#------------------------------------------------------------------------------
#$Date: 2015-06-05 05:04:41 +0300 (Fri, 05 Jun 2015) $
#$Revision: 138110 $
#$URL: svn://www.crystallography.net/cod/cif/4/34/29/4342907.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_4342907
loop_
_publ_author_name
'Cabeza, Javier A.'
'Fernández-Colinas, José M'
'García-Álvarez, Pablo'
'Pérez-Carreño, Enrique'
'Polo, Diego'
_publ_section_title
;
 Reactivity Studies on a Binuclear Ruthenium(0) Complex Equipped with a
 Bridging κ(2)N,Ge-Amidinatogermylene Ligand.
;
_journal_issue                   10
_journal_name_full               'Inorganic chemistry'
_journal_page_first              4850
_journal_page_last               4861
_journal_paper_doi               10.1021/acs.inorgchem.5b00412
_journal_volume                  54
_journal_year                    2015
_chemical_formula_moiety         'C58 H94 Ge2 N8 O10 Ru4 Si4, 0.5 (C6 H14)'
_chemical_formula_sum            'C61 H101 Ge2 N8 O10 Ru4 Si4'
_chemical_formula_weight         1768.31
_chemical_name_systematic
;
 ?
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2014
_cell_angle_alpha                90.000(4)
_cell_angle_beta                 112.594(4)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.7223(6)
_cell_length_b                   34.6848(7)
_cell_length_c                   15.6391(5)
_cell_measurement_reflns_used    10749
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      29.2610
_cell_measurement_theta_min      3.5050
_cell_volume                     7873.8(5)
_computing_cell_refinement
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.34 (release 22-05-2014 CrysAlis171 .NET)
(compiled May 22 2014,16:03:01)
;
_computing_data_collection
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.34 (release 22-05-2014 CrysAlis171 .NET)
(compiled May 22 2014,16:03:01)
;
_computing_data_reduction
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.34 (release 22-05-2014 CrysAlis171 .NET)
(compiled May 22 2014,16:03:01)
;
_computing_molecular_graphics    'MERCUY CSD 3.1 (Build RC5)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SIR-97 (Giacovazzo, 1999)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.987
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1006
_diffrn_reflns_av_unetI/netI     0.1393
_diffrn_reflns_laue_measured_fraction_full 0.987
_diffrn_reflns_laue_measured_fraction_max 0.987
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       47
_diffrn_reflns_limit_k_min       -48
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            73193
_diffrn_reflns_point_group_measured_fraction_full 0.987
_diffrn_reflns_point_group_measured_fraction_max 0.987
_diffrn_reflns_theta_full        30.000
_diffrn_reflns_theta_max         29.999
_diffrn_reflns_theta_min         3.258
_exptl_absorpt_coefficient_mu    1.616
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.96238
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.34 (release 22-05-2014 CrysAlis171 .NET)
(compiled May 22 2014,16:03:01)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.492
_exptl_crystal_description       fragment
_exptl_crystal_F_000             3596
_exptl_crystal_size_max          0.13
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.08
_refine_diff_density_max         0.923
_refine_diff_density_min         -0.870
_refine_diff_density_rms         0.178
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.027
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     837
_refine_ls_number_reflns         22643
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.027
_refine_ls_R_factor_all          0.1244
_refine_ls_R_factor_gt           0.0632
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0115P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0768
_refine_ls_wR_factor_ref         0.0936
_reflns_Friedel_coverage         0.000
_reflns_number_gt                13986
_reflns_number_total             22643
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ic5b00412_si_002.cif
_cod_data_source_block           16
_cod_depositor_comments
'Adding full bibliography for 4342904--4342908.cif.'
_cod_database_code               4342907
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelxl_version_number           2014-3
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
C1 C 0.8030(4) 0.75582(12) 0.2269(3) 0.0236(12) Uani 1 1 d . .
H1A H 0.8176 0.7452 0.2891 0.035 Uiso 1 1 calc R U
H1B H 0.8521 0.7491 0.2056 0.035 Uiso 1 1 calc R U
H1C H 0.7444 0.7450 0.1842 0.035 Uiso 1 1 calc R U
C2 C 0.8813(4) 0.81847(12) 0.2984(4) 0.0242(12) Uani 1 1 d . .
H2A H 0.8761 0.8465 0.2904 0.036 Uiso 1 1 calc R U
H2B H 0.9351 0.8093 0.2873 0.036 Uiso 1 1 calc R U
H2C H 0.8882 0.8118 0.3616 0.036 Uiso 1 1 calc R U
C3 C 0.7949(4) 0.79947(12) 0.2298(3) 0.0202(11) Uani 1 1 d . .
H3 H 0.7871 0.8092 0.1670 0.024 Uiso 1 1 calc R U
C4 C 0.6535(4) 0.83581(12) 0.1851(3) 0.0195(11) Uani 1 1 d . .
C5 C 0.6746(4) 0.85004(13) 0.1034(3) 0.0210(12) Uani 1 1 d . .
C6 C 0.7384(4) 0.87963(13) 0.1149(4) 0.0281(14) Uani 1 1 d . .
H6 H 0.7672 0.8915 0.1737 0.034 Uiso 1 1 calc R U
C7 C 0.7601(4) 0.89179(14) 0.0415(4) 0.0356(16) Uani 1 1 d . .
H7 H 0.8045 0.9115 0.0497 0.043 Uiso 1 1 calc R U
C8 C 0.7158(5) 0.87458(15) -0.0446(4) 0.0392(17) Uani 1 1 d . .
H8 H 0.7289 0.8832 -0.0959 0.047 Uiso 1 1 calc R U
C9 C 0.6538(4) 0.84549(14) -0.0566(4) 0.0355(15) Uani 1 1 d . .
H9 H 0.6246 0.8338 -0.1157 0.043 Uiso 1 1 calc R U
C10 C 0.6332(4) 0.83287(13) 0.0181(3) 0.0271(13) Uani 1 1 d . .
H10 H 0.5905 0.8124 0.0099 0.033 Uiso 1 1 calc R U
C11 C 0.5158(4) 0.87708(13) 0.1246(4) 0.0276(13) Uani 1 1 d . .
H11 H 0.5550 0.8907 0.0967 0.033 Uiso 1 1 calc R U
C12 C 0.4338(4) 0.85909(15) 0.0453(4) 0.0362(14) Uani 1 1 d . .
H12A H 0.4565 0.8400 0.0128 0.054 Uiso 1 1 calc R U
H12B H 0.3999 0.8793 0.0018 0.054 Uiso 1 1 calc R U
H12C H 0.3928 0.8464 0.0706 0.054 Uiso 1 1 calc R U
C13 C 0.4800(4) 0.90749(13) 0.1745(4) 0.0313(14) Uani 1 1 d . .
H13A H 0.4487 0.8945 0.2100 0.047 Uiso 1 1 calc R U
H13B H 0.4365 0.9247 0.1286 0.047 Uiso 1 1 calc R U
H13C H 0.5319 0.9226 0.2166 0.047 Uiso 1 1 calc R U
C14 C 0.4641(4) 0.76305(13) 0.1173(4) 0.0311(13) Uani 1 1 d . .
H14A H 0.4318 0.7767 0.0588 0.047 Uiso 1 1 calc R U
H14B H 0.4649 0.7354 0.1053 0.047 Uiso 1 1 calc R U
H14C H 0.5274 0.7726 0.1459 0.047 Uiso 1 1 calc R U
C15 C 0.4228(4) 0.73038(13) 0.2802(4) 0.0413(17) Uani 1 1 d . .
H15A H 0.4841 0.7327 0.3297 0.062 Uiso 1 1 calc R U
H15B H 0.4189 0.7061 0.2470 0.062 Uiso 1 1 calc R U
H15C H 0.3759 0.7307 0.3071 0.062 Uiso 1 1 calc R U
C16 C 0.2783(5) 0.76908(19) 0.1191(5) 0.063(2) Uani 1 1 d . .
H16A H 0.2401 0.7721 0.1555 0.095 Uiso 1 1 calc R U
H16B H 0.2655 0.7440 0.0877 0.095 Uiso 1 1 calc R U
H16C H 0.2641 0.7897 0.0729 0.095 Uiso 1 1 calc R U
C17 C 0.3905(4) 0.87606(14) 0.3787(4) 0.0458(17) Uani 1 1 d . .
H17A H 0.4441 0.8673 0.4323 0.069 Uiso 1 1 calc R U
H17B H 0.3417 0.8842 0.3992 0.069 Uiso 1 1 calc R U
H17C H 0.4083 0.8978 0.3492 0.069 Uiso 1 1 calc R U
C18 C 0.2987(4) 0.80045(15) 0.3516(4) 0.0460(17) Uani 1 1 d . .
H18A H 0.2677 0.7799 0.3075 0.069 Uiso 1 1 calc R U
H18B H 0.2543 0.8133 0.3719 0.069 Uiso 1 1 calc R U
H18C H 0.3483 0.7893 0.4053 0.069 Uiso 1 1 calc R U
C19 C 0.2508(4) 0.85879(17) 0.1954(4) 0.0504(18) Uani 1 1 d . .
H19A H 0.2761 0.8760 0.1614 0.076 Uiso 1 1 calc R U
H19B H 0.2118 0.8736 0.2194 0.076 Uiso 1 1 calc R U
H19C H 0.2141 0.8386 0.1537 0.076 Uiso 1 1 calc R U
C20 C 0.8172(4) 0.76818(13) 0.4404(3) 0.0202(11) Uani 1 1 d . .
C21 C 0.9659(4) 0.72904(13) 0.5332(3) 0.0216(11) Uani 1 1 d . .
C22 C 1.0236(4) 0.74883(15) 0.6243(4) 0.0382(15) Uani 1 1 d . .
H22A H 1.0426 0.7744 0.6114 0.057 Uiso 1 1 calc R U
H22B H 1.0783 0.7332 0.6576 0.057 Uiso 1 1 calc R U
H22C H 0.9869 0.7516 0.6623 0.057 Uiso 1 1 calc R U
C23 C 0.9330(4) 0.68954(12) 0.5504(4) 0.0323(14) Uani 1 1 d . .
H23A H 0.8992 0.6923 0.5912 0.048 Uiso 1 1 calc R U
H23B H 0.9863 0.6726 0.5797 0.048 Uiso 1 1 calc R U
H23C H 0.8924 0.6783 0.4913 0.048 Uiso 1 1 calc R U
C24 C 1.0178(4) 0.72625(14) 0.4683(4) 0.0301(13) Uani 1 1 d . .
H24A H 0.9777 0.7146 0.4095 0.045 Uiso 1 1 calc R U
H24B H 1.0728 0.7103 0.4971 0.045 Uiso 1 1 calc R U
H24C H 1.0360 0.7521 0.4567 0.045 Uiso 1 1 calc R U
C25 C 0.7206(4) 1.01400(13) 0.7916(4) 0.0267(13) Uani 1 1 d . .
H25A H 0.6770 1.0345 0.7899 0.040 Uiso 1 1 calc R U
H25B H 0.7782 1.0178 0.8455 0.040 Uiso 1 1 calc R U
H25C H 0.6941 0.9889 0.7963 0.040 Uiso 1 1 calc R U
C26 C 0.6567(4) 1.00865(13) 0.6152(4) 0.0268(13) Uani 1 1 d . .
H26A H 0.6724 1.0133 0.5613 0.040 Uiso 1 1 calc R U
H26B H 0.6074 1.0263 0.6137 0.040 Uiso 1 1 calc R U
H26C H 0.6358 0.9820 0.6140 0.040 Uiso 1 1 calc R U
C27 C 0.7402(4) 1.01535(12) 0.7024(4) 0.0207(12) Uani 1 1 d . .
H27 H 0.7627 1.0420 0.6980 0.025 Uiso 1 1 calc R U
C28 C 0.8888(4) 1.00294(12) 0.6950(3) 0.0189(11) Uani 1 1 d . .
C29 C 0.8935(4) 1.04607(12) 0.6798(4) 0.0207(12) Uani 1 1 d . .
C30 C 0.9437(4) 1.06879(13) 0.7544(4) 0.0287(13) Uani 1 1 d . .
H30 H 0.9733 1.0575 0.8140 0.034 Uiso 1 1 calc R U
C31 C 0.9511(4) 1.10843(14) 0.7424(5) 0.0389(17) Uani 1 1 d . .
H31 H 0.9867 1.1241 0.7934 0.047 Uiso 1 1 calc R U
C32 C 0.9060(5) 1.12477(15) 0.6556(5) 0.0429(18) Uani 1 1 d . .
H32 H 0.9099 1.1518 0.6475 0.051 Uiso 1 1 calc R U
C33 C 0.8563(4) 1.10216(13) 0.5817(4) 0.0337(15) Uani 1 1 d . .
H33 H 0.8261 1.1135 0.5224 0.040 Uiso 1 1 calc R U
C34 C 0.8495(4) 1.06260(12) 0.5931(4) 0.0249(13) Uani 1 1 d . .
H34 H 0.8148 1.0470 0.5416 0.030 Uiso 1 1 calc R U
C35 C 1.0335(4) 0.99865(12) 0.6690(3) 0.0187(11) Uani 1 1 d . .
H35 H 1.0092 1.0235 0.6362 0.022 Uiso 1 1 calc R U
C36 C 1.1210(4) 1.00779(12) 0.7518(4) 0.0250(12) Uani 1 1 d . .
H36A H 1.1074 1.0266 0.7915 0.038 Uiso 1 1 calc R U
H36B H 1.1670 1.0185 0.7304 0.038 Uiso 1 1 calc R U
H36C H 1.1451 0.9841 0.7871 0.038 Uiso 1 1 calc R U
C37 C 1.0551(4) 0.97242(12) 0.6015(3) 0.0239(13) Uani 1 1 d . .
H37A H 1.0783 0.9476 0.6315 0.036 Uiso 1 1 calc R U
H37B H 1.1018 0.9846 0.5834 0.036 Uiso 1 1 calc R U
H37C H 0.9988 0.9682 0.5464 0.036 Uiso 1 1 calc R U
C38 C 1.0453(4) 0.88613(12) 0.9663(3) 0.0259(13) Uani 1 1 d . .
H38A H 0.9787 0.8838 0.9320 0.039 Uiso 1 1 calc R U
H38B H 1.0577 0.8948 1.0297 0.039 Uiso 1 1 calc R U
H38C H 1.0745 0.8610 0.9681 0.039 Uiso 1 1 calc R U
C39 C 1.0572(4) 0.97194(11) 0.9256(3) 0.0210(11) Uani 1 1 d . .
H39A H 1.1050 0.9904 0.9274 0.031 Uiso 1 1 calc R U
H39B H 1.0485 0.9729 0.9843 0.031 Uiso 1 1 calc R U
H39C H 0.9993 0.9785 0.8746 0.031 Uiso 1 1 calc R U
C40 C 1.2202(4) 0.92172(14) 0.9748(3) 0.0302(13) Uani 1 1 d . .
H40A H 1.2448 0.8961 0.9706 0.045 Uiso 1 1 calc R U
H40B H 1.2329 0.9277 1.0398 0.045 Uiso 1 1 calc R U
H40C H 1.2495 0.9411 0.9494 0.045 Uiso 1 1 calc R U
C41 C 1.1578(4) 0.83301(13) 0.8362(4) 0.0389(16) Uani 1 1 d . .
H41A H 1.1884 0.8401 0.9016 0.058 Uiso 1 1 calc R U
H41B H 1.1975 0.8154 0.8191 0.058 Uiso 1 1 calc R U
H41C H 1.0992 0.8202 0.8263 0.058 Uiso 1 1 calc R U
C42 C 1.0889(4) 0.85972(13) 0.6414(4) 0.0291(13) Uani 1 1 d . .
H42A H 1.0301 0.8466 0.6288 0.044 Uiso 1 1 calc R U
H42B H 1.1327 0.8417 0.6326 0.044 Uiso 1 1 calc R U
H42C H 1.0791 0.8815 0.5989 0.044 Uiso 1 1 calc R U
C43 C 1.2490(4) 0.89977(14) 0.7763(4) 0.0303(13) Uani 1 1 d . .
H43A H 1.2382 0.9229 0.7376 0.045 Uiso 1 1 calc R U
H43B H 1.2852 0.8812 0.7571 0.045 Uiso 1 1 calc R U
H43C H 1.2830 0.9068 0.8413 0.045 Uiso 1 1 calc R U
C44 C 0.6671(4) 0.92523(12) 0.7142(3) 0.0194(11) Uani 1 1 d . .
C45 C 0.4949(4) 0.91864(14) 0.6925(4) 0.0275(13) Uani 1 1 d . .
C46 C 0.4393(5) 0.94296(18) 0.6109(5) 0.065(2) Uani 1 1 d . .
H46A H 0.4603 0.9698 0.6223 0.097 Uiso 1 1 calc R U
H46B H 0.3741 0.9416 0.6017 0.097 Uiso 1 1 calc R U
H46C H 0.4470 0.9334 0.5554 0.097 Uiso 1 1 calc R U
C47 C 0.4649(4) 0.87710(15) 0.6802(5) 0.0503(18) Uani 1 1 d . .
H47A H 0.4643 0.8676 0.6209 0.075 Uiso 1 1 calc R U
H47B H 0.4030 0.8750 0.6807 0.075 Uiso 1 1 calc R U
H47C H 0.5080 0.8617 0.7308 0.075 Uiso 1 1 calc R U
C48 C 0.4888(5) 0.9344(2) 0.7819(5) 0.070(2) Uani 1 1 d . .
H48A H 0.5240 0.9176 0.8340 0.104 Uiso 1 1 calc R U
H48B H 0.4242 0.9350 0.7752 0.104 Uiso 1 1 calc R U
H48C H 0.5143 0.9605 0.7935 0.104 Uiso 1 1 calc R U
C49 C 0.6689(5) 0.98372(18) -0.0041(5) 0.064(2) Uani 1 1 d . .
H49A H 0.6494 0.9595 -0.0382 0.097 Uiso 1 1 calc R U
H49B H 0.7363 0.9844 0.0256 0.097 Uiso 1 1 calc R U
H49C H 0.6473 1.0055 -0.0471 0.097 Uiso 1 1 calc R U
C50 C 0.6278(5) 0.98662(17) 0.0703(5) 0.0540(19) Uani 1 1 d . .
H50A H 0.6535 0.9656 0.1159 0.065 Uiso 1 1 calc R U
H50B H 0.6468 1.0114 0.1035 0.065 Uiso 1 1 calc R U
C51 C 0.5244(5) 0.98407(16) 0.0321(5) 0.057(2) Uani 1 1 d . .
H51A H 0.5057 0.9593 -0.0012 0.068 Uiso 1 1 calc R U
H51B H 0.5039 0.9838 0.0845 0.068 Uiso 1 1 calc R U
C101 C 0.6441(4) 0.74311(13) 0.2976(3) 0.0182(11) Uani 1 1 d . .
C102 C 0.6440(4) 0.77206(12) 0.4537(3) 0.0204(11) Uani 1 1 d . .
C201 C 0.5935(4) 0.91605(13) 0.4276(3) 0.0225(12) Uani 1 1 d . .
C202 C 0.6396(4) 0.85126(12) 0.5341(3) 0.0192(11) Uani 1 1 d . .
C203 C 0.7073(4) 0.89729(12) 0.3476(3) 0.0223(12) Uani 1 1 d . .
C301 C 0.8497(4) 0.94048(12) 0.8666(3) 0.0193(11) Uani 1 1 d . .
C302 C 0.8197(3) 0.87468(13) 0.7748(3) 0.0182(11) Uani 1 1 d . .
C401 C 0.9014(4) 0.89660(12) 0.4884(3) 0.0214(12) Uani 1 1 d . .
C402 C 0.8490(3) 0.84814(13) 0.6009(3) 0.0163(11) Uani 1 1 d . .
C403 C 0.7939(3) 0.95126(12) 0.5081(3) 0.0178(11) Uani 1 1 d . .
Ge1 Ge 0.94711(4) 0.92635(2) 0.70870(3) 0.01416(11) Uani 1 1 d . .
Ge2 Ge 0.55433(4) 0.83140(2) 0.30072(3) 0.01544(11) Uani 1 1 d . .
N1 N 0.7122(3) 0.81220(10) 0.2467(3) 0.0168(9) Uani 1 1 d . .
N2 N 0.5738(3) 0.84753(10) 0.1899(3) 0.0184(9) Uani 1 1 d . .
N3 N 0.4299(3) 0.81601(10) 0.2575(3) 0.0203(9) Uani 1 1 d . .
N4 N 0.8839(3) 0.75235(10) 0.4862(3) 0.0223(10) Uani 1 1 d . .
N5 N 0.8162(3) 0.98812(9) 0.7074(3) 0.0160(9) Uani 1 1 d . .
N6 N 0.9606(3) 0.98167(9) 0.6961(3) 0.0148(9) Uani 1 1 d . .
N7 N 1.0647(3) 0.91026(9) 0.7894(3) 0.0164(9) Uani 1 1 d . .
N8 N 0.5914(3) 0.92107(10) 0.7050(3) 0.0219(10) Uani 1 1 d . .
O101 O 0.6222(3) 0.71371(9) 0.2614(2) 0.0277(9) Uani 1 1 d . .
O102 O 0.6139(3) 0.76174(8) 0.5065(2) 0.0287(9) Uani 1 1 d . .
O201 O 0.5566(3) 0.94478(9) 0.4274(3) 0.0350(10) Uani 1 1 d . .
O202 O 0.6280(3) 0.84101(9) 0.5988(2) 0.0296(9) Uani 1 1 d . .
O203 O 0.7320(3) 0.91518(9) 0.2992(2) 0.0301(10) Uani 1 1 d . .
O301 O 0.8709(3) 0.94703(9) 0.9437(2) 0.0264(9) Uani 1 1 d . .
O302 O 0.8292(3) 0.84311(8) 0.7980(2) 0.0260(9) Uani 1 1 d . .
O401 O 0.9406(3) 0.89618(10) 0.4396(2) 0.0343(10) Uani 1 1 d . .
O402 O 0.8623(3) 0.81649(8) 0.6238(2) 0.0254(9) Uani 1 1 d . .
O403 O 0.7698(3) 0.98063(8) 0.4719(2) 0.0269(9) Uani 1 1 d . .
Ru1 Ru 0.68629(3) 0.78891(2) 0.36426(3) 0.01433(9) Uani 1 1 d . .
Ru2 Ru 0.66061(3) 0.87121(2) 0.42815(3) 0.01526(9) Uani 1 1 d . .
Ru3 Ru 0.80704(3) 0.92683(2) 0.74055(3) 0.01437(9) Uani 1 1 d . .
Ru4 Ru 0.83282(3) 0.90169(2) 0.56323(3) 0.01482(9) Uani 1 1 d . .
Si1 Si 0.40298(12) 0.77172(4) 0.19770(12) 0.0315(4) Uani 1 1 d . .
Si2 Si 0.34799(11) 0.83605(4) 0.29469(10) 0.0246(3) Uani 1 1 d . .
Si3 Si 1.09344(11) 0.92210(4) 0.90734(10) 0.0208(3) Uani 1 1 d . .
Si4 Si 1.13557(11) 0.87755(4) 0.76279(10) 0.0231(3) Uani 1 1 d . .
H100 H 0.736(3) 0.8317(11) 0.425(3) 0.030(13) Uiso 1 1 d . .
H200 H 0.768(3) 0.9114(10) 0.622(3) 0.024(12) Uiso 1 1 d . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ge Ge 0.1547 1.8001 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 '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
N1 C3 C2 110.5(4) .
N1 C3 C1 112.8(4) .
C2 C3 C1 113.0(4) .
N1 C4 N2 123.2(4) .
N1 C4 C5 119.6(4) .
N2 C4 C5 117.2(4) .
C10 C5 C6 119.4(4) .
C10 C5 C4 120.0(4) .
C6 C5 C4 120.6(4) .
C7 C6 C5 120.8(5) .
C6 C7 C8 118.7(5) .
C9 C8 C7 121.1(5) .
C8 C9 C10 120.0(5) .
C5 C10 C9 120.0(5) .
N2 C11 C12 112.2(4) .
N2 C11 C13 111.8(4) .
C12 C11 C13 109.3(5) .
N4 C20 Ru1 170.3(4) .
N4 C21 C23 107.1(4) .
N4 C21 C22 108.4(4) .
C23 C21 C22 111.1(4) .
N4 C21 C24 107.0(4) .
C23 C21 C24 111.3(4) .
C22 C21 C24 111.7(5) .
N5 C27 C26 110.5(4) .
N5 C27 C25 111.4(4) .
C26 C27 C25 114.0(4) .
N5 C28 N6 123.3(4) .
N5 C28 C29 119.9(4) .
N6 C28 C29 116.8(4) .
C30 C29 C34 120.0(4) .
C30 C29 C28 118.4(4) .
C34 C29 C28 121.6(4) .
C29 C30 C31 119.9(5) .
C32 C31 C30 119.7(5) .
C33 C32 C31 120.2(5) .
C32 C33 C34 120.3(6) .
C29 C34 C33 119.9(5) .
N6 C35 C36 112.6(4) .
N6 C35 C37 111.2(4) .
C36 C35 C37 110.2(4) .
N8 C44 Ru3 173.2(4) .
N8 C45 C46 108.5(4) .
N8 C45 C47 109.3(4) .
C46 C45 C47 112.2(5) .
N8 C45 C48 106.5(5) .
C46 C45 C48 110.8(5) .
C47 C45 C48 109.3(5) .
C51 C50 C49 113.6(6) .
C51 C51 C50 115.0(7) 3_675
O101 C101 Ru1 175.7(4) .
O102 C102 Ru1 177.0(5) .
O201 C201 Ru2 176.1(4) .
O202 C202 Ru2 176.9(4) .
O203 C203 Ru2 175.3(4) .
O301 C301 Ru3 175.1(4) .
O302 C302 Ru3 178.1(5) .
O401 C401 Ru4 174.7(4) .
O402 C402 Ru4 177.2(4) .
O403 C403 Ru4 177.6(4) .
N7 Ge1 N6 104.09(16) .
N7 Ge1 Ru3 126.70(11) .
N6 Ge1 Ru3 98.96(11) .
N7 Ge1 Ru4 134.59(11) .
N6 Ge1 Ru4 108.64(12) .
Ru3 Ge1 Ru4 78.12(2) .
N3 Ge2 N2 104.91(17) .
N3 Ge2 Ru1 125.56(11) .
N2 Ge2 Ru1 97.85(12) .
N3 Ge2 Ru2 137.26(11) .
N2 Ge2 Ru2 105.52(12) .
Ru1 Ge2 Ru2 78.59(2) .
C4 N1 C3 117.7(4) .
C4 N1 Ru1 122.3(3) .
C3 N1 Ru1 119.8(3) .
C4 N2 C11 120.6(4) .
C4 N2 Ge2 115.4(3) .
C11 N2 Ge2 122.9(3) .
Si2 N3 Si1 117.8(2) .
Si2 N3 Ge2 124.3(2) .
Si1 N3 Ge2 116.2(2) .
C20 N4 C21 172.4(5) .
C28 N5 C27 117.3(3) .
C28 N5 Ru3 122.9(3) .
C27 N5 Ru3 119.7(3) .
C28 N6 C35 121.0(3) .
C28 N6 Ge1 114.8(3) .
C35 N6 Ge1 122.9(3) .
Si4 N7 Si3 117.9(2) .
Si4 N7 Ge1 125.8(2) .
Si3 N7 Ge1 114.99(19) .
C44 N8 C45 176.1(5) .
C102 Ru1 C101 89.99(19) .
C102 Ru1 C20 91.3(2) .
C101 Ru1 C20 95.0(2) .
C102 Ru1 N1 170.3(2) .
C101 Ru1 N1 89.19(16) .
C20 Ru1 N1 98.43(16) .
C102 Ru1 Ge2 90.13(15) .
C101 Ru1 Ge2 102.88(16) .
C20 Ru1 Ge2 162.09(12) .
N1 Ru1 Ge2 80.64(10) .
C102 Ru1 Ru2 85.31(13) .
C101 Ru1 Ru2 153.70(16) .
C20 Ru1 Ru2 110.97(12) .
N1 Ru1 Ru2 91.17(9) .
Ge2 Ru1 Ru2 51.376(16) .
C201 Ru2 C203 87.86(19) .
C201 Ru2 C202 91.12(19) .
C203 Ru2 C202 165.3(2) .
C201 Ru2 Ge2 104.75(16) .
C203 Ru2 Ge2 92.56(15) .
C202 Ru2 Ge2 101.85(14) .
C201 Ru2 Ru4 93.81(16) .
C203 Ru2 Ru4 79.70(16) .
C202 Ru2 Ru4 85.76(15) .
Ge2 Ru2 Ru4 159.67(2) .
C201 Ru2 Ru1 154.62(16) .
C203 Ru2 Ru1 95.31(12) .
C202 Ru2 Ru1 91.88(12) .
Ge2 Ru2 Ru1 50.033(15) .
Ru4 Ru2 Ru1 111.543(17) .
C302 Ru3 C301 89.29(19) .
C302 Ru3 C44 91.07(19) .
C301 Ru3 C44 97.9(2) .
C302 Ru3 N5 170.90(18) .
C301 Ru3 N5 88.55(16) .
C44 Ru3 N5 97.99(16) .
C302 Ru3 Ge1 92.69(14) .
C301 Ru3 Ge1 103.28(15) .
C44 Ru3 Ge1 158.48(13) .
N5 Ru3 Ge1 79.21(10) .
C302 Ru3 Ru4 87.01(12) .
C301 Ru3 Ru4 153.81(15) .
C44 Ru3 Ru4 108.03(13) .
N5 Ru3 Ru4 91.04(9) .
Ge1 Ru3 Ru4 51.100(16) .
C401 Ru4 C403 87.98(18) .
C401 Ru4 C402 93.44(18) .
C403 Ru4 C402 168.6(2) .
C401 Ru4 Ge1 102.68(16) .
C403 Ru4 Ge1 95.62(14) .
C402 Ru4 Ge1 95.09(15) .
C401 Ru4 Ru2 96.31(16) .
C403 Ru4 Ru2 87.27(15) .
C402 Ru4 Ru2 81.34(15) .
Ge1 Ru4 Ru2 160.864(19) .
C401 Ru4 Ru3 153.25(16) .
C403 Ru4 Ru3 91.21(12) .
C402 Ru4 Ru3 92.56(12) .
Ge1 Ru4 Ru3 50.781(15) .
Ru2 Ru4 Ru3 110.365(16) .
N3 Si1 C15 111.0(2) .
N3 Si1 C16 111.6(2) .
C15 Si1 C16 105.7(3) .
N3 Si1 C14 114.5(2) .
C15 Si1 C14 110.3(2) .
C16 Si1 C14 103.2(3) .
N3 Si2 C17 115.1(2) .
N3 Si2 C18 113.0(2) .
C17 Si2 C18 105.2(3) .
N3 Si2 C19 111.1(2) .
C17 Si2 C19 103.2(3) .
C18 Si2 C19 108.6(3) .
N7 Si3 C40 112.2(2) .
N7 Si3 C38 111.6(2) .
C40 Si3 C38 105.2(2) .
N7 Si3 C39 113.7(2) .
C40 Si3 C39 104.0(2) .
C38 Si3 C39 109.6(2) .
N7 Si4 C42 114.9(2) .
N7 Si4 C41 112.0(2) .
C42 Si4 C41 105.0(2) .
N7 Si4 C43 111.8(2) .
C42 Si4 C43 103.7(2) .
C41 Si4 C43 108.8(3) .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 C3 1.522(6) .
C2 C3 1.519(7) .
C3 N1 1.490(6) .
C4 N1 1.329(6) .
C4 N2 1.347(6) .
C4 C5 1.520(6) .
C5 C10 1.376(7) .
C5 C6 1.398(7) .
C6 C7 1.383(6) .
C7 C8 1.390(8) .
C8 C9 1.365(8) .
C9 C10 1.397(6) .
C11 N2 1.487(6) .
C11 C12 1.536(7) .
C11 C13 1.541(6) .
C14 Si1 1.876(5) .
C15 Si1 1.873(5) .
C16 Si1 1.874(7) .
C17 Si2 1.851(5) .
C18 Si2 1.856(5) .
C19 Si2 1.882(6) .
C20 N4 1.156(6) .
C20 Ru1 2.071(6) .
C21 N4 1.458(6) .
C21 C23 1.524(6) .
C21 C22 1.526(7) .
C21 C24 1.531(6) .
C25 C27 1.542(6) .
C26 C27 1.504(7) .
C27 N5 1.501(6) .
C28 N5 1.332(6) .
C28 N6 1.343(6) .
C28 C29 1.521(6) .
C29 C30 1.378(7) .
C29 C34 1.386(7) .
C30 C31 1.398(6) .
C31 C32 1.388(8) .
C32 C33 1.367(8) .
C33 C34 1.393(6) .
C35 N6 1.489(5) .
C35 C36 1.517(7) .
C35 C37 1.526(6) .
C38 Si3 1.875(4) .
C39 Si3 1.876(4) .
C40 Si3 1.863(6) .
C41 Si4 1.876(5) .
C42 Si4 1.858(5) .
C43 Si4 1.879(5) .
C44 N8 1.151(6) .
C44 Ru3 2.078(5) .
C45 N8 1.457(6) .
C45 C46 1.499(8) .
C45 C47 1.505(7) .
C45 C48 1.538(7) .
C49 C50 1.536(8) .
C50 C51 1.503(9) .
C51 C51 1.492(11) 3_675
C101 O101 1.153(5) .
C101 Ru1 1.876(5) .
C102 O102 1.155(5) .
C102 Ru1 1.859(5) .
C201 O201 1.153(5) .
C201 Ru2 1.877(5) .
C202 O202 1.151(5) .
C202 Ru2 1.937(5) .
C203 O203 1.154(5) .
C203 Ru2 1.913(5) .
C301 O301 1.144(5) .
C301 Ru3 1.883(5) .
C302 O302 1.145(5) .
C302 Ru3 1.875(5) .
C401 O401 1.151(5) .
C401 Ru4 1.880(5) .
C402 O402 1.148(5) .
C402 Ru4 1.936(4) .
C403 O403 1.157(5) .
C403 Ru4 1.915(5) .
Ge1 N7 1.879(4) .
Ge1 N6 1.949(3) .
Ge1 Ru3 2.4374(6) .
Ge1 Ru4 2.4485(7) .
Ge2 N3 1.885(4) .
Ge2 N2 1.954(3) .
Ge2 Ru1 2.4251(6) .
Ge2 Ru2 2.4721(7) .
N1 Ru1 2.186(3) .
N3 Si2 1.748(4) .
N3 Si1 1.763(4) .
N5 Ru3 2.206(3) .
N7 Si4 1.749(4) .
N7 Si3 1.770(4) .
Ru1 Ru2 3.1017(5) .
Ru2 Ru4 2.9183(6) .
Ru3 Ru4 3.0788(5) .
