#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:29:17 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179113 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/75/4307545.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_4307545
loop_
_publ_author_name
'Richard D. Adams'
'Erin M. Boswell'
'Burjor Captain'
'Mitul A. Patel'
_publ_section_title
;
Multiple Additions of Phenylgermanium Ligands to Tetraruthenium and
Tetraosmium Carbonyl Cluster Complexes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              533
_journal_page_last               540
_journal_paper_doi               10.1021/ic062039w
_journal_volume                  46
_journal_year                    2007
_chemical_formula_sum            'C64 H48 Ge5 O9 Os4'
_chemical_formula_weight         2084.77
_chemical_name_systematic
; 
 ? 
;
_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                104.8460(10)
_cell_angle_beta                 106.6650(10)
_cell_angle_gamma                112.6650(10)
_cell_formula_units_Z            2
_cell_length_a                   14.1902(6)
_cell_length_b                   17.1633(7)
_cell_length_c                   18.0443(7)
_cell_measurement_reflns_used    8325
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      28.31
_cell_measurement_theta_min      2.28
_cell_volume                     3534.9(3)
_computing_cell_refinement       'SAINT+  V6.45 (Bruker, 2003)'
_computing_data_collection       'SMART V5.632 (Bruker, 2005)'
_computing_data_reduction        'SAINT+  V6.45'
_computing_molecular_graphics    'SHELXTL V6.1 (Sheldrick, 2000)'
_computing_publication_material  'SHELXTL V6.1'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'Bruker SMART APEX CCD diffractometer'
_diffrn_measurement_method       'omega scans'
_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  0.0337
_diffrn_reflns_av_sigmaI/netI    0.0377
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            48644
_diffrn_reflns_theta_full        28.31
_diffrn_reflns_theta_max         28.31
_diffrn_reflns_theta_min         1.47
_diffrn_standards_decay_%        <1
_exptl_absorpt_coefficient_mu    9.299
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.438
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS, Bruker, 1997)'
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.959
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             1936
_exptl_crystal_size_max          0.42
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.10
_refine_diff_density_max         2.870
_refine_diff_density_min         -1.471
_refine_diff_density_rms         0.259
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.059
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     740
_refine_ls_number_reflns         17511
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.059
_refine_ls_R_factor_all          0.0340
_refine_ls_R_factor_gt           0.0288
_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)+(0.0483P)²+13.7280P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0939
_refine_ls_wR_factor_ref         0.0968
_reflns_number_gt                15301
_reflns_number_total             17511
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic062039wsi20061024_100643_4.cif
_cod_data_source_block           Compound14
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-scan' changed
to 'multi-scan' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_cell_volume        3534.9(2)
_cod_database_code               4307545
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
Os1 Os 0.784186(15) 0.928283(13) 0.762682(11) 0.01749(5) Uani 1 1 d . . .
Os2 Os 0.548815(15) 0.805269(12) 0.729000(11) 0.01640(5) Uani 1 1 d . . .
Os3 Os 0.474197(14) 0.897252(12) 0.628415(11) 0.01682(5) Uani 1 1 d . . .
Os4 Os 0.698946(14) 1.013423(12) 0.658543(11) 0.01677(5) Uani 1 1 d . . .
Ge1 Ge 0.64322(4) 0.98204(3) 0.77780(3) 0.01756(10) Uani 1 1 d . . .
Ge2 Ge 0.61263(4) 0.83687(3) 0.61540(3) 0.01766(10) Uani 1 1 d . . .
Ge3 Ge 0.34696(4) 0.74915(4) 0.63147(3) 0.02024(10) Uani 1 1 d . . .
Ge4 Ge 0.72377(4) 0.83070(4) 0.84055(3) 0.02030(10) Uani 1 1 d . . .
Ge5 Ge 0.89659(4) 1.03559(4) 0.71140(3) 0.02149(11) Uani 1 1 d . . .
O1 O 0.5213(3) 1.0670(3) 0.5859(3) 0.0284(8) Uani 1 1 d . . .
O11 O 0.8785(4) 0.8070(3) 0.7006(3) 0.0395(10) Uani 1 1 d . . .
O12 O 0.9790(4) 1.0476(3) 0.9398(3) 0.0507(13) Uani 1 1 d . . .
O21 O 0.4807(4) 0.6018(3) 0.6488(3) 0.0456(11) Uani 1 1 d . . .
O22 O 0.4742(4) 0.8096(3) 0.8714(3) 0.0408(10) Uani 1 1 d . . .
O31 O 0.2994(4) 0.7999(3) 0.4433(3) 0.0417(11) Uani 1 1 d . . .
O32 O 0.3589(4) 0.9912(3) 0.7020(3) 0.0398(10) Uani 1 1 d . . .
O41 O 0.7294(3) 1.0189(3) 0.4993(3) 0.0375(10) Uani 1 1 d . . .
O42 O 0.8140(4) 1.2230(3) 0.7507(3) 0.0454(11) Uani 1 1 d . . .
C1 C 0.5487(4) 1.0183(3) 0.6090(3) 0.0216(9) Uani 1 1 d . . .
C11 C 0.8445(5) 0.8531(4) 0.7244(4) 0.0277(11) Uani 1 1 d . . .
C12 C 0.9062(5) 1.0062(4) 0.8734(4) 0.0316(12) Uani 1 1 d . . .
C21 C 0.5072(5) 0.6786(4) 0.6793(3) 0.0261(10) Uani 1 1 d . . .
C22 C 0.5009(4) 0.8072(4) 0.8170(3) 0.0241(10) Uani 1 1 d . . .
C31 C 0.3653(4) 0.8364(4) 0.5116(3) 0.0262(10) Uani 1 1 d . . .
C32 C 0.3984(4) 0.9528(4) 0.6736(3) 0.0256(10) Uani 1 1 d . . .
C41 C 0.7175(4) 1.0157(4) 0.5582(3) 0.0246(10) Uani 1 1 d . . .
C42 C 0.7726(4) 1.1450(4) 0.7162(3) 0.0269(11) Uani 1 1 d . . .
C56 C 0.7482(10) 0.5859(6) 0.8100(7) 0.088(4) Uani 1 1 d . . .
H56 H 0.6998 0.5223 0.7882 0.105 Uiso 1 1 calc R . .
C70 C 0.6505(4) 1.0736(3) 0.8715(3) 0.0224(10) Uani 1 1 d . . .
C71 C 0.5616(5) 1.0498(4) 0.8957(4) 0.0315(12) Uani 1 1 d . . .
H71 H 0.4981 0.9909 0.8651 0.038 Uiso 1 1 calc R . .
C72 C 0.5672(6) 1.1129(5) 0.9647(4) 0.0403(15) Uani 1 1 d . . .
H72 H 0.5080 1.0963 0.9806 0.048 Uiso 1 1 calc R . .
C73 C 0.6610(6) 1.2007(5) 1.0099(4) 0.0413(15) Uani 1 1 d . . .
H73 H 0.6649 1.2431 1.0563 0.050 Uiso 1 1 calc R . .
C74 C 0.7493(6) 1.2258(4) 0.9864(4) 0.0394(14) Uani 1 1 d . . .
H74 H 0.8121 1.2851 1.0170 0.047 Uiso 1 1 calc R . .
C75 C 0.7442(5) 1.1625(4) 0.9170(4) 0.0297(11) Uani 1 1 d . . .
H75 H 0.8035 1.1796 0.9012 0.036 Uiso 1 1 calc R . .
C76 C 1.0167(4) 1.1635(4) 0.7841(4) 0.0278(11) Uani 1 1 d . . .
C77 C 1.0399(5) 1.2094(4) 0.8684(4) 0.0395(14) Uani 1 1 d . . .
H77 H 0.9979 1.1776 0.8926 0.047 Uiso 1 1 calc R . .
C78 C 1.1232(6) 1.3004(5) 0.9166(5) 0.0524(19) Uani 1 1 d . . .
H78 H 1.1385 1.3289 0.9732 0.063 Uiso 1 1 calc R . .
C79 C 1.1848(6) 1.3499(5) 0.8810(5) 0.055(2) Uani 1 1 d . . .
H79 H 1.2425 1.4111 0.9139 0.066 Uiso 1 1 calc R . .
C80 C 1.1599(7) 1.3080(5) 0.7965(6) 0.059(2) Uani 1 1 d . . .
H80 H 1.1986 1.3416 0.7717 0.071 Uiso 1 1 calc R . .
C81 C 1.0764(5) 1.2146(5) 0.7483(4) 0.0405(14) Uani 1 1 d . . .
H81 H 1.0606 1.1863 0.6915 0.049 Uiso 1 1 calc R . .
C82 C 0.9476(4) 0.9831(4) 0.6322(3) 0.0260(10) Uani 1 1 d . . .
C83 C 0.8722(5) 0.9080(4) 0.5552(4) 0.0344(13) Uani 1 1 d . . .
H83 H 0.7950 0.8844 0.5393 0.041 Uiso 1 1 calc R . .
C84 C 0.9075(6) 0.8666(5) 0.5006(4) 0.0399(14) Uani 1 1 d . . .
H84 H 0.8548 0.8157 0.4493 0.048 Uiso 1 1 calc R . .
C85 C 1.0219(6) 0.9020(5) 0.5235(4) 0.0427(16) Uani 1 1 d . . .
H85 H 1.0465 0.8754 0.4869 0.051 Uiso 1 1 calc R . .
C86 C 1.1006(6) 0.9769(5) 0.6007(4) 0.0404(15) Uani 1 1 d . . .
H86 H 1.1776 0.9999 0.6161 0.049 Uiso 1 1 calc R . .
C87 C 1.0641(5) 1.0176(5) 0.6551(4) 0.0323(12) Uani 1 1 d . . .
H87 H 1.1170 1.0679 0.7067 0.039 Uiso 1 1 calc R . .
C88 C 0.5983(4) 0.7472(4) 0.5161(3) 0.0235(10) Uani 1 1 d . . .
C89 C 0.5595(6) 0.7499(4) 0.4377(4) 0.0365(13) Uani 1 1 d . . .
H89 H 0.5397 0.7945 0.4320 0.044 Uiso 1 1 calc R . .
C90 C 0.5505(8) 0.6851(6) 0.3676(4) 0.061(2) Uani 1 1 d . . .
H90 H 0.5253 0.6872 0.3149 0.073 Uiso 1 1 calc R . .
C91 C 0.5781(8) 0.6179(6) 0.3748(5) 0.067(2) Uani 1 1 d . . .
H91 H 0.5698 0.5741 0.3270 0.080 Uiso 1 1 calc R . .
C92 C 0.6175(7) 0.6158(5) 0.4515(5) 0.056(2) Uani 1 1 d . . .
H92 H 0.6381 0.5714 0.4566 0.067 Uiso 1 1 calc R . .
C93 C 0.6274(5) 0.6795(4) 0.5229(4) 0.0357(13) Uani 1 1 d . . .
H93 H 0.6535 0.6771 0.5753 0.043 Uiso 1 1 calc R . .
C94 C 0.7747(5) 0.7394(4) 0.8390(4) 0.0294(11) Uani 1 1 d . . .
C95 C 0.8917(5) 0.7742(5) 0.8767(4) 0.0394(14) Uani 1 1 d . . .
H95 H 0.9404 0.8378 0.8996 0.047 Uiso 1 1 calc R . .
C96 C 0.9362(7) 0.7161(6) 0.8803(5) 0.054(2) Uani 1 1 d . . .
H96 H 1.0142 0.7405 0.9056 0.065 Uiso 1 1 calc R . .
C97 C 0.8648(10) 0.6217(7) 0.8465(6) 0.071(3) Uani 1 1 d . . .
H97 H 0.8945 0.5821 0.8481 0.086 Uiso 1 1 calc R . .
C98 C 0.7046(7) 0.6443(5) 0.8062(6) 0.063(2) Uani 1 1 d . . .
H98 H 0.6264 0.6197 0.7811 0.076 Uiso 1 1 calc R . .
C99 C 0.7519(4) 0.8892(4) 0.9587(3) 0.0258(10) Uani 1 1 d . . .
C100 C 0.7527(5) 0.8407(5) 1.0092(4) 0.0354(13) Uani 1 1 d . . .
H100 H 0.7437 0.7816 0.9874 0.043 Uiso 1 1 calc R . .
C101 C 0.7666(7) 0.8787(6) 1.0919(4) 0.0485(17) Uani 1 1 d . . .
H101 H 0.7675 0.8453 1.1251 0.058 Uiso 1 1 calc R . .
C102 C 0.7791(7) 0.9651(6) 1.1249(4) 0.0502(18) Uani 1 1 d . . .
H102 H 0.7875 0.9899 1.1802 0.060 Uiso 1 1 calc R . .
C103 C 0.7792(7) 1.0160(5) 1.0762(4) 0.0503(18) Uani 1 1 d . . .
H103 H 0.7888 1.0752 1.0986 0.060 Uiso 1 1 calc R . .
C104 C 0.7648(5) 0.9770(4) 0.9931(4) 0.0361(13) Uani 1 1 d . . .
H104 H 0.7639 1.0105 0.9600 0.043 Uiso 1 1 calc R . .
C105 C 0.2713(4) 0.6312(4) 0.5330(3) 0.0266(11) Uani 1 1 d . . .
C106 C 0.3211(5) 0.6138(5) 0.4797(4) 0.0448(16) Uani 1 1 d . . .
H106 H 0.3887 0.6618 0.4881 0.054 Uiso 1 1 calc R . .
C107 C 0.2744(6) 0.5280(5) 0.4147(5) 0.060(2) Uani 1 1 d . . .
H107 H 0.3103 0.5186 0.3803 0.072 Uiso 1 1 calc R . .
C108 C 0.1743(6) 0.4564(5) 0.4012(5) 0.056(2) Uani 1 1 d . . .
H108 H 0.1425 0.3981 0.3577 0.067 Uiso 1 1 calc R . .
C109 C 0.1208(6) 0.4713(5) 0.4526(5) 0.055(2) Uani 1 1 d . . .
H109 H 0.0529 0.4230 0.4433 0.066 Uiso 1 1 calc R . .
C110 C 0.1689(5) 0.5585(4) 0.5179(4) 0.0386(14) Uani 1 1 d . . .
H110 H 0.1324 0.5683 0.5517 0.046 Uiso 1 1 calc R . .
C111 C 0.2346(4) 0.7490(3) 0.6741(3) 0.0233(10) Uani 1 1 d . . .
C112 C 0.2181(4) 0.7117(4) 0.7319(4) 0.0268(11) Uani 1 1 d . . .
H112 H 0.2594 0.6839 0.7501 0.032 Uiso 1 1 calc R . .
C113 C 0.1400(5) 0.7155(4) 0.7631(4) 0.0307(12) Uani 1 1 d . . .
H113 H 0.1313 0.6920 0.8032 0.037 Uiso 1 1 calc R . .
C114 C 0.0757(4) 0.7539(4) 0.7349(4) 0.0293(11) Uani 1 1 d . . .
H114 H 0.0237 0.7564 0.7559 0.035 Uiso 1 1 calc R . .
C115 C 0.0888(5) 0.7887(4) 0.6751(4) 0.0314(12) Uani 1 1 d . . .
H115 H 0.0449 0.8140 0.6553 0.038 Uiso 1 1 calc R . .
C116 C 0.1673(4) 0.7858(4) 0.6445(4) 0.0299(11) Uani 1 1 d . . .
H116 H 0.1750 0.8086 0.6038 0.036 Uiso 1 1 calc R . .
C1S C 0.2260(15) 0.4745(11) 0.6805(9) 0.107(5) Uani 1 1 d . . .
H1S H 0.2398 0.4531 0.6342 0.128 Uiso 1 1 calc R . .
C2S C 0.1209(14) 0.4489(11) 0.6705(10) 0.110(4) Uani 1 1 d . . .
H2S H 0.0625 0.4116 0.6160 0.133 Uiso 1 1 calc R . .
C3S C 0.0950(13) 0.4726(10) 0.7315(11) 0.095(4) Uani 1 1 d . . .
C4S C 0.1768(14) 0.5291(9) 0.8129(10) 0.089(4) Uani 1 1 d . . .
H4S H 0.1556 0.5451 0.8562 0.107 Uiso 1 1 calc R . .
C5S C 0.2930(14) 0.5637(8) 0.8327(9) 0.100(4) Uani 1 1 d . . .
H5S H 0.3498 0.6025 0.8876 0.120 Uiso 1 1 calc R . .
C6S C 0.3168(13) 0.5342(10) 0.7615(11) 0.104(5) Uani 1 1 d . . .
H6S H 0.3912 0.5542 0.7688 0.124 Uiso 1 1 calc R . .
C7S C -0.0264(17) 0.4368(15) 0.7132(13) 0.176(8) Uani 1 1 d . . .
H7S1 H -0.0717 0.4072 0.6528 0.264 Uiso 1 1 calc R . .
H7S2 H -0.0374 0.4874 0.7378 0.264 Uiso 1 1 calc R . .
H7S3 H -0.0486 0.3927 0.7371 0.264 Uiso 1 1 calc R . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
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'
O O 0.0106 0.0060 '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'
Os Os -1.2165 7.6030 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C11 Os1 C12 97.2(3) . . ?
C11 Os1 Ge5 85.42(17) . . ?
C12 Os1 Ge5 87.04(17) . . ?
C11 Os1 Ge4 87.19(16) . . ?
C12 Os1 Ge4 80.26(17) . . ?
Ge5 Os1 Ge4 164.389(18) . . ?
C11 Os1 Ge1 161.33(18) . . ?
C12 Os1 Ge1 99.75(19) . . ?
Ge5 Os1 Ge1 103.180(18) . . ?
Ge4 Os1 Ge1 87.990(17) . . ?
C11 Os1 Ge2 88.86(17) . . ?
C12 Os1 Ge2 173.64(19) . . ?
Ge5 Os1 Ge2 91.504(18) . . ?
Ge4 Os1 Ge2 102.088(18) . . ?
Ge1 Os1 Ge2 74.552(16) . . ?
C11 Os1 Os4 120.72(16) . . ?
C12 Os1 Os4 119.14(18) . . ?
Ge5 Os1 Os4 54.717(13) . . ?
Ge4 Os1 Os4 140.200(14) . . ?
Ge1 Os1 Os4 56.187(12) . . ?
Ge2 Os1 Os4 55.443(12) . . ?
C11 Os1 Os2 108.36(17) . . ?
C12 Os1 Os2 124.45(18) . . ?
Ge5 Os1 Os2 141.859(14) . . ?
Ge4 Os1 Os2 53.726(13) . . ?
Ge1 Os1 Os2 54.995(13) . . ?
Ge2 Os1 Os2 54.685(12) . . ?
Os4 Os1 Os2 88.718(7) . . ?
C21 Os2 C22 100.8(2) . . ?
C21 Os2 Ge4 88.07(16) . . ?
C22 Os2 Ge4 81.85(15) . . ?
C21 Os2 Ge3 83.88(16) . . ?
C22 Os2 Ge3 86.71(15) . . ?
Ge4 Os2 Ge3 164.545(19) . . ?
C21 Os2 Ge2 91.48(16) . . ?
C22 Os2 Ge2 167.08(17) . . ?
Ge4 Os2 Ge2 102.853(18) . . ?
Ge3 Os2 Ge2 90.551(17) . . ?
C21 Os2 Ge1 164.29(17) . . ?
C22 Os2 Ge1 93.69(16) . . ?
Ge4 Os2 Ge1 87.934(17) . . ?
Ge3 Os2 Ge1 103.214(17) . . ?
Ge2 Os2 Ge1 74.633(16) . . ?
C21 Os2 Os3 121.98(16) . . ?
C22 Os2 Os3 113.14(16) . . ?
Ge4 Os2 Os3 140.333(14) . . ?
Ge3 Os2 Os3 54.357(13) . . ?
Ge2 Os2 Os3 55.778(12) . . ?
Ge1 Os2 Os3 55.884(12) . . ?
C21 Os2 Os1 111.43(17) . . ?
C22 Os2 Os1 122.29(15) . . ?
Ge4 Os2 Os1 54.042(13) . . ?
Ge3 Os2 Os1 141.385(14) . . ?
Ge2 Os2 Os1 55.227(12) . . ?
Ge1 Os2 Os1 54.602(12) . . ?
Os3 Os2 Os1 88.792(7) . . ?
C32 Os3 C31 97.5(2) . . ?
C32 Os3 C1 85.3(2) . . ?
C31 Os3 C1 88.5(2) . . ?
C32 Os3 Ge3 88.45(16) . . ?
C31 Os3 Ge3 82.10(16) . . ?
C1 Os3 Ge3 167.94(13) . . ?
C32 Os3 Ge2 162.57(16) . . ?
C31 Os3 Ge2 99.54(17) . . ?
C1 Os3 Ge2 98.88(13) . . ?
Ge3 Os3 Ge2 90.117(17) . . ?
C32 Os3 Ge1 89.57(16) . . ?
C31 Os3 Ge1 171.66(16) . . ?
C1 Os3 Ge1 87.67(13) . . ?
Ge3 Os3 Ge1 102.637(17) . . ?
Ge2 Os3 Ge1 73.797(16) . . ?
C32 Os3 Os4 118.37(16) . . ?
C31 Os3 Os4 115.01(16) . . ?
C1 Os3 Os4 47.81(13) . . ?
Ge3 Os3 Os4 143.734(14) . . ?
Ge2 Os3 Os4 56.777(13) . . ?
Ge1 Os3 Os4 57.259(12) . . ?
C32 Os3 Os2 111.12(16) . . ?
C31 Os3 Os2 125.37(16) . . ?
C1 Os3 Os2 137.51(13) . . ?
Ge3 Os3 Os2 54.528(13) . . ?
Ge2 Os3 Os2 54.999(12) . . ?
Ge1 Os3 Os2 55.060(12) . . ?
Os4 Os3 Os2 91.316(7) . . ?
C42 Os4 C41 94.2(2) . . ?
C42 Os4 C1 86.4(2) . . ?
C41 Os4 C1 88.7(2) . . ?
C42 Os4 Ge5 85.08(16) . . ?
C41 Os4 Ge5 84.09(15) . . ?
C1 Os4 Ge5 168.41(14) . . ?
C42 Os4 Ge2 166.79(16) . . ?
C41 Os4 Ge2 97.91(16) . . ?
C1 Os4 Ge2 99.13(14) . . ?
Ge5 Os4 Ge2 90.867(17) . . ?
C42 Os4 Ge1 94.73(17) . . ?
C41 Os4 Ge1 170.06(16) . . ?
C1 Os4 Ge1 87.44(14) . . ?
Ge5 Os4 Ge1 101.081(17) . . ?
Ge2 Os4 Ge1 73.685(16) . . ?
C42 Os4 Os3 122.11(17) . . ?
C41 Os4 Os3 114.24(16) . . ?
C1 Os4 Os3 47.92(14) . . ?
Ge5 Os4 Os3 143.642(15) . . ?
Ge2 Os4 Os3 56.939(12) . . ?
Ge1 Os4 Os3 56.868(12) . . ?
C42 Os4 Os1 112.83(15) . . ?
C41 Os4 Os1 125.09(15) . . ?
C1 Os4 Os1 137.28(14) . . ?
Ge5 Os4 Os1 53.900(13) . . ?
Ge2 Os4 Os1 55.368(12) . . ?
Ge1 Os4 Os1 54.597(12) . . ?
Os3 Os4 Os1 91.164(8) . . ?
C70 Ge1 Os1 132.29(15) . . ?
C70 Ge1 Os2 128.83(16) . . ?
Os1 Ge1 Os2 70.403(14) . . ?
C70 Ge1 Os3 121.47(15) . . ?
Os1 Ge1 Os3 106.032(18) . . ?
Os2 Ge1 Os3 69.056(13) . . ?
C70 Ge1 Os4 125.02(16) . . ?
Os1 Ge1 Os4 69.216(13) . . ?
Os2 Ge1 Os4 105.377(18) . . ?
Os3 Ge1 Os4 65.873(13) . . ?
C88 Ge2 Os2 127.42(16) . . ?
C88 Ge2 Os1 125.87(16) . . ?
Os2 Ge2 Os1 70.089(14) . . ?
C88 Ge2 Os4 126.41(16) . . ?
Os2 Ge2 Os4 106.175(18) . . ?
Os1 Ge2 Os4 69.188(13) . . ?
C88 Ge2 Os3 128.57(16) . . ?
Os2 Ge2 Os3 69.223(13) . . ?
Os1 Ge2 Os3 105.489(18) . . ?
Os4 Ge2 Os3 66.283(13) . . ?
C105 Ge3 C111 106.3(2) . . ?
C105 Ge3 Os3 120.60(16) . . ?
C111 Ge3 Os3 117.70(15) . . ?
C105 Ge3 Os2 116.22(16) . . ?
C111 Ge3 Os2 122.32(15) . . ?
Os3 Ge3 Os2 71.115(14) . . ?
C99 Ge4 C94 104.5(2) . . ?
C99 Ge4 Os2 116.59(15) . . ?
C94 Ge4 Os2 125.50(17) . . ?
C99 Ge4 Os1 120.32(17) . . ?
C94 Ge4 Os1 116.15(17) . . ?
Os2 Ge4 Os1 72.233(15) . . ?
C76 Ge5 C82 106.9(2) . . ?
C76 Ge5 Os1 124.23(17) . . ?
C82 Ge5 Os1 116.32(16) . . ?
C76 Ge5 Os4 114.70(16) . . ?
C82 Ge5 Os4 120.50(16) . . ?
Os1 Ge5 Os4 71.383(14) . . ?
O1 C1 Os4 137.8(4) . . ?
O1 C1 Os3 137.9(4) . . ?
Os4 C1 Os3 84.27(18) . . ?
O11 C11 Os1 178.7(6) . . ?
O12 C12 Os1 175.5(5) . . ?
O21 C21 Os2 179.2(6) . . ?
O22 C22 Os2 178.6(5) . . ?
O31 C31 Os3 178.5(5) . . ?
O32 C32 Os3 175.7(5) . . ?
O41 C41 Os4 178.6(5) . . ?
O42 C42 Os4 178.4(5) . . ?
C98 C56 C97 120.0(8) . . ?
C75 C70 C71 119.0(5) . . ?
C75 C70 Ge1 121.2(4) . . ?
C71 C70 Ge1 119.8(4) . . ?
C72 C71 C70 120.7(5) . . ?
C73 C72 C71 119.7(6) . . ?
C72 C73 C74 120.4(5) . . ?
C73 C74 C75 120.2(6) . . ?
C70 C75 C74 120.0(5) . . ?
C81 C76 C77 117.7(6) . . ?
C81 C76 Ge5 118.5(5) . . ?
C77 C76 Ge5 123.6(4) . . ?
C78 C77 C76 121.6(6) . . ?
C77 C78 C79 120.1(7) . . ?
C80 C79 C78 119.6(7) . . ?
C79 C80 C81 119.9(7) . . ?
C76 C81 C80 120.9(7) . . ?
C83 C82 C87 117.8(5) . . ?
C83 C82 Ge5 121.7(4) . . ?
C87 C82 Ge5 120.3(4) . . ?
C82 C83 C84 122.3(6) . . ?
C85 C84 C83 119.1(6) . . ?
C84 C85 C86 120.5(6) . . ?
C85 C86 C87 119.9(6) . . ?
C86 C87 C82 120.4(6) . . ?
C89 C88 C93 119.2(5) . . ?
C89 C88 Ge2 120.2(4) . . ?
C93 C88 Ge2 120.5(4) . . ?
C88 C89 C90 119.1(6) . . ?
C91 C90 C89 121.1(7) . . ?
C92 C91 C90 119.9(7) . . ?
C91 C92 C93 120.3(7) . . ?
C92 C93 C88 120.2(6) . . ?
C98 C94 C95 117.9(6) . . ?
C98 C94 Ge4 125.4(5) . . ?
C95 C94 Ge4 116.7(4) . . ?
C96 C95 C94 121.3(7) . . ?
C95 C96 C97 119.8(8) . . ?
C96 C97 C56 119.7(7) . . ?
C56 C98 C94 121.2(8) . . ?
C100 C99 C104 118.0(5) . . ?
C100 C99 Ge4 119.8(4) . . ?
C104 C99 Ge4 122.1(4) . . ?
C99 C100 C101 121.0(6) . . ?
C102 C101 C100 120.4(6) . . ?
C101 C102 C103 120.2(6) . . ?
C102 C103 C104 119.0(7) . . ?
C99 C104 C103 121.4(6) . . ?
C106 C105 C110 117.5(5) . . ?
C106 C105 Ge3 121.6(4) . . ?
C110 C105 Ge3 120.7(4) . . ?
C107 C106 C105 122.5(6) . . ?
C108 C107 C106 119.5(7) . . ?
C107 C108 C109 119.8(6) . . ?
C108 C109 C110 120.0(6) . . ?
C109 C110 C105 120.6(6) . . ?
C112 C111 C116 118.5(5) . . ?
C112 C111 Ge3 122.1(4) . . ?
C116 C111 Ge3 119.4(4) . . ?
C111 C112 C113 120.6(5) . . ?
C114 C113 C112 120.4(5) . . ?
C113 C114 C115 119.6(5) . . ?
C114 C115 C116 120.1(5) . . ?
C115 C116 C111 120.8(5) . . ?
C2S C1S C6S 119.8(13) . . ?
C3S C2S C1S 123.7(16) . . ?
C2S C3S C4S 121.1(14) . . ?
C2S C3S C7S 119.0(18) . . ?
C4S C3S C7S 120.0(15) . . ?
C3S C4S C5S 121.4(11) . . ?
C4S C5S C6S 114.9(13) . . ?
C1S C6S C5S 119.0(13) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Os1 C11 1.899(5) . ?
Os1 C12 1.908(6) . ?
Os1 Ge5 2.4996(5) . ?
Os1 Ge4 2.5108(5) . ?
Os1 Ge1 2.5560(5) . ?
Os1 Ge2 2.5807(5) . ?
Os1 Os4 2.9318(3) . ?
Os1 Os2 2.9540(3) . ?
Os2 C21 1.894(5) . ?
Os2 C22 1.896(5) . ?
Os2 Ge4 2.5007(5) . ?
Os2 Ge3 2.5186(5) . ?
Os2 Ge2 2.5636(5) . ?
Os2 Ge1 2.5684(5) . ?
Os2 Os3 2.9261(3) . ?
Os3 C32 1.904(5) . ?
Os3 C31 1.919(5) . ?
Os3 C1 2.109(5) . ?
Os3 Ge3 2.5132(5) . ?
Os3 Ge2 2.5878(5) . ?
Os3 Ge1 2.5939(5) . ?
Os3 Os4 2.8269(3) . ?
Os4 C42 1.905(5) . ?
Os4 C41 1.910(5) . ?
Os4 C1 2.105(5) . ?
Os4 Ge5 2.5254(5) . ?
Os4 Ge2 2.5830(5) . ?
Os4 Ge1 2.6054(5) . ?
Ge1 C70 1.936(5) . ?
Ge2 C88 1.938(5) . ?
Ge3 C105 1.948(5) . ?
Ge3 C111 1.958(5) . ?
Ge4 C99 1.954(5) . ?
Ge4 C94 1.960(6) . ?
Ge5 C76 1.950(5) . ?
Ge5 C82 1.952(5) . ?
O1 C1 1.166(6) . ?
O11 C11 1.133(7) . ?
O12 C12 1.139(7) . ?
O21 C21 1.145(7) . ?
O22 C22 1.146(6) . ?
O31 C31 1.131(7) . ?
O32 C32 1.135(7) . ?
O41 C41 1.135(6) . ?
O42 C42 1.131(7) . ?
C56 C98 1.373(11) . ?
C56 C97 1.390(15) . ?
C70 C75 1.392(7) . ?
C70 C71 1.400(7) . ?
C71 C72 1.385(8) . ?
C72 C73 1.382(9) . ?
C73 C74 1.384(10) . ?
C74 C75 1.395(8) . ?
C76 C81 1.392(8) . ?
C76 C77 1.393(9) . ?
C77 C78 1.373(9) . ?
C78 C79 1.390(11) . ?
C79 C80 1.377(12) . ?
C80 C81 1.400(10) . ?
C82 C83 1.380(8) . ?
C82 C87 1.408(7) . ?
C83 C84 1.389(8) . ?
C84 C85 1.379(9) . ?
C85 C86 1.387(10) . ?
C86 C87 1.393(8) . ?
C88 C89 1.384(8) . ?
C88 C93 1.396(8) . ?
C89 C90 1.389(9) . ?
C90 C91 1.378(12) . ?
C91 C92 1.352(12) . ?
C92 C93 1.389(9) . ?
C94 C98 1.385(9) . ?
C94 C95 1.399(8) . ?
C95 C96 1.374(9) . ?
C96 C97 1.378(13) . ?
C99 C100 1.384(8) . ?
C99 C104 1.391(8) . ?
C100 C101 1.388(9) . ?
C101 C102 1.367(11) . ?
C102 C103 1.390(10) . ?
C103 C104 1.393(8) . ?
C105 C106 1.385(8) . ?
C105 C110 1.394(8) . ?
C106 C107 1.379(9) . ?
C107 C108 1.374(10) . ?
C108 C109 1.391(10) . ?
C109 C110 1.394(9) . ?
C111 C112 1.386(7) . ?
C111 C116 1.393(7) . ?
C112 C113 1.393(7) . ?
C113 C114 1.376(8) . ?
C114 C115 1.384(8) . ?
C115 C116 1.389(8) . ?
C1S C2S 1.324(19) . ?
C1S C6S 1.41(2) . ?
C2S C3S 1.276(18) . ?
C3S C4S 1.367(19) . ?
C3S C7S 1.49(2) . ?
C4S C5S 1.413(18) . ?
C5S C6S 1.439(17) . ?
