#------------------------------------------------------------------------------
#$Date: 2016-03-26 13:01:32 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180219 $
#$URL: svn://www.crystallography.net/cod/cif/7/11/05/7110506.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the Crystal Eye server at
# http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
# Peter Murray-Rust laboratory.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_7110506
loop_
_publ_author_name
'Hussein, Khansaa'
'Marsden, Colin J.'
'Barthelat, Jean-Claude'
'Rodriguez, Venancio'
'Conejero, Salvador'
'Sabo-Etienne, Sylviane'
'Donnadieu, Bruno'
'Chaudret, Bruno'
_publ_section_title
;
 X-Ray structure and theoretical studies of
 RuH2(η2-H2)(η2-H-SiPh3)(PCy3)2, a complex with two different
 η2-coordinated σ bonds
;
_journal_issue                   14
_journal_name_full               'Chemical Communications'
_journal_page_first              1315
_journal_paper_doi               10.1039/a901558b
_journal_year                    1999
_chemical_formula_sum            'C58 H91 O P2 Ru Si'
_chemical_formula_weight         995.59
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                94.763(14)
_cell_angle_beta                 103.677(14)
_cell_angle_gamma                98.202(15)
_cell_formula_units_Z            4
_cell_length_a                   12.7694(16)
_cell_length_b                   20.991(3)
_cell_length_c                   21.691(2)
_cell_measurement_reflns_used    5000
_cell_measurement_temperature    160(2)
_cell_volume                     5550.1(13)
_computing_cell_refinement
;
Stoe and Cie (1996) IPDS Manual. Version 2.75. Stoe and Cie, 
Darmstadt, Germany
;
_computing_data_collection
;
Stoe and Cie (1996) IPDS Manual. Version 2.75. Stoe and Cie, 
Darmstadt, Germany
;
_computing_data_reduction
;
Stoe and Cie (1996) IPDS Manual. Version 2.75. Stoe and Cie, 
Darmstadt, Germany
;
_computing_molecular_graphics
;
Zsolnai,L.(1997). ZORTEP.Molecular Graphics Program.
University of Heidelberg, Germany
;
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution
;
Altomare, A., Cascarano, G., Giacovazzo G., Guagliardi A., 
Burla M.C., Polidori, G.
  & Camalli, M. (1994) SIR92 - a program for automatic solution 
  of crystal structures
 by direct methods. J. Appl. Cryst. (27), 435'
;
_diffrn_ambient_temperature      160(2)
_diffrn_measured_fraction_theta_full 0.951
_diffrn_measured_fraction_theta_max 0.951
_diffrn_measurement_device_type
;
Stoe and Cie (1996) IPDS Manual. Version 2.75. Stoe and Cie, 
Darmstadt, Germany
;
_diffrn_measurement_method       ' rotation'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0000
_diffrn_reflns_av_sigmaI/netI    0.1758
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            14181
_diffrn_reflns_theta_full        22.72
_diffrn_reflns_theta_max         22.72
_diffrn_reflns_theta_min         1.79
_diffrn_standards_number         200
_exptl_absorpt_coefficient_mu    0.342
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            'yellow pale'
_exptl_crystal_density_diffrn    1.192
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       platelet
_exptl_crystal_F_000             2140
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.08
_refine_diff_density_max         0.775
_refine_diff_density_min         -0.317
_refine_diff_density_rms         0.064
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.671
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1198
_refine_ls_number_reflns         14181
_refine_ls_number_restraints     447
_refine_ls_restrained_S_all      0.668
_refine_ls_R_factor_all          0.0997
_refine_ls_R_factor_gt           0.0381
_refine_ls_shift/su_max          0.421
_refine_ls_shift/su_mean         0.009
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0095P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0626
_refine_ls_wR_factor_ref         0.0725
_reflns_number_gt                6804
_reflns_number_total             14181
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            901558bsup1.cif
_cod_data_source_block           1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'none' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 

The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.0095P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3' was
changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to
'w=1/[\s^2^(Fo^2^)+(0.0095P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        5550.0(12)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7110506
#BEGIN Tags that were not found in dictionaries:
_cell_measurement_2theta_min     3.6
_cell_measurement_2theta_max     48.3
#END Tags that were not found in dictionaries
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_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ru1 Ru 0.85106(4) 0.23854(2) 0.51405(2) 0.01889(14) Uani 1 d DU . .
P1 P 0.95246(11) 0.19981(6) 0.44249(7) 0.0185(3) Uani 1 d U . .
P2 P 0.95676(11) 0.24633(7) 0.62214(7) 0.0227(4) Uani 1 d U . .
Si1 Si 0.65630(13) 0.21657(7) 0.48099(8) 0.0211(4) Uani 1 d DU . .
C11 C 0.5860(4) 0.1718(2) 0.3976(3) 0.0218(13) Uani 1 d U . .
C12 C 0.6074(4) 0.1952(3) 0.3426(3) 0.0246(13) Uani 1 d U . .
H12 H 0.6598 0.2335 0.3476 0.029 Uiso 1 calc R . .
C13 C 0.5564(5) 0.1656(3) 0.2811(3) 0.0315(15) Uani 1 d U . .
H13 H 0.5745 0.1831 0.2453 0.038 Uiso 1 calc R . .
C14 C 0.4802(5) 0.1111(3) 0.2728(3) 0.0340(16) Uani 1 d U . .
H14 H 0.4467 0.0900 0.2309 0.041 Uiso 1 calc R . .
C15 C 0.4510(5) 0.0862(3) 0.3239(3) 0.0342(15) Uani 1 d U . .
H15 H 0.3959 0.0491 0.3174 0.041 Uiso 1 calc R . .
C16 C 0.5034(4) 0.1162(3) 0.3862(3) 0.0274(14) Uani 1 d U . .
H16 H 0.4829 0.0988 0.4215 0.033 Uiso 1 calc R . .
C21 C 0.5909(5) 0.2915(3) 0.4813(3) 0.0236(14) Uani 1 d U . .
C22 C 0.4878(5) 0.2927(3) 0.4426(3) 0.0401(19) Uani 1 d U . .
H22 H 0.4523 0.2551 0.4137 0.048 Uiso 1 calc R . .
C23 C 0.4332(5) 0.3456(3) 0.4436(4) 0.051(2) Uani 1 d U . .
H23 H 0.3628 0.3437 0.4157 0.061 Uiso 1 calc R . .
C24 C 0.4804(6) 0.3991(4) 0.4840(4) 0.067(3) Uani 1 d U . .
H24 H 0.4434 0.4351 0.4853 0.081 Uiso 1 calc R . .
C25 C 0.5819(7) 0.4017(4) 0.5234(5) 0.121(5) Uani 1 d U . .
H25 H 0.6159 0.4399 0.5518 0.146 Uiso 1 calc R . .
C26 C 0.6356(6) 0.3487(4) 0.5222(4) 0.081(3) Uani 1 d U . .
H26 H 0.7059 0.3516 0.5505 0.097 Uiso 1 calc R . .
C31 C 0.5961(4) 0.1651(3) 0.5361(3) 0.0231(12) Uani 1 d U . .
C32 C 0.5466(5) 0.1909(3) 0.5801(3) 0.0342(15) Uani 1 d U . .
H32 H 0.5368 0.2349 0.5806 0.041 Uiso 1 calc R . .
C33 C 0.5101(5) 0.1536(4) 0.6242(3) 0.0489(18) Uani 1 d U . .
H33 H 0.4780 0.1730 0.6547 0.059 Uiso 1 calc R . .
C34 C 0.5206(5) 0.0894(4) 0.6235(3) 0.0472(18) Uani 1 d U . .
H34 H 0.4962 0.0642 0.6534 0.057 Uiso 1 calc R . .
C35 C 0.5669(5) 0.0624(3) 0.5792(3) 0.0406(16) Uani 1 d U . .
H35 H 0.5733 0.0179 0.5778 0.049 Uiso 1 calc R . .
C36 C 0.6043(4) 0.0992(3) 0.5365(3) 0.0329(15) Uani 1 d U . .
H36 H 0.6366 0.0792 0.5065 0.039 Uiso 1 calc R . .
C111 C 1.0853(4) 0.1725(2) 0.4725(3) 0.0219(13) Uani 1 d U . .
H111 H 1.1253 0.2051 0.5098 0.026 Uiso 1 calc R . .
C112 C 1.0720(4) 0.1080(3) 0.5005(3) 0.0267(14) Uani 1 d U . .
H11A H 1.0238 0.1101 0.5300 0.032 Uiso 1 calc R . .
H11B H 1.0365 0.0726 0.4655 0.032 Uiso 1 calc R . .
C113 C 1.1814(5) 0.0925(3) 0.5365(3) 0.0373(16) Uani 1 d U . .
H11C H 1.2156 0.1266 0.5729 0.045 Uiso 1 calc R . .
H11D H 1.1696 0.0506 0.5536 0.045 Uiso 1 calc R . .
C114 C 1.2565(5) 0.0890(3) 0.4923(3) 0.0473(18) Uani 1 d U . .
H11E H 1.2246 0.0530 0.4575 0.057 Uiso 1 calc R . .
H11F H 1.3281 0.0803 0.5164 0.057 Uiso 1 calc R . .
C115 C 1.2727(5) 0.1526(3) 0.4640(3) 0.0441(17) Uani 1 d U . .
H11G H 1.3112 0.1878 0.4986 0.053 Uiso 1 calc R . .
H11H H 1.3189 0.1489 0.4336 0.053 Uiso 1 calc R . .
C116 C 1.1647(5) 0.1697(3) 0.4299(3) 0.0368(16) Uani 1 d U . .
H11I H 1.1306 0.1371 0.3922 0.044 Uiso 1 calc R . .
H11J H 1.1782 0.2124 0.4143 0.044 Uiso 1 calc R . .
C121 C 0.9917(4) 0.2598(2) 0.3899(3) 0.0197(12) Uani 1 d U . .
H121 H 1.0281 0.2369 0.3607 0.024 Uiso 1 calc R . .
C122 C 1.0764(4) 0.3186(2) 0.4270(3) 0.0253(14) Uani 1 d U . .
H12A H 1.0430 0.3439 0.4554 0.030 Uiso 1 calc R . .
H12B H 1.1395 0.3032 0.4540 0.030 Uiso 1 calc R . .
C123 C 1.1161(5) 0.3621(3) 0.3814(3) 0.0290(15) Uani 1 d U . .
H12C H 1.1681 0.4003 0.4064 0.035 Uiso 1 calc R . .
H12D H 1.1552 0.3380 0.3555 0.035 Uiso 1 calc R . .
C124 C 0.8797(8) 0.4278(3) 0.6831(4) 0.086(3) Uani 1 d U . .
H12E H 0.8888 0.4707 0.6675 0.104 Uiso 1 calc R . .
H12F H 0.8006 0.4100 0.6722 0.104 Uiso 1 calc R . .
C125 C 0.9340(5) 0.3283(2) 0.3017(3) 0.0242(14) Uani 1 d U . .
H12G H 0.9641 0.3030 0.2714 0.029 Uiso 1 calc R . .
H12H H 0.8707 0.3451 0.2765 0.029 Uiso 1 calc R . .
C126 C 0.8958(4) 0.2842(3) 0.3469(3) 0.0235(14) Uani 1 d U . .
H12I H 0.8427 0.2467 0.3217 0.028 Uiso 1 calc R . .
H12J H 0.8581 0.3082 0.3738 0.028 Uiso 1 calc R . .
C131 C 0.8637(4) 0.1336(2) 0.3823(2) 0.0178(12) Uani 1 d U . .
H131 H 0.8015 0.1540 0.3598 0.021 Uiso 1 calc R . .
C132 C 0.9109(5) 0.1069(3) 0.3289(3) 0.0315(15) Uani 1 d U . .
H13A H 0.9428 0.1433 0.3093 0.038 Uiso 1 calc R . .
H13B H 0.9702 0.0831 0.3472 0.038 Uiso 1 calc R . .
C133 C 0.8235(6) 0.0614(3) 0.2773(3) 0.0377(17) Uani 1 d U . .
H13C H 0.7677 0.0861 0.2561 0.045 Uiso 1 calc R . .
H13D H 0.8575 0.0436 0.2446 0.045 Uiso 1 calc R . .
C134 C 0.7689(5) 0.0061(3) 0.3053(3) 0.0351(16) Uani 1 d U . .
H13E H 0.8228 -0.0218 0.3220 0.042 Uiso 1 calc R . .
H13F H 0.7092 -0.0207 0.2715 0.042 Uiso 1 calc R . .
C135 C 0.7228(4) 0.0321(3) 0.3589(3) 0.0254(14) Uani 1 d U . .
H13G H 0.6634 0.0560 0.3411 0.031 Uiso 1 calc R . .
H13H H 0.6913 -0.0046 0.3783 0.031 Uiso 1 calc R . .
C136 C 0.8099(4) 0.0769(2) 0.4101(3) 0.0240(13) Uani 1 d U . .
H13I H 0.8664 0.0521 0.4304 0.029 Uiso 1 calc R . .
H13J H 0.7765 0.0938 0.4435 0.029 Uiso 1 calc R . .
C211 C 1.1088(5) 0.2561(3) 0.6361(3) 0.0350(15) Uani 1 d U . .
H211 H 1.1207 0.2188 0.6082 0.042 Uiso 1 calc R . .
C212 C 1.1584(5) 0.3160(4) 0.6109(3) 0.055(2) Uani 1 d U . .
H21A H 1.1138 0.3191 0.5676 0.066 Uiso 1 calc R . .
H21B H 1.1570 0.3553 0.6391 0.066 Uiso 1 calc R . .
C213 C 1.2759(6) 0.3130(5) 0.6082(4) 0.073(3) Uani 1 d U . .
H21C H 1.2768 0.2752 0.5779 0.088 Uiso 1 calc R . .
H21D H 1.3061 0.3527 0.5923 0.088 Uiso 1 calc R . .
C214 C 1.3467(5) 0.3071(4) 0.6737(3) 0.058(2) Uani 1 d U . .
H21E H 1.4212 0.3024 0.6703 0.070 Uiso 1 calc R . .
H21F H 1.3524 0.3470 0.7029 0.070 Uiso 1 calc R . .
C215 C 1.2980(5) 0.2489(4) 0.7009(4) 0.055(2) Uani 1 d U . .
H21G H 1.3424 0.2478 0.7448 0.066 Uiso 1 calc R . .
H21H H 1.3014 0.2088 0.6745 0.066 Uiso 1 calc R . .
C216 C 1.1790(4) 0.2502(3) 0.7027(3) 0.0378(16) Uani 1 d U . .
H21I H 1.1760 0.2874 0.7331 0.045 Uiso 1 calc R . .
H21J H 1.1494 0.2099 0.7179 0.045 Uiso 1 calc R . .
C221 C 0.9290(5) 0.1777(3) 0.6682(3) 0.0346(14) Uani 1 d U . .
H221 H 0.9801 0.1903 0.7116 0.042 Uiso 1 calc R . .
C222 C 0.9594(6) 0.1153(3) 0.6423(3) 0.0459(18) Uani 1 d U . .
H22A H 0.9115 0.1001 0.5991 0.055 Uiso 1 calc R . .
H22B H 1.0359 0.1239 0.6387 0.055 Uiso 1 calc R . .
C223 C 0.9481(6) 0.0628(3) 0.6852(4) 0.063(2) Uani 1 d U . .
H22C H 0.9623 0.0220 0.6650 0.076 Uiso 1 calc R . .
H22D H 1.0034 0.0754 0.7265 0.076 Uiso 1 calc R . .
C224 C 0.8391(6) 0.0520(3) 0.6968(4) 0.064(2) Uani 1 d U . .
H22E H 0.8360 0.0189 0.7266 0.077 Uiso 1 calc R . .
H22F H 0.7844 0.0352 0.6560 0.077 Uiso 1 calc R . .
C225 C 0.8109(7) 0.1132(3) 0.7246(4) 0.059(2) Uani 1 d U . .
H22G H 0.8619 0.1283 0.7670 0.071 Uiso 1 calc R . .
H22H H 0.7359 0.1044 0.7306 0.071 Uiso 1 calc R . .
C226 C 0.8180(5) 0.1683(3) 0.6795(4) 0.0518(19) Uani 1 d U . .
H22I H 0.7622 0.1555 0.6384 0.062 Uiso 1 calc R . .
H22J H 0.8043 0.2092 0.6999 0.062 Uiso 1 calc R . .
C231 C 0.9235(5) 0.3127(2) 0.6728(2) 0.0245(13) Uani 1 d U . .
H231 H 0.8430 0.3016 0.6681 0.029 Uiso 1 calc R . .
C232 C 0.9733(6) 0.3241(4) 0.7438(3) 0.064(2) Uani 1 d U . .
H23A H 1.0515 0.3434 0.7523 0.077 Uiso 1 calc R . .
H23B H 0.9685 0.2822 0.7616 0.077 Uiso 1 calc R . .
C233 C 0.9126(7) 0.3704(4) 0.7770(3) 0.076(3) Uani 1 d U . .
H23C H 0.8345 0.3511 0.7688 0.091 Uiso 1 calc R . .
H23D H 0.9447 0.3764 0.8238 0.091 Uiso 1 calc R . .
C234 C 0.9229(7) 0.4349(3) 0.7515(4) 0.067(2) Uani 1 d U . .
H23E H 0.8828 0.4639 0.7720 0.081 Uiso 1 calc R . .
H23F H 1.0008 0.4553 0.7624 0.081 Uiso 1 calc R . .
C235 C 1.0206(5) 0.3847(3) 0.3376(3) 0.0306(15) Uani 1 d U . .
H23G H 0.9874 0.4133 0.3634 0.037 Uiso 1 calc R . .
H23H H 1.0477 0.4103 0.3066 0.037 Uiso 1 calc R . .
C236 C 0.9405(6) 0.3814(3) 0.6499(4) 0.054(2) Uani 1 d U . .
H23I H 1.0195 0.3993 0.6606 0.065 Uiso 1 calc R . .
H23J H 0.9119 0.3777 0.6030 0.065 Uiso 1 calc R . .
H1 H 0.926(3) 0.3100(14) 0.514(2) 0.025(10) Uiso 1 d D . .
H2 H 0.862(4) 0.3155(13) 0.503(2) 0.032(16) Uiso 1 d D . .
H3 H 0.816(3) 0.1685(19) 0.518(3) 0.062(11) Uiso 1 d D . .
H4 H 0.770(3) 0.2630(19) 0.5439(18) 0.020(8) Uiso 1 d D . .
H5 H 0.767(3) 0.2328(19) 0.4491(19) 0.010(8) Uiso 1 d D . .
Ru2 Ru 0.35070(4) 0.28557(2) 0.08310(2) 0.01976(13) Uani 1 d DU . .
P3 P 0.25086(12) 0.32957(7) 0.15267(7) 0.0199(4) Uani 1 d U . .
P4 P 0.23235(11) 0.25643(6) -0.02332(7) 0.0204(4) Uani 1 d U . .
Si2 Si 0.54576(13) 0.31012(7) 0.10982(8) 0.0206(4) Uani 1 d DU . .
C41 C 0.6025(4) 0.3529(2) 0.0477(3) 0.0209(12) Uani 1 d U . .
C42 C 0.6584(5) 0.3231(3) 0.0088(3) 0.0278(14) Uani 1 d U . .
H42 H 0.6725 0.2806 0.0149 0.033 Uiso 1 calc R . .
C43 C 0.6936(5) 0.3534(3) -0.0379(3) 0.0394(16) Uani 1 d U . .
H43 H 0.7304 0.3312 -0.0640 0.047 Uiso 1 calc R . .
C44 C 0.6765(5) 0.4155(3) -0.0476(3) 0.0401(16) Uani 1 d U . .
H44 H 0.7024 0.4364 -0.0797 0.048 Uiso 1 calc R . .
C45 C 0.6217(5) 0.4470(3) -0.0106(3) 0.0336(15) Uani 1 d U . .
H45 H 0.6091 0.4898 -0.0169 0.040 Uiso 1 calc R . .
C46 C 0.5847(4) 0.4158(3) 0.0362(3) 0.0275(14) Uani 1 d U . .
H46 H 0.5460 0.4379 0.0612 0.033 Uiso 1 calc R . .
C51 C 0.6159(5) 0.2362(3) 0.1167(3) 0.0258(14) Uani 1 d U . .
C52 C 0.5717(5) 0.1755(3) 0.0824(3) 0.046(2) Uani 1 d U . .
H52 H 0.4982 0.1684 0.0574 0.055 Uiso 1 calc R . .
C53 C 0.6305(5) 0.1252(3) 0.0835(4) 0.057(2) Uani 1 d U . .
H53 H 0.5973 0.0846 0.0592 0.068 Uiso 1 calc R . .
C54 C 0.7352(5) 0.1332(3) 0.1189(3) 0.0426(18) Uani 1 d U . .
H54 H 0.7755 0.0985 0.1191 0.051 Uiso 1 calc R . .
C55 C 0.7820(5) 0.1910(3) 0.1541(3) 0.0381(17) Uani 1 d U . .
H55 H 0.8551 0.1967 0.1795 0.046 Uiso 1 calc R . .
C56 C 0.7237(5) 0.2421(3) 0.1533(3) 0.0323(16) Uani 1 d U . .
H56 H 0.7579 0.2822 0.1783 0.039 Uiso 1 calc R . .
C61 C 0.6197(4) 0.3630(3) 0.1882(3) 0.0218(13) Uani 1 d U . .
C62 C 0.6964(4) 0.4191(2) 0.1924(3) 0.0273(14) Uani 1 d U . .
H62 H 0.7107 0.4333 0.1543 0.033 Uiso 1 calc R . .
C63 C 0.7525(5) 0.4547(3) 0.2516(3) 0.0361(16) Uani 1 d U . .
H63 H 0.8029 0.4930 0.2527 0.043 Uiso 1 calc R . .
C64 C 0.7361(5) 0.4356(3) 0.3065(3) 0.0381(17) Uani 1 d U . .
H64 H 0.7756 0.4599 0.3461 0.046 Uiso 1 calc R . .
C65 C 0.6609(5) 0.3800(3) 0.3052(3) 0.0376(16) Uani 1 d U . .
H65 H 0.6477 0.3663 0.3437 0.045 Uiso 1 calc R . .
C66 C 0.6057(4) 0.3451(3) 0.2466(3) 0.0271(14) Uani 1 d U . .
H66 H 0.5556 0.3069 0.2462 0.033 Uiso 1 calc R . .
C311 C 0.2113(4) 0.2728(2) 0.2077(3) 0.0191(12) Uani 1 d U . .
H311 H 0.1778 0.2976 0.2371 0.023 Uiso 1 calc R . .
C312 C 0.1251(4) 0.2147(2) 0.1741(3) 0.0243(13) Uani 1 d U . .
H31A H 0.1543 0.1896 0.1431 0.029 Uiso 1 calc R . .
H31B H 0.0598 0.2303 0.1498 0.029 Uiso 1 calc R . .
C313 C 0.0914(5) 0.1699(3) 0.2209(3) 0.0309(15) Uani 1 d U . .
H31C H 0.0553 0.1934 0.2492 0.037 Uiso 1 calc R . .
H31D H 0.0382 0.1319 0.1968 0.037 Uiso 1 calc R . .
C314 C 0.1896(5) 0.1471(3) 0.2611(3) 0.0331(15) Uani 1 d U . .
H31E H 0.2221 0.1203 0.2333 0.040 Uiso 1 calc R . .
H31F H 0.1666 0.1200 0.2923 0.040 Uiso 1 calc R . .
C315 C 0.2749(5) 0.2055(3) 0.2965(3) 0.0309(15) Uani 1 d U . .
H31G H 0.2440 0.2304 0.3267 0.037 Uiso 1 calc R . .
H31H H 0.3398 0.1901 0.3216 0.037 Uiso 1 calc R . .
C316 C 0.3092(4) 0.2496(3) 0.2497(3) 0.0264(14) Uani 1 d U . .
H31I H 0.3461 0.2258 0.2222 0.032 Uiso 1 calc R . .
H31J H 0.3621 0.2877 0.2740 0.032 Uiso 1 calc R . .
C321 C 0.3396(4) 0.3984(2) 0.2114(3) 0.0211(13) Uani 1 d U . .
H321 H 0.4094 0.3822 0.2283 0.025 Uiso 1 calc R . .
C322 C 0.3006(5) 0.4183(3) 0.2715(3) 0.0386(16) Uani 1 d U . .
H32A H 0.2351 0.4391 0.2591 0.046 Uiso 1 calc R . .
H32B H 0.2805 0.3792 0.2916 0.046 Uiso 1 calc R . .
C323 C 0.3918(6) 0.4654(3) 0.3191(3) 0.0474(19) Uani 1 d U . .
H32C H 0.3656 0.4787 0.3569 0.057 Uiso 1 calc R . .
H32D H 0.4550 0.4433 0.3337 0.057 Uiso 1 calc R . .
C324 C 0.4282(5) 0.5254(3) 0.2898(3) 0.0384(17) Uani 1 d U . .
H32E H 0.3673 0.5502 0.2794 0.046 Uiso 1 calc R . .
H32F H 0.4901 0.5535 0.3211 0.046 Uiso 1 calc R . .
C325 C 0.4627(5) 0.5067(3) 0.2304(3) 0.0372(16) Uani 1 d U . .
H32G H 0.5291 0.4866 0.2418 0.045 Uiso 1 calc R . .
H32H H 0.4813 0.5462 0.2106 0.045 Uiso 1 calc R . .
C326 C 0.3730(5) 0.4591(3) 0.1816(3) 0.0357(15) Uani 1 d U . .
H32I H 0.3086 0.4803 0.1670 0.043 Uiso 1 calc R . .
H32J H 0.4002 0.4467 0.1439 0.043 Uiso 1 calc R . .
C331 C 0.1193(4) 0.3556(3) 0.1186(3) 0.0224(13) Uani 1 d U . .
H331 H 0.0740 0.3167 0.0899 0.027 Uiso 1 calc R . .
C332 C 0.1278(5) 0.4081(3) 0.0741(3) 0.0310(15) Uani 1 d U . .
H33A H 0.1673 0.4494 0.0998 0.037 Uiso 1 calc R . .
H33B H 0.1708 0.3955 0.0440 0.037 Uiso 1 calc R . .
C333 C 0.0171(5) 0.4184(3) 0.0365(3) 0.0389(17) Uani 1 d U . .
H33C H 0.0264 0.4531 0.0091 0.047 Uiso 1 calc R . .
H33D H -0.0210 0.3781 0.0085 0.047 Uiso 1 calc R . .
C334 C -0.0509(5) 0.4370(3) 0.0813(3) 0.0424(18) Uani 1 d U . .
H33E H -0.0157 0.4792 0.1068 0.051 Uiso 1 calc R . .
H33F H -0.1241 0.4420 0.0561 0.051 Uiso 1 calc R . .
C335 C -0.0628(6) 0.3863(4) 0.1254(4) 0.054(2) Uani 1 d U . .
H33G H -0.1048 0.3453 0.1002 0.065 Uiso 1 calc R . .
H33H H -0.1043 0.4006 0.1558 0.065 Uiso 1 calc R . .
C336 C 0.0486(5) 0.3744(3) 0.1628(3) 0.0441(17) Uani 1 d U . .
H33I H 0.0380 0.3393 0.1896 0.053 Uiso 1 calc R . .
H33J H 0.0872 0.4142 0.1916 0.053 Uiso 1 calc R . .
C411 C 0.0812(4) 0.2473(3) -0.0360(3) 0.0240(14) Uani 1 d U . .
H411 H 0.0686 0.2878 -0.0133 0.029 Uiso 1 calc R . .
C412 C 0.0357(5) 0.1927(3) -0.0029(3) 0.0390(16) Uani 1 d U . .
H41A H 0.0815 0.1960 0.0413 0.047 Uiso 1 calc R . .
H41B H 0.0400 0.1506 -0.0256 0.047 Uiso 1 calc R . .
C413 C -0.0823(5) 0.1942(4) -0.0009(4) 0.054(2) Uani 1 d U . .
H41C H -0.1091 0.1570 0.0197 0.065 Uiso 1 calc R . .
H41D H -0.0865 0.2346 0.0247 0.065 Uiso 1 calc R . .
C414 C -0.1533(5) 0.1909(3) -0.0679(3) 0.0451(17) Uani 1 d U . .
H41E H -0.2285 0.1954 -0.0659 0.054 Uiso 1 calc R . .
H41F H -0.1564 0.1480 -0.0917 0.054 Uiso 1 calc R . .
C415 C -0.1097(5) 0.2435(3) -0.1030(3) 0.0430(17) Uani 1 d U . .
H41G H -0.1149 0.2863 -0.0821 0.052 Uiso 1 calc R . .
H41H H -0.1555 0.2383 -0.1475 0.052 Uiso 1 calc R . .
C416 C 0.0079(5) 0.2420(3) -0.1043(3) 0.0352(16) Uani 1 d U . .
H41I H 0.0342 0.2784 -0.1260 0.042 Uiso 1 calc R . .
H41J H 0.0124 0.2010 -0.1289 0.042 Uiso 1 calc R . .
C421 C 0.2622(5) 0.1805(2) -0.0615(3) 0.0204(13) Uani 1 d U . .
H421 H 0.3420 0.1911 -0.0591 0.024 Uiso 1 calc R . .
C422 C 0.2109(5) 0.1596(3) -0.1326(3) 0.0389(17) Uani 1 d U . .
H42A H 0.1322 0.1423 -0.1391 0.047 Uiso 1 calc R . .
H42B H 0.2169 0.1978 -0.1562 0.047 Uiso 1 calc R . .
C423 C 0.2657(6) 0.1083(3) -0.1592(3) 0.053(2) Uani 1 d U . .
H42C H 0.2299 0.0957 -0.2052 0.064 Uiso 1 calc R . .
H42D H 0.3433 0.1264 -0.1552 0.064 Uiso 1 calc R . .
C424 C 0.2596(6) 0.0497(3) -0.1247(3) 0.0493(19) Uani 1 d U . .
H42E H 0.2998 0.0181 -0.1415 0.059 Uiso 1 calc R . .
H42F H 0.1823 0.0289 -0.1324 0.059 Uiso 1 calc R . .
C425 C 0.3082(7) 0.0678(3) -0.0537(3) 0.058(2) Uani 1 d U . .
H42G H 0.3875 0.0841 -0.0456 0.069 Uiso 1 calc R . .
H42H H 0.2990 0.0288 -0.0315 0.069 Uiso 1 calc R . .
C426 C 0.2535(6) 0.1194(3) -0.0270(3) 0.0466(18) Uani 1 d U . .
H42I H 0.2884 0.1313 0.0191 0.056 Uiso 1 calc R . .
H42J H 0.1755 0.1018 -0.0319 0.056 Uiso 1 calc R . .
C431 C 0.2566(4) 0.3121(2) -0.0827(3) 0.0209(12) Uani 1 d U . .
H431 H 0.2060 0.2923 -0.1246 0.025 Uiso 1 calc R . .
C432 C 0.2274(4) 0.3790(2) -0.0685(3) 0.0281(13) Uani 1 d U . .
H43A H 0.1509 0.3740 -0.0649 0.034 Uiso 1 calc R . .
H43B H 0.2755 0.4005 -0.0271 0.034 Uiso 1 calc R . .
C433 C 0.2404(4) 0.4209(3) -0.1207(3) 0.0324(14) Uani 1 d U . .
H43C H 0.1865 0.4017 -0.1611 0.039 Uiso 1 calc R . .
H43D H 0.2246 0.4645 -0.1091 0.039 Uiso 1 calc R . .
C434 C 0.3535(5) 0.4275(3) -0.1312(3) 0.0372(16) Uani 1 d U . .
H43E H 0.4069 0.4518 -0.0928 0.045 Uiso 1 calc R . .
H43F H 0.3569 0.4523 -0.1678 0.045 Uiso 1 calc R . .
C435 C 0.3832(4) 0.3613(3) -0.1444(3) 0.0298(14) Uani 1 d U . .
H43G H 0.4599 0.3665 -0.1478 0.036 Uiso 1 calc R . .
H43H H 0.3358 0.3395 -0.1859 0.036 Uiso 1 calc R . .
C436 C 0.3703(4) 0.3188(3) -0.0923(3) 0.0262(13) Uani 1 d U . .
H43I H 0.3864 0.2753 -0.1040 0.031 Uiso 1 calc R . .
H43J H 0.4236 0.3380 -0.0517 0.031 Uiso 1 calc R . .
H1' H 0.307(4) 0.2149(14) 0.105(2) 0.025(10) Uiso 1 d D . .
H2' H 0.369(3) 0.2131(13) 0.100(2) 0.013(12) Uiso 1 d D . .
H4' H 0.429(3) 0.2660(19) 0.0473(18) 0.020(8) Uiso 1 d D . .
H3' H 0.381(3) 0.3544(19) 0.075(3) 0.062(11) Uiso 1 d D . .
H5' H 0.440(3) 0.3100(19) 0.1458(18) 0.010(8) Uiso 1 d D . .
O1 O 0.4296(4) -0.1209(3) 0.1480(3) 0.0908(18) Uani 1 d U . .
C101 C 0.4267(8) -0.0542(4) 0.1625(4) 0.095(3) Uani 1 d DU . .
H10A H 0.4967 -0.0325 0.1920 0.114 Uiso 1 calc R . .
H10B H 0.3670 -0.0490 0.1835 0.114 Uiso 1 calc R . .
C102 C 0.4081(9) -0.0242(5) 0.1011(5) 0.124(4) Uani 1 d DU . .
H10C H 0.3383 -0.0081 0.0935 0.186 Uiso 1 calc R . .
H10D H 0.4063 -0.0568 0.0656 0.186 Uiso 1 calc R . .
H10E H 0.4675 0.0120 0.1041 0.186 Uiso 1 calc R . .
C103 C 0.4436(8) -0.1538(4) 0.2010(4) 0.091(3) Uani 1 d DU . .
H10F H 0.3872 -0.1463 0.2240 0.109 Uiso 1 calc R . .
H10G H 0.5161 -0.1366 0.2303 0.109 Uiso 1 calc R . .
C104 C 0.4354(7) -0.2249(4) 0.1833(4) 0.102(3) Uani 1 d DU . .
H10H H 0.4200 -0.2481 0.2184 0.153 Uiso 1 calc R . .
H10I H 0.5047 -0.2338 0.1754 0.153 Uiso 1 calc R . .
H10J H 0.3763 -0.2394 0.1446 0.153 Uiso 1 calc R . .
O2 C 0.0000 0.0000 0.0000 0.085(4) Uani 1 d SU . .
C1A C 0.095(3) 0.0229(19) 0.1101(13) 0.148(16) Uani 0.50 d PDU A 1
C2A C 0.0778(16) -0.0076(8) 0.0411(9) 0.077(5) Uani 0.50 d PDU A 1
C3A C -0.0172(17) -0.0262(8) -0.0715(11) 0.083(5) Uani 0.50 d PDU A 2
C4A C -0.113(4) -0.001(2) -0.1134(17) 0.171(17) Uani 0.50 d PDU A 2
O3 C 1.0515(15) 0.4831(4) 0.5148(4) 0.142(5) Uani 0.50 d PU . 1
C1B C 1.0515(15) 0.4831(4) 0.5148(4) 0.142(5) Uani 0.50 d PU . 2
C2B C 1.1452(16) 0.5157(6) 0.5082(6) 0.173(6) Uani 1 d DU . .
C3B C 1.246(2) 0.4802(10) 0.5393(9) 0.158(7) Uani 0.50 d PDU . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0020 0.0020 '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'
O O 0.0080 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0720 0.0710 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.0900 0.0950 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.4200 0.8360 '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
Si1 Ru1 P2 124.85(6) . .
Si1 Ru1 P1 118.49(6) . .
P2 Ru1 P1 109.71(5) . .
Si1 Ru1 H1 124.3(15) . .
P2 Ru1 H1 84.3(16) . .
P1 Ru1 H1 84.0(17) . .
Si1 Ru1 H2 95.5(16) . .
P2 Ru1 H2 100.7(17) . .
P1 Ru1 H2 100.6(18) . .
H1 Ru1 H2 28.9(8) . .
Si1 Ru1 H3 72.3(14) . .
P2 Ru1 H3 88(2) . .
P1 Ru1 H3 85(2) . .
H1 Ru1 H3 163(2) . .
H2 Ru1 H3 168(2) . .
Si1 Ru1 H4 50.2(10) . .
P2 Ru1 H4 83.7(13) . .
P1 Ru1 H4 166.6(13) . .
H1 Ru1 H4 97(2) . .
H2 Ru1 H4 76(2) . .
H3 Ru1 H4 97(3) . .
Si1 Ru1 H5 45.9(11) . .
P2 Ru1 H5 170.7(11) . .
P1 Ru1 H5 78.9(12) . .
H1 Ru1 H5 101(2) . .
H2 Ru1 H5 81(2) . .
H3 Ru1 H5 90(2) . .
H4 Ru1 H5 87.8(17) . .
C111 P1 C121 100.3(2) . .
C111 P1 C131 107.2(2) . .
C121 P1 C131 101.1(2) . .
C111 P1 Ru1 121.72(19) . .
C121 P1 Ru1 114.25(18) . .
C131 P1 Ru1 109.98(18) . .
C231 P2 C221 99.4(3) . .
C231 P2 C211 108.6(3) . .
C221 P2 C211 101.4(3) . .
C231 P2 Ru1 110.66(17) . .
C221 P2 Ru1 117.6(2) . .
C211 P2 Ru1 117.4(2) . .
C21 Si1 C31 105.0(3) . .
C21 Si1 C11 102.3(2) . .
C31 Si1 C11 103.4(2) . .
C21 Si1 Ru1 113.70(19) . .
C31 Si1 Ru1 111.70(16) . .
C11 Si1 Ru1 119.21(18) . .
C21 Si1 H5 107.5(13) . .
C31 Si1 H5 144.3(14) . .
C11 Si1 H5 83.9(14) . .
Ru1 Si1 H5 40.2(14) . .
C12 C11 C16 114.9(5) . .
C12 C11 Si1 121.4(4) . .
C16 C11 Si1 123.6(5) . .
C13 C12 C11 123.6(6) . .
C13 C12 H12 118.2 . .
C11 C12 H12 118.2 . .
C14 C13 C12 119.2(6) . .
C14 C13 H13 120.4 . .
C12 C13 H13 120.4 . .
C13 C14 C15 121.1(6) . .
C13 C14 H14 119.4 . .
C15 C14 H14 119.4 . .
C14 C15 C16 119.4(6) . .
C14 C15 H15 120.3 . .
C16 C15 H15 120.3 . .
C15 C16 C11 121.7(6) . .
C15 C16 H16 119.1 . .
C11 C16 H16 119.1 . .
C22 C21 C26 113.5(5) . .
C22 C21 Si1 121.8(4) . .
C26 C21 Si1 124.6(4) . .
C21 C22 C23 124.1(6) . .
C21 C22 H22 117.9 . .
C23 C22 H22 117.9 . .
C24 C23 C22 119.5(6) . .
C24 C23 H23 120.3 . .
C22 C23 H23 120.3 . .
C23 C24 C25 119.9(6) . .
C23 C24 H24 120.1 . .
C25 C24 H24 120.1 . .
C24 C25 C26 120.2(7) . .
C24 C25 H25 119.9 . .
C26 C25 H25 119.9 . .
C25 C26 C21 122.8(6) . .
C25 C26 H26 118.6 . .
C21 C26 H26 118.6 . .
C32 C31 C36 116.1(6) . .
C32 C31 Si1 122.0(4) . .
C36 C31 Si1 121.8(4) . .
C31 C32 C33 121.6(6) . .
C31 C32 H32 119.2 . .
C33 C32 H32 119.2 . .
C34 C33 C32 120.4(7) . .
C34 C33 H33 119.8 . .
C32 C33 H33 119.8 . .
C35 C34 C33 118.9(7) . .
C35 C34 H34 120.6 . .
C33 C34 H34 120.6 . .
C34 C35 C36 120.8(6) . .
C34 C35 H35 119.6 . .
C36 C35 H35 119.6 . .
C35 C36 C31 122.1(6) . .
C35 C36 H36 118.9 . .
C31 C36 H36 118.9 . .
C116 C111 C112 108.5(4) . .
C116 C111 P1 120.1(4) . .
C112 C111 P1 112.4(4) . .
C116 C111 H111 104.8 . .
C112 C111 H111 104.8 . .
P1 C111 H111 104.8 . .
C113 C112 C111 112.0(5) . .
C113 C112 H11A 109.2 . .
C111 C112 H11A 109.2 . .
C113 C112 H11B 109.2 . .
C111 C112 H11B 109.2 . .
H11A C112 H11B 107.9 . .
C114 C113 C112 110.2(5) . .
C114 C113 H11C 109.6 . .
C112 C113 H11C 109.6 . .
C114 C113 H11D 109.6 . .
C112 C113 H11D 109.6 . .
H11C C113 H11D 108.1 . .
C113 C114 C115 110.2(5) . .
C113 C114 H11E 109.6 . .
C115 C114 H11E 109.6 . .
C113 C114 H11F 109.6 . .
C115 C114 H11F 109.6 . .
H11E C114 H11F 108.1 . .
C116 C115 C114 111.4(5) . .
C116 C115 H11G 109.4 . .
C114 C115 H11G 109.4 . .
C116 C115 H11H 109.4 . .
C114 C115 H11H 109.4 . .
H11G C115 H11H 108.0 . .
C115 C116 C111 112.9(5) . .
C115 C116 H11I 109.0 . .
C111 C116 H11I 109.0 . .
C115 C116 H11J 109.0 . .
C111 C116 H11J 109.0 . .
H11I C116 H11J 107.8 . .
C126 C121 C122 109.0(4) . .
C126 C121 P1 115.0(4) . .
C122 C121 P1 113.1(4) . .
C126 C121 H121 106.4 . .
C122 C121 H121 106.4 . .
P1 C121 H121 106.4 . .
C123 C122 C121 111.2(5) . .
C123 C122 H12A 109.4 . .
C121 C122 H12A 109.4 . .
C123 C122 H12B 109.4 . .
C121 C122 H12B 109.4 . .
H12A C122 H12B 108.0 . .
C235 C123 C122 110.7(5) . .
C235 C123 H12C 109.5 . .
C122 C123 H12C 109.5 . .
C235 C123 H12D 109.5 . .
C122 C123 H12D 109.5 . .
H12C C123 H12D 108.1 . .
C234 C124 C236 110.2(7) . .
C234 C124 H12E 109.6 . .
C236 C124 H12E 109.6 . .
C234 C124 H12F 109.6 . .
C236 C124 H12F 109.6 . .
H12E C124 H12F 108.1 . .
C235 C125 C126 111.5(5) . .
C235 C125 H12G 109.3 . .
C126 C125 H12G 109.3 . .
C235 C125 H12H 109.3 . .
C126 C125 H12H 109.3 . .
H12G C125 H12H 108.0 . .
C125 C126 C121 111.6(5) . .
C125 C126 H12I 109.3 . .
C121 C126 H12I 109.3 . .
C125 C126 H12J 109.3 . .
C121 C126 H12J 109.3 . .
H12I C126 H12J 108.0 . .
C136 C131 C132 108.9(4) . .
C136 C131 P1 115.1(4) . .
C132 C131 P1 117.6(4) . .
C136 C131 H131 104.6 . .
C132 C131 H131 104.6 . .
P1 C131 H131 104.6 . .
C133 C132 C131 111.6(5) . .
C133 C132 H13A 109.3 . .
C131 C132 H13A 109.3 . .
C133 C132 H13B 109.3 . .
C131 C132 H13B 109.3 . .
H13A C132 H13B 108.0 . .
C134 C133 C132 111.4(5) . .
C134 C133 H13C 109.3 . .
C132 C133 H13C 109.3 . .
C134 C133 H13D 109.3 . .
C132 C133 H13D 109.4 . .
H13C C133 H13D 108.0 . .
C133 C134 C135 110.4(5) . .
C133 C134 H13E 109.6 . .
C135 C134 H13E 109.6 . .
C133 C134 H13F 109.6 . .
C135 C134 H13F 109.6 . .
H13E C134 H13F 108.1 . .
C136 C135 C134 111.7(5) . .
C136 C135 H13G 109.3 . .
C134 C135 H13G 109.3 . .
C136 C135 H13H 109.3 . .
C134 C135 H13H 109.3 . .
H13G C135 H13H 107.9 . .
C135 C136 C131 111.5(5) . .
C135 C136 H13I 109.3 . .
C131 C136 H13I 109.3 . .
C135 C136 H13J 109.3 . .
C131 C136 H13J 109.3 . .
H13I C136 H13J 108.0 . .
C212 C211 C216 109.5(5) . .
C212 C211 P2 113.5(4) . .
C216 C211 P2 119.4(5) . .
C212 C211 H211 104.2 . .
C216 C211 H211 104.2 . .
P2 C211 H211 104.2 . .
C213 C212 C211 111.3(7) . .
C213 C212 H21A 109.4 . .
C211 C212 H21A 109.4 . .
C213 C212 H21B 109.4 . .
C211 C212 H21B 109.4 . .
H21A C212 H21B 108.0 . .
C214 C213 C212 111.0(7) . .
C214 C213 H21C 109.4 . .
C212 C213 H21C 109.4 . .
C214 C213 H21D 109.4 . .
C212 C213 H21D 109.4 . .
H21C C213 H21D 108.0 . .
C215 C214 C213 110.5(6) . .
C215 C214 H21E 109.6 . .
C213 C214 H21E 109.6 . .
C215 C214 H21F 109.6 . .
C213 C214 H21F 109.6 . .
H21E C214 H21F 108.1 . .
C214 C215 C216 112.6(6) . .
C214 C215 H21G 109.1 . .
C216 C215 H21G 109.1 . .
C214 C215 H21H 109.1 . .
C216 C215 H21H 109.1 . .
H21G C215 H21H 107.8 . .
C215 C216 C211 110.6(6) . .
C215 C216 H21I 109.5 . .
C211 C216 H21I 109.5 . .
C215 C216 H21J 109.5 . .
C211 C216 H21J 109.5 . .
H21I C216 H21J 108.1 . .
C226 C221 C222 112.9(5) . .
C226 C221 P2 114.2(4) . .
C222 C221 P2 113.0(4) . .
C226 C221 H221 105.2 . .
C222 C221 H221 105.2 . .
P2 C221 H221 105.2 . .
C223 C222 C221 111.5(6) . .
C223 C222 H22A 109.3 . .
C221 C222 H22A 109.3 . .
C223 C222 H22B 109.3 . .
C221 C222 H22B 109.3 . .
H22A C222 H22B 108.0 . .
C224 C223 C222 111.7(6) . .
C224 C223 H22C 109.3 . .
C222 C223 H22C 109.3 . .
C224 C223 H22D 109.3 . .
C222 C223 H22D 109.3 . .
H22C C223 H22D 107.9 . .
C223 C224 C225 111.7(6) . .
C223 C224 H22E 109.3 . .
C225 C224 H22E 109.3 . .
C223 C224 H22F 109.3 . .
C225 C224 H22F 109.3 . .
H22E C224 H22F 107.9 . .
C224 C225 C226 111.1(6) . .
C224 C225 H22G 109.4 . .
C226 C225 H22G 109.4 . .
C224 C225 H22H 109.4 . .
C226 C225 H22H 109.4 . .
H22G C225 H22H 108.0 . .
C221 C226 C225 108.2(5) . .
C221 C226 H22I 110.1 . .
C225 C226 H22I 110.1 . .
C221 C226 H22J 110.1 . .
C225 C226 H22J 110.1 . .
H22I C226 H22J 108.4 . .
C232 C231 C236 104.7(5) . .
C232 C231 P2 120.8(4) . .
C236 C231 P2 115.1(4) . .
C232 C231 H231 104.9 . .
C236 C231 H231 104.9 . .
P2 C231 H231 104.9 . .
C231 C232 C233 110.6(6) . .
C231 C232 H23A 109.5 . .
C233 C232 H23A 109.5 . .
C231 C232 H23B 109.5 . .
C233 C232 H23B 109.5 . .
H23A C232 H23B 108.1 . .
C234 C233 C232 109.7(7) . .
C234 C233 H23C 109.7 . .
C232 C233 H23C 109.7 . .
C234 C233 H23D 109.7 . .
C232 C233 H23D 109.7 . .
H23C C233 H23D 108.2 . .
C124 C234 C233 111.2(6) . .
C124 C234 H23E 109.4 . .
C233 C234 H23E 109.4 . .
C124 C234 H23F 109.4 . .
C233 C234 H23F 109.4 . .
H23E C234 H23F 108.0 . .
C125 C235 C123 112.0(4) . .
C125 C235 H23G 109.2 . .
C123 C235 H23G 109.2 . .
C125 C235 H23H 109.2 . .
C123 C235 H23H 109.2 . .
H23G C235 H23H 107.9 . .
C124 C236 C231 110.0(6) . .
C124 C236 H23I 109.7 . .
C231 C236 H23I 109.7 . .
C124 C236 H23J 109.6 . .
C231 C236 H23J 109.7 . .
H23I C236 H23J 108.2 . .
Si2 Ru2 P3 120.15(6) . .
Si2 Ru2 P4 126.02(6) . .
P3 Ru2 P4 109.49(6) . .
Si2 Ru2 H1' 111.7(16) . .
P3 Ru2 H1' 84.8(15) . .
P4 Ru2 H1' 91.6(16) . .
Si2 Ru2 H2' 84.9(15) . .
P3 Ru2 H2' 108.8(16) . .
P4 Ru2 H2' 98.8(15) . .
H1' Ru2 H2' 29.3(7) . .
Si2 Ru2 H4' 50.2(10) . .
P3 Ru2 H4' 170.2(11) . .
P4 Ru2 H4' 79.0(11) . .
H1' Ru2 H4' 100(2) . .
H2' Ru2 H4' 74(2) . .
Si2 Ru2 H3' 72.8(14) . .
P3 Ru2 H3' 83(2) . .
P4 Ru2 H3' 95(2) . .
H1' Ru2 H3' 168(3) . .
H2' Ru2 H3' 158(2) . .
H4' Ru2 H3' 91(3) . .
Si2 Ru2 H5' 45.8(11) . .
P3 Ru2 H5' 76.6(11) . .
P4 Ru2 H5' 170.7(12) . .
H1' Ru2 H5' 96(2) . .
H2' Ru2 H5' 85(2) . .
H4' Ru2 H5' 94.4(15) . .
H3' Ru2 H5' 79(2) . .
C331 P3 C311 101.3(2) . .
C331 P3 C321 107.8(2) . .
C311 P3 C321 100.9(2) . .
C331 P3 Ru2 119.98(19) . .
C311 P3 Ru2 113.69(18) . .
C321 P3 Ru2 111.13(18) . .
C431 P4 C421 99.7(2) . .
C431 P4 C411 101.7(2) . .
C421 P4 C411 107.3(2) . .
C431 P4 Ru2 115.54(17) . .
C421 P4 Ru2 110.35(18) . .
C411 P4 Ru2 120.1(2) . .
C51 Si2 C41 103.2(2) . .
C51 Si2 C61 101.8(2) . .
C41 Si2 C61 103.4(2) . .
C51 Si2 Ru2 114.21(19) . .
C41 Si2 Ru2 113.62(16) . .
C61 Si2 Ru2 118.70(18) . .
C51 Si2 H5' 115.6(13) . .
C41 Si2 H5' 139.5(13) . .
C61 Si2 H5' 80.2(13) . .
Ru2 Si2 H5' 40.2(13) . .
C42 C41 C46 115.9(6) . .
C42 C41 Si2 122.7(4) . .
C46 C41 Si2 121.3(4) . .
C43 C42 C41 121.9(6) . .
C43 C42 H42 119.0 . .
C41 C42 H42 119.0 . .
C42 C43 C44 121.0(6) . .
C42 C43 H43 119.5 . .
C44 C43 H43 119.5 . .
C45 C44 C43 119.4(6) . .
C45 C44 H44 120.3 . .
C43 C44 H44 120.3 . .
C44 C45 C46 119.5(6) . .
C44 C45 H45 120.2 . .
C46 C45 H45 120.2 . .
C45 C46 C41 122.3(6) . .
C45 C46 H46 118.9 . .
C41 C46 H46 118.9 . .
C52 C51 C56 115.1(5) . .
C52 C51 Si2 124.5(4) . .
C56 C51 Si2 120.0(4) . .
C53 C52 C51 122.4(6) . .
C53 C52 H52 118.8 . .
C51 C52 H52 118.8 . .
C54 C53 C52 120.7(6) . .
C54 C53 H53 119.6 . .
C52 C53 H53 119.6 . .
C53 C54 C55 119.5(6) . .
C53 C54 H54 120.3 . .
C55 C54 H54 120.3 . .
C54 C55 C56 120.4(6) . .
C54 C55 H55 119.8 . .
C56 C55 H55 119.8 . .
C55 C56 C51 121.9(5) . .
C55 C56 H56 119.0 . .
C51 C56 H56 119.0 . .
C66 C61 C62 115.1(5) . .
C66 C61 Si2 121.1(4) . .
C62 C61 Si2 123.6(5) . .
C61 C62 C63 121.5(6) . .
C61 C62 H62 119.2 . .
C63 C62 H62 119.2 . .
C64 C63 C62 121.1(6) . .
C64 C63 H63 119.4 . .
C62 C63 H63 119.4 . .
C63 C64 C65 119.8(6) . .
C63 C64 H64 120.1 . .
C65 C64 H64 120.1 . .
C66 C65 C64 118.7(6) . .
C66 C65 H65 120.6 . .
C64 C65 H65 120.6 . .
C65 C66 C61 123.7(6) . .
C65 C66 H66 118.2 . .
C61 C66 H66 118.2 . .
C312 C311 C316 109.8(4) . .
C312 C311 P3 113.7(4) . .
C316 C311 P3 113.0(4) . .
C312 C311 H311 106.6 . .
C316 C311 H311 106.6 . .
P3 C311 H311 106.6 . .
C311 C312 C313 112.5(4) . .
C311 C312 H31A 109.1 . .
C313 C312 H31A 109.1 . .
C311 C312 H31B 109.1 . .
C313 C312 H31B 109.1 . .
H31A C312 H31B 107.8 . .
C314 C313 C312 110.9(5) . .
C314 C313 H31C 109.5 . .
C312 C313 H31C 109.5 . .
C314 C313 H31D 109.5 . .
C312 C313 H31D 109.5 . .
H31C C313 H31D 108.0 . .
C313 C314 C315 110.1(4) . .
C313 C314 H31E 109.7 . .
C315 C314 H31E 109.6 . .
C313 C314 H31F 109.7 . .
C315 C314 H31F 109.6 . .
H31E C314 H31F 108.2 . .
C316 C315 C314 110.9(5) . .
C316 C315 H31G 109.4 . .
C314 C315 H31G 109.5 . .
C316 C315 H31H 109.5 . .
C314 C315 H31H 109.5 . .
H31G C315 H31H 108.0 . .
C315 C316 C311 111.9(5) . .
C315 C316 H31I 109.2 . .
C311 C316 H31I 109.2 . .
C315 C316 H31J 109.2 . .
C311 C316 H31J 109.2 . .
H31I C316 H31J 107.9 . .
C326 C321 C322 109.3(4) . .
C326 C321 P3 114.5(4) . .
C322 C321 P3 117.3(4) . .
C326 C321 H321 104.8 . .
C322 C321 H321 104.8 . .
P3 C321 H321 104.8 . .
C323 C322 C321 109.7(5) . .
C323 C322 H32A 109.7 . .
C321 C322 H32A 109.7 . .
C323 C322 H32B 109.7 . .
C321 C322 H32B 109.7 . .
H32A C322 H32B 108.2 . .
C324 C323 C322 111.8(6) . .
C324 C323 H32C 109.2 . .
C322 C323 H32C 109.2 . .
C324 C323 H32D 109.3 . .
C322 C323 H32D 109.3 . .
H32C C323 H32D 107.9 . .
C325 C324 C323 110.6(5) . .
C325 C324 H32E 109.5 . .
C323 C324 H32E 109.5 . .
C325 C324 H32F 109.5 . .
C323 C324 H32F 109.5 . .
H32E C324 H32F 108.1 . .
C324 C325 C326 112.2(5) . .
C324 C325 H32G 109.2 . .
C326 C325 H32G 109.2 . .
C324 C325 H32H 109.2 . .
C326 C325 H32H 109.2 . .
H32G C325 H32H 107.9 . .
C321 C326 C325 110.5(5) . .
C321 C326 H32I 109.6 . .
C325 C326 H32I 109.6 . .
C321 C326 H32J 109.6 . .
C325 C326 H32J 109.6 . .
H32I C326 H32J 108.1 . .
C336 C331 C332 108.4(5) . .
C336 C331 P3 119.5(4) . .
C332 C331 P3 113.7(4) . .
C336 C331 H331 104.5 . .
C332 C331 H331 104.5 . .
P3 C331 H331 104.5 . .
C333 C332 C331 112.4(5) . .
C333 C332 H33A 109.1 . .
C331 C332 H33A 109.1 . .
C333 C332 H33B 109.1 . .
C331 C332 H33B 109.1 . .
H33A C332 H33B 107.9 . .
C334 C333 C332 110.3(5) . .
C334 C333 H33C 109.6 . .
C332 C333 H33C 109.6 . .
C334 C333 H33D 109.6 . .
C332 C333 H33D 109.6 . .
H33C C333 H33D 108.1 . .
C335 C334 C333 110.9(5) . .
C335 C334 H33E 109.5 . .
C333 C334 H33E 109.5 . .
C335 C334 H33F 109.5 . .
C333 C334 H33F 109.5 . .
H33E C334 H33F 108.0 . .
C334 C335 C336 111.2(6) . .
C334 C335 H33G 109.4 . .
C336 C335 H33G 109.4 . .
C334 C335 H33H 109.4 . .
C336 C335 H33H 109.4 . .
H33G C335 H33H 108.0 . .
C335 C336 C331 112.0(5) . .
C335 C336 H33I 109.2 . .
C331 C336 H33I 109.2 . .
C335 C336 H33J 109.2 . .
C331 C336 H33J 109.2 . .
H33I C336 H33J 107.9 . .
C412 C411 C416 108.3(5) . .
C412 C411 P4 112.6(4) . .
C416 C411 P4 119.6(5) . .
C412 C411 H411 105.0 . .
C416 C411 H411 105.0 . .
P4 C411 H411 105.0 . .
C411 C412 C413 112.6(5) . .
C411 C412 H41A 109.1 . .
C413 C412 H41A 109.1 . .
C411 C412 H41B 109.1 . .
C413 C412 H41B 109.1 . .
H41A C412 H41B 107.8 . .
C414 C413 C412 110.0(6) . .
C414 C413 H41C 109.7 . .
C412 C413 H41C 109.7 . .
C414 C413 H41D 109.7 . .
C412 C413 H41D 109.7 . .
H41C C413 H41D 108.2 . .
C413 C414 C415 111.4(5) . .
C413 C414 H41E 109.3 . .
C415 C414 H41E 109.3 . .
C413 C414 H41F 109.3 . .
C415 C414 H41F 109.3 . .
H41E C414 H41F 108.0 . .
C414 C415 C416 112.1(5) . .
C414 C415 H41G 109.2 . .
C416 C415 H41G 109.2 . .
C414 C415 H41H 109.2 . .
C416 C415 H41H 109.2 . .
H41G C415 H41H 107.9 . .
C415 C416 C411 110.8(5) . .
C415 C416 H41I 109.5 . .
C411 C416 H41I 109.5 . .
C415 C416 H41J 109.5 . .
C411 C416 H41J 109.5 . .
H41I C416 H41J 108.1 . .
C422 C421 C426 107.4(5) . .
C422 C421 P4 119.0(4) . .
C426 C421 P4 118.0(4) . .
C422 C421 H421 103.3 . .
C426 C421 H421 103.3 . .
P4 C421 H421 103.3 . .
C423 C422 C421 111.7(5) . .
C423 C422 H42A 109.3 . .
C421 C422 H42A 109.3 . .
C423 C422 H42B 109.3 . .
C421 C422 H42B 109.3 . .
H42A C422 H42B 107.9 . .
C424 C423 C422 111.3(6) . .
C424 C423 H42C 109.4 . .
C422 C423 H42C 109.4 . .
C424 C423 H42D 109.4 . .
C422 C423 H42D 109.4 . .
H42C C423 H42D 108.0 . .
C423 C424 C425 110.8(5) . .
C423 C424 H42E 109.5 . .
C425 C424 H42E 109.5 . .
C423 C424 H42F 109.5 . .
C425 C424 H42F 109.5 . .
H42E C424 H42F 108.1 . .
C424 C425 C426 111.0(5) . .
C424 C425 H42G 109.4 . .
C426 C425 H42G 109.4 . .
C424 C425 H42H 109.4 . .
C426 C425 H42H 109.4 . .
H42G C425 H42H 108.0 . .
C425 C426 C421 111.6(6) . .
C425 C426 H42I 109.3 . .
C421 C426 H42I 109.3 . .
C425 C426 H42J 109.3 . .
C421 C426 H42J 109.3 . .
H42I C426 H42J 108.0 . .
C436 C431 C432 110.2(4) . .
C436 C431 P4 113.8(3) . .
C432 C431 P4 113.1(4) . .
C436 C431 H431 106.4 . .
C432 C431 H431 106.4 . .
P4 C431 H431 106.4 . .
C433 C432 C431 111.2(5) . .
C433 C432 H43A 109.4 . .
C431 C432 H43A 109.4 . .
C433 C432 H43B 109.4 . .
C431 C432 H43B 109.4 . .
H43A C432 H43B 108.0 . .
C434 C433 C432 112.1(5) . .
C434 C433 H43C 109.2 . .
C432 C433 H43C 109.2 . .
C434 C433 H43D 109.2 . .
C432 C433 H43D 109.2 . .
H43C C433 H43D 107.9 . .
C433 C434 C435 110.4(5) . .
C433 C434 H43E 109.6 . .
C435 C434 H43E 109.6 . .
C433 C434 H43F 109.6 . .
C435 C434 H43F 109.6 . .
H43E C434 H43F 108.1 . .
C434 C435 C436 112.1(5) . .
C434 C435 H43G 109.2 . .
C436 C435 H43G 109.2 . .
C434 C435 H43H 109.2 . .
C436 C435 H43H 109.2 . .
H43G C435 H43H 107.9 . .
C431 C436 C435 111.4(4) . .
C431 C436 H43I 109.3 . .
C435 C436 H43I 109.3 . .
C431 C436 H43J 109.3 . .
C435 C436 H43J 109.3 . .
H43I C436 H43J 108.0 . .
C103 O1 C101 113.2(7) . .
O1 C101 C102 108.3(8) . .
O1 C101 H10A 110.0 . .
C102 C101 H10A 110.0 . .
O1 C101 H10B 110.0 . .
C102 C101 H10B 110.0 . .
H10A C101 H10B 108.4 . .
C101 C102 H10C 109.5 . .
C101 C102 H10D 109.5 . .
H10C C102 H10D 109.5 . .
C101 C102 H10E 109.5 . .
H10C C102 H10E 109.5 . .
H10D C102 H10E 109.5 . .
O1 C103 C104 111.8(7) . .
O1 C103 H10F 109.3 . .
C104 C103 H10F 109.3 . .
O1 C103 H10G 109.3 . .
C104 C103 H10G 109.3 . .
H10F C103 H10G 107.9 . .
C103 C104 H10H 109.5 . .
C103 C104 H10I 109.5 . .
H10H C104 H10I 109.5 . .
C103 C104 H10J 109.5 . .
H10H C104 H10J 109.5 . .
H10I C104 H10J 109.5 . .
C2A O2 C2A 180.000(5) 2 .
C2A O2 C3A 57.5(10) 2 .
C2A O2 C3A 122.5(10) . .
C2A O2 C3A 122.5(10) 2 2
C2A O2 C3A 57.5(10) . 2
C3A O2 C3A 180.000(3) . 2
O2 C2A C1A 120.6(18) . .
C4A C3A O2 111(2) . .
C2B O3 O3 112.1(11) . 2_766
O3 C2B C3B 110.0(14) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ru1 Si1 2.3846(18) .
Ru1 P2 2.3921(16) .
Ru1 P1 2.4058(17) .
Ru1 H1 1.66(2) .
Ru1 H2 1.64(2) .
Ru1 H3 1.49(4) .
Ru1 H4 1.48(4) .
Ru1 H5 1.54(4) .
P1 C111 1.857(5) .
P1 C121 1.860(6) .
P1 C131 1.863(5) .
P2 C231 1.861(5) .
P2 C221 1.861(6) .
P2 C211 1.871(6) .
Si1 C21 1.883(5) .
Si1 C31 1.897(6) .
Si1 C11 1.916(6) .
Si1 H5 1.72(3) .
C11 C12 1.397(8) .
C11 C16 1.418(7) .
C12 C13 1.388(7) .
C12 H12 0.9500 .
C13 C14 1.360(8) .
C13 H13 0.9500 .
C14 C15 1.369(9) .
C14 H14 0.9500 .
C15 C16 1.407(8) .
C15 H15 0.9500 .
C16 H16 0.9500 .
C21 C22 1.388(7) .
C21 C26 1.395(8) .
C22 C23 1.395(8) .
C22 H22 0.9500 .
C23 C24 1.336(9) .
C23 H23 0.9500 .
C24 C25 1.364(10) .
C24 H24 0.9500 .
C25 C26 1.389(9) .
C25 H25 0.9500 .
C26 H26 0.9500 .
C31 C32 1.378(8) .
C31 C36 1.402(8) .
C32 C33 1.406(9) .
C32 H32 0.9500 .
C33 C34 1.372(9) .
C33 H33 0.9500 .
C34 C35 1.366(9) .
C34 H34 0.9500 .
C35 C36 1.380(8) .
C35 H35 0.9500 .
C36 H36 0.9500 .
C111 C116 1.529(8) .
C111 C112 1.534(8) .
C111 H111 1.0000 .
C112 C113 1.523(7) .
C112 H11A 0.9900 .
C112 H11B 0.9900 .
C113 C114 1.512(9) .
C113 H11C 0.9900 .
C113 H11D 0.9900 .
C114 C115 1.522(9) .
C114 H11E 0.9900 .
C114 H11F 0.9900 .
C115 C116 1.510(8) .
C115 H11G 0.9900 .
C115 H11H 0.9900 .
C116 H11I 0.9900 .
C116 H11J 0.9900 .
C121 C126 1.534(7) .
C121 C122 1.544(7) .
C121 H121 1.0000 .
C122 C123 1.523(8) .
C122 H12A 0.9900 .
C122 H12B 0.9900 .
C123 C235 1.519(7) .
C123 H12C 0.9900 .
C123 H12D 0.9900 .
C124 C234 1.443(10) .
C124 C236 1.559(10) .
C124 H12E 0.9900 .
C124 H12F 0.9900 .
C125 C235 1.516(7) .
C125 C126 1.517(8) .
C125 H12G 0.9900 .
C125 H12H 0.9900 .
C126 H12I 0.9900 .
C126 H12J 0.9900 .
C131 C136 1.529(7) .
C131 C132 1.530(7) .
C131 H131 1.0000 .
C132 C133 1.529(8) .
C132 H13A 0.9900 .
C132 H13B 0.9900 .
C133 C134 1.512(9) .
C133 H13C 0.9900 .
C133 H13D 0.9900 .
C134 C135 1.519(8) .
C134 H13E 0.9900 .
C134 H13F 0.9900 .
C135 C136 1.515(7) .
C135 H13G 0.9900 .
C135 H13H 0.9900 .
C136 H13I 0.9900 .
C136 H13J 0.9900 .
C211 C212 1.526(9) .
C211 C216 1.535(8) .
C211 H211 1.0000 .
C212 C213 1.525(10) .
C212 H21A 0.9900 .
C212 H21B 0.9900 .
C213 C214 1.518(10) .
C213 H21C 0.9900 .
C213 H21D 0.9900 .
C214 C215 1.518(10) .
C214 H21E 0.9900 .
C214 H21F 0.9900 .
C215 C216 1.534(8) .
C215 H21G 0.9900 .
C215 H21H 0.9900 .
C216 H21I 0.9900 .
C216 H21J 0.9900 .
C221 C226 1.483(9) .
C221 C222 1.520(7) .
C221 H221 1.0000 .
C222 C223 1.511(9) .
C222 H22A 0.9900 .
C222 H22B 0.9900 .
C223 C224 1.461(10) .
C223 H22C 0.9900 .
C223 H22D 0.9900 .
C224 C225 1.500(9) .
C224 H22E 0.9900 .
C224 H22F 0.9900 .
C225 C226 1.582(10) .
C225 H22G 0.9900 .
C225 H22H 0.9900 .
C226 H22I 0.9900 .
C226 H22J 0.9900 .
C231 C232 1.505(8) .
C231 C236 1.565(8) .
C231 H231 1.0000 .
C232 C233 1.557(9) .
C232 H23A 0.9900 .
C232 H23B 0.9900 .
C233 C234 1.506(10) .
C233 H23C 0.9900 .
C233 H23D 0.9900 .
C234 H23E 0.9900 .
C234 H23F 0.9900 .
C235 H23G 0.9900 .
C235 H23H 0.9900 .
C236 H23I 0.9900 .
C236 H23J 0.9900 .
Ru2 Si2 2.3889(18) .
Ru2 P3 2.4022(17) .
Ru2 P4 2.4162(16) .
Ru2 H1' 1.66(2) .
Ru2 H2' 1.63(2) .
Ru2 H4' 1.48(4) .
Ru2 H3' 1.48(4) .
Ru2 H5' 1.55(4) .
P3 C331 1.846(5) .
P3 C311 1.857(6) .
P3 C321 1.882(5) .
P4 C431 1.859(5) .
P4 C421 1.863(5) .
P4 C411 1.864(6) .
Si2 C51 1.899(5) .
Si2 C41 1.903(6) .
Si2 C61 1.908(6) .
Si2 H5' 1.72(3) .
C41 C42 1.392(7) .
C41 C46 1.405(7) .
C42 C43 1.369(9) .
C42 H42 0.9500 .
C43 C44 1.378(8) .
C43 H43 0.9500 .
C44 C45 1.372(8) .
C44 H44 0.9500 .
C45 C46 1.389(8) .
C45 H45 0.9500 .
C46 H46 0.9500 .
C51 C52 1.391(8) .
C51 C56 1.399(7) .
C52 C53 1.378(8) .
C52 H52 0.9500 .
C53 C54 1.354(8) .
C53 H53 0.9500 .
C54 C55 1.356(8) .
C54 H54 0.9500 .
C55 C56 1.389(8) .
C55 H55 0.9500 .
C56 H56 0.9500 .
C61 C66 1.393(8) .
C61 C62 1.402(7) .
C62 C63 1.405(7) .
C62 H62 0.9500 .
C63 C64 1.340(9) .
C63 H63 0.9500 .
C64 C65 1.395(9) .
C64 H64 0.9500 .
C65 C66 1.388(7) .
C65 H65 0.9500 .
C66 H66 0.9500 .
C311 C312 1.524(7) .
C311 C316 1.530(7) .
C311 H311 1.0000 .
C312 C313 1.534(8) .
C312 H31A 0.9900 .
C312 H31B 0.9900 .
C313 C314 1.511(7) .
C313 H31C 0.9900 .
C313 H31D 0.9900 .
C314 C315 1.532(8) .
C314 H31E 0.9900 .
C314 H31F 0.9900 .
C315 C316 1.526(8) .
C315 H31G 0.9900 .
C315 H31H 0.9900 .
C316 H31I 0.9900 .
C316 H31J 0.9900 .
C321 C326 1.528(8) .
C321 C322 1.548(8) .
C321 H321 1.0000 .
C322 C323 1.528(8) .
C322 H32A 0.9900 .
C322 H32B 0.9900 .
C323 C324 1.519(9) .
C323 H32C 0.9900 .
C323 H32D 0.9900 .
C324 C325 1.498(9) .
C324 H32E 0.9900 .
C324 H32F 0.9900 .
C325 C326 1.534(7) .
C325 H32G 0.9900 .
C325 H32H 0.9900 .
C326 H32I 0.9900 .
C326 H32J 0.9900 .
C331 C336 1.529(8) .
C331 C332 1.532(8) .
C331 H331 1.0000 .
C332 C333 1.510(7) .
C332 H33A 0.9900 .
C332 H33B 0.9900 .
C333 C334 1.510(9) .
C333 H33C 0.9900 .
C333 H33D 0.9900 .
C334 C335 1.505(10) .
C334 H33E 0.9900 .
C334 H33F 0.9900 .
C335 C336 1.528(8) .
C335 H33G 0.9900 .
C335 H33H 0.9900 .
C336 H33I 0.9900 .
C336 H33J 0.9900 .
C411 C412 1.519(8) .
C411 C416 1.539(8) .
C411 H411 1.0000 .
C412 C413 1.523(8) .
C412 H41A 0.9900 .
C412 H41B 0.9900 .
C413 C414 1.509(9) .
C413 H41C 0.9900 .
C413 H41D 0.9900 .
C414 C415 1.509(9) .
C414 H41E 0.9900 .
C414 H41F 0.9900 .
C415 C416 1.514(8) .
C415 H41G 0.9900 .
C415 H41H 0.9900 .
C416 H41I 0.9900 .
C416 H41J 0.9900 .
C421 C422 1.526(8) .
C421 C426 1.541(8) .
C421 H421 1.0000 .
C422 C423 1.512(8) .
C422 H42A 0.9900 .
C422 H42B 0.9900 .
C423 C424 1.493(9) .
C423 H42C 0.9900 .
C423 H42D 0.9900 .
C424 C425 1.513(8) .
C424 H42E 0.9900 .
C424 H42F 0.9900 .
C425 C426 1.516(9) .
C425 H42G 0.9900 .
C425 H42H 0.9900 .
C426 H42I 0.9900 .
C426 H42J 0.9900 .
C431 C436 1.503(7) .
C431 C432 1.529(6) .
C431 H431 1.0000 .
C432 C433 1.517(8) .
C432 H43A 0.9900 .
C432 H43B 0.9900 .
C433 C434 1.504(8) .
C433 H43C 0.9900 .
C433 H43D 0.9900 .
C434 C435 1.516(7) .
C434 H43E 0.9900 .
C434 H43F 0.9900 .
C435 C436 1.522(8) .
C435 H43G 0.9900 .
C435 H43H 0.9900 .
C436 H43I 0.9900 .
C436 H43J 0.9900 .
O1 C103 1.378(10) .
O1 C101 1.418(9) .
C101 C102 1.504(11) .
C101 H10A 0.9900 .
C101 H10B 0.9900 .
C102 H10C 0.9801 .
C102 H10D 0.9801 .
C102 H10E 0.9801 .
C103 C104 1.492(10) .
C103 H10F 0.9900 .
C103 H10G 0.9900 .
C104 H10H 0.9800 .
C104 H10I 0.9800 .
C104 H10J 0.9800 .
O2 C2A 1.206(18) 2
O2 C2A 1.206(19) .
O2 C3A 1.56(2) .
O2 C3A 1.56(2) 2
C1A C2A 1.531(17) .
C3A C4A 1.528(17) .
O3 C2B 1.33(2) .
O3 O3 1.61(3) 2_766
C2B C3B 1.613(16) .
