#------------------------------------------------------------------------------
#$Date: 2016-03-21 07:01:35 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178545 $
#$URL: svn://www.crystallography.net/cod/cif/4/06/52/4065267.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4065267
loop_
_publ_author_name
'Villar, Amparo'
'Díez, Josefina'
'Lastra, Elena'
'Gamasa, M. Pilar'
_publ_section_title
;
 Ruthenium-Mediated Cyclometalation Reactions of Allene and Allylphosphine
 C═C Bonds: Synthesis of
 κ(P),η4-(Hexa-2,5-dien-1-yl)diphenylphosphine--Ruthenium(II) Complexes
;
_journal_issue                   21
_journal_name_full               Organometallics
_journal_page_first              5803
_journal_paper_doi               10.1021/om200668h
_journal_volume                  30
_journal_year                    2011
_chemical_compound_source        synthesis
_chemical_formula_moiety
'2(C32 H12 B F24), 2(C30 H38 P Ru), 0.5(C6 H14)'
_chemical_formula_sum            'C127 H107 B2 F48 P2 Ru2'
_chemical_formula_weight         2830.83
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                107.61(2)
_cell_angle_beta                 96.99(2)
_cell_angle_gamma                104.684(16)
_cell_formula_units_Z            2
_cell_length_a                   12.868(2)
_cell_length_b                   21.135(4)
_cell_length_c                   25.841(9)
_cell_measurement_reflns_used    39966
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      74.4812
_cell_measurement_theta_min      3.4038
_cell_volume                     6328(3)
_computing_cell_refinement
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.31.5 (release 28-08-2006 CrysAlis171 .NET)
(compiled Aug 28 2006,13:05:05)
;
_computing_data_collection
;
CrysAlis CCD, Oxford Diffraction Ltd.,
Version 1.171.31.5 (release 28-08-2006 CrysAlis171 .NET)
(compiled Aug 28 2006,13:05:05)
;
_computing_data_reduction
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.31.5 (release 28-08-2006 CrysAlis171 .NET)
(compiled Aug 28 2006,13:05:05)
;
_computing_molecular_graphics    'PLATON (Spek, 2007)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_computing_structure_refinement  'SHELXH-97 (Sheldrick, 1997)'
_computing_structure_solution    DIRDIF-1999
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 8.2640
_diffrn_measured_fraction_theta_full 0.962
_diffrn_measured_fraction_theta_max 0.962
_diffrn_measurement_device
; 
165 mm Onyx CCD detector in κ-geometry diffractometer
;
_diffrn_measurement_device_type  'Xcalibur, Onyx, Nova'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Nova (Cu) X-ray Source'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_reflns_av_R_equivalents  0.0283
_diffrn_reflns_av_sigmaI/netI    0.0259
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       26
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            78915
_diffrn_reflns_theta_full        74.91
_diffrn_reflns_theta_max         74.91
_diffrn_reflns_theta_min         3.41
_exptl_absorpt_coefficient_mu    3.231
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.15991
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.31.5 (release 28-08-2006 CrysAlis171 .NET)
(compiled Aug 28 2006,13:05:05)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            Yellow
_exptl_crystal_density_diffrn    1.486
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             2858
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.259
_refine_diff_density_min         -0.723
_refine_diff_density_rms         0.088
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.118
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1601
_refine_ls_number_reflns         25038
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.118
_refine_ls_R_factor_all          0.0949
_refine_ls_R_factor_gt           0.0779
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1635P)²+3.5661P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2381
_refine_ls_wR_factor_ref         0.2619
_reflns_number_gt                18227
_reflns_number_total             25038
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om200668h_si_002.cif
_cod_data_source_block           6a
_cod_database_code               4065267
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.0174(6) 0.0502(3) 0.2205(3) 0.0849(16) Uani 1 1 d . . .
H1A H 0.0078 0.0521 0.2560 0.102 Uiso 1 1 calc R . .
H1B H -0.0425 0.0434 0.1931 0.102 Uiso 1 1 calc R . .
C2 C 0.1185(6) 0.0572(3) 0.2087(3) 0.0825(15) Uani 1 1 d . . .
H2 H 0.1245 0.0549 0.1728 0.099 Uiso 1 1 calc R . .
C3 C 0.2246(6) 0.0687(4) 0.2500(3) 0.0940(18) Uani 1 1 d . . .
C4 C 0.2512(5) 0.1467(3) 0.2786(3) 0.0829(15) Uani 1 1 d . . .
H4 H 0.3039 0.1736 0.2658 0.100 Uiso 1 1 calc R . .
C5 C 0.2113(4) 0.1845(3) 0.3199(2) 0.0730(13) Uani 1 1 d . . .
H5 H 0.2395 0.2327 0.3299 0.088 Uiso 1 1 calc R . .
C6 C 0.1268(5) 0.1591(3) 0.3521(3) 0.0797(14) Uani 1 1 d . . .
H6A H 0.1453 0.1874 0.3913 0.096 Uiso 1 1 calc R . .
H6B H 0.1132 0.1102 0.3476 0.096 Uiso 1 1 calc R . .
C7 C 0.2105(9) 0.0248(4) 0.2872(4) 0.123(3) Uani 1 1 d . . .
H7A H 0.2731 0.0432 0.3176 0.184 Uiso 1 1 calc R . .
H7B H 0.2045 -0.0225 0.2661 0.184 Uiso 1 1 calc R . .
H7C H 0.1451 0.0258 0.3013 0.184 Uiso 1 1 calc R . .
C8 C 0.3169(7) 0.0549(5) 0.2179(4) 0.128(3) Uani 1 1 d . . .
H8A H 0.3277 0.0836 0.1952 0.192 Uiso 1 1 calc R . .
H8B H 0.2954 0.0067 0.1948 0.192 Uiso 1 1 calc R . .
H8C H 0.3842 0.0661 0.2441 0.192 Uiso 1 1 calc R . .
C9 C 0.0106(4) 0.2593(3) 0.3563(2) 0.0650(11) Uani 1 1 d . . .
C10 C 0.1038(5) 0.3092(3) 0.3942(2) 0.0756(13) Uani 1 1 d . . .
H10 H 0.1706 0.2997 0.3966 0.091 Uiso 1 1 calc R . .
C11 C 0.0987(6) 0.3714(3) 0.4276(3) 0.0869(16) Uani 1 1 d . . .
H11 H 0.1617 0.4042 0.4522 0.104 Uiso 1 1 calc R . .
C12 C 0.0002(7) 0.3858(3) 0.4249(3) 0.0962(19) Uani 1 1 d . . .
H12 H -0.0035 0.4283 0.4478 0.115 Uiso 1 1 calc R . .
C13 C -0.0927(6) 0.3375(4) 0.3884(4) 0.099(2) Uani 1 1 d . . .
H13 H -0.1595 0.3469 0.3870 0.119 Uiso 1 1 calc R . .
C14 C -0.0870(5) 0.2745(3) 0.3538(3) 0.0832(16) Uani 1 1 d . . .
H14 H -0.1499 0.2423 0.3286 0.100 Uiso 1 1 calc R . .
C15 C -0.1184(5) 0.1190(3) 0.3117(3) 0.0741(13) Uani 1 1 d . . .
C16 C -0.1428(6) 0.1115(4) 0.3600(4) 0.0975(14) Uani 1 1 d . . .
H16 H -0.0888 0.1305 0.3926 0.117 Uiso 1 1 calc R . .
C17 C -0.2510(9) 0.0746(4) 0.3598(5) 0.118(3) Uani 1 1 d . . .
H17 H -0.2688 0.0697 0.3924 0.142 Uiso 1 1 calc R . .
C18 C -0.3290(7) 0.0466(4) 0.3122(6) 0.123(3) Uani 1 1 d . . .
H18 H -0.4005 0.0229 0.3124 0.147 Uiso 1 1 calc R . .
C19 C -0.3035(6) 0.0527(4) 0.2643(4) 0.0975(14) Uani 1 1 d . . .
H19 H -0.3573 0.0320 0.2316 0.117 Uiso 1 1 calc R . .
C20 C -0.2006(5) 0.0886(3) 0.2633(3) 0.0895(17) Uani 1 1 d . . .
H20 H -0.1848 0.0930 0.2302 0.107 Uiso 1 1 calc R . .
C21 C 0.1068(7) 0.2633(3) 0.2239(3) 0.0895(17) Uani 1 1 d . . .
C22 C 0.0053(6) 0.2145(5) 0.1930(3) 0.096(2) Uani 1 1 d . . .
C23 C 0.0256(7) 0.1609(4) 0.1540(3) 0.102(2) Uani 1 1 d . . .
C24 C 0.1374(8) 0.1772(4) 0.1579(3) 0.102(2) Uani 1 1 d . . .
C25 C 0.1891(5) 0.2395(4) 0.2011(3) 0.096(2) Uani 1 1 d . . .
C26 C 0.1244(13) 0.3350(4) 0.2655(4) 0.157(5) Uani 1 1 d . . .
H26A H 0.1959 0.3510 0.2895 0.235 Uiso 1 1 calc R . .
H26B H 0.0692 0.3327 0.2873 0.235 Uiso 1 1 calc R . .
H26C H 0.1192 0.3667 0.2462 0.235 Uiso 1 1 calc R . .
C27 C -0.1064(8) 0.2238(8) 0.1966(6) 0.178(6) Uani 1 1 d . . .
H27A H -0.1326 0.2365 0.1659 0.267 Uiso 1 1 calc R . .
H27B H -0.1008 0.2600 0.2309 0.267 Uiso 1 1 calc R . .
H27C H -0.1569 0.1809 0.1952 0.267 Uiso 1 1 calc R . .
C28 C -0.0632(14) 0.0999(7) 0.1090(4) 0.221(9) Uani 1 1 d . . .
H28A H -0.0779 0.1121 0.0766 0.332 Uiso 1 1 calc R . .
H28B H -0.1292 0.0896 0.1227 0.332 Uiso 1 1 calc R . .
H28C H -0.0380 0.0596 0.0996 0.332 Uiso 1 1 calc R . .
C29 C 0.1984(15) 0.1406(7) 0.1163(6) 0.198(7) Uani 1 1 d . . .
H29A H 0.1636 0.0910 0.1033 0.297 Uiso 1 1 calc R . .
H29B H 0.2736 0.1512 0.1343 0.297 Uiso 1 1 calc R . .
H29C H 0.1959 0.1566 0.0853 0.297 Uiso 1 1 calc R . .
C30 C 0.3103(8) 0.2796(7) 0.2168(6) 0.155(4) Uani 1 1 d . . .
H30A H 0.3523 0.2475 0.2103 0.232 Uiso 1 1 calc R . .
H30B H 0.3298 0.3082 0.2555 0.232 Uiso 1 1 calc R . .
H30C H 0.3258 0.3086 0.1947 0.232 Uiso 1 1 calc R . .
C31 C 0.6302(4) 0.2195(2) 0.0781(2) 0.0588(10) Uani 1 1 d . . .
C32 C 0.5883(5) 0.1484(3) 0.0699(2) 0.0702(12) Uani 1 1 d . . .
H32 H 0.5752 0.1160 0.0344 0.084 Uiso 1 1 calc R . .
C33 C 0.5657(5) 0.1249(3) 0.1131(3) 0.0773(14) Uani 1 1 d . D .
C34 C 0.5826(5) 0.1709(3) 0.1662(2) 0.0767(14) Uani 1 1 d . . .
H34 H 0.5654 0.1549 0.1948 0.092 Uiso 1 1 calc R . .
C35 C 0.6252(4) 0.2407(3) 0.1760(2) 0.0700(12) Uani 1 1 d . E .
C36 C 0.6491(4) 0.2641(3) 0.13252(19) 0.0610(10) Uani 1 1 d . . .
H36 H 0.6789 0.3118 0.1404 0.073 Uiso 1 1 calc R . .
C37 C 0.6461(7) 0.2932(5) 0.2327(3) 0.100(2) Uani 1 1 d . . .
C38 C 0.5192(9) 0.0484(5) 0.1007(4) 0.117(3) Uani 1 1 d . . .
C39 C 0.6609(3) 0.3263(2) 0.03741(17) 0.0531(9) Uani 1 1 d . . .
C40 C 0.5797(4) 0.3497(3) 0.0602(2) 0.0616(10) Uani 1 1 d . . .
H40 H 0.5316 0.3209 0.0738 0.074 Uiso 1 1 calc R . .
C41 C 0.5665(4) 0.4143(3) 0.0639(2) 0.0672(11) Uani 1 1 d . A .
C42 C 0.6356(5) 0.4580(3) 0.0431(2) 0.0686(12) Uani 1 1 d . . .
H42 H 0.6274 0.5010 0.0448 0.082 Uiso 1 1 calc R . .
C43 C 0.7162(4) 0.4357(2) 0.0199(2) 0.0634(11) Uani 1 1 d . . .
C44 C 0.7294(4) 0.3719(2) 0.01738(18) 0.0570(9) Uani 1 1 d . . .
H44 H 0.7856 0.3589 0.0018 0.068 Uiso 1 1 calc R . .
C45 C 0.7890(6) 0.4798(3) -0.0049(3) 0.0828(15) Uani 1 1 d . . .
C46 C 0.4792(6) 0.4368(4) 0.0893(3) 0.0925(18) Uani 1 1 d . . .
C47 C 0.7870(4) 0.2380(2) 0.02450(18) 0.0567(9) Uani 1 1 d . . .
C48 C 0.8842(4) 0.2902(3) 0.0566(2) 0.0656(11) Uani 1 1 d . . .
H48 H 0.8795 0.3320 0.0800 0.079 Uiso 1 1 calc R . .
C49 C 0.9868(4) 0.2815(4) 0.0546(3) 0.0807(15) Uani 1 1 d . . .
C50 C 0.9978(5) 0.2216(4) 0.0205(3) 0.0869(17) Uani 1 1 d . . .
H50 H 1.0671 0.2168 0.0180 0.104 Uiso 1 1 calc R . .
C51 C 0.9040(5) 0.1678(3) -0.0103(2) 0.0775(14) Uani 1 1 d . B .
C52 C 0.8014(4) 0.1761(3) -0.0080(2) 0.0655(11) Uani 1 1 d . . .
H52 H 0.7394 0.1390 -0.0289 0.079 Uiso 1 1 calc R . .
C53 C 1.0865(7) 0.3406(5) 0.0887(4) 0.103(2) Uiso 1 1 d . . .
C54 C 0.9118(7) 0.1002(6) -0.0469(3) 0.113(3) Uani 1 1 d . . .
C55 C 0.5764(4) 0.2010(2) -0.03141(19) 0.0577(10) Uani 1 1 d . . .
C56 C 0.6096(4) 0.1927(3) -0.0818(2) 0.0644(11) Uani 1 1 d . . .
H56 H 0.6836 0.2112 -0.0814 0.077 Uiso 1 1 calc R . .
C57 C 0.5353(5) 0.1574(3) -0.1329(2) 0.0767(14) Uani 1 1 d . C .
C58 C 0.4243(6) 0.1339(3) -0.1342(3) 0.0918(19) Uani 1 1 d . . .
H58 H 0.3737 0.1127 -0.1680 0.110 Uiso 1 1 calc R . .
C59 C 0.3896(5) 0.1420(3) -0.0857(3) 0.0863(17) Uani 1 1 d . . .
C60 C 0.4639(4) 0.1747(3) -0.0349(2) 0.0712(12) Uani 1 1 d . . .
H60 H 0.4380 0.1790 -0.0023 0.085 Uiso 1 1 calc R . .
C61 C 0.5818(10) 0.1493(5) -0.1844(3) 0.127(3) Uani 1 1 d . . .
C62 C 0.2703(6) 0.1153(5) -0.0845(6) 0.146(5) Uani 1 1 d . . .
B1 B 0.6645(4) 0.2467(3) 0.0278(2) 0.0545(10) Uani 1 1 d . . .
F1 F 0.4122(9) 0.4509(6) 0.0544(4) 0.121(3) Uiso 0.50 1 d P A 1
F2 F 0.5190(8) 0.4988(5) 0.1302(4) 0.107(2) Uiso 0.50 1 d P A 1
F3 F 0.4101(10) 0.3912(6) 0.1008(6) 0.132(3) Uiso 0.50 1 d P A 1
F4 F 0.7580(6) 0.4583(3) -0.05893(18) 0.147(2) Uani 1 1 d . . .
F5 F 0.7888(4) 0.54595(19) 0.01161(18) 0.1076(12) Uani 1 1 d . . .
F6 F 0.8905(4) 0.4830(3) 0.0076(4) 0.163(3) Uani 1 1 d . . .
F7 F 1.1727(5) 0.3227(5) 0.0959(6) 0.272(6) Uani 1 1 d . . .
F8 F 1.1067(9) 0.3899(6) 0.0752(5) 0.312(8) Uani 1 1 d . . .
F9 F 1.0829(6) 0.3652(5) 0.1391(3) 0.218(4) Uani 1 1 d . . .
F10 F 0.8440(8) 0.0452(5) -0.0406(4) 0.109(2) Uiso 0.50 1 d P B 1
F11 F 0.8783(10) 0.0914(6) -0.1007(5) 0.122(3) Uiso 0.50 1 d P B 1
F12 F 1.0120(9) 0.0939(6) -0.0323(4) 0.115(3) Uiso 0.50 1 d P B 1
F10A F 0.8212(12) 0.0579(8) -0.0843(6) 0.155(4) Uiso 0.50 1 d P B 2
F11A F 0.9702(11) 0.1117(6) -0.0866(5) 0.137(3) Uiso 0.50 1 d P B 2
F12A F 0.9632(15) 0.0677(9) -0.0260(7) 0.166(5) Uiso 0.50 1 d P B 2
F13 F 0.6221(6) 0.2060(4) -0.1931(3) 0.162(2) Uiso 1 1 d . C .
F14 F 0.6813(8) 0.1343(5) -0.1805(4) 0.107(2) Uiso 0.50 1 d P C 1
F15 F 0.5264(9) 0.0964(6) -0.2299(4) 0.117(3) Uiso 0.50 1 d P C 1
F16 F 0.2074(6) 0.1022(9) -0.1303(5) 0.297(8) Uani 1 1 d . . .
F17 F 0.2341(6) 0.1626(6) -0.0564(7) 0.285(7) Uani 1 1 d . . .
F18 F 0.2436(6) 0.0673(7) -0.0729(8) 0.324(10) Uani 1 1 d . . .
F19 F 0.5590(8) 0.0095(5) 0.0638(4) 0.106(2) Uiso 0.50 1 d P D 1
F20 F 0.4077(11) 0.0258(7) 0.0740(5) 0.139(3) Uiso 0.50 1 d P D 1
F21 F 0.5281(10) 0.0294(6) 0.1451(5) 0.120(3) Uiso 0.50 1 d P D 1
F19A F 0.6077(14) 0.0225(9) 0.1072(7) 0.175(5) Uiso 0.50 1 d P D 2
F20A F 0.4686(12) 0.0098(7) 0.0537(6) 0.151(4) Uiso 0.50 1 d P D 2
F21A F 0.4709(10) 0.0292(5) 0.1360(4) 0.114(3) Uiso 0.50 1 d P D 2
F22 F 0.6810(8) 0.2659(5) 0.2727(4) 0.113(2) Uiso 0.50 1 d P E 1
F23 F 0.5732(12) 0.3104(9) 0.2489(6) 0.157(4) Uiso 0.50 1 d P E 1
F24 F 0.7443(7) 0.3454(5) 0.2460(4) 0.094(2) Uiso 0.50 1 d P E 1
F22A F 0.5713(9) 0.2692(7) 0.2612(5) 0.133(3) Uiso 0.50 1 d P E 2
F23A F 0.6000(7) 0.3473(5) 0.2321(4) 0.096(2) Uiso 0.50 1 d P E 2
F24A F 0.7432(16) 0.3207(10) 0.2561(8) 0.177(6) Uiso 0.50 1 d P E 2
P1 P 0.01553(10) 0.17521(7) 0.31230(5) 0.0637(3) Uani 1 1 d . . .
Ru1 Ru 0.09756(3) 0.163742(19) 0.236337(16) 0.06342(13) Uani 1 1 d . . .
C63 C 0.8585(7) 0.5856(3) 0.1513(3) 0.097(2) Uani 1 1 d . . .
H63A H 0.7934 0.5898 0.1620 0.116 Uiso 1 1 calc R . .
H63B H 0.8805 0.6018 0.1234 0.116 Uiso 1 1 calc R . .
C64 C 0.9223(6) 0.5555(3) 0.1766(3) 0.0909(18) Uani 1 1 d . . .
H64 H 0.9870 0.5520 0.1651 0.109 Uiso 1 1 calc R . .
C65 C 0.8930(6) 0.5279(3) 0.2220(3) 0.0923(18) Uani 1 1 d . . .
C66 C 0.9449(5) 0.5958(3) 0.2703(2) 0.0755(13) Uani 1 1 d . . .
H66 H 1.0162 0.6015 0.2875 0.091 Uiso 1 1 calc R . .
C67 C 0.9062(5) 0.6502(3) 0.2933(2) 0.0692(12) Uani 1 1 d . . .
H67 H 0.9555 0.6874 0.3226 0.083 Uiso 1 1 calc R . .
C68 C 0.7941(5) 0.6583(3) 0.2776(2) 0.0721(12) Uani 1 1 d . . .
H68A H 0.7695 0.6830 0.3096 0.087 Uiso 1 1 calc R . .
H68B H 0.7385 0.6141 0.2564 0.087 Uiso 1 1 calc R . .
C69 C 0.7695(7) 0.4922(4) 0.2151(4) 0.117(3) Uani 1 1 d . . .
H69A H 0.7286 0.5223 0.2086 0.175 Uiso 1 1 calc R . .
H69B H 0.7568 0.4829 0.2483 0.175 Uiso 1 1 calc R . .
H69C H 0.7460 0.4491 0.1841 0.175 Uiso 1 1 calc R . .
C70 C 0.9553(9) 0.4760(5) 0.2265(5) 0.132(3) Uani 1 1 d . . .
H70A H 0.9173 0.4312 0.1986 0.197 Uiso 1 1 calc R . .
H70B H 0.9591 0.4720 0.2627 0.197 Uiso 1 1 calc R . .
H70C H 1.0284 0.4923 0.2210 0.197 Uiso 1 1 calc R . .
C71 C 0.7218(5) 0.6962(3) 0.1797(3) 0.0792(15) Uani 1 1 d . . .
C72 C 0.7389(7) 0.6942(4) 0.1277(3) 0.102(2) Uani 1 1 d . . .
H72 H 0.8088 0.6991 0.1202 0.123 Uiso 1 1 calc R . .
C73 C 0.6496(10) 0.6848(5) 0.0865(4) 0.132(4) Uani 1 1 d . . .
H73 H 0.6620 0.6856 0.0520 0.158 Uiso 1 1 calc R . .
C74 C 0.5494(9) 0.6747(5) 0.0946(5) 0.130(4) Uani 1 1 d . . .
H74 H 0.4914 0.6673 0.0660 0.156 Uiso 1 1 calc R . .
C75 C 0.5306(7) 0.6754(5) 0.1464(5) 0.130(3) Uani 1 1 d . . .
H75 H 0.4594 0.6682 0.1524 0.155 Uiso 1 1 calc R . .
C76 C 0.6162(5) 0.6864(4) 0.1894(3) 0.0962(19) Uani 1 1 d . . .
H76 H 0.6031 0.6873 0.2242 0.115 Uiso 1 1 calc R . .
C77 C 0.8576(4) 0.8005(3) 0.2800(2) 0.0706(12) Uani 1 1 d . . .
C78 C 0.8414(6) 0.8495(3) 0.2573(3) 0.0906(17) Uani 1 1 d . . .
H78 H 0.8165 0.8363 0.2192 0.109 Uiso 1 1 calc R . .
C79 C 0.8619(6) 0.9190(4) 0.2913(4) 0.105(2) Uani 1 1 d . . .
H79 H 0.8506 0.9518 0.2759 0.126 Uiso 1 1 calc R . .
C80 C 0.8987(7) 0.9382(4) 0.3475(4) 0.117(3) Uani 1 1 d . . .
H80 H 0.9122 0.9841 0.3704 0.140 Uiso 1 1 calc R . .
C81 C 0.9160(6) 0.8888(4) 0.3701(3) 0.108(2) Uani 1 1 d . . .
H81 H 0.9426 0.9020 0.4081 0.130 Uiso 1 1 calc R . .
C82 C 0.8941(5) 0.8221(3) 0.3371(3) 0.0863(16) Uani 1 1 d . . .
H82 H 0.9038 0.7894 0.3530 0.104 Uiso 1 1 calc R . .
C83 C 1.1031(7) 0.6976(5) 0.1703(3) 0.106(2) Uani 1 1 d . . .
C84 C 1.0873(5) 0.7603(4) 0.2045(3) 0.0884(17) Uani 1 1 d . . .
C85 C 1.1258(5) 0.7680(3) 0.2612(3) 0.0831(16) Uani 1 1 d . . .
C86 C 1.1656(5) 0.7119(4) 0.2608(3) 0.0921(18) Uani 1 1 d . . .
C87 C 1.1537(6) 0.6699(5) 0.2067(4) 0.104(2) Uani 1 1 d . . .
C88 C 1.0842(11) 0.6742(8) 0.1084(4) 0.176(6) Uani 1 1 d . . .
H88A H 1.0335 0.6948 0.0946 0.264 Uiso 1 1 calc R . .
H88B H 1.0543 0.6243 0.0930 0.264 Uiso 1 1 calc R . .
H88C H 1.1528 0.6886 0.0976 0.264 Uiso 1 1 calc R . .
C89 C 1.0522(8) 0.8133(5) 0.1846(5) 0.127(3) Uani 1 1 d . . .
H89A H 1.1160 0.8475 0.1831 0.191 Uiso 1 1 calc R . .
H89B H 1.0131 0.8359 0.2099 0.191 Uiso 1 1 calc R . .
H89C H 1.0052 0.7904 0.1483 0.191 Uiso 1 1 calc R . .
C90 C 1.1449(7) 0.8330(4) 0.3102(4) 0.117(3) Uani 1 1 d . . .
H90A H 1.1502 0.8223 0.3437 0.176 Uiso 1 1 calc R . .
H90B H 1.0846 0.8515 0.3063 0.176 Uiso 1 1 calc R . .
H90C H 1.2120 0.8670 0.3118 0.176 Uiso 1 1 calc R . .
C91 C 1.2216(6) 0.7021(6) 0.3119(5) 0.133(3) Uani 1 1 d . . .
H91A H 1.2154 0.6537 0.3037 0.200 Uiso 1 1 calc R . .
H91B H 1.1867 0.7172 0.3421 0.200 Uiso 1 1 calc R . .
H91C H 1.2978 0.7292 0.3220 0.200 Uiso 1 1 calc R . .
C92 C 1.1976(9) 0.6080(6) 0.1879(6) 0.160(5) Uani 1 1 d . . .
H92A H 1.2766 0.6244 0.1960 0.241 Uiso 1 1 calc R . .
H92B H 1.1706 0.5841 0.1486 0.241 Uiso 1 1 calc R . .
H92C H 1.1734 0.5766 0.2072 0.241 Uiso 1 1 calc R . .
C93 C 0.3632(4) 0.2254(2) 0.55100(19) 0.0564(9) Uani 1 1 d . . .
C94 C 0.4083(4) 0.2165(3) 0.5994(2) 0.0616(10) Uani 1 1 d . . .
H94 H 0.4574 0.2549 0.6278 0.074 Uiso 1 1 calc R . .
C95 C 0.3820(4) 0.1522(3) 0.6061(2) 0.0695(12) Uani 1 1 d . G .
C96 C 0.3080(5) 0.0935(3) 0.5647(3) 0.0768(14) Uani 1 1 d . . .
H96 H 0.2894 0.0503 0.5693 0.092 Uiso 1 1 calc R . .
C97 C 0.2636(4) 0.1013(3) 0.5169(2) 0.0694(12) Uani 1 1 d . . .
C98 C 0.2924(4) 0.1660(2) 0.5099(2) 0.0606(10) Uani 1 1 d . . .
H98 H 0.2629 0.1693 0.4765 0.073 Uiso 1 1 calc R . .
C99 C 0.1812(6) 0.0413(3) 0.4720(3) 0.0916(18) Uani 1 1 d . . .
C100 C 0.4322(5) 0.1470(3) 0.6588(3) 0.0831(16) Uani 1 1 d . . .
C101 C 0.4925(3) 0.3590(2) 0.59166(19) 0.0529(9) Uani 1 1 d . . .
C102 C 0.4880(4) 0.3920(2) 0.64624(19) 0.0574(10) Uani 1 1 d . . .
H102 H 0.4210 0.3810 0.6567 0.069 Uiso 1 1 calc R . .
C103 C 0.5779(4) 0.4403(3) 0.6859(2) 0.0641(11) Uiso 1 1 d . F .
C104 C 0.6800(4) 0.4563(3) 0.6725(2) 0.0660(11) Uani 1 1 d . . .
H104 H 0.7415 0.4880 0.6989 0.079 Uiso 1 1 calc R . .
C105 C 0.6877(4) 0.4240(3) 0.6189(2) 0.0657(11) Uani 1 1 d . . .
C106 C 0.5971(4) 0.3762(2) 0.5797(2) 0.0588(10) Uani 1 1 d . . .
H106 H 0.6058 0.3547 0.5441 0.071 Uiso 1 1 calc R . .
C107 C 0.5661(5) 0.4750(3) 0.7429(3) 0.0805(15) Uani 1 1 d . . .
C108 C 0.7962(4) 0.4397(4) 0.6030(3) 0.0856(17) Uani 1 1 d . . .
C109 C 0.2734(4) 0.3270(2) 0.55345(19) 0.0565(9) Uani 1 1 d . . .
C110 C 0.2787(4) 0.3970(3) 0.5737(2) 0.0628(11) Uani 1 1 d . . .
H110 H 0.3467 0.4309 0.5829 0.075 Uiso 1 1 calc R . .
C111 C 0.1850(4) 0.4182(3) 0.5806(2) 0.0731(13) Uani 1 1 d . H .
C112 C 0.0831(4) 0.3694(3) 0.5671(2) 0.0747(13) Uani 1 1 d . . .
H112 H 0.0207 0.3833 0.5716 0.090 Uiso 1 1 calc R . .
C113 C 0.0747(4) 0.2999(3) 0.5470(2) 0.0691(12) Uani 1 1 d . . .
C114 C 0.1680(4) 0.2794(3) 0.5405(2) 0.0619(10) Uani 1 1 d . . .
H114 H 0.1601 0.2320 0.5270 0.074 Uiso 1 1 calc R . .
C115 C -0.0335(4) 0.2471(4) 0.5325(3) 0.0802(15) Uani 1 1 d . . .
C116 C 0.1972(5) 0.4939(4) 0.6031(4) 0.102(2) Uani 1 1 d . . .
C117 C 0.4101(4) 0.2997(2) 0.48363(19) 0.0555(9) Uani 1 1 d . . .
C118 C 0.4034(4) 0.3532(2) 0.46335(19) 0.0561(9) Uani 1 1 d . . .
H118 H 0.3711 0.3858 0.4815 0.067 Uiso 1 1 calc R . .
C119 C 0.4437(4) 0.3592(2) 0.41681(19) 0.0576(10) Uani 1 1 d . . .
C120 C 0.4904(4) 0.3113(3) 0.3883(2) 0.0662(11) Uani 1 1 d . . .
H120 H 0.5175 0.3152 0.3572 0.079 Uiso 1 1 calc R . .
C121 C 0.4959(5) 0.2571(3) 0.4069(2) 0.0698(12) Uani 1 1 d . . .
C122 C 0.4572(4) 0.2521(3) 0.4535(2) 0.0630(11) Uani 1 1 d . . .
H122 H 0.4630 0.2154 0.4653 0.076 Uiso 1 1 calc R . .
C123 C 0.4371(5) 0.4197(3) 0.3989(3) 0.0764(14) Uani 1 1 d . . .
C124 C 0.5487(7) 0.2046(4) 0.3780(3) 0.094(2) Uani 1 1 d . . .
B2 B 0.3840(4) 0.3023(3) 0.5450(2) 0.0531(10) Uani 1 1 d . . .
F25 F 0.4713(5) 0.4181(3) 0.3533(2) 0.1339(18) Uani 1 1 d . . .
F26 F 0.4968(6) 0.4786(2) 0.4355(2) 0.156(2) Uani 1 1 d . . .
F27 F 0.3387(4) 0.4236(3) 0.3916(3) 0.164(3) Uani 1 1 d . . .
F28 F 0.5029(7) 0.1426(3) 0.3775(3) 0.172(3) Uani 1 1 d . . .
F29 F 0.5336(7) 0.1924(4) 0.3233(2) 0.169(3) Uani 1 1 d . . .
F30 F 0.6462(5) 0.2196(4) 0.3964(5) 0.256(6) Uani 1 1 d . . .
F31 F 0.4675(8) 0.4815(5) 0.7462(4) 0.110(2) Uiso 0.50 1 d P F 1
F32 F 0.5630(9) 0.4308(5) 0.7714(4) 0.113(3) Uiso 0.50 1 d P F 1
F33 F 0.6417(9) 0.5347(6) 0.7700(4) 0.118(3) Uiso 0.50 1 d P F 1
F31A F 0.4928(10) 0.4374(6) 0.7609(5) 0.122(3) Uiso 0.50 1 d P F 2
F32A F 0.6574(8) 0.5038(5) 0.7806(4) 0.107(2) Uiso 0.50 1 d P F 2
F33A F 0.5159(8) 0.5238(5) 0.7444(4) 0.114(3) Uiso 0.50 1 d P F 2
F34 F 0.8676(4) 0.4989(5) 0.6371(3) 0.200(4) Uani 1 1 d . . .
F35 F 0.8457(6) 0.3960(5) 0.6040(5) 0.238(5) Uani 1 1 d . . .
F36 F 0.7948(4) 0.4481(4) 0.5570(2) 0.172(3) Uani 1 1 d . . .
F37 F 0.5381(8) 0.1762(6) 0.6727(4) 0.111(3) Uiso 0.50 1 d P G 1
F38 F 0.3941(8) 0.1794(5) 0.7006(4) 0.111(2) Uiso 0.50 1 d P G 1
F39 F 0.4149(7) 0.0801(5) 0.6549(4) 0.104(2) Uiso 0.50 1 d P G 1
F37A F 0.4747(11) 0.2081(7) 0.7010(5) 0.143(4) Uiso 0.50 1 d P G 2
F38A F 0.3705(9) 0.1022(5) 0.6758(4) 0.118(3) Uiso 0.50 1 d P G 2
F39A F 0.5316(10) 0.1375(7) 0.6569(5) 0.130(3) Uiso 0.50 1 d P G 2
F40 F 0.1554(6) -0.0159(2) 0.4829(3) 0.167(3) Uani 1 1 d . . .
F41 F 0.0888(5) 0.0532(3) 0.4609(4) 0.195(4) Uani 1 1 d . . .
F42 F 0.2100(7) 0.0249(4) 0.4257(3) 0.199(4) Uani 1 1 d . . .
F43 F -0.1058(4) 0.2513(4) 0.4965(3) 0.185(3) Uani 1 1 d . . .
F44 F -0.0787(5) 0.2464(4) 0.5733(2) 0.202(4) Uani 1 1 d . . .
F45 F -0.0347(4) 0.1843(3) 0.5113(5) 0.214(4) Uani 1 1 d . . .
F46A F 0.1245(8) 0.5087(5) 0.6351(4) 0.102(2) Uiso 0.50 1 d P H 2
F47 F 0.2380(10) 0.5275(6) 0.5726(5) 0.117(3) Uiso 0.50 1 d P H 1
F48 F 0.2774(8) 0.5256(5) 0.6528(4) 0.108(3) Uiso 0.50 1 d P H 1
P2 P 0.83598(10) 0.71087(6) 0.23545(5) 0.0626(3) Uani 1 1 d . . .
Ru2 Ru 0.98608(3) 0.67098(2) 0.222221(15) 0.06383(13) Uani 1 1 d . . .
C125 C 0.5429(11) 0.0339(7) 0.5161(8) 0.187(7) Uani 1 1 d . . .
H12A H 0.5225 0.0538 0.5510 0.224 Uiso 1 1 calc R . .
H12B H 0.6117 0.0246 0.5250 0.224 Uiso 1 1 calc R . .
C126 C 0.5624(13) 0.0859(11) 0.4896(8) 0.205(8) Uani 1 1 d . . .
H12C H 0.4952 0.0973 0.4815 0.246 Uiso 1 1 calc R . .
H12D H 0.5837 0.0673 0.4548 0.246 Uiso 1 1 calc R . .
C127 C 0.6488(12) 0.1484(11) 0.5257(8) 0.241(10) Uani 1 1 d . . .
H12E H 0.6180 0.1770 0.5520 0.362 Uiso 1 1 calc R . .
H12F H 0.6815 0.1741 0.5037 0.362 Uiso 1 1 calc R . .
H12G H 0.7039 0.1357 0.5451 0.362 Uiso 1 1 calc R . .
F1A F 0.3772(9) 0.4004(6) 0.0560(5) 0.127(3) Uiso 0.50 1 d P A 2
F2A F 0.4775(10) 0.4977(7) 0.0945(6) 0.138(3) Uiso 0.50 1 d P A 2
F3A F 0.4618(8) 0.4173(5) 0.1324(4) 0.103(2) Uiso 0.50 1 d P A 2
F14A F 0.6047(15) 0.0938(10) -0.1948(7) 0.182(5) Uiso 0.50 1 d P C 2
F15A F 0.4920(10) 0.1249(7) -0.2286(5) 0.134(3) Uiso 0.50 1 d P C 2
F48A F 0.2885(10) 0.5360(6) 0.6301(5) 0.122(3) Uiso 0.50 1 d P H 2
F46 F 0.1034(10) 0.5068(6) 0.6082(6) 0.128(3) Uiso 0.50 1 d P H 1
F47A F 0.1778(11) 0.5168(6) 0.5589(5) 0.128(3) Uiso 0.50 1 d P H 2
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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 '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'
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
C2 C1 Ru1 72.4(3) . .
C2 C1 H1A 120.0 . .
Ru1 C1 H1A 100.2 . .
C2 C1 H1B 120.0 . .
Ru1 C1 H1B 97.3 . .
H1A C1 H1B 120.0 . .
C1 C2 C3 125.5(6) . .
C1 C2 Ru1 72.5(3) . .
C3 C2 Ru1 101.4(4) . .
C1 C2 H2 117.3 . .
C3 C2 H2 117.3 . .
Ru1 C2 H2 96.4 . .
C4 C3 C7 116.3(7) . .
C4 C3 C2 97.7(5) . .
C7 C3 C2 114.6(7) . .
C4 C3 C8 108.5(7) . .
C7 C3 C8 109.1(7) . .
C2 C3 C8 110.2(6) . .
C5 C4 C3 131.3(6) . .
C5 C4 Ru1 73.0(3) . .
C3 C4 Ru1 99.8(4) . .
C5 C4 H4 114.3 . .
C3 C4 H4 114.3 . .
Ru1 C4 H4 98.6 . .
C4 C5 C6 129.4(6) . .
C4 C5 Ru1 72.5(3) . .
C6 C5 Ru1 100.9(3) . .
C4 C5 H5 115.3 . .
C6 C5 H5 115.3 . .
Ru1 C5 H5 97.5 . .
C5 C6 P1 93.5(4) . .
C5 C6 H6A 113.0 . .
P1 C6 H6A 113.0 . .
C5 C6 H6B 113.0 . .
P1 C6 H6B 113.0 . .
H6A C6 H6B 110.4 . .
C3 C7 H7A 109.5 . .
C3 C7 H7B 109.5 . .
H7A C7 H7B 109.5 . .
C3 C7 H7C 109.5 . .
H7A C7 H7C 109.5 . .
H7B C7 H7C 109.5 . .
C3 C8 H8A 109.5 . .
C3 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
C3 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
C14 C9 C10 118.3(5) . .
C14 C9 P1 119.9(4) . .
C10 C9 P1 121.8(4) . .
C11 C10 C9 121.2(6) . .
C11 C10 H10 119.4 . .
C9 C10 H10 119.4 . .
C10 C11 C12 119.9(6) . .
C10 C11 H11 120.0 . .
C12 C11 H11 120.0 . .
C13 C12 C11 119.9(6) . .
C13 C12 H12 120.0 . .
C11 C12 H12 120.0 . .
C12 C13 C14 120.1(6) . .
C12 C13 H13 119.9 . .
C14 C13 H13 119.9 . .
C9 C14 C13 120.5(6) . .
C9 C14 H14 119.8 . .
C13 C14 H14 119.8 . .
C16 C15 C20 119.0(6) . .
C16 C15 P1 120.3(5) . .
C20 C15 P1 120.4(5) . .
C15 C16 C17 119.1(8) . .
C15 C16 H16 120.4 . .
C17 C16 H16 120.4 . .
C18 C17 C16 120.3(8) . .
C18 C17 H17 119.9 . .
C16 C17 H17 119.9 . .
C17 C18 C19 120.2(8) . .
C17 C18 H18 119.9 . .
C19 C18 H18 119.9 . .
C18 C19 C20 120.9(8) . .
C18 C19 H19 119.5 . .
C20 C19 H19 119.5 . .
C19 C20 C15 120.4(7) . .
C19 C20 H20 119.8 . .
C15 C20 H20 119.8 . .
C25 C21 C22 107.2(6) . .
C25 C21 C26 125.2(9) . .
C22 C21 C26 126.4(9) . .
C25 C21 Ru1 72.7(4) . .
C22 C21 Ru1 71.7(4) . .
C26 C21 Ru1 130.5(5) . .
C23 C22 C21 108.1(6) . .
C23 C22 C27 125.5(10) . .
C21 C22 C27 125.8(10) . .
C23 C22 Ru1 71.2(4) . .
C21 C22 Ru1 71.1(4) . .
C27 C22 Ru1 129.5(5) . .
C22 C23 C24 108.1(6) . .
C22 C23 C28 124.7(11) . .
C24 C23 C28 126.7(11) . .
C22 C23 Ru1 72.3(4) . .
C24 C23 Ru1 73.5(4) . .
C28 C23 Ru1 126.8(5) . .
C23 C24 C25 109.2(7) . .
C23 C24 C29 127.1(10) . .
C25 C24 C29 122.9(10) . .
C23 C24 Ru1 70.3(4) . .
C25 C24 Ru1 71.8(4) . .
C29 C24 Ru1 131.5(7) . .
C24 C25 C21 107.3(7) . .
C24 C25 C30 126.8(9) . .
C21 C25 C30 125.5(9) . .
C24 C25 Ru1 72.1(4) . .
C21 C25 Ru1 70.4(4) . .
C30 C25 Ru1 128.4(6) . .
C21 C26 H26A 109.5 . .
C21 C26 H26B 109.5 . .
H26A C26 H26B 109.5 . .
C21 C26 H26C 109.5 . .
H26A C26 H26C 109.5 . .
H26B C26 H26C 109.5 . .
C22 C27 H27A 109.5 . .
C22 C27 H27B 109.5 . .
H27A C27 H27B 109.5 . .
C22 C27 H27C 109.5 . .
H27A C27 H27C 109.5 . .
H27B C27 H27C 109.5 . .
C23 C28 H28A 109.5 . .
C23 C28 H28B 109.5 . .
H28A C28 H28B 109.5 . .
C23 C28 H28C 109.5 . .
H28A C28 H28C 109.5 . .
H28B C28 H28C 109.5 . .
C24 C29 H29A 109.5 . .
C24 C29 H29B 109.5 . .
H29A C29 H29B 109.5 . .
C24 C29 H29C 109.5 . .
H29A C29 H29C 109.5 . .
H29B C29 H29C 109.5 . .
C25 C30 H30A 109.5 . .
C25 C30 H30B 109.5 . .
H30A C30 H30B 109.5 . .
C25 C30 H30C 109.5 . .
H30A C30 H30C 109.5 . .
H30B C30 H30C 109.5 . .
C36 C31 C32 115.2(4) . .
C36 C31 B1 122.7(4) . .
C32 C31 B1 121.8(4) . .
C33 C32 C31 122.1(5) . .
C33 C32 H32 118.9 . .
C31 C32 H32 118.9 . .
C34 C33 C32 121.0(5) . .
C34 C33 C38 120.2(6) . .
C32 C33 C38 118.9(6) . .
C35 C34 C33 118.6(5) . .
C35 C34 H34 120.7 . .
C33 C34 H34 120.7 . .
C34 C35 C36 120.2(5) . .
C34 C35 C37 121.3(5) . .
C36 C35 C37 118.5(5) . .
C31 C36 C35 122.8(5) . .
C31 C36 H36 118.6 . .
C35 C36 H36 118.6 . .
F23 C37 F24A 125.0(14) . .
F23 C37 F22A 45.9(8) . .
F24A C37 F22A 119.6(12) . .
F23 C37 F24 115.8(11) . .
F24A C37 F24 28.2(9) . .
F22A C37 F24 136.2(9) . .
F23 C37 F22 101.3(10) . .
F24A C37 F22 66.0(10) . .
F22A C37 F22 62.0(7) . .
F24 C37 F22 93.5(8) . .
F23 C37 F23A 44.8(9) . .
F24A C37 F23A 107.5(12) . .
F22A C37 F23A 90.7(8) . .
F24 C37 F23A 83.5(7) . .
F22 C37 F23A 136.4(7) . .
F23 C37 C35 119.4(10) . .
F24A C37 C35 115.0(10) . .
F22A C37 C35 109.6(8) . .
F24 C37 C35 112.8(6) . .
F22 C37 C35 109.5(8) . .
F23A C37 C35 111.6(6) . .
F20A C38 F21A 109.2(11) . .
F20A C38 F19 54.6(8) . .
F21A C38 F19 124.9(9) . .
F20A C38 F21 125.2(11) . .
F21A C38 F21 33.1(6) . .
F19 C38 F21 107.3(9) . .
F20A C38 F19A 101.2(12) . .
F21A C38 F19A 97.9(10) . .
F19 C38 F19A 49.4(8) . .
F21 C38 F19A 67.0(9) . .
F20A C38 F20 47.0(8) . .
F21A C38 F20 77.5(9) . .
F19 C38 F20 101.1(9) . .
F21 C38 F20 108.9(10) . .
F19A C38 F20 140.5(11) . .
F20A C38 C33 120.1(9) . .
F21A C38 C33 117.3(9) . .
F19 C38 C33 114.8(7) . .
F21 C38 C33 114.2(9) . .
F19A C38 C33 107.3(10) . .
F20 C38 C33 109.6(9) . .
C40 C39 C44 115.4(4) . .
C40 C39 B1 121.1(4) . .
C44 C39 B1 123.0(4) . .
C39 C40 C41 123.2(5) . .
C39 C40 H40 118.4 . .
C41 C40 H40 118.4 . .
C42 C41 C40 119.9(5) . .
C42 C41 C46 119.4(5) . .
C40 C41 C46 120.8(5) . .
C43 C42 C41 118.0(5) . .
C43 C42 H42 121.0 . .
C41 C42 H42 121.0 . .
C42 C43 C44 121.5(4) . .
C42 C43 C45 119.6(5) . .
C44 C43 C45 118.9(5) . .
C43 C44 C39 122.1(4) . .
C43 C44 H44 118.9 . .
C39 C44 H44 118.9 . .
F6 C45 F4 108.6(7) . .
F6 C45 F5 105.2(6) . .
F4 C45 F5 104.1(5) . .
F6 C45 C43 112.7(5) . .
F4 C45 C43 112.1(5) . .
F5 C45 C43 113.6(5) . .
F2A C46 F3 126.8(9) . .
F2A C46 F1 56.6(7) . .
F3 C46 F1 99.9(9) . .
F2A C46 F3A 115.4(9) . .
F3 C46 F3A 40.9(6) . .
F1 C46 F3A 130.1(8) . .
F2A C46 F2 45.1(7) . .
F3 C46 F2 114.3(9) . .
F1 C46 F2 100.6(8) . .
F3A C46 F2 80.3(7) . .
F2A C46 F1A 98.9(9) . .
F3 C46 F1A 57.5(8) . .
F1 C46 F1A 46.6(6) . .
F3A C46 F1A 97.0(8) . .
F2 C46 F1A 132.9(8) . .
F2A C46 C41 116.8(8) . .
F3 C46 C41 116.3(8) . .
F1 C46 C41 111.7(7) . .
F3A C46 C41 113.8(6) . .
F2 C46 C41 112.1(7) . .
F1A C46 C41 111.7(7) . .
C52 C47 C48 115.1(4) . .
C52 C47 B1 122.2(4) . .
C48 C47 B1 122.6(4) . .
C49 C48 C47 122.2(5) . .
C49 C48 H48 118.9 . .
C47 C48 H48 118.9 . .
C50 C49 C48 121.1(6) . .
C50 C49 C53 120.1(6) . .
C48 C49 C53 118.8(6) . .
C49 C50 C51 118.6(5) . .
C49 C50 H50 120.7 . .
C51 C50 H50 120.7 . .
C50 C51 C52 120.4(6) . .
C50 C51 C54 120.6(6) . .
C52 C51 C54 119.0(6) . .
C51 C52 C47 122.6(5) . .
C51 C52 H52 118.7 . .
C47 C52 H52 118.7 . .
F8 C53 F9 103.5(11) . .
F8 C53 F7 109.3(11) . .
F9 C53 F7 97.6(10) . .
F8 C53 C49 116.7(8) . .
F9 C53 C49 113.7(7) . .
F7 C53 C49 113.9(8) . .
F12A C54 F10A 112.4(13) . .
F12A C54 F10 68.2(10) . .
F10A C54 F10 56.3(9) . .
F12A C54 F11 129.5(11) . .
F10A C54 F11 48.6(7) . .
F10 C54 F11 103.6(10) . .
F12A C54 F12 35.3(8) . .
F10A C54 F12 133.2(10) . .
F10 C54 F12 103.0(9) . .
F11 C54 F12 116.4(8) . .
F12A C54 F11A 101.8(10) . .
F10A C54 F11A 93.9(10) . .
F10 C54 F11A 136.0(10) . .
F11 C54 F11A 48.5(7) . .
F12 C54 F11A 72.8(8) . .
F12A C54 C51 118.8(10) . .
F10A C54 C51 116.3(8) . .
F10 C54 C51 112.8(7) . .
F11 C54 C51 110.4(8) . .
F12 C54 C51 110.4(8) . .
F11A C54 C51 109.4(9) . .
C60 C55 C56 116.2(5) . .
C60 C55 B1 122.7(4) . .
C56 C55 B1 120.8(4) . .
C55 C56 C57 122.1(5) . .
C55 C56 H56 119.0 . .
C57 C56 H56 119.0 . .
C58 C57 C56 119.5(6) . .
C58 C57 C61 123.4(6) . .
C56 C57 C61 117.1(6) . .
C59 C58 C57 119.5(5) . .
C59 C58 H58 120.2 . .
C57 C58 H58 120.2 . .
C58 C59 C60 121.0(6) . .
C58 C59 C62 122.0(8) . .
C60 C59 C62 117.1(8) . .
C59 C60 C55 121.6(6) . .
C59 C60 H60 119.2 . .
C55 C60 H60 119.2 . .
F14A C61 F13 133.2(14) . .
F14A C61 F15 60.7(10) . .
F13 C61 F15 113.7(8) . .
F14A C61 F15A 95.9(11) . .
F13 C61 F15A 93.9(8) . .
F15 C61 F15A 35.5(6) . .
F14A C61 F14 47.2(9) . .
F13 C61 F14 93.8(10) . .
F15 C61 F14 98.1(9) . .
F15A C61 F14 130.6(9) . .
F14A C61 C57 105.8(10) . .
F13 C61 C57 115.1(7) . .
F15 C61 C57 117.8(10) . .
F15A C61 C57 105.9(10) . .
F14 C61 C57 114.5(6) . .
F18 C62 F16 105.8(11) . .
F18 C62 F17 110.1(17) . .
F16 C62 F17 95.9(11) . .
F18 C62 C59 117.5(9) . .
F16 C62 C59 112.3(13) . .
F17 C62 C59 112.9(7) . .
C31 B1 C39 112.9(4) . .
C31 B1 C55 111.8(4) . .
C39 B1 C55 103.0(4) . .
C31 B1 C47 104.8(4) . .
C39 B1 C47 113.4(4) . .
C55 B1 C47 111.1(4) . .
C9 P1 C15 100.6(2) . .
C9 P1 C6 104.0(3) . .
C15 P1 C6 111.3(3) . .
C9 P1 Ru1 121.94(17) . .
C15 P1 Ru1 124.7(2) . .
C6 P1 Ru1 92.2(2) . .
C23 Ru1 C21 61.6(3) . .
C23 Ru1 C22 36.4(3) . .
C21 Ru1 C22 37.2(3) . .
C23 Ru1 C25 61.1(3) . .
C21 Ru1 C25 36.9(3) . .
C22 Ru1 C25 61.2(3) . .
C23 Ru1 C24 36.2(3) . .
C21 Ru1 C24 60.7(3) . .
C22 Ru1 C24 60.2(3) . .
C25 Ru1 C24 36.1(3) . .
C23 Ru1 C2 96.9(3) . .
C21 Ru1 C2 150.5(3) . .
C22 Ru1 C2 131.6(3) . .
C25 Ru1 C2 116.3(3) . .
C24 Ru1 C2 89.9(3) . .
C23 Ru1 C1 95.6(3) . .
C21 Ru1 C1 153.7(3) . .
C22 Ru1 C1 116.6(3) . .
C25 Ru1 C1 144.4(3) . .
C24 Ru1 C1 109.4(3) . .
C2 Ru1 C1 35.1(2) . .
C23 Ru1 C4 138.2(3) . .
C21 Ru1 C4 120.7(3) . .
C22 Ru1 C4 156.3(3) . .
C25 Ru1 C4 95.6(3) . .
C24 Ru1 C4 104.6(3) . .
C2 Ru1 C4 60.8(2) . .
C1 Ru1 C4 84.8(2) . .
C23 Ru1 C5 165.8(3) . .
C21 Ru1 C5 109.5(2) . .
C22 Ru1 C5 141.6(3) . .
C25 Ru1 C5 105.0(3) . .
C24 Ru1 C5 130.6(3) . .
C2 Ru1 C5 86.8(2) . .
C1 Ru1 C5 95.3(2) . .
C4 Ru1 C5 34.5(2) . .
C23 Ru1 P1 126.7(3) . .
C21 Ru1 P1 101.18(19) . .
C22 Ru1 P1 98.3(2) . .
C25 Ru1 P1 133.7(2) . .
C24 Ru1 P1 158.4(2) . .
C2 Ru1 P1 108.10(18) . .
C1 Ru1 P1 81.43(19) . .
C4 Ru1 P1 94.80(18) . .
C5 Ru1 P1 64.13(15) . .
C64 C63 Ru2 71.8(4) . .
C64 C63 H63A 120.0 . .
Ru2 C63 H63A 101.8 . .
C64 C63 H63B 120.0 . .
Ru2 C63 H63B 96.2 . .
H63A C63 H63B 120.0 . .
C63 C64 C65 123.5(7) . .
C63 C64 Ru2 72.6(4) . .
C65 C64 Ru2 102.2(4) . .
C63 C64 H64 118.3 . .
C65 C64 H64 118.3 . .
Ru2 C64 H64 95.3 . .
C64 C65 C66 97.2(5) . .
C64 C65 C70 109.9(7) . .
C66 C65 C70 109.2(6) . .
C64 C65 C69 115.0(7) . .
C66 C65 C69 116.6(6) . .
C70 C65 C69 108.4(7) . .
C67 C66 C65 131.7(6) . .
C67 C66 Ru2 73.3(3) . .
C65 C66 Ru2 99.6(4) . .
C67 C66 H66 114.1 . .
C65 C66 H66 114.1 . .
Ru2 C66 H66 98.6 . .
C66 C67 C68 129.1(5) . .
C66 C67 Ru2 72.2(3) . .
C68 C67 Ru2 101.0(3) . .
C66 C67 H67 115.5 . .
C68 C67 H67 115.5 . .
Ru2 C67 H67 97.6 . .
C67 C68 P2 95.5(3) . .
C67 C68 H68A 112.6 . .
P2 C68 H68A 112.6 . .
C67 C68 H68B 112.6 . .
P2 C68 H68B 112.6 . .
H68A C68 H68B 110.1 . .
C65 C69 H69A 109.5 . .
C65 C69 H69B 109.5 . .
H69A C69 H69B 109.5 . .
C65 C69 H69C 109.5 . .
H69A C69 H69C 109.5 . .
H69B C69 H69C 109.5 . .
C65 C70 H70A 109.5 . .
C65 C70 H70B 109.5 . .
H70A C70 H70B 109.5 . .
C65 C70 H70C 109.5 . .
H70A C70 H70C 109.5 . .
H70B C70 H70C 109.5 . .
C72 C71 C76 119.5(6) . .
C72 C71 P2 120.8(5) . .
C76 C71 P2 119.8(5) . .
C71 C72 C73 119.0(9) . .
C71 C72 H72 120.5 . .
C73 C72 H72 120.5 . .
C74 C73 C72 122.5(10) . .
C74 C73 H73 118.7 . .
C72 C73 H73 118.7 . .
C73 C74 C75 119.1(8) . .
C73 C74 H74 120.4 . .
C75 C74 H74 120.4 . .
C76 C75 C74 121.0(9) . .
C76 C75 H75 119.5 . .
C74 C75 H75 119.5 . .
C75 C76 C71 118.8(9) . .
C75 C76 H76 120.6 . .
C71 C76 H76 120.6 . .
C78 C77 C82 118.0(6) . .
C78 C77 P2 120.6(5) . .
C82 C77 P2 121.4(5) . .
C77 C78 C79 120.6(7) . .
C77 C78 H78 119.7 . .
C79 C78 H78 119.7 . .
C80 C79 C78 119.4(8) . .
C80 C79 H79 120.3 . .
C78 C79 H79 120.3 . .
C79 C80 C81 119.8(7) . .
C79 C80 H80 120.1 . .
C81 C80 H80 120.1 . .
C82 C81 C80 120.1(8) . .
C82 C81 H81 119.9 . .
C80 C81 H81 119.9 . .
C81 C82 C77 122.0(7) . .
C81 C82 H82 119.0 . .
C77 C82 H82 119.0 . .
C87 C83 C84 106.9(7) . .
C87 C83 C88 128.2(10) . .
C84 C83 C88 124.3(10) . .
C87 C83 Ru2 72.6(4) . .
C84 C83 Ru2 71.0(3) . .
C88 C83 Ru2 128.4(7) . .
C83 C84 C85 107.2(6) . .
C83 C84 C89 126.2(8) . .
C85 C84 C89 126.1(8) . .
C83 C84 Ru2 71.3(4) . .
C85 C84 Ru2 71.1(3) . .
C89 C84 Ru2 129.3(5) . .
C86 C85 C84 107.5(6) . .
C86 C85 C90 126.3(7) . .
C84 C85 C90 124.6(7) . .
C86 C85 Ru2 72.4(4) . .
C84 C85 Ru2 71.0(4) . .
C90 C85 Ru2 133.2(4) . .
C87 C86 C85 109.5(7) . .
C87 C86 C91 125.0(8) . .
C85 C86 C91 125.3(8) . .
C87 C86 Ru2 72.6(4) . .
C85 C86 Ru2 70.8(4) . .
C91 C86 Ru2 126.5(5) . .
C86 C87 C83 108.9(7) . .
C86 C87 C92 126.1(9) . .
C83 C87 C92 124.7(9) . .
C86 C87 Ru2 71.5(4) . .
C83 C87 Ru2 70.2(4) . .
C92 C87 Ru2 129.1(7) . .
C83 C88 H88A 109.5 . .
C83 C88 H88B 109.5 . .
H88A C88 H88B 109.5 . .
C83 C88 H88C 109.5 . .
H88A C88 H88C 109.5 . .
H88B C88 H88C 109.5 . .
C84 C89 H89A 109.5 . .
C84 C89 H89B 109.5 . .
H89A C89 H89B 109.5 . .
C84 C89 H89C 109.5 . .
H89A C89 H89C 109.5 . .
H89B C89 H89C 109.5 . .
C85 C90 H90A 109.5 . .
C85 C90 H90B 109.5 . .
H90A C90 H90B 109.5 . .
C85 C90 H90C 109.5 . .
H90A C90 H90C 109.5 . .
H90B C90 H90C 109.5 . .
C86 C91 H91A 109.5 . .
C86 C91 H91B 109.5 . .
H91A C91 H91B 109.5 . .
C86 C91 H91C 109.5 . .
H91A C91 H91C 109.5 . .
H91B C91 H91C 109.5 . .
C87 C92 H92A 109.5 . .
C87 C92 H92B 109.5 . .
H92A C92 H92B 109.5 . .
C87 C92 H92C 109.5 . .
H92A C92 H92C 109.5 . .
H92B C92 H92C 109.5 . .
C98 C93 C94 116.0(4) . .
C98 C93 B2 121.4(4) . .
C94 C93 B2 122.4(4) . .
C95 C94 C93 122.0(5) . .
C95 C94 H94 119.0 . .
C93 C94 H94 119.0 . .
C94 C95 C96 120.8(5) . .
C94 C95 C100 118.8(5) . .
C96 C95 C100 120.4(5) . .
C97 C96 C95 118.0(5) . .
C97 C96 H96 121.0 . .
C95 C96 H96 121.0 . .
C96 C97 C98 120.9(5) . .
C96 C97 C99 120.5(5) . .
C98 C97 C99 118.6(5) . .
C93 C98 C97 122.3(5) . .
C93 C98 H98 118.8 . .
C97 C98 H98 118.8 . .
F42 C99 F41 104.6(8) . .
F42 C99 F40 105.1(7) . .
F41 C99 F40 104.9(7) . .
F42 C99 C97 114.3(6) . .
F41 C99 C97 112.4(6) . .
F40 C99 C97 114.6(6) . .
F38A C100 F37 129.7(8) . .
F38A C100 F38 69.9(7) . .
F37 C100 F38 105.4(8) . .
F38A C100 F37A 109.2(9) . .
F37 C100 F37A 60.7(8) . .
F38 C100 F37A 46.9(6) . .
F38A C100 F39 41.9(5) . .
F37 C100 F39 106.3(8) . .
F38 C100 F39 109.8(7) . .
F37A C100 F39 133.7(8) . .
F38A C100 F39A 111.4(8) . .
F37 C100 F39A 33.8(6) . .
F38 C100 F39A 130.8(9) . .
F37A C100 F39A 92.7(9) . .
F39 C100 F39A 76.0(8) . .
F38A C100 C95 115.4(7) . .
F37 C100 C95 112.7(6) . .
F38 C100 C95 111.2(7) . .
F37A C100 C95 114.7(7) . .
F39 C100 C95 111.2(6) . .
F39A C100 C95 111.3(7) . .
C102 C101 C106 114.8(4) . .
C102 C101 B2 122.6(4) . .
C106 C101 B2 122.6(4) . .
C103 C102 C101 123.5(4) . .
C103 C102 H102 118.2 . .
C101 C102 H102 118.2 . .
C102 C103 C104 120.0(5) . .
C102 C103 C107 120.5(5) . .
C104 C103 C107 119.5(5) . .
C105 C104 C103 118.0(5) . .
C105 C104 H104 121.0 . .
C103 C104 H104 121.0 . .
C104 C105 C106 121.3(4) . .
C104 C105 C108 119.5(5) . .
C106 C105 C108 119.2(5) . .
C105 C106 C101 122.3(4) . .
C105 C106 H106 118.8 . .
C101 C106 H106 118.8 . .
F31A C107 F32A 109.3(8) . .
F31A C107 F33 129.5(8) . .
F32A C107 F33 37.5(5) . .
F31A C107 F31 54.9(7) . .
F32A C107 F31 129.1(8) . .
F33 C107 F31 110.1(8) . .
F31A C107 F33A 95.6(8) . .
F32A C107 F33A 108.0(8) . .
F33 C107 F33A 74.5(8) . .
F31 C107 F33A 42.7(5) . .
F31A C107 F32 42.8(6) . .
F32A C107 F32 75.9(7) . .
F33 C107 F32 110.7(8) . .
F31 C107 F32 96.7(7) . .
F33A C107 F32 132.1(8) . .
F31A C107 C103 115.2(7) . .
F32A C107 C103 115.5(6) . .
F33 C107 C103 114.5(7) . .
F31 C107 C103 114.5(6) . .
F33A C107 C103 111.3(6) . .
F32 C107 C103 109.0(6) . .
F35 C108 F36 107.8(8) . .
F35 C108 F34 103.0(8) . .
F36 C108 F34 101.8(7) . .
F35 C108 C105 114.0(6) . .
F36 C108 C105 115.5(5) . .
F34 C108 C105 113.4(6) . .
C110 C109 C114 115.3(4) . .
C110 C109 B2 122.1(4) . .
C114 C109 B2 122.6(4) . .
C109 C110 C111 122.3(5) . .
C109 C110 H110 118.9 . .
C111 C110 H110 118.9 . .
C112 C111 C110 120.3(5) . .
C112 C111 C116 120.4(5) . .
C110 C111 C116 119.3(5) . .
C113 C112 C111 119.0(5) . .
C113 C112 H112 120.5 . .
C111 C112 H112 120.5 . .
C112 C113 C114 120.3(5) . .
C112 C113 C115 119.8(5) . .
C114 C113 C115 119.9(5) . .
C113 C114 C109 122.8(5) . .
C113 C114 H114 118.6 . .
C109 C114 H114 118.6 . .
F44 C115 F45 103.0(8) . .
F44 C115 F43 104.8(7) . .
F45 C115 F43 101.8(7) . .
F44 C115 C113 114.4(5) . .
F45 C115 C113 115.7(5) . .
F43 C115 C113 115.5(6) . .
F48A C116 F47 71.9(9) . .
F48A C116 F46 123.4(10) . .
F47 C116 F46 105.5(9) . .
F48A C116 F46A 105.6(9) . .
F47 C116 F46A 126.7(8) . .
F46 C116 F46A 30.3(6) . .
F48A C116 F47A 102.0(10) . .
F47 C116 F47A 32.6(6) . .
F46 C116 F47A 78.7(9) . .
F46A C116 F47A 106.8(8) . .
F48A C116 F48 30.0(6) . .
F47 C116 F48 101.8(9) . .
F46 C116 F48 113.0(9) . .
F46A C116 F48 85.9(8) . .
F47A C116 F48 130.3(9) . .
F48A C116 C111 119.4(7) . .
F47 C116 C111 113.2(8) . .
F46 C116 C111 113.2(8) . .
F46A C116 C111 113.2(7) . .
F47A C116 C111 108.6(8) . .
F48 C116 C111 109.6(7) . .
C122 C117 C118 115.6(4) . .
C122 C117 B2 122.7(4) . .
C118 C117 B2 120.9(4) . .
C119 C118 C117 122.1(4) . .
C119 C118 H118 119.0 . .
C117 C118 H118 119.0 . .
C120 C119 C118 120.6(4) . .
C120 C119 C123 120.6(4) . .
C118 C119 C123 118.8(4) . .
C119 C120 C121 118.3(4) . .
C119 C120 H120 120.8 . .
C121 C120 H120 120.8 . .
C122 C121 C120 120.7(5) . .
C122 C121 C124 119.0(5) . .
C120 C121 C124 120.2(5) . .
C121 C122 C117 122.7(4) . .
C121 C122 H122 118.7 . .
C117 C122 H122 118.7 . .
F27 C123 F26 106.0(7) . .
F27 C123 F25 107.5(6) . .
F26 C123 F25 105.1(6) . .
F27 C123 C119 111.9(5) . .
F26 C123 C119 112.1(5) . .
F25 C123 C119 113.6(5) . .
F30 C124 F28 107.7(8) . .
F30 C124 F29 108.0(8) . .
F28 C124 F29 99.9(7) . .
F30 C124 C121 114.4(7) . .
F28 C124 C121 113.5(5) . .
F29 C124 C121 112.3(6) . .
C93 B2 C101 110.1(4) . .
C93 B2 C117 110.6(4) . .
C101 B2 C117 106.7(3) . .
C93 B2 C109 108.7(3) . .
C101 B2 C109 110.4(4) . .
C117 B2 C109 110.3(4) . .
C68 P2 C71 110.8(3) . .
C68 P2 C77 105.1(3) . .
C71 P2 C77 102.8(3) . .
C68 P2 Ru2 92.24(19) . .
C71 P2 Ru2 124.1(2) . .
C77 P2 Ru2 119.65(18) . .
C84 Ru2 C85 37.9(3) . .
C84 Ru2 C83 37.7(3) . .
C85 Ru2 C83 62.8(3) . .
C84 Ru2 C86 62.0(3) . .
C85 Ru2 C86 36.8(3) . .
C83 Ru2 C86 61.7(3) . .
C84 Ru2 C64 134.3(3) . .
C85 Ru2 C64 150.0(3) . .
C83 Ru2 C64 98.0(3) . .
C86 Ru2 C64 114.8(3) . .
C84 Ru2 C87 62.0(3) . .
C85 Ru2 C87 61.2(3) . .
C83 Ru2 C87 37.3(3) . .
C86 Ru2 C87 35.8(3) . .
C64 Ru2 C87 89.4(3) . .
C84 Ru2 C63 117.8(3) . .
C85 Ru2 C63 155.5(3) . .
C83 Ru2 C63 95.2(3) . .
C86 Ru2 C63 143.2(3) . .
C64 Ru2 C63 35.6(3) . .
C87 Ru2 C63 108.6(3) . .
C84 Ru2 C66 155.9(2) . .
C85 Ru2 C66 118.8(2) . .
C83 Ru2 C66 139.2(3) . .
C86 Ru2 C66 95.0(2) . .
C64 Ru2 C66 59.8(2) . .
C87 Ru2 C66 104.3(3) . .
C63 Ru2 C66 84.7(2) . .
C84 Ru2 C67 138.6(2) . .
C85 Ru2 C67 106.4(2) . .
C83 Ru2 C67 164.9(3) . .
C86 Ru2 C67 103.2(2) . .
C64 Ru2 C67 87.1(2) . .
C87 Ru2 C67 129.2(3) . .
C63 Ru2 C67 97.1(3) . .
C66 Ru2 C67 34.5(2) . .
C84 Ru2 P2 97.58(19) . .
C85 Ru2 P2 102.24(17) . .
C83 Ru2 P2 126.2(3) . .
C86 Ru2 P2 135.1(2) . .
C64 Ru2 P2 107.8(2) . .
C87 Ru2 P2 159.5(2) . .
C63 Ru2 P2 81.4(2) . .
C66 Ru2 P2 94.27(16) . .
C67 Ru2 P2 64.58(15) . .
C126 C125 C125 117(2) . 2_656
C126 C125 H12A 108.1 . .
C125 C125 H12A 108.1 2_656 .
C126 C125 H12B 108.1 . .
C125 C125 H12B 108.1 2_656 .
H12A C125 H12B 107.3 . .
C125 C126 C127 110.2(17) . .
C125 C126 H12C 109.6 . .
C127 C126 H12C 109.6 . .
C125 C126 H12D 109.6 . .
C127 C126 H12D 109.6 . .
H12C C126 H12D 108.1 . .
C126 C127 H12E 109.5 . .
C126 C127 H12F 109.5 . .
H12E C127 H12F 109.5 . .
C126 C127 H12G 109.5 . .
H12E C127 H12G 109.5 . .
H12F C127 H12G 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 C2 1.354(9) .
C1 Ru1 2.245(6) .
C1 H1A 0.9300 .
C1 H1B 0.9300 .
C2 C3 1.543(10) .
C2 Ru1 2.243(6) .
C2 H2 0.9300 .
C3 C4 1.515(9) .
C3 C7 1.522(12) .
C3 C8 1.566(11) .
C4 C5 1.365(9) .
C4 Ru1 2.302(6) .
C4 H4 0.9300 .
C5 C6 1.537(9) .
C5 Ru1 2.308(5) .
C5 H5 0.9300 .
C6 P1 1.824(6) .
C6 H6A 0.9700 .
C6 H6B 0.9700 .
C7 H7A 0.9600 .
C7 H7B 0.9600 .
C7 H7C 0.9600 .
C8 H8A 0.9600 .
C8 H8B 0.9600 .
C8 H8C 0.9600 .
C9 C14 1.372(8) .
C9 C10 1.399(8) .
C9 P1 1.819(5) .
C10 C11 1.359(9) .
C10 H10 0.9300 .
C11 C12 1.375(10) .
C11 H11 0.9300 .
C12 C13 1.373(10) .
C12 H12 0.9300 .
C13 C14 1.386(9) .
C13 H13 0.9300 .
C14 H14 0.9300 .
C15 C16 1.368(10) .
C15 C20 1.394(9) .
C15 P1 1.824(6) .
C16 C17 1.411(12) .
C16 H16 0.9300 .
C17 C18 1.351(14) .
C17 H17 0.9300 .
C18 C19 1.353(13) .
C18 H18 0.9300 .
C19 C20 1.357(10) .
C19 H19 0.9300 .
C20 H20 0.9300 .
C21 C25 1.400(10) .
C21 C22 1.404(11) .
C21 C26 1.512(11) .
C21 Ru1 2.199(6) .
C22 C23 1.374(12) .
C22 C27 1.510(11) .
C22 Ru1 2.206(6) .
C23 C24 1.375(12) .
C23 C28 1.531(11) .
C23 Ru1 2.192(7) .
C24 C25 1.381(11) .
C24 C29 1.544(12) .
C24 Ru1 2.231(7) .
C25 C30 1.511(11) .
C25 Ru1 2.228(6) .
C26 H26A 0.9600 .
C26 H26B 0.9600 .
C26 H26C 0.9600 .
C27 H27A 0.9600 .
C27 H27B 0.9600 .
C27 H27C 0.9600 .
C28 H28A 0.9600 .
C28 H28B 0.9600 .
C28 H28C 0.9600 .
C29 H29A 0.9600 .
C29 H29B 0.9600 .
C29 H29C 0.9600 .
C30 H30A 0.9600 .
C30 H30B 0.9600 .
C30 H30C 0.9600 .
C31 C36 1.387(7) .
C31 C32 1.400(7) .
C31 B1 1.637(7) .
C32 C33 1.384(8) .
C32 H32 0.9300 .
C33 C34 1.375(9) .
C33 C38 1.491(10) .
C34 C35 1.367(8) .
C34 H34 0.9300 .
C35 C36 1.396(7) .
C35 C37 1.491(10) .
C36 H36 0.9300 .
C37 F23 1.168(15) .
C37 F24A 1.224(19) .
C37 F22A 1.369(14) .
C37 F24 1.374(13) .
C37 F22 1.407(12) .
C37 F23A 1.419(12) .
C38 F20A 1.227(16) .
C38 F21A 1.271(12) .
C38 F19 1.308(13) .
C38 F21 1.328(13) .
C38 F19A 1.396(18) .
C38 F20 1.405(16) .
C39 C40 1.386(6) .
C39 C44 1.397(6) .
C39 B1 1.638(7) .
C40 C41 1.393(7) .
C40 H40 0.9300 .
C41 C42 1.390(8) .
C41 C46 1.477(8) .
C42 C43 1.374(7) .
C42 H42 0.9300 .
C43 C44 1.384(7) .
C43 C45 1.493(7) .
C44 H44 0.9300 .
C45 F6 1.286(8) .
C45 F4 1.304(8) .
C45 F5 1.333(7) .
C46 F2A 1.260(13) .
C46 F3 1.269(13) .
C46 F1 1.322(12) .
C46 F3A 1.324(11) .
C46 F2 1.337(12) .
C46 F1A 1.366(13) .
C47 C52 1.394(7) .
C47 C48 1.401(7) .
C47 B1 1.643(7) .
C48 C49 1.383(8) .
C48 H48 0.9300 .
C49 C50 1.359(10) .
C49 C53 1.493(11) .
C50 C51 1.380(10) .
C50 H50 0.9300 .
C51 C52 1.381(8) .
C51 C54 1.492(10) .
C52 H52 0.9300 .
C53 F8 1.174(11) .
C53 F9 1.259(11) .
C53 F7 1.270(11) .
C54 F12A 1.253(17) .
C54 F10A 1.329(16) .
C54 F10 1.331(13) .
C54 F11 1.344(13) .
C54 F12 1.349(13) .
C54 F11A 1.386(14) .
C55 C60 1.394(7) .
C55 C56 1.394(7) .
C55 B1 1.640(7) .
C56 C57 1.397(7) .
C56 H56 0.9300 .
C57 C58 1.380(10) .
C57 C61 1.505(12) .
C58 C59 1.358(11) .
C58 H58 0.9300 .
C59 C60 1.389(8) .
C59 C62 1.504(11) .
C60 H60 0.9300 .
C61 F14A 1.241(18) .
C61 F13 1.277(11) .
C61 F15 1.318(13) .
C61 F15A 1.388(14) .
C61 F14 1.394(14) .
C62 F18 1.128(13) .
C62 F16 1.259(15) .
C62 F17 1.273(14) .
P1 Ru1 2.3178(15) .
C63 C64 1.376(10) .
C63 Ru2 2.253(6) .
C63 H63A 0.9300 .
C63 H63B 0.9300 .
C64 C65 1.505(10) .
C64 Ru2 2.242(6) .
C64 H64 0.9300 .
C65 C66 1.513(9) .
C65 C70 1.538(10) .
C65 C69 1.539(11) .
C66 C67 1.368(9) .
C66 Ru2 2.298(5) .
C66 H66 0.9300 .
C67 C68 1.517(8) .
C67 Ru2 2.311(5) .
C67 H67 0.9300 .
C68 P2 1.812(5) .
C68 H68A 0.9700 .
C68 H68B 0.9700 .
C69 H69A 0.9600 .
C69 H69B 0.9600 .
C69 H69C 0.9600 .
C70 H70A 0.9600 .
C70 H70B 0.9600 .
C70 H70C 0.9600 .
C71 C72 1.377(10) .
C71 C76 1.388(10) .
C71 P2 1.821(6) .
C72 C73 1.396(12) .
C72 H72 0.9300 .
C73 C74 1.307(16) .
C73 H73 0.9300 .
C74 C75 1.386(16) .
C74 H74 0.9300 .
C75 C76 1.384(11) .
C75 H75 0.9300 .
C76 H76 0.9300 .
C77 C78 1.381(9) .
C77 C82 1.386(9) .
C77 P2 1.824(6) .
C78 C79 1.402(10) .
C78 H78 0.9300 .
C79 C80 1.368(13) .
C79 H79 0.9300 .
C80 C81 1.392(13) .
C80 H80 0.9300 .
C81 C82 1.345(10) .
C81 H81 0.9300 .
C82 H82 0.9300 .
C83 C87 1.425(12) .
C83 C84 1.431(11) .
C83 C88 1.493(12) .
C83 Ru2 2.215(6) .
C84 C85 1.436(10) .
C84 C89 1.508(11) .
C84 Ru2 2.211(6) .
C85 C86 1.402(10) .
C85 C90 1.500(10) .
C85 Ru2 2.212(6) .
C86 C87 1.377(11) .
C86 C91 1.522(11) .
C86 Ru2 2.232(6) .
C87 C92 1.524(12) .
C87 Ru2 2.246(6) .
C88 H88A 0.9600 .
C88 H88B 0.9600 .
C88 H88C 0.9600 .
C89 H89A 0.9600 .
C89 H89B 0.9600 .
C89 H89C 0.9600 .
C90 H90A 0.9600 .
C90 H90B 0.9600 .
C90 H90C 0.9600 .
C91 H91A 0.9600 .
C91 H91B 0.9600 .
C91 H91C 0.9600 .
C92 H92A 0.9600 .
C92 H92B 0.9600 .
C92 H92C 0.9600 .
C93 C98 1.383(7) .
C93 C94 1.398(7) .
C93 B2 1.636(6) .
C94 C95 1.385(7) .
C94 H94 0.9300 .
C95 C96 1.394(8) .
C95 C100 1.480(8) .
C96 C97 1.371(8) .
C96 H96 0.9300 .
C97 C98 1.396(7) .
C97 C99 1.485(8) .
C98 H98 0.9300 .
C99 F42 1.270(10) .
C99 F41 1.293(9) .
C99 F40 1.294(8) .
C100 F38A 1.295(11) .
C100 F37 1.299(12) .
C100 F38 1.313(12) .
C100 F37A 1.342(14) .
C100 F39 1.345(11) .
C100 F39A 1.349(13) .
C101 C102 1.387(6) .
C101 C106 1.401(6) .
C101 B2 1.645(7) .
C102 C103 1.382(7) .
C102 H102 0.9300 .
C103 C104 1.385(7) .
C103 C107 1.478(8) .
C104 C105 1.374(8) .
C104 H104 0.9300 .
C105 C106 1.379(7) .
C105 C108 1.489(7) .
C106 H106 0.9300 .
C107 F31A 1.298(12) .
C107 F32A 1.304(11) .
C107 F33 1.307(12) .
C107 F31 1.321(11) .
C107 F33A 1.343(11) .
C107 F32 1.349(12) .
C108 F35 1.251(9) .
C108 F36 1.253(8) .
C108 F34 1.319(9) .
C109 C110 1.393(7) .
C109 C114 1.398(7) .
C109 B2 1.652(6) .
C110 C111 1.401(7) .
C110 H110 0.9300 .
C111 C112 1.375(8) .
C111 C116 1.488(9) .
C112 C113 1.372(8) .
C112 H112 0.9300 .
C113 C114 1.388(7) .
C113 C115 1.470(8) .
C114 H114 0.9300 .
C115 F44 1.267(8) .
C115 F45 1.269(9) .
C115 F43 1.273(8) .
C116 F48A 1.245(13) .
C116 F47 1.284(13) .
C116 F46 1.316(13) .
C116 F46A 1.356(11) .
C116 F47A 1.389(14) .
C116 F48 1.403(13) .
C117 C122 1.392(7) .
C117 C118 1.399(6) .
C117 B2 1.648(6) .
C118 C119 1.393(6) .
C118 H118 0.9300 .
C119 C120 1.377(7) .
C119 C123 1.502(7) .
C120 C121 1.383(7) .
C120 H120 0.9300 .
C121 C122 1.380(7) .
C121 C124 1.503(8) .
C122 H122 0.9300 .
C123 F27 1.285(7) .
C123 F26 1.288(8) .
C123 F25 1.301(7) .
C124 F30 1.209(10) .
C124 F28 1.288(9) .
C124 F29 1.339(9) .
P2 Ru2 2.3173(14) .
C125 C126 1.449(19) .
C125 C125 1.49(3) 2_656
C125 H12A 0.9700 .
C125 H12B 0.9700 .
C126 C127 1.45(2) .
C126 H12C 0.9700 .
C126 H12D 0.9700 .
C127 H12E 0.9600 .
C127 H12F 0.9600 .
C127 H12G 0.9600 .
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
Ru1 C1 C2 C3 91.7(6) .
C1 C2 C3 C4 -81.9(7) .
Ru1 C2 C3 C4 -5.3(6) .
C1 C2 C3 C7 41.8(9) .
Ru1 C2 C3 C7 118.3(6) .
C1 C2 C3 C8 165.2(7) .
Ru1 C2 C3 C8 -118.2(6) .
C7 C3 C4 C5 -41.3(10) .
C2 C3 C4 C5 81.0(8) .
C8 C3 C4 C5 -164.7(7) .
C7 C3 C4 Ru1 -117.2(6) .
C2 C3 C4 Ru1 5.1(5) .
C8 C3 C4 Ru1 119.4(6) .
C3 C4 C5 C6 1.7(11) .
Ru1 C4 C5 C6 89.8(6) .
C3 C4 C5 Ru1 -88.1(7) .
C4 C5 C6 P1 -102.2(6) .
Ru1 C5 C6 P1 -26.0(3) .
C14 C9 C10 C11 -0.4(9) .
P1 C9 C10 C11 -178.8(5) .
C9 C10 C11 C12 0.8(10) .
C10 C11 C12 C13 -0.2(11) .
C11 C12 C13 C14 -0.8(12) .
C10 C9 C14 C13 -0.6(10) .
P1 C9 C14 C13 177.8(6) .
C12 C13 C14 C9 1.2(12) .
C20 C15 C16 C17 -1.4(10) .
P1 C15 C16 C17 172.4(5) .
C15 C16 C17 C18 0.7(11) .
C16 C17 C18 C19 1.0(12) .
C17 C18 C19 C20 -1.9(12) .
C18 C19 C20 C15 1.1(11) .
C16 C15 C20 C19 0.5(10) .
P1 C15 C20 C19 -173.2(5) .
C25 C21 C22 C23 2.5(7) .
C26 C21 C22 C23 170.8(7) .
Ru1 C21 C22 C23 -62.0(5) .
C25 C21 C22 C27 -169.9(7) .
C26 C21 C22 C27 -1.6(11) .
Ru1 C21 C22 C27 125.6(7) .
C25 C21 C22 Ru1 64.5(5) .
C26 C21 C22 Ru1 -127.2(7) .
C21 C22 C23 C24 -3.3(8) .
C27 C22 C23 C24 169.1(7) .
Ru1 C22 C23 C24 -65.3(5) .
C21 C22 C23 C28 -175.2(7) .
C27 C22 C23 C28 -2.7(11) .
Ru1 C22 C23 C28 122.9(7) .
C21 C22 C23 Ru1 61.9(4) .
C27 C22 C23 Ru1 -125.6(7) .
C22 C23 C24 C25 2.9(8) .
C28 C23 C24 C25 174.5(8) .
Ru1 C23 C24 C25 -61.6(5) .
C22 C23 C24 C29 -167.7(8) .
C28 C23 C24 C29 3.9(14) .
Ru1 C23 C24 C29 127.8(9) .
C22 C23 C24 Ru1 64.5(5) .
C28 C23 C24 Ru1 -123.9(8) .
C23 C24 C25 C21 -1.3(8) .
C29 C24 C25 C21 169.8(8) .
Ru1 C24 C25 C21 -62.0(5) .
C23 C24 C25 C30 -174.3(8) .
C29 C24 C25 C30 -3.2(14) .
Ru1 C24 C25 C30 125.0(9) .
C23 C24 C25 Ru1 60.7(5) .
C29 C24 C25 Ru1 -128.2(9) .
C22 C21 C25 C24 -0.7(8) .
C26 C21 C25 C24 -169.1(7) .
Ru1 C21 C25 C24 63.1(5) .
C22 C21 C25 C30 172.4(8) .
C26 C21 C25 C30 4.0(12) .
Ru1 C21 C25 C30 -123.8(8) .
C22 C21 C25 Ru1 -63.8(4) .
C26 C21 C25 Ru1 127.7(7) .
C36 C31 C32 C33 1.1(8) .
B1 C31 C32 C33 175.8(5) .
C31 C32 C33 C34 0.7(9) .
C31 C32 C33 C38 178.9(7) .
C32 C33 C34 C35 -1.8(9) .
C38 C33 C34 C35 -179.9(7) .
C33 C34 C35 C36 1.1(8) .
C33 C34 C35 C37 -179.6(6) .
C32 C31 C36 C35 -1.8(7) .
B1 C31 C36 C35 -176.5(5) .
C34 C35 C36 C31 0.8(8) .
C37 C35 C36 C31 -178.5(5) .
C34 C35 C37 F23 -80.5(14) .
C36 C35 C37 F23 98.7(13) .
C34 C35 C37 F24A 107.4(13) .
C36 C35 C37 F24A -73.4(13) .
C34 C35 C37 F22A -30.8(11) .
C36 C35 C37 F22A 148.5(8) .
C34 C35 C37 F24 138.2(8) .
C36 C35 C37 F24 -42.6(10) .
C34 C35 C37 F22 35.4(9) .
C36 C35 C37 F22 -145.3(7) .
C34 C35 C37 F23A -129.8(7) .
C36 C35 C37 F23A 49.5(8) .
C34 C33 C38 F20A 154.2(11) .
C32 C33 C38 F20A -23.9(15) .
C34 C33 C38 F21A 17.5(14) .
C32 C33 C38 F21A -160.6(9) .
C34 C33 C38 F19 -143.9(8) .
C32 C33 C38 F19 38.0(12) .
C34 C33 C38 F21 -19.3(13) .
C32 C33 C38 F21 162.6(9) .
C34 C33 C38 F19A -91.3(11) .
C32 C33 C38 F19A 90.6(11) .
C34 C33 C38 F20 103.3(9) .
C32 C33 C38 F20 -74.9(10) .
C44 C39 C40 C41 -0.7(7) .
B1 C39 C40 C41 -173.2(4) .
C39 C40 C41 C42 1.2(8) .
C39 C40 C41 C46 -179.2(5) .
C40 C41 C42 C43 -0.7(8) .
C46 C41 C42 C43 179.8(5) .
C41 C42 C43 C44 -0.4(8) .
C41 C42 C43 C45 177.5(5) .
C42 C43 C44 C39 0.9(7) .
C45 C43 C44 C39 -176.9(5) .
C40 C39 C44 C43 -0.4(6) .
B1 C39 C44 C43 171.9(4) .
C42 C43 C45 F6 137.5(6) .
C44 C43 C45 F6 -44.6(8) .
C42 C43 C45 F4 -99.6(7) .
C44 C43 C45 F4 78.3(7) .
C42 C43 C45 F5 18.0(8) .
C44 C43 C45 F5 -164.1(5) .
C42 C41 C46 F2A -5.2(12) .
C40 C41 C46 F2A 175.3(9) .
C42 C41 C46 F3 171.1(9) .
C40 C41 C46 F3 -8.5(11) .
C42 C41 C46 F1 57.3(9) .
C40 C41 C46 F1 -122.2(8) .
C42 C41 C46 F3A -143.6(7) .
C40 C41 C46 F3A 36.8(10) .
C42 C41 C46 F2 -54.8(9) .
C40 C41 C46 F2 125.7(7) .
C42 C41 C46 F1A 107.7(8) .
C40 C41 C46 F1A -71.9(9) .
C52 C47 C48 C49 2.1(7) .
B1 C47 C48 C49 178.2(5) .
C47 C48 C49 C50 0.8(9) .
C47 C48 C49 C53 178.0(6) .
C48 C49 C50 C51 -3.1(9) .
C53 C49 C50 C51 179.8(6) .
C49 C50 C51 C52 2.4(9) .
C49 C50 C51 C54 -178.0(6) .
C50 C51 C52 C47 0.6(8) .
C54 C51 C52 C47 -179.0(6) .
C48 C47 C52 C51 -2.7(7) .
B1 C47 C52 C51 -178.9(5) .
C50 C49 C53 F8 108.5(13) .
C48 C49 C53 F8 -68.7(14) .
C50 C49 C53 F9 -131.1(9) .
C48 C49 C53 F9 51.7(11) .
C50 C49 C53 F7 -20.4(13) .
C48 C49 C53 F7 162.4(10) .
C50 C51 C54 F12A 56.0(15) .
C52 C51 C54 F12A -124.5(12) .
C50 C51 C54 F10A -164.9(10) .
C52 C51 C54 F10A 14.6(13) .
C50 C51 C54 F10 132.7(8) .
C52 C51 C54 F10 -47.7(9) .
C50 C51 C54 F11 -112.0(9) .
C52 C51 C54 F11 67.6(10) .
C50 C51 C54 F12 18.1(11) .
C52 C51 C54 F12 -162.3(8) .
C50 C51 C54 F11A -60.2(10) .
C52 C51 C54 F11A 119.4(9) .
C60 C55 C56 C57 -2.5(7) .
B1 C55 C56 C57 -176.3(5) .
C55 C56 C57 C58 4.4(8) .
C55 C56 C57 C61 -177.6(6) .
C56 C57 C58 C59 -3.6(9) .
C61 C57 C58 C59 178.6(6) .
C57 C58 C59 C60 1.0(10) .
C57 C58 C59 C62 -177.8(7) .
C58 C59 C60 C55 0.8(9) .
C62 C59 C60 C55 179.8(6) .
C56 C55 C60 C59 -0.1(8) .
B1 C55 C60 C59 173.6(5) .
C58 C57 C61 F14A -92.4(13) .
C56 C57 C61 F14A 89.7(12) .
C58 C57 C61 F13 110.9(9) .
C56 C57 C61 F13 -67.0(10) .
C58 C57 C61 F15 -27.5(12) .
C56 C57 C61 F15 154.6(9) .
C58 C57 C61 F15A 8.7(11) .
C56 C57 C61 F15A -169.2(8) .
C58 C57 C61 F14 -142.1(8) .
C56 C57 C61 F14 40.0(10) .
C58 C59 C62 F18 106.0(17) .
C60 C59 C62 F18 -72.9(17) .
C58 C59 C62 F16 -17.1(15) .
C60 C59 C62 F16 164.0(12) .
C58 C59 C62 F17 -124.2(14) .
C60 C59 C62 F17 56.9(15) .
C36 C31 B1 C39 -30.0(6) .
C32 C31 B1 C39 155.7(4) .
C36 C31 B1 C55 -145.5(4) .
C32 C31 B1 C55 40.1(6) .
C36 C31 B1 C47 94.0(5) .
C32 C31 B1 C47 -80.4(5) .
C40 C39 B1 C31 -38.1(6) .
C44 C39 B1 C31 150.0(4) .
C40 C39 B1 C55 82.7(5) .
C44 C39 B1 C55 -89.3(5) .
C40 C39 B1 C47 -157.1(4) .
C44 C39 B1 C47 30.9(6) .
C60 C55 B1 C31 35.3(6) .
C56 C55 B1 C31 -151.4(4) .
C60 C55 B1 C39 -86.2(5) .
C56 C55 B1 C39 87.1(5) .
C60 C55 B1 C47 152.0(4) .
C56 C55 B1 C47 -34.6(6) .
C52 C47 B1 C31 88.0(5) .
C48 C47 B1 C31 -87.8(5) .
C52 C47 B1 C39 -148.4(4) .
C48 C47 B1 C39 35.8(6) .
C52 C47 B1 C55 -33.0(6) .
C48 C47 B1 C55 151.2(4) .
C14 C9 P1 C15 -35.4(5) .
C10 C9 P1 C15 142.9(5) .
C14 C9 P1 C6 -150.7(5) .
C10 C9 P1 C6 27.6(5) .
C14 C9 P1 Ru1 107.6(5) .
C10 C9 P1 Ru1 -74.1(5) .
C16 C15 P1 C9 -62.9(5) .
C20 C15 P1 C9 110.8(5) .
C16 C15 P1 C6 46.8(6) .
C20 C15 P1 C6 -139.5(5) .
C16 C15 P1 Ru1 155.5(4) .
C20 C15 P1 Ru1 -30.8(6) .
C5 C6 P1 C9 -98.4(4) .
C5 C6 P1 C15 154.2(3) .
C5 C6 P1 Ru1 25.4(3) .
C22 C23 Ru1 C21 -37.5(4) .
C24 C23 Ru1 C21 78.3(5) .
C28 C23 Ru1 C21 -157.9(13) .
C24 C23 Ru1 C22 115.7(6) .
C28 C23 Ru1 C22 -120.5(14) .
C22 C23 Ru1 C25 -79.7(5) .
C24 C23 Ru1 C25 36.0(4) .
C28 C23 Ru1 C25 159.8(13) .
C22 C23 Ru1 C24 -115.7(6) .
C28 C23 Ru1 C24 123.8(14) .
C22 C23 Ru1 C2 164.0(4) .
C24 C23 Ru1 C2 -80.3(5) .
C28 C23 Ru1 C2 43.5(13) .
C22 C23 Ru1 C1 128.7(4) .
C24 C23 Ru1 C1 -115.6(5) .
C28 C23 Ru1 C1 8.2(13) .
C22 C23 Ru1 C4 -142.9(5) .
C24 C23 Ru1 C4 -27.2(6) .
C28 C23 Ru1 C4 96.6(12) .
C22 C23 Ru1 C5 -91.5(13) .
C24 C23 Ru1 C5 24.2(15) .
C28 C23 Ru1 C5 148.0(12) .
C22 C23 Ru1 P1 45.2(5) .
C24 C23 Ru1 P1 161.0(4) .
C28 C23 Ru1 P1 -75.2(13) .
C25 C21 Ru1 C23 -78.7(5) .
C22 C21 Ru1 C23 36.7(5) .
C26 C21 Ru1 C23 159.4(11) .
C25 C21 Ru1 C22 -115.4(6) .
C26 C21 Ru1 C22 122.7(12) .
C22 C21 Ru1 C25 115.4(6) .
C26 C21 Ru1 C25 -121.9(12) .
C25 C21 Ru1 C24 -37.2(5) .
C22 C21 Ru1 C24 78.2(5) .
C26 C21 Ru1 C24 -159.1(11) .
C25 C21 Ru1 C2 -31.2(8) .
C22 C21 Ru1 C2 84.2(7) .
C26 C21 Ru1 C2 -153.1(9) .
C25 C21 Ru1 C1 -111.2(7) .
C22 C21 Ru1 C1 4.2(8) .
C26 C21 Ru1 C1 126.9(10) .
C25 C21 Ru1 C4 53.0(5) .
C22 C21 Ru1 C4 168.4(4) .
C26 C21 Ru1 C4 -68.9(10) .
C25 C21 Ru1 C5 89.2(5) .
C22 C21 Ru1 C5 -155.4(4) .
C26 C21 Ru1 C5 -32.7(10) .
C25 C21 Ru1 P1 155.5(4) .
C22 C21 Ru1 P1 -89.1(4) .
C26 C21 Ru1 P1 33.6(10) .
C21 C22 Ru1 C23 -117.6(6) .
C27 C22 Ru1 C23 121.0(13) .
C23 C22 Ru1 C21 117.6(6) .
C27 C22 Ru1 C21 -121.4(13) .
C23 C22 Ru1 C25 79.4(5) .
C21 C22 Ru1 C25 -38.2(4) .
C27 C22 Ru1 C25 -159.6(12) .
C23 C22 Ru1 C24 37.8(4) .
C21 C22 Ru1 C24 -79.8(5) .
C27 C22 Ru1 C24 158.8(12) .
C23 C22 Ru1 C2 -21.5(6) .
C21 C22 Ru1 C2 -139.1(4) .
C27 C22 Ru1 C2 99.5(11) .
C23 C22 Ru1 C1 -60.3(5) .
C21 C22 Ru1 C1 -177.9(4) .
C27 C22 Ru1 C1 60.7(12) .
C23 C22 Ru1 C4 92.1(9) .
C21 C22 Ru1 C4 -25.5(10) .
C27 C22 Ru1 C4 -146.9(10) .
C23 C22 Ru1 C5 156.8(5) .
C21 C22 Ru1 C5 39.2(6) .
C27 C22 Ru1 C5 -82.2(11) .
C23 C22 Ru1 P1 -144.9(4) .
C21 C22 Ru1 P1 97.5(4) .
C27 C22 Ru1 P1 -23.8(11) .
C24 C25 Ru1 C23 -36.1(5) .
C21 C25 Ru1 C23 80.3(5) .
C30 C25 Ru1 C23 -159.3(11) .
C24 C25 Ru1 C21 -116.5(7) .
C30 C25 Ru1 C21 120.4(11) .
C24 C25 Ru1 C22 -78.0(5) .
C21 C25 Ru1 C22 38.5(5) .
C30 C25 Ru1 C22 158.9(11) .
C21 C25 Ru1 C24 116.5(7) .
C30 C25 Ru1 C24 -123.2(12) .
C24 C25 Ru1 C2 47.0(6) .
C21 C25 Ru1 C2 163.5(4) .
C30 C25 Ru1 C2 -76.2(10) .
C24 C25 Ru1 C1 18.3(7) .
C21 C25 Ru1 C1 134.7(5) .
C30 C25 Ru1 C1 -104.9(10) .
C24 C25 Ru1 C4 107.1(5) .
C21 C25 Ru1 C4 -136.4(4) .
C30 C25 Ru1 C4 -16.0(10) .
C24 C25 Ru1 C5 140.9(5) .
C21 C25 Ru1 C5 -102.6(4) .
C30 C25 Ru1 C5 17.7(10) .
C24 C25 Ru1 P1 -150.7(4) .
C21 C25 Ru1 P1 -34.2(5) .
C30 C25 Ru1 P1 86.1(10) .
C25 C24 Ru1 C23 119.0(7) .
C29 C24 Ru1 C23 -122.7(14) .
C23 C24 Ru1 C21 -81.0(5) .
C25 C24 Ru1 C21 38.0(5) .
C29 C24 Ru1 C21 156.3(13) .
C23 C24 Ru1 C22 -38.0(5) .
C25 C24 Ru1 C22 81.0(5) .
C29 C24 Ru1 C22 -160.7(13) .
C23 C24 Ru1 C25 -119.0(7) .
C29 C24 Ru1 C25 118.3(14) .
C23 C24 Ru1 C2 101.9(5) .
C25 C24 Ru1 C2 -139.0(5) .
C29 C24 Ru1 C2 -20.8(12) .
C23 C24 Ru1 C1 72.1(5) .
C25 C24 Ru1 C1 -168.9(4) .
C29 C24 Ru1 C1 -50.6(12) .
C23 C24 Ru1 C4 161.7(5) .
C25 C24 Ru1 C4 -79.3(5) .
C29 C24 Ru1 C4 39.0(12) .
C23 C24 Ru1 C5 -172.4(4) .
C25 C24 Ru1 C5 -53.4(6) .
C29 C24 Ru1 C5 64.9(12) .
C23 C24 Ru1 P1 -45.3(9) .
C25 C24 Ru1 P1 73.8(9) .
C29 C24 Ru1 P1 -167.9(10) .
C1 C2 Ru1 C23 -89.8(5) .
C3 C2 Ru1 C23 146.4(5) .
C1 C2 Ru1 C21 -130.6(6) .
C3 C2 Ru1 C21 105.5(6) .
C1 C2 Ru1 C22 -77.1(5) .
C3 C2 Ru1 C22 159.0(4) .
C1 C2 Ru1 C25 -150.9(4) .
C3 C2 Ru1 C25 85.2(5) .
C1 C2 Ru1 C24 -125.4(5) .
C3 C2 Ru1 C24 110.8(5) .
C3 C2 Ru1 C1 -123.8(7) .
C1 C2 Ru1 C4 127.8(5) .
C3 C2 Ru1 C4 4.0(4) .
C1 C2 Ru1 C5 103.9(4) .
C3 C2 Ru1 C5 -19.9(4) .
C1 C2 Ru1 P1 42.5(4) .
C3 C2 Ru1 P1 -81.4(4) .
C2 C1 Ru1 C23 94.2(5) .
C2 C1 Ru1 C21 122.6(6) .
C2 C1 Ru1 C22 125.4(4) .
C2 C1 Ru1 C25 48.5(6) .
C2 C1 Ru1 C24 59.8(5) .
C2 C1 Ru1 C4 -43.9(4) .
C2 C1 Ru1 C5 -76.7(4) .
C2 C1 Ru1 P1 -139.5(4) .
C5 C4 Ru1 C23 160.2(4) .
C3 C4 Ru1 C23 -69.4(6) .
C5 C4 Ru1 C21 79.7(4) .
C3 C4 Ru1 C21 -149.9(4) .
C5 C4 Ru1 C22 97.3(8) .
C3 C4 Ru1 C22 -132.3(7) .
C5 C4 Ru1 C25 108.5(4) .
C3 C4 Ru1 C25 -121.1(5) .
C5 C4 Ru1 C24 144.1(4) .
C3 C4 Ru1 C24 -85.6(5) .
C5 C4 Ru1 C2 -134.4(5) .
C3 C4 Ru1 C2 -4.0(4) .
C5 C4 Ru1 C1 -107.2(4) .
C3 C4 Ru1 C1 23.1(5) .
C3 C4 Ru1 C5 130.4(6) .
C5 C4 Ru1 P1 -26.3(4) .
C3 C4 Ru1 P1 104.1(4) .
C4 C5 Ru1 C23 -67.1(13) .
C6 C5 Ru1 C23 164.8(11) .
C4 C5 Ru1 C21 -116.1(4) .
C6 C5 Ru1 C21 115.7(4) .
C4 C5 Ru1 C22 -140.1(4) .
C6 C5 Ru1 C22 91.8(5) .
C4 C5 Ru1 C25 -77.7(4) .
C6 C5 Ru1 C25 154.1(4) .
C4 C5 Ru1 C24 -48.4(5) .
C6 C5 Ru1 C24 -176.6(4) .
C4 C5 Ru1 C2 38.7(4) .
C6 C5 Ru1 C2 -89.4(4) .
C4 C5 Ru1 C1 72.8(4) .
C6 C5 Ru1 C1 -55.3(4) .
C6 C5 Ru1 C4 -128.1(6) .
C4 C5 Ru1 P1 150.6(4) .
C6 C5 Ru1 P1 22.5(3) .
C9 P1 Ru1 C23 -79.7(3) .
C15 P1 Ru1 C23 54.3(3) .
C6 P1 Ru1 C23 172.3(3) .
C9 P1 Ru1 C21 -16.8(3) .
C15 P1 Ru1 C21 117.2(3) .
C6 P1 Ru1 C21 -124.9(3) .
C9 P1 Ru1 C22 -54.5(3) .
C15 P1 Ru1 C22 79.5(3) .
C6 P1 Ru1 C22 -162.5(3) .
C9 P1 Ru1 C25 3.3(3) .
C15 P1 Ru1 C25 137.3(3) .
C6 P1 Ru1 C25 -104.7(3) .
C9 P1 Ru1 C24 -48.1(7) .
C15 P1 Ru1 C24 85.8(7) .
C6 P1 Ru1 C24 -156.2(7) .
C9 P1 Ru1 C2 166.6(3) .
C15 P1 Ru1 C2 -59.4(3) .
C6 P1 Ru1 C2 58.6(3) .
C9 P1 Ru1 C1 -170.2(3) .
C15 P1 Ru1 C1 -36.3(3) .
C6 P1 Ru1 C1 81.7(3) .
C9 P1 Ru1 C4 105.8(3) .
C15 P1 Ru1 C4 -120.2(3) .
C6 P1 Ru1 C4 -2.3(3) .
C9 P1 Ru1 C5 89.6(3) .
C15 P1 Ru1 C5 -136.4(3) .
C6 P1 Ru1 C5 -18.5(3) .
Ru2 C63 C64 C65 93.4(6) .
C63 C64 C65 C66 -86.6(7) .
Ru2 C64 C65 C66 -9.5(6) .
C63 C64 C65 C70 159.9(7) .
Ru2 C64 C65 C70 -123.0(6) .
C63 C64 C65 C69 37.3(9) .
Ru2 C64 C65 C69 114.4(6) .
C64 C65 C66 C67 85.3(8) .
C70 C65 C66 C67 -160.7(7) .
C69 C65 C66 C67 -37.4(10) .
C64 C65 C66 Ru2 9.2(5) .
C70 C65 C66 Ru2 123.2(6) .
C69 C65 C66 Ru2 -113.5(6) .
C65 C66 C67 C68 1.9(10) .
Ru2 C66 C67 C68 89.9(5) .
C65 C66 C67 Ru2 -88.0(7) .
C66 C67 C68 P2 -98.1(6) .
Ru2 C67 C68 P2 -22.1(3) .
C76 C71 C72 C73 2.2(11) .
P2 C71 C72 C73 -178.3(6) .
C71 C72 C73 C74 -3.0(14) .
C72 C73 C74 C75 1.8(15) .
C73 C74 C75 C76 0.0(15) .
C74 C75 C76 C71 -0.7(13) .
C72 C71 C76 C75 -0.5(11) .
P2 C71 C76 C75 -180.0(6) .
C82 C77 C78 C79 0.3(10) .
P2 C77 C78 C79 -177.6(5) .
C77 C78 C79 C80 0.2(11) .
C78 C79 C80 C81 0.4(13) .
C79 C80 C81 C82 -1.5(13) .
C80 C81 C82 C77 2.1(12) .
C78 C77 C82 C81 -1.4(10) .
P2 C77 C82 C81 176.4(6) .
C87 C83 C84 C85 -1.8(7) .
C88 C83 C84 C85 -173.5(8) .
Ru2 C83 C84 C85 62.4(4) .
C87 C83 C84 C89 170.3(7) .
C88 C83 C84 C89 -1.5(12) .
Ru2 C83 C84 C89 -125.5(7) .
C87 C83 C84 Ru2 -64.2(5) .
C88 C83 C84 Ru2 124.1(9) .
C83 C84 C85 C86 1.1(7) .
C89 C84 C85 C86 -170.9(6) .
Ru2 C84 C85 C86 63.7(4) .
C83 C84 C85 C90 167.5(6) .
C89 C84 C85 C90 -4.5(10) .
Ru2 C84 C85 C90 -130.0(6) .
C83 C84 C85 Ru2 -62.5(5) .
C89 C84 C85 Ru2 125.4(7) .
C84 C85 C86 C87 0.0(7) .
C90 C85 C86 C87 -166.1(6) .
Ru2 C85 C86 C87 62.7(5) .
C84 C85 C86 C91 175.5(6) .
C90 C85 C86 C91 9.4(10) .
Ru2 C85 C86 C91 -121.7(7) .
C84 C85 C86 Ru2 -62.8(4) .
C90 C85 C86 Ru2 131.1(6) .
C85 C86 C87 C83 -1.1(8) .
C91 C86 C87 C83 -176.6(6) .
Ru2 C86 C87 C83 60.5(5) .
C85 C86 C87 C92 173.0(8) .
C91 C86 C87 C92 -2.5(12) .
Ru2 C86 C87 C92 -125.3(9) .
C85 C86 C87 Ru2 -61.6(4) .
C91 C86 C87 Ru2 122.8(7) .
C84 C83 C87 C86 1.8(8) .
C88 C83 C87 C86 173.1(8) .
Ru2 C83 C87 C86 -61.4(5) .
C84 C83 C87 C92 -172.5(8) .
C88 C83 C87 C92 -1.1(14) .
Ru2 C83 C87 C92 124.4(9) .
C84 C83 C87 Ru2 63.1(5) .
C88 C83 C87 Ru2 -125.5(9) .
C98 C93 C94 C95 -1.1(7) .
B2 C93 C94 C95 173.8(4) .
C93 C94 C95 C96 -0.6(8) .
C93 C94 C95 C100 -179.3(5) .
C94 C95 C96 C97 0.9(9) .
C100 C95 C96 C97 179.6(6) .
C95 C96 C97 C98 0.5(9) .
C95 C96 C97 C99 -177.8(6) .
C94 C93 C98 C97 2.6(7) .
B2 C93 C98 C97 -172.4(4) .
C96 C97 C98 C93 -2.4(8) .
C99 C97 C98 C93 176.0(5) .
C96 C97 C99 F42 -120.0(8) .
C98 C97 C99 F42 61.7(10) .
C96 C97 C99 F41 121.1(8) .
C98 C97 C99 F41 -57.3(9) .
C96 C97 C99 F40 1.4(10) .
C98 C97 C99 F40 -176.9(7) .
C94 C95 C100 F38A 145.8(8) .
C96 C95 C100 F38A -32.9(10) .
C94 C95 C100 F37 -49.4(10) .
C96 C95 C100 F37 131.9(8) .
C94 C95 C100 F38 68.7(8) .
C96 C95 C100 F38 -110.0(8) .
C94 C95 C100 F37A 17.6(10) .
C96 C95 C100 F37A -161.2(8) .
C94 C95 C100 F39 -168.6(6) .
C96 C95 C100 F39 12.7(9) .
C94 C95 C100 F39A -86.0(9) .
C96 C95 C100 F39A 95.3(9) .
C106 C101 C102 C103 2.3(7) .
B2 C101 C102 C103 -179.3(4) .
C101 C102 C103 C104 -2.2(8) .
C101 C102 C103 C107 178.1(5) .
C102 C103 C104 C105 1.3(8) .
C107 C103 C104 C105 -178.9(5) .
C103 C104 C105 C106 -0.9(8) .
C103 C104 C105 C108 -179.7(5) .
C104 C105 C106 C101 1.3(7) .
C108 C105 C106 C101 -179.9(5) .
C102 C101 C106 C105 -1.9(7) .
B2 C101 C106 C105 179.7(4) .
C102 C103 C107 F31A 32.5(10) .
C104 C103 C107 F31A -147.3(8) .
C102 C103 C107 F32A 161.5(7) .
C104 C103 C107 F32A -18.3(10) .
C102 C103 C107 F33 -157.0(7) .
C104 C103 C107 F33 23.3(10) .
C102 C103 C107 F31 -28.5(9) .
C104 C103 C107 F31 151.7(7) .
C102 C103 C107 F33A -74.9(8) .
C104 C103 C107 F33A 105.3(7) .
C102 C103 C107 F32 78.4(8) .
C104 C103 C107 F32 -101.3(7) .
C104 C105 C108 F35 97.3(9) .
C106 C105 C108 F35 -81.5(9) .
C104 C105 C108 F36 -137.1(7) .
C106 C105 C108 F36 44.1(9) .
C104 C105 C108 F34 -20.1(9) .
C106 C105 C108 F34 161.0(7) .
C114 C109 C110 C111 0.1(7) .
B2 C109 C110 C111 179.6(5) .
C109 C110 C111 C112 -0.2(9) .
C109 C110 C111 C116 179.2(6) .
C110 C111 C112 C113 0.1(9) .
C116 C111 C112 C113 -179.4(6) .
C111 C112 C113 C114 0.3(8) .
C111 C112 C113 C115 179.8(5) .
C112 C113 C114 C109 -0.5(8) .
C115 C113 C114 C109 180.0(5) .
C110 C109 C114 C113 0.3(7) .
B2 C109 C114 C113 -179.2(4) .
C112 C113 C115 F44 -64.3(9) .
C114 C113 C115 F44 115.3(8) .
C112 C113 C115 F45 176.3(8) .
C114 C113 C115 F45 -4.2(10) .
C112 C113 C115 F43 57.5(9) .
C114 C113 C115 F43 -123.0(8) .
C112 C111 C116 F48A 158.7(9) .
C110 C111 C116 F48A -20.7(13) .
C112 C111 C116 F47 -119.8(9) .
C110 C111 C116 F47 60.8(10) .
C112 C111 C116 F46 0.3(12) .
C110 C111 C116 F46 -179.2(9) .
C112 C111 C116 F46A 33.3(11) .
C110 C111 C116 F46A -146.1(7) .
C112 C111 C116 F47A -85.1(9) .
C110 C111 C116 F47A 95.5(9) .
C112 C111 C116 F48 127.4(7) .
C110 C111 C116 F48 -52.1(9) .
C122 C117 C118 C119 -1.4(7) .
B2 C117 C118 C119 168.1(4) .
C117 C118 C119 C120 1.1(7) .
C117 C118 C119 C123 -177.8(4) .
C118 C119 C120 C121 0.1(7) .
C123 C119 C120 C121 179.0(5) .
C119 C120 C121 C122 -1.1(8) .
C119 C120 C121 C124 -178.4(6) .
C120 C121 C122 C117 0.8(9) .
C124 C121 C122 C117 178.2(6) .
C118 C117 C122 C121 0.4(7) .
B2 C117 C122 C121 -168.9(5) .
C120 C119 C123 F27 126.8(7) .
C118 C119 C123 F27 -54.3(8) .
C120 C119 C123 F26 -114.3(7) .
C118 C119 C123 F26 64.6(7) .
C120 C119 C123 F25 4.7(8) .
C118 C119 C123 F25 -176.4(5) .
C122 C121 C124 F30 -87.2(10) .
C120 C121 C124 F30 90.2(10) .
C122 C121 C124 F28 36.9(10) .
C120 C121 C124 F28 -145.7(7) .
C122 C121 C124 F29 149.3(7) .
C120 C121 C124 F29 -33.3(10) .
C98 C93 B2 C101 -166.2(4) .
C94 C93 B2 C101 19.2(6) .
C98 C93 B2 C117 -48.6(5) .
C94 C93 B2 C117 136.8(4) .
C98 C93 B2 C109 72.7(5) .
C94 C93 B2 C109 -102.0(5) .
C102 C101 B2 C93 -81.9(5) .
C106 C101 B2 C93 96.4(5) .
C102 C101 B2 C117 158.1(4) .
C106 C101 B2 C117 -23.6(5) .
C102 C101 B2 C109 38.2(6) .
C106 C101 B2 C109 -143.5(4) .
C122 C117 B2 C93 -27.3(6) .
C118 C117 B2 C93 163.9(4) .
C122 C117 B2 C101 92.4(5) .
C118 C117 B2 C101 -76.4(5) .
C122 C117 B2 C109 -147.6(4) .
C118 C117 B2 C109 43.6(5) .
C110 C109 B2 C93 152.5(4) .
C114 C109 B2 C93 -28.0(6) .
C110 C109 B2 C101 31.5(6) .
C114 C109 B2 C101 -149.0(4) .
C110 C109 B2 C117 -86.1(5) .
C114 C109 B2 C117 93.4(5) .
C67 C68 P2 C71 149.7(4) .
C67 C68 P2 C77 -99.9(4) .
C67 C68 P2 Ru2 21.6(3) .
C72 C71 P2 C68 -142.0(6) .
C76 C71 P2 C68 37.5(6) .
C72 C71 P2 C77 106.1(6) .
C76 C71 P2 C77 -74.4(6) .
C72 C71 P2 Ru2 -34.1(6) .
C76 C71 P2 Ru2 145.4(5) .
C78 C77 P2 C68 -150.5(5) .
C82 C77 P2 C68 31.6(5) .
C78 C77 P2 C71 -34.5(6) .
C82 C77 P2 C71 147.7(5) .
C78 C77 P2 Ru2 107.9(5) .
C82 C77 P2 Ru2 -69.9(5) .
C83 C84 Ru2 C85 116.5(6) .
C89 C84 Ru2 C85 -121.7(9) .
C85 C84 Ru2 C83 -116.5(6) .
C89 C84 Ru2 C83 121.9(10) .
C83 C84 Ru2 C86 79.0(5) .
C85 C84 Ru2 C86 -37.4(4) .
C89 C84 Ru2 C86 -159.1(9) .
C83 C84 Ru2 C64 -19.3(6) .
C85 C84 Ru2 C64 -135.8(4) .
C89 C84 Ru2 C64 102.6(8) .
C83 C84 Ru2 C87 38.3(5) .
C85 C84 Ru2 C87 -78.2(5) .
C89 C84 Ru2 C87 160.1(9) .
C83 C84 Ru2 C63 -59.1(6) .
C85 C84 Ru2 C63 -175.5(4) .
C89 C84 Ru2 C63 62.8(9) .
C83 C84 Ru2 C66 98.0(7) .
C85 C84 Ru2 C66 -18.5(8) .
C89 C84 Ru2 C66 -140.2(8) .
C83 C84 Ru2 C67 156.9(5) .
C85 C84 Ru2 C67 40.4(5) .
C89 C84 Ru2 C67 -81.2(9) .
C83 C84 Ru2 P2 -143.3(5) .
C85 C84 Ru2 P2 100.2(4) .
C89 C84 Ru2 P2 -21.4(8) .
C86 C85 Ru2 C84 -116.3(6) .
C90 C85 Ru2 C84 120.1(10) .
C86 C85 Ru2 C83 -78.3(5) .
C84 C85 Ru2 C83 38.0(4) .
C90 C85 Ru2 C83 158.1(9) .
C84 C85 Ru2 C86 116.3(6) .
C90 C85 Ru2 C86 -123.6(10) .
C86 C85 Ru2 C64 -23.6(7) .
C84 C85 Ru2 C64 92.7(6) .
C90 C85 Ru2 C64 -147.2(8) .
C86 C85 Ru2 C87 -35.9(4) .
C84 C85 Ru2 C87 80.4(5) .
C90 C85 Ru2 C87 -159.5(9) .
C86 C85 Ru2 C63 -106.8(7) .
C84 C85 Ru2 C63 9.5(8) .
C90 C85 Ru2 C63 129.6(9) .
C86 C85 Ru2 C66 55.2(5) .
C84 C85 Ru2 C66 171.5(4) .
C90 C85 Ru2 C66 -68.4(9) .
C86 C85 Ru2 C67 90.3(4) .
C84 C85 Ru2 C67 -153.4(4) .
C90 C85 Ru2 C67 -33.3(8) .
C86 C85 Ru2 P2 157.1(4) .
C84 C85 Ru2 P2 -86.6(4) .
C90 C85 Ru2 P2 33.5(8) .
C87 C83 Ru2 C84 115.5(7) .
C88 C83 Ru2 C84 -119.2(13) .
C87 C83 Ru2 C85 77.3(5) .
C84 C83 Ru2 C85 -38.2(4) .
C88 C83 Ru2 C85 -157.3(12) .
C87 C83 Ru2 C86 35.6(5) .
C84 C83 Ru2 C86 -79.9(5) .
C88 C83 Ru2 C86 160.9(12) .
C87 C83 Ru2 C64 -78.4(5) .
C84 C83 Ru2 C64 166.2(5) .
C88 C83 Ru2 C64 47.0(11) .
C84 C83 Ru2 C87 -115.5(7) .
C88 C83 Ru2 C87 125.3(13) .
C87 C83 Ru2 C63 -114.1(5) .
C84 C83 Ru2 C63 130.4(5) .
C88 C83 Ru2 C63 11.2(11) .
C87 C83 Ru2 C66 -26.3(7) .
C84 C83 Ru2 C66 -141.7(4) .
C88 C83 Ru2 C66 99.1(11) .
C87 C83 Ru2 C67 30.5(13) .
C84 C83 Ru2 C67 -84.9(12) .
C88 C83 Ru2 C67 155.9(10) .
C87 C83 Ru2 P2 162.7(4) .
C84 C83 Ru2 P2 47.2(5) .
C88 C83 Ru2 P2 -72.0(11) .
C87 C86 Ru2 C84 -80.0(5) .
C85 C86 Ru2 C84 38.6(4) .
C91 C86 Ru2 C84 158.9(9) .
C87 C86 Ru2 C85 -118.6(6) .
C91 C86 Ru2 C85 120.3(10) .
C87 C86 Ru2 C83 -37.0(5) .
C85 C86 Ru2 C83 81.6(5) .
C91 C86 Ru2 C83 -158.1(9) .
C87 C86 Ru2 C64 48.7(6) .
C85 C86 Ru2 C64 167.3(4) .
C91 C86 Ru2 C64 -72.4(9) .
C85 C86 Ru2 C87 118.6(6) .
C91 C86 Ru2 C87 -121.1(10) .
C87 C86 Ru2 C63 19.9(7) .
C85 C86 Ru2 C63 138.5(5) .
C91 C86 Ru2 C63 -101.2(9) .
C87 C86 Ru2 C66 107.6(5) .
C85 C86 Ru2 C66 -133.8(4) .
C91 C86 Ru2 C66 -13.5(8) .
C87 C86 Ru2 C67 141.6(5) .
C85 C86 Ru2 C67 -99.8(4) .
C91 C86 Ru2 C67 20.5(9) .
C87 C86 Ru2 P2 -151.2(4) .
C85 C86 Ru2 P2 -32.6(5) .
C91 C86 Ru2 P2 87.7(8) .
C63 C64 Ru2 C84 -76.1(6) .
C65 C64 Ru2 C84 162.3(4) .
C63 C64 Ru2 C85 -135.0(6) .
C65 C64 Ru2 C85 103.4(6) .
C63 C64 Ru2 C83 -87.9(5) .
C65 C64 Ru2 C83 150.5(5) .
C63 C64 Ru2 C86 -150.3(5) .
C65 C64 Ru2 C86 88.1(5) .
C63 C64 Ru2 C87 -124.3(5) .
C65 C64 Ru2 C87 114.2(5) .
C65 C64 Ru2 C63 -121.6(7) .
C63 C64 Ru2 C66 128.8(5) .
C65 C64 Ru2 C66 7.2(4) .
C63 C64 Ru2 C67 106.4(5) .
C65 C64 Ru2 C67 -15.2(5) .
C63 C64 Ru2 P2 44.3(5) .
C65 C64 Ru2 P2 -77.3(5) .
C86 C87 Ru2 C84 80.2(5) .
C83 C87 Ru2 C84 -38.7(5) .
C92 C87 Ru2 C84 -157.9(11) .
C86 C87 Ru2 C85 36.9(4) .
C83 C87 Ru2 C85 -82.1(5) .
C92 C87 Ru2 C85 158.8(11) .
C86 C87 Ru2 C83 118.9(7) .
C92 C87 Ru2 C83 -119.2(12) .
C83 C87 Ru2 C86 -118.9(7) .
C92 C87 Ru2 C86 121.9(12) .
C86 C87 Ru2 C64 -137.0(5) .
C83 C87 Ru2 C64 104.1(5) .
C92 C87 Ru2 C64 -15.1(10) .
C86 C87 Ru2 C63 -167.6(5) .
C83 C87 Ru2 C63 73.5(5) .
C92 C87 Ru2 C63 -45.7(10) .
C86 C87 Ru2 C66 -78.5(5) .
C83 C87 Ru2 C66 162.6(5) .
C92 C87 Ru2 C66 43.4(10) .
C86 C87 Ru2 C67 -51.2(6) .
C83 C87 Ru2 C67 -170.2(4) .
C92 C87 Ru2 C67 70.7(11) .
C86 C87 Ru2 P2 75.7(9) .
C83 C87 Ru2 P2 -43.2(10) .
C92 C87 Ru2 P2 -162.4(7) .
C64 C63 Ru2 C84 128.2(5) .
C64 C63 Ru2 C85 121.6(6) .
C64 C63 Ru2 C83 96.4(5) .
C64 C63 Ru2 C86 48.6(7) .
C64 C63 Ru2 C87 60.7(5) .
C64 C63 Ru2 C66 -42.6(5) .
C64 C63 Ru2 C67 -74.9(5) .
C64 C63 Ru2 P2 -137.8(5) .
C67 C66 Ru2 C84 89.5(7) .
C65 C66 Ru2 C84 -139.7(6) .
C67 C66 Ru2 C85 76.6(4) .
C65 C66 Ru2 C85 -152.5(4) .
C67 C66 Ru2 C83 157.4(4) .
C65 C66 Ru2 C83 -71.8(6) .
C67 C66 Ru2 C86 106.2(4) .
C65 C66 Ru2 C86 -122.9(5) .
C67 C66 Ru2 C64 -137.9(4) .
C65 C66 Ru2 C64 -7.1(4) .
C67 C66 Ru2 C87 141.3(4) .
C65 C66 Ru2 C87 -87.8(5) .
C67 C66 Ru2 C63 -110.8(4) .
C65 C66 Ru2 C63 20.1(5) .
C65 C66 Ru2 C67 130.9(6) .
C67 C66 Ru2 P2 -29.8(3) .
C65 C66 Ru2 P2 101.0(4) .
C66 C67 Ru2 C84 -141.8(4) .
C68 C67 Ru2 C84 90.4(5) .
C66 C67 Ru2 C85 -117.3(4) .
C68 C67 Ru2 C85 115.0(4) .
C66 C67 Ru2 C83 -74.8(11) .
C68 C67 Ru2 C83 157.5(10) .
C66 C67 Ru2 C86 -79.4(4) .
C68 C67 Ru2 C86 152.9(4) .
C66 C67 Ru2 C64 35.4(4) .
C68 C67 Ru2 C64 -92.3(4) .
C66 C67 Ru2 C87 -51.4(5) .
C68 C67 Ru2 C87 -179.1(4) .
C66 C67 Ru2 C63 69.7(4) .
C68 C67 Ru2 C63 -58.0(4) .
C68 C67 Ru2 C66 -127.7(5) .
C66 C67 Ru2 P2 146.7(4) .
C68 C67 Ru2 P2 18.9(3) .
C68 P2 Ru2 C84 -156.2(3) .
C71 P2 Ru2 C84 86.7(3) .
C77 P2 Ru2 C84 -47.4(3) .
C68 P2 Ru2 C85 -118.0(3) .
C71 P2 Ru2 C85 124.8(3) .
C77 P2 Ru2 C85 -9.2(3) .
C68 P2 Ru2 C83 176.9(3) .
C71 P2 Ru2 C83 59.7(4) .
C77 P2 Ru2 C83 -74.3(4) .
C68 P2 Ru2 C86 -98.7(3) .
C71 P2 Ru2 C86 144.1(4) .
C77 P2 Ru2 C86 10.1(3) .
C68 P2 Ru2 C64 62.4(3) .
C71 P2 Ru2 C64 -54.8(3) .
C77 P2 Ru2 C64 171.2(3) .
C68 P2 Ru2 C87 -152.2(7) .
C71 P2 Ru2 C87 90.6(7) .
C77 P2 Ru2 C87 -43.4(7) .
C68 P2 Ru2 C63 86.7(3) .
C71 P2 Ru2 C63 -30.5(3) .
C77 P2 Ru2 C63 -164.5(3) .
C68 P2 Ru2 C66 2.7(2) .
C71 P2 Ru2 C66 -114.4(3) .
C77 P2 Ru2 C66 111.5(3) .
C68 P2 Ru2 C67 -15.5(2) .
C71 P2 Ru2 C67 -132.6(3) .
C77 P2 Ru2 C67 93.3(3) .
C125 C125 C126 C127 -179.3(16) 2_656
