_length_c                   20.939(7)
_cell_angle_alpha                80.13(3)
_cell_angle_beta                 86.41(4)
_cell_angle_gamma                68.98(4)
_cell_volume                     2741.2(19)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    5834
_cell_measurement_theta_min      2.91
_cell_measurement_theta_max      28.82

_exptl_crystal_description       plate
_exptl_crystal_colour            'dark brown'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.848
_exptl_crystal_F_000             1464
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.060
_exptl_crystal_size_min          0.030
_exptl_absorpt_coefficient_mu    3.678
_shelx_estimated_absorpt_T_min   0.527
_shelx_estimated_absorpt_T_max   0.898
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_correction_T_min  0.631
_exptl_absorpt_correction_T_max  0.930
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
Analytical numeric absorption correction using a multifaceted crystal
			model based on expressions derived by R.C. Clark & J.S. Reid.
(Clark, R. C. & Reid, J. S. (1995). Acta Cryst. A51, 887-897)
;

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'Enhance (Mo) X-ray Source'
_diffrn_measurement_device_type  'Xcalibur, Ruby'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean 10.3456
_diffrn_reflns_number            18240
_diffrn_reflns_av_unetI/netI     0.0856
_diffrn_reflns_av_R_equivalents  0.0412
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_theta_min         2.911
_diffrn_reflns_theta_max         25.499
_diffrn_reflns_theta_full        25.500
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measured_fraction_theta_full 0.994
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_Laue_measured_fraction_full 0.994
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_point_group_measured_fraction_full 0.994
_reflns_number_total             10152
_reflns_number_gt                7730
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 ?
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
;
 w=1/[σ²(Fo²)+(0.0191P)²]
 where P=(Fo²+2Fc²)/3
;
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         10152
_refine_ls_number_parameters     681
_refine_ls_number_restraints     7
_refine_ls_R_factor_all          0.0649
_refine_ls_R_factor_gt           0.0418
_refine_ls_wR_factor_ref         0.0742
_refine_ls_wR_factor_gt          0.0687
_refine_ls_goodness_of_fit_ref   0.983
_refine_ls_restrained_S_all      0.984
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.09679(3) 0.60527(2) 0.29362(2) 0.01162(7) Uani 1 1 d . . . . .
Ru1 Ru -0.16852(5) 0.56962(4) 0.20543(2) 0.01307(12) Uani 1 1 d . . . . .
Ru2 Ru -0.24951(5) 0.42936(4) 0.15063(2) 0.01612(13) Uani 1 1 d . . . . .
Ru3 Ru -0.34419(5) 0.64411(4) 0.09056(2) 0.01583(13) Uani 1 1 d . . . . .
Ru4 Ru -0.45362(5) 0.57955(5) 0.20413(3) 0.02047(14) Uani 1 1 d . . . . .
N22 N 0.0333(5) 0.7565(4) 0.2573(2) 0.0120(12) Uani 1 1 d . . . . .
N23 N 0.1344(5) 0.6392(4) 0.3813(2) 0.0157(12) Uani 1 1 d . . . . .
N24 N 0.1625(5) 0.4542(4) 0.3312(2) 0.0148(12) Uani 1 1 d . . . . .
C1 C 0.0642(6) 0.4720(5) 0.1970(3) 0.0120(14) Uani 1 1 d . . . . .
C2 C -0.0060(6) 0.4816(5) 0.1360(3) 0.0110(13) Uiso 1 1 d . . . . .
C2A C -0.0264(6) 0.3952(5) 0.1129(3) 0.0160(15) Uani 1 1 d . . . . .
H2A H 0.0429 0.3243 0.1280 0.019 Uiso 1 1 calc R U . . .
C2B C -0.1187(6) 0.4040(5) 0.0636(3) 0.0171(16) Uani 1 1 d . . . . .
H2B H -0.1061 0.3396 0.0454 0.020 Uiso 1 1 calc R U . . .
C2C C -0.2207(6) 0.4981(5) 0.0332(3) 0.0147(15) Uani 1 1 d . . . . .
H2C H -0.2763 0.4849 0.0012 0.018 Uiso 1 1 d R U . . .
C3 C -0.0584(6) 0.5913(5) 0.1087(3) 0.0111(14) Uani 1 1 d . . . . .
C3A C -0.1323(6) 0.6397(5) 0.0474(3) 0.0152(15) Uani 1 1 d . . . . .
H3A H -0.1249 0.7077 0.0268 0.018 Uiso 1 1 calc R U . . .
C3B C -0.1998(6) 0.5952(5) 0.0115(3) 0.0164(15) Uani 1 1 d . . . . .
H3B H -0.2307 0.6313 -0.0335 0.020 Uiso 1 1 calc R U . . .
C4 C -0.0141(6) 0.6451(5) 0.1542(3) 0.0166(15) Uani 1 1 d . . . . .
C5 C -0.0324(6) 0.7537(5) 0.1450(3) 0.0137(14) Uani 1 1 d . . . . .
C5A C -0.0640(6) 0.8224(5) 0.0794(3) 0.0154(15) Uani 1 1 d . . . . .
C5B C -0.1936(7) 0.8992(5) 0.0651(3) 0.0215(16) Uani 1 1 d . . . . .
H5B H -0.2660 0.9101 0.0969 0.026 Uiso 1 1 calc R U . . .
C5C C -0.2176(8) 0.9596(5) 0.0052(3) 0.0281(18) Uani 1 1 d . . . . .
H5C H -0.3073 1.0118 -0.0044 0.034 Uiso 1 1 calc R U . . .
C5D C -0.1125(8) 0.9458(6) -0.0420(3) 0.034(2) Uani 1 1 d . . . . .
H5D H -0.1307 0.9880 -0.0834 0.040 Uiso 1 1 calc R U . . .
C5E C 0.0165(8) 0.8712(6) -0.0281(3) 0.0291(19) Uani 1 1 d . . . . .
H5E H 0.0887 0.8626 -0.0599 0.035 Uiso 1 1 calc R U . . .
C5F C 0.0437(7) 0.8069(5) 0.0328(3) 0.0181(15) Uani 1 1 d . . . . .
H5F H 0.1331 0.7542 0.0422 0.022 Uiso 1 1 calc R U . . .
C6 C -0.0119(6) 0.8027(5) 0.1928(3) 0.0140(14) Uani 1 1 d . . . . .
C7 C -0.0355(6) 0.9120(5) 0.1858(3) 0.0170(15) Uani 1 1 d . . . . .
H7 H -0.0649 0.9613 0.1474 0.020 Uiso 1 1 calc R U . . .
C8 C -0.0089(6) 0.9320(5) 0.2428(3) 0.0171(15) Uani 1 1 d . . . . .
H8 H -0.0171 0.9981 0.2522 0.020 Uiso 1 1 calc R U . . .
C9 C 0.0347(6) 0.8351(5) 0.2876(3) 0.0168(15) Uani 1 1 d . . . . .
C10 C 0.0754(6) 0.8267(5) 0.3518(3) 0.0141(14) Uani 1 1 d . . . . .
C10A C 0.0796(7) 0.9230(5) 0.3731(3) 0.0180(15) Uani 1 1 d . U . . .
C10B C -0.0403(8) 0.9975(7) 0.3911(4) 0.062(3) Uani 1 1 d . U . . .
H10B H -0.1278 0.9878 0.3902 0.075 Uiso 1 1 calc R U . . .
C10C C -0.0366(9) 1.0866(8) 0.4105(5) 0.075(4) Uani 1 1 d . . . . .
H10C H -0.1217 1.1393 0.4199 0.090 Uiso 1 1 calc R U . . .
C10D C 0.0880(8) 1.0986(6) 0.4160(3) 0.0316(19) Uani 1 1 d . . . . .
H10D H 0.0917 1.1566 0.4329 0.018(17) Uiso 1 1 calc R . . . .
C10E C 0.2064(8) 1.0277(6) 0.3975(4) 0.039(2) Uani 1 1 d . . . . .
H10E H 0.2934 1.0380 0.3983 0.047 Uiso 1 1 calc R U . . .
C10F C 0.2024(7) 0.9380(6) 0.3766(4) 0.037(2) Uani 1 1 d . . . . .
H10F H 0.2874 0.8874 0.3649 0.044 Uiso 1 1 calc R U . . .
C11 C 0.1182(6) 0.7349(5) 0.3949(3) 0.0159(15) Uani 1 1 d . . . . .
C12 C 0.1480(6) 0.7265(5) 0.4628(3) 0.0187(15) Uani 1 1 d . U . . .
H12 H 0.1415 0.7821 0.4848 0.022 Uiso 1 1 calc R U . . .
C13 C 0.1863(6) 0.6261(5) 0.4887(3) 0.0192(15) Uani 1 1 d . U . . .
H13 H 0.2126 0.5969 0.5324 0.023 Uiso 1 1 calc R U . . .
C14 C 0.1801(6) 0.5699(5) 0.4372(3) 0.0136(14) Uani 1 1 d . . . . .
C15 C 0.2188(6) 0.4626(5) 0.4434(3) 0.0156(15) Uani 1 1 d . . . . .
C15A C 0.2800(6) 0.3986(5) 0.5066(3) 0.0184(16) Uani 1 1 d . . . . .
C15B C 0.4155(7) 0.3893(5) 0.5225(3) 0.0219(16) Uani 1 1 d . . . . .
H15B H 0.4651 0.4253 0.4942 0.026 Uiso 1 1 calc R U . . .
C15C C 0.4778(7) 0.3273(6) 0.5798(3) 0.0269(18) Uani 1 1 d . . . . .
H15C H 0.5713 0.3187 0.5899 0.032 Uiso 1 1 calc R U . . .
C15D C 0.4041(7) 0.2787(6) 0.6216(3) 0.0250(17) Uani 1 1 d . . . . .
H15D H 0.4458 0.2378 0.6612 0.030 Uiso 1 1 calc R U . . .
C15E C 0.2697(7) 0.2889(6) 0.6067(3) 0.0259(17) Uani 1 1 d . . . . .
H15E H 0.2193 0.2550 0.6361 0.031 Uiso 1 1 calc R U . . .
C15F C 0.2078(7) 0.3476(6) 0.5495(3) 0.0254(17) Uani 1 1 d . . . . .
H15F H 0.1155 0.3533 0.5393 0.031 Uiso 1 1 calc R U . . .
C16 C 0.2125(6) 0.4107(5) 0.3924(3) 0.0144(14) Uani 1 1 d . . . . .
C17 C 0.2690(6) 0.2993(5) 0.3979(3) 0.0188(15) Uani 1 1 d . . . . .
H17 H 0.3073 0.2518 0.4360 0.023 Uiso 1 1 calc R U . . .
C18 C 0.2585(7) 0.2739(5) 0.3400(3) 0.0219(16) Uani 1 1 d . . . . .
H18 H 0.2925 0.2060 0.3288 0.026 Uiso 1 1 calc R U . . .
C19 C 0.1855(6) 0.3700(5) 0.2977(3) 0.0132(14) Uani 1 1 d . . . . .
C20 C 0.1428(6) 0.3752(5) 0.2358(3) 0.0131(14) Uani 1 1 d . . . . .
C20A C 0.2029(6) 0.2756(5) 0.2083(3) 0.0162(15) Uani 1 1 d . . . . .
C20B C 0.3028(6) 0.2690(5) 0.1585(3) 0.0185(15) Uani 1 1 d . . . . .
H20B H 0.3307 0.3268 0.1428 0.022 Uiso 1 1 calc R U . . .
C20C C 0.3609(7) 0.1782(6) 0.1321(3) 0.0265(18) Uani 1 1 d . . . . .
H20C H 0.4266 0.1750 0.0975 0.032 Uiso 1 1 calc R U . . .
C20D C 0.3244(7) 0.0925(6) 0.1556(3) 0.0277(18) Uani 1 1 d . . . . .
H20D H 0.3662 0.0301 0.1379 0.033 Uiso 1 1 calc R U . . .
C20E C 0.2277(7) 0.0981(6) 0.2044(3) 0.0284(18) Uani 1 1 d . . . . .
H20E H 0.2023 0.0392 0.2202 0.034 Uiso 1 1 calc R U . . .
C20F C 0.1655(7) 0.1888(5) 0.2314(3) 0.0228(17) Uani 1 1 d . . . . .
H20F H 0.0982 0.1915 0.2652 0.027 Uiso 1 1 calc R U . . .
C21 C 0.0515(6) 0.5734(5) 0.2099(3) 0.0122(14) Uani 1 1 d . . . . .
C22 C -0.1852(7) 0.5149(6) 0.2937(3) 0.0215(16) Uani 1 1 d . . . . .
O22 O -0.1857(5) 0.4783(4) 0.3465(2) 0.0292(12) Uani 1 1 d . . . . .
C23 C -0.2065(7) 0.3441(6) 0.2306(3) 0.0223(16) Uani 1 1 d . . . . .
O23 O -0.1761(5) 0.2895(4) 0.2793(2) 0.0369(14) Uani 1 1 d . . . . .
C24 C -0.3349(7) 0.3412(5) 0.1284(3) 0.0223(16) Uani 1 1 d . . . . .
O24 O -0.3867(5) 0.2866(4) 0.1166(2) 0.0404(14) Uani 1 1 d . . . . .
C25 C -0.5073(7) 0.6482(6) 0.0536(3) 0.0304(19) Uani 1 1 d . . . . .
O25 O -0.6060(5) 0.6517(4) 0.0285(3) 0.0444(15) Uani 1 1 d . . . . .
C26 C -0.4306(7) 0.7873(6) 0.0852(3) 0.0202(16) Uani 1 1 d . . . . .
O26 O -0.4955(5) 0.8750(4) 0.0803(2) 0.0341(13) Uani 1 1 d . . . . .
C27 C -0.3122(7) 0.6977(6) 0.2155(3) 0.0209(16) Uani 1 1 d . . . . .
O27 O -0.3578(4) 0.7836(4) 0.22311(19) 0.0184(10) Uani 1 1 d . . . . .
C28 C -0.4786(8) 0.5149(7) 0.2892(4) 0.039(2) Uani 1 1 d . . . . .
O28 O -0.4982(6) 0.4750(5) 0.3397(3) 0.0620(19) Uani 1 1 d . . . . .
C29 C -0.5696(7) 0.5247(6) 0.1672(3) 0.0296(19) Uani 1 1 d . . . . .
O29 O -0.6467(5) 0.4963(4) 0.1462(3) 0.0453(16) Uani 1 1 d . . . . .
C30 C -0.5931(7) 0.7112(6) 0.2146(3) 0.0283(18) Uani 1 1 d . . . . .
O30 O -0.6764(5) 0.7900(4) 0.2179(3) 0.0481(16) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
Pt1 N22 1.997(5) . ?
Pt1 C21 2.000(6) . ?
Pt1 N24 2.001(5) . ?
Pt1 N23 2.065(5) . ?
Ru1 C22 1.896(7) . ?
Ru1 C27 1.897(7) . ?
Ru1 C21 2.270(6) . ?
Ru1 C3 2.280(6) . ?
Ru1 C2 2.284(6) . ?
Ru1 C1 2.286(6) . ?
Ru1 C4 2.308(6) . ?
Ru1 Ru2 2.8080(12) . ?
Ru1 Ru4 2.8606(13) . ?
Ru1 Ru3 2.9014(16) . ?
Ru2 C23 1.857(7) . ?
Ru2 C24 1.872(7) . ?
Ru2 C2B 2.191(5) . ?
Ru2 C2A 2.269(6) . ?
Ru2 C2C 2.522(6) . ?
Ru2 Ru4 2.7141(16) . ?
Ru2 Ru3 2.8796(16) . ?
Ru3 C25 1.856(7) . ?
Ru3 C26 1.860(7) . ?
Ru3 C3B 2.176(6) . ?
Ru3 C3A 2.273(6) . ?
Ru3 C2C 2.449(6) . ?
Ru3 Ru4 2.7141(13) . ?
Ru4 C29 1.884(8) . ?
Ru4 C28 1.899(8) . ?
Ru4 C30 1.917(8) . ?
Ru4 C27 2.596(7) . ?
N22 C9 1.364(7) . ?
N22 C6 1.421(7) . ?
N23 C11 1.363(8) . ?
N23 C14 1.370(7) . ?
N24 C16 1.365(7) . ?
N24 C19 1.412(7) . ?
C1 C20 1.435(9) . ?
C1 C21 1.446(8) . ?
C1 C2 1.464(8) . ?
C2 C3 1.453(8) . ?
C2 C2A 1.458(8) . ?
C2A C2B 1.400(8) . ?
C2A H2A 1.0000 . ?
C2B C2C 1.424(9) . ?
C2B H2B 1.0000 . ?
C2C C3B 1.440(9) . ?
C2C H2C 0.9836 . ?
C3 C3A 1.460(8) . ?
C3 C4 1.490(8) . ?
C3A C3B 1.399(8) . ?
C3A H3A 1.0000 . ?
C3B H3B 1.0000 . ?
C4 C21 1.423(8) . ?
C4 C5 1.440(9) . ?
C5 C6 1.371(8) . ?
C5 C5A 1.514(8) . ?
C5A C5B 1.381(9) . ?
C5A C5F 1.404(8) . ?
C5B C5C 1.369(9) . ?
C5B H5B 0.9500 . ?
C5C C5D 1.394(9) . ?
C5C H5C 0.9500 . ?
C5D C5E 1.363(10) . ?
C5D H5D 0.9500 . ?
C5E C5F 1.409(9) . ?
C5E H5E 0.9500 . ?
C5F H5F 0.9500 . ?
C6 C7 1.440(9) . ?
C7 C8 1.336(8) . ?
C7 H7 0.9500 . ?
C8 C9 1.448(9) . ?
C8 H8 0.9500 . ?
C9 C10 1.404(8) . ?
C10 C11 1.379(9) . ?
C10 C10A 1.503(9) . ?
C10A C10F 1.350(9) . ?
C10A C10B 1.371(9) . ?
C10B C10C 1.387(10) . ?
C10B H10B 0.9500 . ?
C10C C10D 1.355(10) . ?
C10C H10C 0.9500 . ?
C10D C10E 1.343(9) . ?
C10D H10D 0.9500 . ?
C10E C10F 1.409(9) . ?
C10E H10E 0.9500 . ?
C10F H10F 0.9500 . ?
C11 C12 1.449(8) . ?
C12 C13 1.337(9) . ?
C12 H12 0.9500 . ?
C13 C14 1.455(8) . ?
C13 H13 0.9500 . ?
C14 C15 1.391(9) . ?
C15 C16 1.406(8) . ?
C15 C15A 1.497(8) . ?
C15A C15F 1.389(9) . ?
C15A C15B 1.396(8) . ?
C15B C15C 1.393(9) . ?
C15B H15B 0.9500 . ?
C15C C15D 1.368(9) . ?
C15C H15C 0.9500 . ?
C15D C15E 1.375(9) . ?
C15D H15D 0.9500 . ?
C15E C15F 1.375(9) . ?
C15E H15E 0.9500 . ?
C15F H15F 0.9500 . ?
C16 C17 1.439(9) . ?
C17 C18 1.341(8) . ?
C17 H17 0.9500 . ?
C18 C19 1.448(9) . ?
C18 H18 0.9500 . ?
C19 C20 1.375(8) . ?
C20 C20A 1.503(8) . ?
C20A C20F 1.399(9) . ?
C20A C20B 1.401(8) . ?
C20B C20C 1.387(9) . ?
C20B H20B 0.9500 . ?
C20C C20D 1.382(9) . ?
C20C H20C 0.9500 . ?
C20D C20E 1.367(9) . ?
C20D H20D 0.9500 . ?
C20E C20F 1.397(9) . ?
C20E H20E 0.9500 . ?
C20F H20F 0.9500 . ?
C22 O22 1.138(7) . ?
C23 O23 1.148(7) . ?
C24 O24 1.137(7) . ?
C25 O25 1.145(8) . ?
C26 O26 1.154(8) . ?
C27 O27 1.157(7) . ?
C28 O28 1.149(8) . ?
C29 O29 1.139(8) . ?
C30 O30 1.134(8) . ?

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
N22 Pt1 C21 90.5(2) . . ?
N22 Pt1 N24 178.9(2) . . ?
C21 Pt1 N24 90.4(2) . . ?
N22 Pt1 N23 89.3(2) . . ?
C21 Pt1 N23 177.4(2) . . ?
N24 Pt1 N23 89.7(2) . . ?
C22 Ru1 C27 91.1(3) . . ?
C22 Ru1 C21 98.1(2) . . ?
C27 Ru1 C21 113.4(3) . . ?
C22 Ru1 C3 156.9(3) . . ?
C27 Ru1 C3 108.5(2) . . ?
C21 Ru1 C3 63.4(2) . . ?
C22 Ru1 C2 123.6(3) . . ?
C27 Ru1 C2 145.2(2) . . ?
C21 Ru1 C2 63.3(2) . . ?
C3 Ru1 C2 37.1(2) . . ?
C22 Ru1 C1 95.1(2) . . ?
C27 Ru1 C1 150.3(3) . . ?
C21 Ru1 C1 37.0(2) . . ?
C3 Ru1 C1 61.8(2) . . ?
C2 Ru1 C1 37.38(19) . . ?
C22 Ru1 C4 131.2(2) . . ?
C27 Ru1 C4 94.7(3) . . ?
C21 Ru1 C4 36.2(2) . . ?
C3 Ru1 C4 37.89(19) . . ?
C2 Ru1 C4 61.6(2) . . ?
C1 Ru1 C4 59.8(2) . . ?
C22 Ru1 Ru2 97.4(2) . . ?
C27 Ru1 Ru2 116.4(2) . . ?
C21 Ru1 Ru2 127.28(15) . . ?
C3 Ru1 Ru2 84.88(15) . . ?
C2 Ru1 Ru2 66.14(15) . . ?
C1 Ru1 Ru2 91.61(16) . . ?
C4 Ru1 Ru2 122.23(15) . . ?
C22 Ru1 Ru4 81.1(2) . . ?
C27 Ru1 Ru4 62.3(2) . . ?
C21 Ru1 Ru4 175.50(15) . . ?
C3 Ru1 Ru4 118.43(15) . . ?
C2 Ru1 Ru4 120.82(15) . . ?
C1 Ru1 Ru4 147.36(16) . . ?
C4 Ru1 Ru4 142.74(17) . . ?
Ru2 Ru1 Ru4 57.20(4) . . ?
C22 Ru1 Ru3 137.3(2) . . ?
C27 Ru1 Ru3 71.14(19) . . ?
C21 Ru1 Ru3 124.55(15) . . ?
C3 Ru1 Ru3 63.30(15) . . ?
C2 Ru1 Ru3 82.91(15) . . ?
C1 Ru1 Ru3 119.69(14) . . ?
C4 Ru1 Ru3 89.78(16) . . ?
Ru2 Ru1 Ru3 60.55(3) . . ?
Ru4 Ru1 Ru3 56.20(4) . . ?
C23 Ru2 C24 88.1(3) . . ?
C23 Ru2 C2B 124.6(3) . . ?
C24 Ru2 C2B 88.3(3) . . ?
C23 Ru2 C2A 97.7(3) . . ?
C24 Ru2 C2A 113.5(2) . . ?
C2B Ru2 C2A 36.5(2) . . ?
C23 Ru2 C2C 158.8(2) . . ?
C24 Ru2 C2C 91.8(2) . . ?
C2B Ru2 C2C 34.3(2) . . ?
C2A Ru2 C2C 63.1(2) . . ?
C23 Ru2 Ru4 91.5(2) . . ?
C24 Ru2 Ru4 106.40(19) . . ?
C2B Ru2 Ru4 141.92(19) . . ?
C2A Ru2 Ru4 139.20(16) . . ?
C2C Ru2 Ru4 108.81(15) . . ?
C23 Ru2 Ru1 86.1(2) . . ?
C24 Ru2 Ru1 167.15(19) . . ?
C2B Ru2 Ru1 104.41(17) . . ?
C2A Ru2 Ru1 78.62(15) . . ?
C2C Ru2 Ru1 97.72(14) . . ?
Ru4 Ru2 Ru1 62.37(3) . . ?
C23 Ru2 Ru3 142.4(2) . . ?
C24 Ru2 Ru3 119.5(2) . . ?
C2B Ru2 Ru3 84.12(19) . . ?
C2A Ru2 Ru3 93.98(18) . . ?
C2C Ru2 Ru3 53.42(14) . . ?
Ru4 Ru2 Ru3 57.96(4) . . ?
Ru1 Ru2 Ru3 61.33(4) . . ?
C25 Ru3 C26 85.9(3) . . ?
C25 Ru3 C3B 98.4(3) . . ?
C26 Ru3 C3B 114.5(3) . . ?
C25 Ru3 C3A 132.1(3) . . ?
C26 Ru3 C3A 98.6(3) . . ?
C3B Ru3 C3A 36.6(2) . . ?
C25 Ru3 C2C 86.4(3) . . ?
C26 Ru3 C2C 147.0(2) . . ?
C3B Ru3 C2C 35.7(2) . . ?
C3A Ru3 C2C 64.3(2) . . ?
C25 Ru3 Ru4 85.1(2) . . ?
C26 Ru3 Ru4 100.2(2) . . ?
C3B Ru3 Ru4 145.26(18) . . ?
C3A Ru3 Ru4 139.32(16) . . ?
C2C Ru3 Ru4 111.05(15) . . ?
C25 Ru3 Ru2 97.6(2) . . ?
C26 Ru3 Ru2 157.18(19) . . ?
C3B Ru3 Ru2 87.38(18) . . ?
C3A Ru3 Ru2 95.67(18) . . ?
C2C Ru3 Ru2 55.79(15) . . ?
Ru4 Ru3 Ru2 57.96(4) . . ?
C25 Ru3 Ru1 145.1(2) . . ?
C26 Ru3 Ru1 107.42(19) . . ?
C3B Ru3 Ru1 104.45(17) . . ?
C3A Ru3 Ru1 78.89(15) . . ?
C2C Ru3 Ru1 97.00(15) . . ?
Ru4 Ru3 Ru1 61.14(3) . . ?
Ru2 Ru3 Ru1 58.12(4) . . ?
C29 Ru4 C28 92.7(3) . . ?
C29 Ru4 C30 98.1(3) . . ?
C28 Ru4 C30 93.9(3) . . ?
C29 Ru4 C27 159.6(3) . . ?
C28 Ru4 C27 106.8(3) . . ?
C30 Ru4 C27 75.1(2) . . ?
C29 Ru4 Ru2 81.7(2) . . ?
C28 Ru4 Ru2 104.9(2) . . ?
C30 Ru4 Ru2 161.1(2) . . ?
C27 Ru4 Ru2 98.61(15) . . ?
C29 Ru4 Ru3 96.1(2) . . ?
C28 Ru4 Ru3 164.6(2) . . ?
C30 Ru4 Ru3 97.3(2) . . ?
C27 Ru4 Ru3 66.38(13) . . ?
Ru2 Ru4 Ru3 64.08(4) . . ?
C29 Ru4 Ru1 141.5(2) . . ?
C28 Ru4 Ru1 102.9(2) . . ?
C30 Ru4 Ru1 115.41(19) . . ?
C27 Ru4 Ru1 40.33(15) . . ?
Ru2 Ru4 Ru1 60.42(4) . . ?
Ru3 Ru4 Ru1 62.66(4) . . ?
C9 N22 C6 106.1(5) . . ?
C9 N22 Pt1 127.1(4) . . ?
C6 N22 Pt1 126.6(4) . . ?
C11 N23 C14 106.9(5) . . ?
C11 N23 Pt1 126.6(4) . . ?
C14 N23 Pt1 126.5(4) . . ?
C16 N24 C19 105.6(5) . . ?
C16 N24 Pt1 126.8(4) . . ?
C19 N24 Pt1 127.1(4) . . ?
C20 C1 C21 124.9(5) . . ?
C20 C1 C2 124.5(6) . . ?
C21 C1 C2 110.4(5) . . ?
C20 C1 Ru1 128.0(4) . . ?
C21 C1 Ru1 70.9(3) . . ?
C2 C1 Ru1 71.3(3) . . ?
C3 C2 C2A 128.8(5) . . ?
C3 C2 C1 106.9(5) . . ?
C2A C2 C1 124.1(6) . . ?
C3 C2 Ru1 71.3(3) . . ?
C2A C2 Ru1 118.5(4) . . ?
C1 C2 Ru1 71.4(3) . . ?
C2B C2A C2 125.7(6) . . ?
C2B C2A Ru2 68.7(3) . . ?
C2 C2A Ru2 95.6(3) . . ?
C2B C2A H2A 116.7 . . ?
C2 C2A H2A 116.7 . . ?
Ru2 C2A H2A 116.7 . . ?
C2A C2B C2C 125.8(6) . . ?
C2A C2B Ru2 74.7(3) . . ?
C2C C2B Ru2 85.7(4) . . ?
C2A C2B H2B 117.0 . . ?
C2C C2B H2B 117.0 . . ?
Ru2 C2B H2B 117.0 . . ?
C2B C2C C3B 126.3(6) . . ?
C2B C2C Ru3 122.8(4) . . ?
C3B C2C Ru3 61.8(3) . . ?
C2B C2C Ru2 60.0(3) . . ?
C3B C2C Ru2 123.6(4) . . ?
Ru3 C2C Ru2 70.79(15) . . ?
C2B C2C H2C 111.4 . . ?
C3B C2C H2C 110.3 . . ?
Ru3 C2C H2C 116.1 . . ?
Ru2 C2C H2C 117.1 . . ?
C2 C3 C3A 127.7(5) . . ?
C2 C3 C4 106.0(5) . . ?
C3A C3 C4 126.2(6) . . ?
C2 C3 Ru1 71.6(3) . . ?
C3A C3 Ru1 123.9(4) . . ?
C4 C3 Ru1 72.1(3) . . ?
C3B C3A C3 126.1(6) . . ?
C3B C3A Ru3 67.9(3) . . ?
C3 C3A Ru3 93.3(3) . . ?
C3B C3A H3A 116.8 . . ?
C3 C3A H3A 116.8 . . ?
Ru3 C3A H3A 116.8 . . ?
C3A C3B C2C 124.7(6) . . ?
C3A C3B Ru3 75.5(3) . . ?
C2C C3B Ru3 82.5(3) . . ?
C3A C3B H3B 117.6 . . ?
C2C C3B H3B 117.6 . . ?
Ru3 C3B H3B 117.6 . . ?
C21 C4 C5 123.3(5) . . ?
C21 C4 C3 110.4(6) . . ?
C5 C4 C3 126.4(6) . . ?
C21 C4 Ru1 70.4(3) . . ?
C5 C4 Ru1 126.6(4) . . ?
C3 C4 Ru1 70.1(3) . . ?
C6 C5 C4 123.8(6) . . ?
C6 C5 C5A 113.5(6) . . ?
C4 C5 C5A 122.5(5) . . ?
C5B C5A C5F 120.2(6) . . ?
C5B C5A C5 121.9(5) . . ?
C5F C5A C5 117.9(6) . . ?
C5C C5B C5A 119.9(6) . . ?
C5C C5B H5B 120.0 . . ?
C5A C5B H5B 120.0 . . ?
C5B C5C C5D 121.1(7) . . ?
C5B C5C H5C 119.5 . . ?
C5D C5C H5C 119.5 . . ?
C5E C5D C5C 119.5(7) . . ?
C5E C5D H5D 120.2 . . ?
C5C C5D H5D 120.2 . . ?
C5D C5E C5F 120.7(6) . . ?
C5D C5E H5E 119.6 . . ?
C5F C5E H5E 119.6 . . ?
C5A C5F C5E 118.6(6) . . ?
C5A C5F H5F 120.7 . . ?
C5E C5F H5F 120.7 . . ?
C5 C6 N22 126.7(6) . . ?
C5 C6 C7 125.0(6) . . ?
N22 C6 C7 108.3(5) . . ?
C8 C7 C6 108.0(6) . . ?
C8 C7 H7 126.0 . . ?
C6 C7 H7 126.0 . . ?
C7 C8 C9 107.9(6) . . ?
C7 C8 H8 126.1 . . ?
C9 C8 H8 126.1 . . ?
N22 C9 C10 127.0(6) . . ?
N22 C9 C8 109.7(5) . . ?
C10 C9 C8 123.3(6) . . ?
C11 C10 C9 123.9(6) . . ?
C11 C10 C10A 118.5(6) . . ?
C9 C10 C10A 117.5(6) . . ?
C10F C10A C10B 117.6(7) . . ?
C10F C10A C10 120.9(6) . . ?
C10B C10A C10 121.4(6) . . ?
C10A C10B C10C 121.4(7) . . ?
C10A C10B H10B 119.3 . . ?
C10C C10B H10B 119.3 . . ?
C10D C10C C10B 120.1(8) . . ?
C10D C10C H10C 119.9 . . ?
C10B C10C H10C 119.9 . . ?
C10E C10D C10C 119.2(7) . . ?
C10E C10D H10D 120.4 . . ?
C10C C10D H10D 120.4 . . ?
C10D C10E C10F 120.5(7) . . ?
C10D C10E H10E 119.7 . . ?
C10F C10E H10E 119.7 . . ?
C10A C10F C10E 120.9(7) . . ?
C10A C10F H10F 119.6 . . ?
C10E C10F H10F 119.6 . . ?
N23 C11 C10 125.9(6) . . ?
N23 C11 C12 109.5(6) . . ?
C10 C11 C12 124.5(6) . . ?
C13 C12 C11 107.3(6) . . ?
C13 C12 H12 126.3 . . ?
C11 C12 H12 126.3 . . ?
C12 C13 C14 107.1(6) . . ?
C12 C13 H13 126.4 . . ?
C14 C13 H13 126.4 . . ?
N23 C14 C15 125.7(5) . . ?
N23 C14 C13 109.1(6) . . ?
C15 C14 C13 125.2(6) . . ?
C14 C15 C16 123.7(6) . . ?
C14 C15 C15A 117.9(5) . . ?
C16 C15 C15A 118.2(6) . . ?
C15F C15A C15B 119.1(6) . . ?
C15F C15A C15 122.5(6) . . ?
C15B C15A C15 118.3(6) . . ?
C15C C15B C15A 119.9(6) . . ?
C15C C15B H15B 120.0 . . ?
C15A C15B H15B 120.0 . . ?
C15D C15C C15B 119.9(6) . . ?
C15D C15C H15C 120.1 . . ?
C15B C15C H15C 120.1 . . ?
C15C C15D C15E 120.4(6) . . ?
C15C C15D H15D 119.8 . . ?
C15E C15D H15D 119.8 . . ?
C15F C15E C15D 120.6(6) . . ?
C15F C15E H15E 119.7 . . ?
C15D C15E H15E 119.7 . . ?
C15E C15F C15A 120.1(6) . . ?
C15E C15F H15F 119.9 . . ?
C15A C15F H15F 119.9 . . ?
N24 C16 C15 127.4(6) . . ?
N24 C16 C17 110.0(5) . . ?
C15 C16 C17 122.5(6) . . ?
C18 C17 C16 108.4(6) . . ?
C18 C17 H17 125.8 . . ?
C16 C17 H17 125.8 . . ?
C17 C18 C19 106.6(6) . . ?
C17 C18 H18 126.7 . . ?
C19 C18 H18 126.7 . . ?
C20 C19 N24 126.8(6) . . ?
C20 C19 C18 124.0(6) . . ?
N24 C19 C18 109.1(5) . . ?
C19 C20 C1 122.0(6) . . ?
C19 C20 C20A 115.2(6) . . ?
C1 C20 C20A 122.1(5) . . ?
C20F C20A C20B 118.8(6) . . ?
C20F C20A C20 122.7(5) . . ?
C20B C20A C20 118.5(6) . . ?
C20C C20B C20A 120.1(6) . . ?
C20C C20B H20B 119.9 . . ?
C20A C20B H20B 119.9 . . ?
C20D C20C C20B 120.7(6) . . ?
C20D C20C H20C 119.7 . . ?
C20B C20C H20C 119.7 . . ?
C20E C20D C20C 119.6(7) . . ?
C20E C20D H20D 120.2 . . ?
C20C C20D H20D 120.2 . . ?
C20D C20E C20F 121.2(7) . . ?
C20D C20E H20E 119.4 . . ?
C20F C20E H20E 119.4 . . ?
C20E C20F C20A 119.6(6) . . ?
C20E C20F H20F 120.2 . . ?
C20A C20F H20F 120.2 . . ?
C4 C21 C1 105.9(5) . . ?
C4 C21 Pt1 127.7(5) . . ?
C1 C21 Pt1 126.0(5) . . ?
C4 C21 Ru1 73.4(3) . . ?
C1 C21 Ru1 72.1(3) . . ?
Pt1 C21 Ru1 114.2(2) . . ?
O22 C22 Ru1 175.3(6) . . ?
O23 C23 Ru2 177.8(6) . . ?
O24 C24 Ru2 178.1(6) . . ?
O25 C25 Ru3 177.4(7) . . ?
O26 C26 Ru3 173.7(6) . . ?
O27 C27 Ru1 155.9(6) . . ?
O27 C27 Ru4 126.7(5) . . ?
Ru1 C27 Ru4 77.4(2) . . ?
O28 C28 Ru4 177.2(7) . . ?
O29 C29 Ru4 175.7(6) . . ?
O30 C30 Ru4 176.9(7) . . ?

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
C20 C1 C2 C3 -173.3(5) . . . . ?
C21 C1 C2 C3 2.5(6) . . . . ?
Ru1 C1 C2 C3 62.9(4) . . . . ?
C20 C1 C2 C2A 11.5(9) . . . . ?
C21 C1 C2 C2A -172.6(5) . . . . ?
Ru1 C1 C2 C2A -112.3(5) . . . . ?
C20 C1 C2 Ru1 123.8(6) . . . . ?
C21 C1 C2 Ru1 -60.3(4) . . . . ?
C3 C2 C2A C2B -9.4(10) . . . . ?
C1 C2 C2A C2B 164.6(5) . . . . ?
Ru1 C2 C2A C2B 78.7(7) . . . . ?
C3 C2 C2A Ru2 -77.1(6) . . . . ?
C1 C2 C2A Ru2 96.9(5) . . . . ?
Ru1 C2 C2A Ru2 11.0(5) . . . . ?
C2 C2A C2B C2C -8.3(9) . . . . ?
Ru2 C2A C2B C2C 73.0(5) . . . . ?
C2 C2A C2B Ru2 -81.3(5) . . . . ?
C2A C2B C2C C3B 44.0(9) . . . . ?
Ru2 C2B C2C C3B 111.7(6) . . . . ?
C2A C2B C2C Ru3 -33.0(8) . . . . ?
Ru2 C2B C2C Ru3 34.7(4) . . . . ?
C2A C2B C2C Ru2 -67.7(5) . . . . ?
C2A C2 C3 C3A -7.1(10) . . . . ?
C1 C2 C3 C3A 178.1(5) . . . . ?
Ru1 C2 C3 C3A -119.0(6) . . . . ?
C2A C2 C3 C4 176.2(5) . . . . ?
C1 C2 C3 C4 1.4(6) . . . . ?
Ru1 C2 C3 C4 64.3(4) . . . . ?
C2A C2 C3 Ru1 111.9(6) . . . . ?
C1 C2 C3 Ru1 -62.9(4) . . . . ?
C2 C3 C3A C3B 18.4(9) . . . . ?
C4 C3 C3A C3B -165.5(6) . . . . ?
Ru1 C3 C3A C3B -73.7(7) . . . . ?
C2 C3 C3A Ru3 83.3(6) . . . . ?
C4 C3 C3A Ru3 -100.6(5) . . . . ?
Ru1 C3 C3A Ru3 -8.8(5) . . . . ?
C3 C3A C3B C2C 7.3(9) . . . . ?
Ru3 C3A C3B C2C -70.0(5) . . . . ?
C3 C3A C3B Ru3 77.3(5) . . . . ?
C2B C2C C3B C3A -45.1(9) . . . . ?
Ru3 C2C C3B C3A 66.5(5) . . . . ?
Ru2 C2C C3B C3A 30.1(8) . . . . ?
C2B C2C C3B Ru3 -111.6(6) . . . . ?
Ru2 C2C C3B Ru3 -36.4(4) . . . . ?
C2 C3 C4 C21 -5.0(6) . . . . ?
C3A C3 C4 C21 178.3(5) . . . . ?
Ru1 C3 C4 C21 59.0(4) . . . . ?
C2 C3 C4 C5 174.7(6) . . . . ?
C3A C3 C4 C5 -2.1(9) . . . . ?
Ru1 C3 C4 C5 -121.3(6) . . . . ?
C2 C3 C4 Ru1 -64.0(4) . . . . ?
C3A C3 C4 Ru1 119.3(6) . . . . ?
C21 C4 C5 C6 -12.0(9) . . . . ?
C3 C4 C5 C6 168.4(6) . . . . ?
Ru1 C4 C5 C6 77.3(7) . . . . ?
C21 C4 C5 C5A 162.6(5) . . . . ?
C3 C4 C5 C5A -17.1(9) . . . . ?
Ru1 C4 C5 C5A -108.2(6) . . . . ?
C6 C5 C5A C5B -75.2(7) . . . . ?
C4 C5 C5A C5B 109.8(7) . . . . ?
C6 C5 C5A C5F 104.0(6) . . . . ?
C4 C5 C5A C5F -71.1(8) . . . . ?
C5F C5A C5B C5C 0.8(9) . . . . ?
C5 C5A C5B C5C 179.9(6) . . . . ?
C5A C5B C5C C5D -0.7(10) . . . . ?
C5B C5C C5D C5E -0.3(10) . . . . ?
C5C C5D C5E C5F 1.2(10) . . . . ?
C5B C5A C5F C5E 0.0(9) . . . . ?
C5 C5A C5F C5E -179.1(5) . . . . ?
C5D C5E C5F C5A -1.1(9) . . . . ?
C4 C5 C6 N22 1.9(9) . . . . ?
C5A C5 C6 N22 -173.1(5) . . . . ?
C4 C5 C6 C7 -177.0(6) . . . . ?
C5A C5 C6 C7 8.0(8) . . . . ?
C9 N22 C6 C5 -178.3(6) . . . . ?
Pt1 N22 C6 C5 6.2(8) . . . . ?
C9 N22 C6 C7 0.8(6) . . . . ?
Pt1 N22 C6 C7 -174.7(4) . . . . ?
C5 C6 C7 C8 178.1(6) . . . . ?
N22 C6 C7 C8 -1.0(7) . . . . ?
C6 C7 C8 C9 0.8(7) . . . . ?
C6 N22 C9 C10 -178.4(6) . . . . ?
Pt1 N22 C9 C10 -3.0(9) . . . . ?
C6 N22 C9 C8 -0.3(6) . . . . ?
Pt1 N22 C9 C8 175.2(4) . . . . ?
C7 C8 C9 N22 -0.3(7) . . . . ?
C7 C8 C9 C10 177.9(5) . . . . ?
N22 C9 C10 C11 -1.5(10) . . . . ?
C8 C9 C10 C11 -179.4(6) . . . . ?
N22 C9 C10 C10A 175.1(5) . . . . ?
C8 C9 C10 C10A -2.9(9) . . . . ?
C11 C10 C10A C10F 75.7(8) . . . . ?
C9 C10 C10A C10F -101.1(8) . . . . ?
C11 C10 C10A C10B -102.8(8) . . . . ?
C9 C10 C10A C10B 80.4(8) . . . . ?
C10F C10A C10B C10C 1.7(14) . . . . ?
C10 C10A C10B C10C -179.7(8) . . . . ?
C10A C10B C10C C10D -4.2(16) . . . . ?
C10B C10C C10D C10E 5.5(15) . . . . ?
C10C C10D C10E C10F -4.4(13) . . . . ?
C10B C10A C10F C10E -0.6(12) . . . . ?
C10 C10A C10F C10E -179.2(7) . . . . ?
C10D C10E C10F C10A 2.0(12) . . . . ?
C14 N23 C11 C10 179.1(6) . . . . ?
Pt1 N23 C11 C10 -1.0(9) . . . . ?
C14 N23 C11 C12 -3.0(6) . . . . ?
Pt1 N23 C11 C12 176.9(4) . . . . ?
C9 C10 C11 N23 3.6(10) . . . . ?
C10A C10 C11 N23 -173.0(5) . . . . ?
C9 C10 C11 C12 -174.0(5) . . . . ?
C10A C10 C11 C12 9.5(9) . . . . ?
N23 C11 C12 C13 2.1(7) . . . . ?
C10 C11 C12 C13 -180.0(6) . . . . ?
C11 C12 C13 C14 -0.4(7) . . . . ?
C11 N23 C14 C15 -175.4(6) . . . . ?
Pt1 N23 C14 C15 4.7(9) . . . . ?
C11 N23 C14 C13 2.8(6) . . . . ?
Pt1 N23 C14 C13 -177.1(4) . . . . ?
C12 C13 C14 N23 -1.5(7) . . . . ?
C12 C13 C14 C15 176.7(6) . . . . ?
N23 C14 C15 C16 -1.6(10) . . . . ?
C13 C14 C15 C16 -179.5(5) . . . . ?
N23 C14 C15 C15A 173.9(5) . . . . ?
C13 C14 C15 C15A -4.0(9) . . . . ?
C14 C15 C15A C15F 109.2(7) . . . . ?
C16 C15 C15A C15F -75.0(8) . . . . ?
C14 C15 C15A C15B -71.5(8) . . . . ?
C16 C15 C15A C15B 104.3(7) . . . . ?
C15F C15A C15B C15C 1.7(10) . . . . ?
C15 C15A C15B C15C -177.6(6) . . . . ?
C15A C15B C15C C15D -2.4(10) . . . . ?
C15B C15C C15D C15E 1.5(10) . . . . ?
C15C C15D C15E C15F 0.2(11) . . . . ?
C15D C15E C15F C15A -1.0(10) . . . . ?
C15B C15A C15F C15E 0.0(10) . . . . ?
C15 C15A C15F C15E 179.3(6) . . . . ?
C19 N24 C16 C15 177.1(6) . . . . ?
Pt1 N24 C16 C15 5.1(9) . . . . ?
C19 N24 C16 C17 0.9(6) . . . . ?
Pt1 N24 C16 C17 -171.2(4) . . . . ?
C14 C15 C16 N24 -3.6(10) . . . . ?
C15A C15 C16 N24 -179.2(6) . . . . ?
C14 C15 C16 C17 172.2(6) . . . . ?
C15A C15 C16 C17 -3.3(8) . . . . ?
N24 C16 C17 C18 2.0(7) . . . . ?
C15 C16 C17 C18 -174.5(6) . . . . ?
C16 C17 C18 C19 -3.9(7) . . . . ?
C16 N24 C19 C20 174.8(6) . . . . ?
Pt1 N24 C19 C20 -13.2(8) . . . . ?
C16 N24 C19 C18 -3.2(6) . . . . ?
Pt1 N24 C19 C18 168.8(4) . . . . ?
C17 C18 C19 C20 -173.6(6) . . . . ?
C17 C18 C19 N24 4.5(7) . . . . ?
N24 C19 C20 C1 -1.1(9) . . . . ?
C18 C19 C20 C1 176.7(6) . . . . ?
N24 C19 C20 C20A 169.9(5) . . . . ?
C18 C19 C20 C20A -12.4(8) . . . . ?
C21 C1 C20 C19 16.4(9) . . . . ?
C2 C1 C20 C19 -168.3(5) . . . . ?
Ru1 C1 C20 C19 -75.9(7) . . . . ?
C21 C1 C20 C20A -154.0(5) . . . . ?
C2 C1 C20 C20A 21.3(9) . . . . ?
Ru1 C1 C20 C20A 113.8(6) . . . . ?
C19 C20 C20A C20F 69.2(8) . . . . ?
C1 C20 C20A C20F -119.8(7) . . . . ?
C19 C20 C20A C20B -109.2(6) . . . . ?
C1 C20 C20A C20B 61.7(8) . . . . ?
C20F C20A C20B C20C 1.2(9) . . . . ?
C20 C20A C20B C20C 179.7(5) . . . . ?
C20A C20B C20C C20D -1.8(10) . . . . ?
C20B C20C C20D C20E 1.4(10) . . . . ?
C20C C20D C20E C20F -0.4(11) . . . . ?
C20D C20E C20F C20A -0.2(10) . . . . ?
C20B C20A C20F C20E -0.2(9) . . . . ?
C20 C20A C20F C20E -178.7(6) . . . . ?
C5 C4 C21 C1 -173.2(5) . . . . ?
C3 C4 C21 C1 6.4(6) . . . . ?
Ru1 C4 C21 C1 65.2(4) . . . . ?
C5 C4 C21 Pt1 13.4(9) . . . . ?
C3 C4 C21 Pt1 -166.9(4) . . . . ?
Ru1 C4 C21 Pt1 -108.1(4) . . . . ?
C5 C4 C21 Ru1 121.5(6) . . . . ?
C3 C4 C21 Ru1 -58.8(4) . . . . ?
C20 C1 C21 C4 170.3(5) . . . . ?
C2 C1 C21 C4 -5.6(6) . . . . ?
Ru1 C1 C21 C4 -66.1(4) . . . . ?
C20 C1 C21 Pt1 -16.2(8) . . . . ?
C2 C1 C21 Pt1 167.9(4) . . . . ?
Ru1 C1 C21 Pt1 107.4(4) . . . . ?
C20 C1 C21 Ru1 -123.6(6) . . . . ?
C2 C1 C21 Ru1 60.5(4) . . . . ?
C22 Ru1 C27 O27 99.3(13) . . . . ?
C21 Ru1 C27 O27 0.1(14) . . . . ?
C3 Ru1 C27 O27 -68.3(13) . . . . ?
C2 Ru1 C27 O27 -76.3(14) . . . . ?
C1 Ru1 C27 O27 -3.1(16) . . . . ?
C4 Ru1 C27 O27 -32.1(13) . . . . ?
Ru2 Ru1 C27 O27 -161.8(12) . . . . ?
Ru4 Ru1 C27 O27 178.7(14) . . . . ?
Ru3 Ru1 C27 O27 -120.3(13) . . . . ?
C22 Ru1 C27 Ru4 -79.4(2) . . . . ?
C21 Ru1 C27 Ru4 -178.64(16) . . . . ?
C3 Ru1 C27 Ru4 113.03(18) . . . . ?
C2 Ru1 C27 Ru4 105.0(4) . . . . ?
C1 Ru1 C27 Ru4 178.2(4) . . . . ?
C4 Ru1 C27 Ru4 149.16(17) . . . . ?
Ru2 Ru1 C27 Ru4 19.52(19) . . . . ?
Ru3 Ru1 C27 Ru4 61.01(10) . . . . ?

loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.500 0.000 0.500 384 92 ' '
_platon_squeeze_details          
;

;

_refine_diff_density_max         0.74
_refine_diff_density_min         -0.77
_refine_diff_density_rms         0.17
_database_code_depnum_ccdc_archive 'CCDC 1006128'
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_7

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C50 H31 N3 Pt'
_chemical_formula_weight         868.87

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -4.5932 6.9264 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   10.315(3)
_cell_length_b                   11.935(3)
_cell_length_c                   14.841(4)
_cell_angle_alpha                103.07(4)
_cell_angle_beta                 97.56(3)
_cell_angle_gamma                102.32(4)
_cell_volume                     1707.4(9)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    8452
_cell_measurement_theta_min      3.11
_cell_measurement_theta_max      77.67

_exptl_crystal_description       plate
_exptl_crystal_colour            'dark green'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.690
_exptl_crystal_F_000             860
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.05
_exptl_absorpt_coefficient_mu    8.016
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_correction_T_min  0.457
_exptl_absorpt_correction_T_max  0.773
_exptl_absorpt_process_details   
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.33.32 (release 27-01-2009 CrysAlis171 .NET)
(compiled Jan 27 2009,14:17:37)
Analytical numeric absorption correction using a multifaceted crystal
			model based on expressions derived by R.C. Clark & J.S. Reid.
(Clark, R. C. & Reid, J. S. (1995). Acta Cryst. A51, 887-897)
;

_exptl_special_details           
;

;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     1.54184
_diffrn_radiation_type           CuK\a
_diffrn_source                   'Enhance (Cu) X-ray Source'
_diffrn_measurement_device_type  'Goniometer Xcalibur, detector: Onyx'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean 8.196
_diffrn_reflns_number            12842
_diffrn_reflns_av_unetI/netI     0.0915
_diffrn_reflns_av_R_equivalents  0.1023
_diffrn_reflns_limit_h_min       -7
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_theta_min         3.113
_diffrn_reflns_theta_max         66.990
_diffrn_reflns_theta_full        67.000
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measured_fraction_theta_full 0.988
_diffrn_reflns_Laue_measured_fraction_max 0.988
_diffrn_reflns_Laue_measured_fraction_full 0.988
_diffrn_reflns_point_group_measured_fraction_max 0.988
_diffrn_reflns_point_group_measured_fraction_full 0.988
_reflns_number_total             6010
_reflns_number_gt                5043
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 ?
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
;
 w=1/[σ²(Fo²)+(0.1440P)²+16.5400P]
 where P=(Fo²+2Fc²)/3
;
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         6010
_refine_ls_number_parameters     476
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0836
_refine_ls_R_factor_gt           0.0749
_refine_ls_wR_factor_ref         0.1953
_refine_ls_wR_factor_gt          0.1837
_refine_ls_goodness_of_fit_ref   0.959
_refine_ls_restrained_S_all      0.959
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.26209(4) 0.49574(4) 0.84357(3) 0.01473(18) Uani 1 1 d . . . . .
N22 N 0.3435(9) 0.3502(8) 0.8224(7) 0.0209(19) Uani 1 1 d . U . . .
N23 N 0.2740(8) 0.5035(7) 0.7074(5) 0.0124(15) Uani 1 1 d . . . . .
N24 N 0.1743(8) 0.6376(8) 0.8595(6) 0.0186(18) Uani 1 1 d . . . . .
C1 C 0.2034(11) 0.5654(10) 1.0424(7) 0.020(2) Uani 1 1 d . . . . .
C2 C 0.2063(11) 0.5257(10) 1.1284(8) 0.023(2) Uani 1 1 d . . . . .
C2A C 0.1287(12) 0.5488(9) 1.1962(8) 0.020(2) Uani 1 1 d . . . . .
H2A H 0.0658 0.5938 1.1839 0.024 Uiso 1 1 calc R U . . .
C2B C 0.1303(12) 0.5150(10) 1.2803(7) 0.022(2) Uani 1 1 d . . . . .
H2B H 0.0620 0.5318 1.3145 0.027 Uiso 1 1 calc R U . . .
C2C C 0.2195(15) 0.4598(12) 1.3199(9) 0.035(3) Uani 1 1 d . . . . .
H2C H 0.2075 0.4488 1.3799 0.042 Uiso 1 1 calc R U . . .
C3 C 0.2921(11) 0.4425(9) 1.1198(8) 0.019(2) Uani 1 1 d . . . . .
C3A C 0.3513(11) 0.4106(10) 1.1962(8) 0.024(2) Uani 1 1 d . . . . .
H3A H 0.4252 0.3770 1.1848 0.029 Uiso 1 1 calc R U . . .
C3B C 0.3241(12) 0.4181(12) 1.2852(9) 0.031(3) Uani 1 1 d . . . . .
H3B H 0.3820 0.3923 1.3269 0.037 Uiso 1 1 calc R U . . .
C4 C 0.3106(11) 0.4136(9) 1.0231(8) 0.019(2) Uani 1 1 d . . . . .
C5 C 0.3524(11) 0.3130(10) 0.9801(8) 0.022(2) Uani 1 1 d . . . . .
C5A C 0.3761(12) 0.2252(10) 1.0332(8) 0.022(2) Uani 1 1 d . . . . .
C5B C 0.2718(12) 0.1592(11) 1.0641(9) 0.027(2) Uani 1 1 d . . . . .
H5B H 0.1834 0.1696 1.0494 0.032 Uiso 1 1 calc R U . . .
C5C C 0.2915(13) 0.0783(12) 1.1158(9) 0.030(3) Uani 1 1 d . . . . .
H5C H 0.2190 0.0359 1.1380 0.036 Uiso 1 1 calc R U . . .
C5D C 0.4221(13) 0.0616(11) 1.1339(9) 0.028(2) Uani 1 1 d . . . . .
H5D H 0.4388 0.0070 1.1690 0.034 Uiso 1 1 calc R U . . .
C5E C 0.5277(13) 0.1245(11) 1.1008(9) 0.029(3) Uani 1 1 d . . . . .
H5E H 0.6154 0.1119 1.1133 0.035 Uiso 1 1 calc R U . . .
C5F C 0.5062(12) 0.2045(12) 1.0501(8) 0.028(3) Uani 1 1 d . . . . .
H5F H 0.5782 0.2455 1.0267 0.034 Uiso 1 1 calc R U . . .
C6 C 0.3633(10) 0.2869(9) 0.8866(7) 0.0157(19) Uani 1 1 d . . . . .
C7 C 0.3936(11) 0.1804(10) 0.8372(8) 0.020(2) Uiso 1 1 d . . . . .
H7 H 0.4071 0.1170 0.8631 0.025 Uiso 1 1 calc R U . . .
C8 C 0.3996(11) 0.1849(10) 0.7493(8) 0.023(2) Uani 1 1 d . . . . .
H8 H 0.4204 0.1268 0.7020 0.027 Uiso 1 1 calc R U . . .
C9 C 0.3690(11) 0.2933(8) 0.7388(7) 0.018(2) Uani 1 1 d . U . . .
C10 C 0.3735(11) 0.3338(9) 0.6560(7) 0.017(2) Uani 1 1 d . . . . .
C10A C 0.4230(12) 0.2673(10) 0.5795(8) 0.023(2) Uani 1 1 d . . . . .
C10B C 0.5492(12) 0.2414(10) 0.5898(8) 0.024(2) Uani 1 1 d . . . . .
H10B H 0.6054 0.2671 0.6505 0.029 Uiso 1 1 calc R U . . .
C10C C 0.5955(13) 0.1805(10) 0.5159(8) 0.026(2) Uani 1 1 d . . . . .
H10C H 0.6831 0.1668 0.5255 0.031 Uiso 1 1 calc R U . . .
C10D C 0.5145(14) 0.1394(10) 0.4278(10) 0.032(3) Uani 1 1 d . . . . .
H10D H 0.5444 0.0945 0.3769 0.038 Uiso 1 1 calc R U . . .
C10E C 0.3881(14) 0.1640(12) 0.4137(9) 0.034(3) Uani 1 1 d . . . . .
H10E H 0.3343 0.1397 0.3523 0.041 Uiso 1 1 calc R U . . .
C10F C 0.3417(12) 0.2222(9) 0.4869(8) 0.023(2) Uani 1 1 d . . . . .
H10F H 0.2531 0.2334 0.4766 0.028 Uiso 1 1 calc R U . . .
C11 C 0.3327(11) 0.4362(9) 0.6454(7) 0.018(2) Uani 1 1 d . . . . .
C12 C 0.3451(10) 0.4840(9) 0.5647(7) 0.018(2) Uani 1 1 d . . . . .
H12 H 0.3867 0.4566 0.5134 0.022 Uiso 1 1 calc R U . . .
C13 C 0.2861(12) 0.5746(10) 0.5770(8) 0.023(2) Uani 1 1 d . . . . .
H13 H 0.2765 0.6222 0.5344 0.028 Uiso 1 1 calc R U . . .
C14 C 0.2390(11) 0.5882(9) 0.6664(7) 0.018(2) Uani 1 1 d . . . . .
C15 C 0.1730(11) 0.6715(9) 0.7023(7) 0.019(2) Uani 1 1 d . . . . .
C15A C 0.1302(10) 0.7427(9) 0.6371(7) 0.017(2) Uani 1 1 d . . . . .
C15B C 0.0424(11) 0.6845(10) 0.5519(7) 0.021(2) Uani 1 1 d . . . . .
H15B H 0.0074 0.6008 0.5371 0.025 Uiso 1 1 calc R U . . .
C15C C 0.0049(12) 0.7458(11) 0.4884(8) 0.027(2) Uani 1 1 d . . . . .
H15C H -0.0546 0.7046 0.4303 0.033 Uiso 1 1 calc R U . . .
C15D C 0.0548(13) 0.8676(13) 0.5103(9) 0.031(3) Uani 1 1 d . . . . .
H15D H 0.0321 0.9100 0.4661 0.037 Uiso 1 1 calc R U . . .
C15E C 0.1382(11) 0.9287(10) 0.5967(8) 0.021(2) Uani 1 1 d . . . . .
H15E H 0.1684 1.0129 0.6130 0.025 Uiso 1 1 calc R U . . .
C15F C 0.1769(11) 0.8654(10) 0.6592(8) 0.022(2) Uani 1 1 d . . . . .
H15F H 0.2360 0.9066 0.7175 0.026 Uiso 1 1 calc R U . . .
C16 C 0.1438(10) 0.6920(9) 0.7929(7) 0.0152(19) Uani 1 1 d . . . . .
C17 C 0.0830(11) 0.7857(10) 0.8346(9) 0.024(2) Uani 1 1 d . . . . .
H17 H 0.0472 0.8368 0.8033 0.028 Uiso 1 1 calc R U . . .
C18 C 0.0866(11) 0.7869(10) 0.9241(8) 0.021(2) Uani 1 1 d . . . . .
H18 H 0.0581 0.8425 0.9689 0.025 Uiso 1 1 calc R U . . .
C19 C 0.1392(11) 0.6934(10) 0.9431(7) 0.019(2) Uani 1 1 d . . . . .
C20 C 0.1527(10) 0.6642(8) 1.0284(7) 0.0144(19) Uani 1 1 d . . . . .
C20A C 0.1294(11) 0.7478(11) 1.1115(8) 0.022(2) Uani 1 1 d . . . . .
C20B C 0.0045(11) 0.7750(10) 1.1178(7) 0.020(2) Uani 1 1 d . . . . .
H20B H -0.0704 0.7380 1.0675 0.024 Uiso 1 1 calc R U . . .
C20C C -0.0105(12) 0.8564(11) 1.1975(9) 0.028(3) Uani 1 1 d . . . . .
H20C H -0.0947 0.8758 1.2008 0.034 Uiso 1 1 calc R U . . .
C20D C 0.0965(14) 0.9076(11) 1.2704(8) 0.031(3) Uani 1 1 d . . . . .
H20D H 0.0858 0.9617 1.3250 0.038 Uiso 1 1 calc R U . . .
C20E C 0.2213(12) 0.8819(10) 1.2659(8) 0.024(2) Uani 1 1 d . . . . .
H20E H 0.2958 0.9184 1.3166 0.029 Uiso 1 1 calc R U . . .
C20F C 0.2348(12) 0.8032(10) 1.1875(8) 0.023(2) Uani 1 1 d . . . . .
H20F H 0.3200 0.7855 1.1848 0.028 Uiso 1 1 calc R U . . .
C21 C 0.2580(10) 0.4920(9) 0.9765(6) 0.0129(18) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
Pt1 C21 1.989(9) . ?
Pt1 N23 2.063(8) . ?
Pt1 N22 2.065(9) . ?
Pt1 N24 2.066(9) . ?
N22 C9 1.360(14) . ?
N22 C6 1.364(14) . ?
N23 C11 1.371(13) . ?
N23 C14 1.377(13) . ?
N24 C16 1.340(14) . ?
N24 C19 1.401(13) . ?
C1 C21 1.418(14) . ?
C1 C20 1.432(14) . ?
C1 C2 1.457(15) . ?
C2 C2A 1.382(17) . ?
C2 C3 1.461(15) . ?
C2A C2B 1.395(15) . ?
C2A H2A 0.9500 . ?
C2B C2C 1.384(18) . ?
C2B H2B 0.9500 . ?
C2C C3B 1.39(2) . ?
C2C H2C 0.9500 . ?
C3 C3A 1.383(16) . ?
C3 C4 1.447(16) . ?
C3A C3B 1.374(18) . ?
C3A H3A 0.9500 . ?
C3B H3B 0.9500 . ?
C4 C5 1.408(16) . ?
C4 C21 1.434(14) . ?
C5 C6 1.377(16) . ?
C5 C5A 1.488(15) . ?
C5A C5B 1.385(17) . ?
C5A C5F 1.416(16) . ?
C5B C5C 1.394(17) . ?
C5B H5B 0.9500 . ?
C5C C5D 1.404(18) . ?
C5C H5C 0.9500 . ?
C5D C5E 1.397(18) . ?
C5D H5D 0.9500 . ?
C5E C5F 1.377(17) . ?
C5E H5E 0.9500 . ?
C5F H5F 0.9500 . ?
C6 C7 1.435(15) . ?
C7 C8 1.326(17) . ?
C7 H7 0.9500 . ?
C8 C9 1.432(14) . ?
C8 H8 0.9500 . ?
C9 C10 1.420(15) . ?
C10 C11 1.409(14) . ?
C10 C10A 1.448(15) . ?
C10A C10B 1.398(17) . ?
C10A C10F 1.433(16) . ?
C10B C10C 1.372(17) . ?
C10B H10B 0.9500 . ?
C10C C10D 1.377(18) . ?
C10C H10C 0.9500 . ?
C10D C10E 1.396(19) . ?
C10D H10D 0.9500 . ?
C10E C10F 1.352(17) . ?
C10E H10E 0.9500 . ?
C10F H10F 0.9500 . ?
C11 C12 1.447(15) . ?
C12 C13 1.340(16) . ?
C12 H12 0.9500 . ?
C13 C14 1.459(15) . ?
C13 H13 0.9500 . ?
C14 C15 1.373(16) . ?
C15 C16 1.395(15) . ?
C15 C15A 1.507(15) . ?
C15A C15F 1.387(15) . ?
C15A C15B 1.391(15) . ?
C15B C15C 1.382(16) . ?
C15B H15B 0.9500 . ?
C15C C15D 1.381(19) . ?
C15C H15C 0.9500 . ?
C15D C15E 1.391(18) . ?
C15D H15D 0.9500 . ?
C15E C15F 1.392(16) . ?
C15E H15E 0.9500 . ?
C15F H15F 0.9500 . ?
C16 C17 1.455(15) . ?
C17 C18 1.321(17) . ?
C17 H17 0.9500 . ?
C18 C19 1.407(15) . ?
C18 H18 0.9500 . ?
C19 C20 1.386(15) . ?
C20 C20A 1.483(15) . ?
C20A C20F 1.388(16) . ?
C20A C20B 1.403(16) . ?
C20B C20C 1.399(17) . ?
C20B H20B 0.9500 . ?
C20C C20D 1.365(19) . ?
C20C H20C 0.9500 . ?
C20D C20E 1.392(19) . ?
C20D H20D 0.9500 . ?
C20E C20F 1.363(17) . ?
C20E H20E 0.9500 . ?
C20F H20F 0.9500 . ?

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
C21 Pt1 N23 177.8(4) . . ?
C21 Pt1 N22 90.5(4) . . ?
N23 Pt1 N22 89.4(4) . . ?
C21 Pt1 N24 91.1(4) . . ?
N23 Pt1 N24 89.1(3) . . ?
N22 Pt1 N24 177.5(4) . . ?
C9 N22 C6 109.1(8) . . ?
C9 N22 Pt1 125.3(7) . . ?
C6 N22 Pt1 125.1(7) . . ?
C11 N23 C14 107.2(8) . . ?
C11 N23 Pt1 126.8(7) . . ?
C14 N23 Pt1 125.5(7) . . ?
C16 N24 C19 109.0(9) . . ?
C16 N24 Pt1 126.0(7) . . ?
C19 N24 Pt1 124.9(7) . . ?
C21 C1 C20 126.0(9) . . ?
C21 C1 C2 109.7(9) . . ?
C20 C1 C2 124.2(10) . . ?
C2A C2 C1 126.7(10) . . ?
C2A C2 C3 127.6(10) . . ?
C1 C2 C3 105.1(10) . . ?
C2 C2A C2B 128.6(10) . . ?
C2 C2A H2A 115.7 . . ?
C2B C2A H2A 115.7 . . ?
C2C C2B C2A 127.8(11) . . ?
C2C C2B H2B 116.1 . . ?
C2A C2B H2B 116.1 . . ?
C2B C2C C3B 129.9(12) . . ?
C2B C2C H2C 115.0 . . ?
C3B C2C H2C 115.0 . . ?
C3A C3 C4 129.3(10) . . ?
C3A C3 C2 122.9(10) . . ?
C4 C3 C2 107.5(9) . . ?
C3B C3A C3 132.5(11) . . ?
C3B C3A H3A 113.8 . . ?
C3 C3A H3A 113.8 . . ?
C3A C3B C2C 126.1(12) . . ?
C3A C3B H3B 117.0 . . ?
C2C C3B H3B 117.0 . . ?
C5 C4 C21 126.5(10) . . ?
C5 C4 C3 124.4(10) . . ?
C21 C4 C3 108.4(9) . . ?
C6 C5 C4 122.2(10) . . ?
C6 C5 C5A 117.3(10) . . ?
C4 C5 C5A 120.4(10) . . ?
C5B C5A C5F 118.7(10) . . ?
C5B C5A C5 121.3(10) . . ?
C5F C5A C5 120.0(11) . . ?
C5A C5B C5C 122.6(11) . . ?
C5A C5B H5B 118.7 . . ?
C5C C5B H5B 118.7 . . ?
C5B C5C C5D 117.7(12) . . ?
C5B C5C H5C 121.1 . . ?
C5D C5C H5C 121.1 . . ?
C5E C5D C5C 120.5(11) . . ?
C5E C5D H5D 119.7 . . ?
C5C C5D H5D 119.7 . . ?
C5F C5E C5D 120.8(12) . . ?
C5F C5E H5E 119.6 . . ?
C5D C5E H5E 119.6 . . ?
C5E C5F C5A 119.6(12) . . ?
C5E C5F H5F 120.2 . . ?
C5A C5F H5F 120.2 . . ?
N22 C6 C5 128.8(10) . . ?
N22 C6 C7 106.7(9) . . ?
C5 C6 C7 124.5(10) . . ?
C8 C7 C6 108.8(10) . . ?
C8 C7 H7 125.6 . . ?
C6 C7 H7 125.6 . . ?
C7 C8 C9 107.5(10) . . ?
C7 C8 H8 126.3 . . ?
C9 C8 H8 126.3 . . ?
N22 C9 C10 127.8(9) . . ?
N22 C9 C8 107.7(9) . . ?
C10 C9 C8 124.3(10) . . ?
C11 C10 C9 122.8(9) . . ?
C11 C10 C10A 118.6(10) . . ?
C9 C10 C10A 118.6(9) . . ?
C10B C10A C10F 115.6(10) . . ?
C10B C10A C10 123.7(11) . . ?
C10F C10A C10 120.7(10) . . ?
C10C C10B C10A 122.8(11) . . ?
C10C C10B H10B 118.6 . . ?
C10A C10B H10B 118.6 . . ?
C10B C10C C10D 119.7(12) . . ?
C10B C10C H10C 120.2 . . ?
C10D C10C H10C 120.2 . . ?
C10C C10D C10E 119.7(12) . . ?
C10C C10D H10D 120.2 . . ?
C10E C10D H10D 120.2 . . ?
C10F C10E C10D 120.5(12) . . ?
C10F C10E H10E 119.8 . . ?
C10D C10E H10E 119.8 . . ?
C10E C10F C10A 121.6(11) . . ?
C10E C10F H10F 119.2 . . ?
C10A C10F H10F 119.2 . . ?
N23 C11 C10 126.0(10) . . ?
N23 C11 C12 110.1(9) . . ?
C10 C11 C12 123.9(10) . . ?
C13 C12 C11 106.0(10) . . ?
C13 C12 H12 127.0 . . ?
C11 C12 H12 127.0 . . ?
C12 C13 C14 108.9(10) . . ?
C12 C13 H13 125.6 . . ?
C14 C13 H13 125.6 . . ?
C15 C14 N23 126.9(10) . . ?
C15 C14 C13 125.5(10) . . ?
N23 C14 C13 107.6(9) . . ?
C14 C15 C16 124.2(10) . . ?
C14 C15 C15A 116.0(9) . . ?
C16 C15 C15A 119.9(10) . . ?
C15F C15A C15B 118.6(10) . . ?
C15F C15A C15 121.9(10) . . ?
C15B C15A C15 119.5(9) . . ?
C15C C15B C15A 121.4(11) . . ?
C15C C15B H15B 119.3 . . ?
C15A C15B H15B 119.3 . . ?
C15D C15C C15B 119.3(11) . . ?
C15D C15C H15C 120.3 . . ?
C15B C15C H15C 120.3 . . ?
C15C C15D C15E 120.4(11) . . ?
C15C C15D H15D 119.8 . . ?
C15E C15D H15D 119.8 . . ?
C15D C15E C15F 119.5(11) . . ?
C15D C15E H15E 120.3 . . ?
C15F C15E H15E 120.3 . . ?
C15A C15F C15E 120.7(10) . . ?
C15A C15F H15F 119.7 . . ?
C15E C15F H15F 119.7 . . ?
N24 C16 C15 127.7(9) . . ?
N24 C16 C17 107.2(9) . . ?
C15 C16 C17 124.9(10) . . ?
C18 C17 C16 107.5(10) . . ?
C18 C17 H17 126.3 . . ?
C16 C17 H17 126.3 . . ?
C17 C18 C19 109.6(10) . . ?
C17 C18 H18 125.2 . . ?
C19 C18 H18 125.2 . . ?
C20 C19 N24 127.6(10) . . ?
C20 C19 C18 125.9(10) . . ?
N24 C19 C18 106.5(9) . . ?
C19 C20 C1 123.2(10) . . ?
C19 C20 C20A 117.8(9) . . ?
C1 C20 C20A 118.6(9) . . ?
C20F C20A C20B 117.4(11) . . ?
C20F C20A C20 119.4(10) . . ?
C20B C20A C20 123.2(10) . . ?
C20C C20B C20A 120.5(10) . . ?
C20C C20B H20B 119.7 . . ?
C20A C20B H20B 119.7 . . ?
C20D C20C C20B 119.6(11) . . ?
C20D C20C H20C 120.2 . . ?
C20B C20C H20C 120.2 . . ?
C20C C20D C20E 120.9(11) . . ?
C20C C20D H20D 119.5 . . ?
C20E C20D H20D 119.5 . . ?
C20F C20E C20D 118.9(11) . . ?
C20F C20E H20E 120.6 . . ?
C20D C20E H20E 120.6 . . ?
C20E C20F C20A 122.7(11) . . ?
C20E C20F H20F 118.6 . . ?
C20A C20F H20F 118.6 . . ?
C1 C21 C4 107.5(8) . . ?
C1 C21 Pt1 126.8(7) . . ?
C4 C21 Pt1 125.8(8) . . ?

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
C21 C1 C2 C2A -159.3(11) . . . . ?
C20 C1 C2 C2A 20.9(18) . . . . ?
C21 C1 C2 C3 12.3(12) . . . . ?
C20 C1 C2 C3 -167.5(10) . . . . ?
C1 C2 C2A C2B -178.4(12) . . . . ?
C3 C2 C2A C2B 12(2) . . . . ?
C2 C2A C2B C2C 7(2) . . . . ?
C2A C2B C2C C3B -4(2) . . . . ?
C2A C2 C3 C3A -27.2(18) . . . . ?
C1 C2 C3 C3A 161.3(11) . . . . ?
C2A C2 C3 C4 158.2(11) . . . . ?
C1 C2 C3 C4 -13.3(12) . . . . ?
C4 C3 C3A C3B -168.0(13) . . . . ?
C2 C3 C3A C3B 19(2) . . . . ?
C3 C3A C3B C2C 2(2) . . . . ?
C2B C2C C3B C3A -8(2) . . . . ?
C3A C3 C4 C5 25.2(19) . . . . ?
C2 C3 C4 C5 -160.7(11) . . . . ?
C3A C3 C4 C21 -164.3(11) . . . . ?
C2 C3 C4 C21 9.8(12) . . . . ?
C21 C4 C5 C6 8.6(18) . . . . ?
C3 C4 C5 C6 177.4(10) . . . . ?
C21 C4 C5 C5A -166.5(10) . . . . ?
C3 C4 C5 C5A 2.3(17) . . . . ?
C6 C5 C5A C5B -111.4(13) . . . . ?
C4 C5 C5A C5B 64.0(16) . . . . ?
C6 C5 C5A C5F 66.3(14) . . . . ?
C4 C5 C5A C5F -118.4(12) . . . . ?
C5F C5A C5B C5C 3.8(18) . . . . ?
C5 C5A C5B C5C -178.5(12) . . . . ?
C5A C5B C5C C5D -2.1(19) . . . . ?
C5B C5C C5D C5E -0.1(19) . . . . ?
C5C C5D C5E C5F 0.4(19) . . . . ?
C5D C5E C5F C5A 1.4(19) . . . . ?
C5B C5A C5F C5E -3.4(17) . . . . ?
C5 C5A C5F C5E 178.9(11) . . . . ?
C9 N22 C6 C5 178.2(11) . . . . ?
Pt1 N22 C6 C5 -9.7(16) . . . . ?
C9 N22 C6 C7 -4.2(12) . . . . ?
Pt1 N22 C6 C7 167.9(7) . . . . ?
C4 C5 C6 N22 3.0(18) . . . . ?
C5A C5 C6 N22 178.2(10) . . . . ?
C4 C5 C6 C7 -174.1(10) . . . . ?
C5A C5 C6 C7 1.1(16) . . . . ?
N22 C6 C7 C8 3.7(13) . . . . ?
C5 C6 C7 C8 -178.6(11) . . . . ?
C6 C7 C8 C9 -1.8(13) . . . . ?
C6 N22 C9 C10 -173.4(11) . . . . ?
Pt1 N22 C9 C10 14.6(16) . . . . ?
C6 N22 C9 C8 3.2(12) . . . . ?
Pt1 N22 C9 C8 -168.9(7) . . . . ?
C7 C8 C9 N22 -0.8(13) . . . . ?
C7 C8 C9 C10 175.9(11) . . . . ?
N22 C9 C10 C11 -9.0(18) . . . . ?
C8 C9 C10 C11 175.0(11) . . . . ?
N22 C9 C10 C10A 170.5(11) . . . . ?
C8 C9 C10 C10A -5.5(17) . . . . ?
C11 C10 C10A C10B 124.3(12) . . . . ?
C9 C10 C10A C10B -55.3(16) . . . . ?
C11 C10 C10A C10F -56.5(15) . . . . ?
C9 C10 C10A C10F 123.9(12) . . . . ?
C10F C10A C10B C10C 2.2(16) . . . . ?
C10 C10A C10B C10C -178.6(11) . . . . ?
C10A C10B C10C C10D -1.9(18) . . . . ?
C10B C10C C10D C10E 2.5(18) . . . . ?
C10C C10D C10E C10F -4(2) . . . . ?
C10D C10E C10F C10A 4(2) . . . . ?
C10B C10A C10F C10E -3.4(17) . . . . ?
C10 C10A C10F C10E 177.4(12) . . . . ?
C14 N23 C11 C10 -174.5(10) . . . . ?
Pt1 N23 C11 C10 12.9(15) . . . . ?
C14 N23 C11 C12 4.2(11) . . . . ?
Pt1 N23 C11 C12 -168.3(7) . . . . ?
C9 C10 C11 N23 -5.9(17) . . . . ?
C10A C10 C11 N23 174.6(10) . . . . ?
C9 C10 C11 C12 175.5(10) . . . . ?
C10A C10 C11 C12 -4.0(16) . . . . ?
N23 C11 C12 C13 -3.7(12) . . . . ?
C10 C11 C12 C13 175.1(10) . . . . ?
C11 C12 C13 C14 1.7(12) . . . . ?
C11 N23 C14 C15 177.4(10) . . . . ?
Pt1 N23 C14 C15 -10.0(15) . . . . ?
C11 N23 C14 C13 -3.1(11) . . . . ?
Pt1 N23 C14 C13 169.5(7) . . . . ?
C12 C13 C14 C15 -179.6(11) . . . . ?
C12 C13 C14 N23 0.9(13) . . . . ?
N23 C14 C15 C16 7.6(18) . . . . ?
C13 C14 C15 C16 -171.8(11) . . . . ?
N23 C14 C15 C15A -171.9(10) . . . . ?
C13 C14 C15 C15A 8.7(16) . . . . ?
C14 C15 C15A C15F -119.6(11) . . . . ?
C16 C15 C15A C15F 60.8(14) . . . . ?
C14 C15 C15A C15B 59.8(14) . . . . ?
C16 C15 C15A C15B -119.8(11) . . . . ?
C15F C15A C15B C15C 2.1(16) . . . . ?
C15 C15A C15B C15C -177.4(10) . . . . ?
C15A C15B C15C C15D -0.5(17) . . . . ?
C15B C15C C15D C15E -2.2(18) . . . . ?
C15C C15D C15E C15F 3.4(17) . . . . ?
C15B C15A C15F C15E -0.9(16) . . . . ?
C15 C15A C15F C15E 178.6(10) . . . . ?
C15D C15E C15F C15A -1.8(16) . . . . ?
C19 N24 C16 C15 173.9(11) . . . . ?
Pt1 N24 C16 C15 -5.2(16) . . . . ?
C19 N24 C16 C17 -1.4(12) . . . . ?
Pt1 N24 C16 C17 179.5(7) . . . . ?
C14 C15 C16 N24 0.6(18) . . . . ?
C15A C15 C16 N24 -179.8(10) . . . . ?
C14 C15 C16 C17 175.2(11) . . . . ?
C15A C15 C16 C17 -5.3(16) . . . . ?
N24 C16 C17 C18 3.2(13) . . . . ?
C15 C16 C17 C18 -172.2(11) . . . . ?
C16 C17 C18 C19 -3.7(13) . . . . ?
C16 N24 C19 C20 179.3(11) . . . . ?
Pt1 N24 C19 C20 -1.6(16) . . . . ?
C16 N24 C19 C18 -0.8(12) . . . . ?
Pt1 N24 C19 C18 178.3(7) . . . . ?
C17 C18 C19 C20 -177.2(11) . . . . ?
C17 C18 C19 N24 2.9(13) . . . . ?
N24 C19 C20 C1 -2.1(18) . . . . ?
C18 C19 C20 C1 178.0(11) . . . . ?
N24 C19 C20 C20A 170.3(10) . . . . ?
C18 C19 C20 C20A -9.6(17) . . . . ?
C21 C1 C20 C19 6.5(18) . . . . ?
C2 C1 C20 C19 -173.7(11) . . . . ?
C21 C1 C20 C20A -165.8(10) . . . . ?
C2 C1 C20 C20A 14.0(16) . . . . ?
C19 C20 C20A C20F -116.8(12) . . . . ?
C1 C20 C20A C20F 55.9(15) . . . . ?
C19 C20 C20A C20B 63.0(15) . . . . ?
C1 C20 C20A C20B -124.3(12) . . . . ?
C20F C20A C20B C20C 0.9(16) . . . . ?
C20 C20A C20B C20C -178.9(10) . . . . ?
C20A C20B C20C C20D -1.3(18) . . . . ?
C20B C20C C20D C20E 1.2(18) . . . . ?
C20C C20D C20E C20F -0.7(17) . . . . ?
C20D C20E C20F C20A 0.3(17) . . . . ?
C20B C20A C20F C20E -0.4(17) . . . . ?
C20 C20A C20F C20E 179.4(10) . . . . ?
C20 C1 C21 C4 173.3(10) . . . . ?
C2 C1 C21 C4 -6.5(12) . . . . ?
C20 C1 C21 Pt1 -6.7(16) . . . . ?
C2 C1 C21 Pt1 173.5(8) . . . . ?
C5 C4 C21 C1 168.2(11) . . . . ?
C3 C4 C21 C1 -2.1(12) . . . . ?
C5 C4 C21 Pt1 -11.8(16) . . . . ?
C3 C4 C21 Pt1 177.9(7) . . . . ?

_refine_diff_density_max         3.82
_refine_diff_density_min         -3.07
_refine_diff_density_rms         0.35

_database_code_depnum_ccdc_archive 'CCDC 1006129'
