#------------------------------------------------------------------------------
#$Date: 2017-03-05 07:17:27 +0200 (Sun, 05 Mar 2017) $
#$Revision: 193832 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/04/18/7041889.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_7041889
loop_
_publ_author_name
'Tanimoto, Hiroki'
'Fujiwara, Taro'
'Mori, Junta'
'Nagao, Tomohiko'
'Nishiyama, Yasuhiro'
'Morimoto, Tsumoru'
'Ito, Shunichiro'
'Tanaka, Kazuo'
'Chujo, Yoshiki'
'Kakiuchi, Kiyomi'
_publ_section_title
;
 Extended germa[N]pericyclynes: synthesis and characterization.
;
_journal_issue                   7
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2281
_journal_page_last               2288
_journal_paper_doi               10.1039/c6dt04633a
_journal_volume                  46
_journal_year                    2017
_chemical_formula_moiety         'C80 H40 Ge5, C6'
_chemical_formula_sum            'C86 H40 Ge5'
_chemical_formula_weight         1436.21
_chemical_name_common            'Ext_PhGe[5] with hexane'
_chemical_name_systematic        'extended decaphenyl germa[5]pericyclyne'
_space_group_crystal_system      orthorhombic
_space_group_IT_number           62
_space_group_name_Hall           '-P 2ac 2n'
_space_group_name_H-M_alt        'P n m a'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_update_record
;
2016-11-12 deposited with the CCDC.
2017-01-16 downloaded from the CCDC.
;
_cell_angle_alpha                90.0000
_cell_angle_beta                 90.0000
_cell_angle_gamma                90.0000
_cell_formula_units_Z            4
_cell_length_a                   30.1774(6)
_cell_length_b                   27.4706(5)
_cell_length_c                   8.96993(16)
_cell_measurement_reflns_used    73340
_cell_measurement_temperature    123
_cell_measurement_theta_max      25.36
_cell_measurement_theta_min      3.03
_cell_volume                     7436.0(2)
_computing_cell_refinement       'RAPID AUTO'
_computing_data_collection       'RAPID AUTO (Rigaku, ????)'
_computing_data_reduction        'RAPID AUTO'
_computing_molecular_graphics    'CrystalStructure 4.2'
_computing_publication_material  'CrystalStructure 4.2 (Rigaku, 2015)'
_computing_structure_refinement  'SHELXL Version 2014/7 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT Version 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      123
_diffrn_detector_area_resol_mean 10.000
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       ω
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0502
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       36
_diffrn_reflns_limit_h_min       -36
_diffrn_reflns_limit_k_max       33
_diffrn_reflns_limit_k_min       -33
_diffrn_reflns_limit_l_max       10
_diffrn_reflns_limit_l_min       -10
_diffrn_reflns_number            100653
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.351
_diffrn_reflns_theta_min         3.030
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    2.038
_exptl_absorpt_correction_T_max  0.903
_exptl_absorpt_correction_T_min  0.736
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'ABSCOR (Rigaku, 1995)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.283
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             2864.00
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.090
_exptl_crystal_size_min          0.050
_refine_diff_density_max         1.15
_refine_diff_density_min         -1.14
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.034
_refine_ls_hydrogen_treatment    mixed
_refine_ls_number_parameters     504
_refine_ls_number_reflns         6951
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0590
_refine_ls_R_factor_gt           0.0467
_refine_ls_shift/su_max          0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[σ²(Fo²)+(0.0453P)²+20.4757P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1074
_refine_ls_wR_factor_ref         0.1136
_reflns_Friedel_coverage         0.000
_reflns_number_gt                5771
_reflns_number_total             6951
_reflns_threshold_expression     F²>2.0σ(F²)
_cod_data_source_file            c6dt04633a2.cif
_cod_data_source_block           Extended-Diphenyl-Ge5
_cod_depositor_comments
'Adding full bibliography for 7041886--7041889.cif.'
_cod_database_code               7041889
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 +X,+Y,+Z
2 1/2+X,1/2-Y,1/2-Z
3 -X,1/2+Y,-Z
4 1/2-X,-Y,1/2+Z
5 -X,-Y,-Z
6 -1/2-X,-1/2+Y,-1/2+Z
7 +X,-1/2-Y,+Z
8 -1/2+X,+Y,-1/2-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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ge1 Ge 0.79643(2) 0.7500 0.42905(5) 0.02518(13) Uani 1 2 d S T P A .
Ge2 Ge 0.65258(2) 0.57074(2) 0.84688(4) 0.03111(12) Uani 1 1 d . . . . .
Ge3 Ge 0.44164(2) 0.61167(2) 0.41292(5) 0.05855(18) Uani 1 1 d . . . . .
C1 C 0.76467(12) 0.69718(13) 0.5184(4) 0.0299(8) Uani 1 1 d . . . . .
C2 C 0.74083(12) 0.67097(12) 0.5884(4) 0.0282(7) Uani 1 1 d . . . . .
C3 C 0.71360(12) 0.64103(13) 0.6700(4) 0.0300(8) Uani 1 1 d . . . . .
C4 C 0.68930(12) 0.61544(14) 0.7416(4) 0.0351(8) Uani 1 1 d . . . . .
C5 C 0.59823(12) 0.57047(14) 0.7391(4) 0.0352(8) Uani 1 1 d . . . . .
C6 C 0.56423(12) 0.57519(15) 0.6704(4) 0.0356(9) Uani 1 1 d . . . . .
C7 C 0.52610(13) 0.58300(17) 0.5898(4) 0.0428(10) Uani 1 1 d . . . . .
C8 C 0.49314(14) 0.5914(2) 0.5194(4) 0.0547(13) Uani 1 1 d . . . . .
C9 C 0.44225(16) 0.6809(3) 0.4208(6) 0.0645(15) Uani 1 1 d . . . . .
C10 C 0.44256(15) 0.7241(3) 0.4215(5) 0.0673(17) Uani 1 1 d . . . . .
C11 C 0.78667(17) 0.7500 0.2165(5) 0.0319(11) Uani 1 2 d S T P . .
C12 C 0.8205(3) 0.7500 0.1170(8) 0.093(3) Uani 1 2 d S T P . .
H12 H 0.8502 0.7500 0.1516 0.112 Uiso 1 2 calc R U P . .
C13 C 0.8119(4) 0.7500 -0.0355(9) 0.116(4) Uani 1 2 d S T P . .
H13 H 0.8359 0.7500 -0.1041 0.139 Uiso 1 2 calc R U P . .
C14 C 0.7701(4) 0.7500 -0.0870(8) 0.074(2) Uani 1 2 d S T P . .
H14 H 0.7644 0.7500 -0.1911 0.089 Uiso 1 2 calc R U P . .
C15 C 0.7370(3) 0.7500 0.0097(9) 0.114(4) Uani 1 2 d S T P . .
H15 H 0.7074 0.7500 -0.0258 0.136 Uiso 1 2 calc R U P . .
C16 C 0.7450(3) 0.7500 0.1629(8) 0.095(3) Uani 1 2 d S T P . .
H16 H 0.7207 0.7500 0.2302 0.114 Uiso 1 2 calc R U P . .
C17 C 0.85644(17) 0.7500 0.4996(6) 0.0381(13) Uani 1 2 d S T P . .
C18 C 0.8698(3) 0.7844(4) 0.6054(11) 0.053(2) Uani 0.5 1 d . . P A -1
H18 H 0.8497 0.8089 0.6371 0.064 Uiso 0.5 1 calc R U P A -1
C19 C 0.9120(3) 0.7831(4) 0.6640(11) 0.063(3) Uani 0.5 1 d . . P A -1
H19 H 0.9205 0.8059 0.7383 0.075 Uiso 0.5 1 calc R U P A -1
C21 C 0.9290(5) 0.7183(7) 0.510(2) 0.159(9) Uani 0.5 1 d . . P A -1
H21 H 0.9500 0.6954 0.4739 0.190 Uiso 0.5 1 calc R U P A -1
C22 C 0.8865(4) 0.7189(6) 0.4513(19) 0.126(7) Uani 0.5 1 d . . P A -1
H22 H 0.8789 0.6965 0.3749 0.151 Uiso 0.5 1 calc R U P A -1
C20 C 0.9408(3) 0.7500 0.6168(12) 0.091(3) Uani 1 2 d S T P . .
H20 H 0.963(3) 0.7500 0.657(10) 0.09(3) Uiso 1 2 d S . P . .
C23 C 0.68256(12) 0.50899(15) 0.8372(4) 0.0358(9) Uani 1 1 d . . . . .
C24 C 0.70659(18) 0.49552(17) 0.7158(6) 0.0624(14) Uani 1 1 d . . . . .
H24 H 0.7084 0.5170 0.6331 0.075 Uiso 1 1 calc R U . . .
C25 C 0.7285(2) 0.45158(19) 0.7094(6) 0.0705(16) Uani 1 1 d . . . . .
H25 H 0.7451 0.4433 0.6231 0.085 Uiso 1 1 calc R U . . .
C26 C 0.72648(19) 0.4207(2) 0.8230(6) 0.0688(15) Uani 1 1 d . . . . .
H26 H 0.7388 0.3890 0.8154 0.083 Uiso 1 1 calc R U . . .
C27 C 0.7064(3) 0.4356(3) 0.9499(8) 0.126(4) Uani 1 1 d . . . . .
H27 H 0.7075 0.4154 1.0358 0.151 Uiso 1 1 calc R U . . .
C28 C 0.6844(3) 0.4797(2) 0.9569(7) 0.113(3) Uani 1 1 d . . . . .
H28 H 0.6705 0.4894 1.0471 0.135 Uiso 1 1 calc R U . . .
C29 C 0.64137(13) 0.59398(15) 1.0463(4) 0.0377(9) Uani 1 1 d . . . . .
C30 C 0.6049(2) 0.5777(3) 1.1225(7) 0.099(3) Uani 1 1 d . . . . .
H30 H 0.5846 0.5562 1.0754 0.119 Uiso 1 1 calc R U . . .
C31 C 0.5974(3) 0.5927(3) 1.2686(7) 0.123(3) Uani 1 1 d . . . . .
H31 H 0.5725 0.5804 1.3213 0.148 Uiso 1 1 calc R U . . .
C32 C 0.6249(2) 0.6241(2) 1.3361(5) 0.0694(15) Uani 1 1 d . . . . .
H32 H 0.6187 0.6355 1.4339 0.083 Uiso 1 1 calc R U . . .
C33 C 0.66123(17) 0.6392(2) 1.2638(5) 0.0630(14) Uani 1 1 d . . . . .
H33 H 0.6815 0.6604 1.3125 0.076 Uiso 1 1 calc R U . . .
C34 C 0.66962(14) 0.62433(19) 1.1185(5) 0.0509(11) Uani 1 1 d . . . . .
H34 H 0.6955 0.6356 1.0690 0.061 Uiso 1 1 calc R U . . .
C35A C 0.4456(6) 0.6019(5) 0.207(2) 0.039(3) Uani 0.526(8) 1 d . . P B 1
C36A C 0.4856(3) 0.6094(5) 0.1345(11) 0.075(4) Uani 0.526(8) 1 d . . P B 1
C37A C 0.4881(3) 0.6012(6) -0.0213(11) 0.087(4) Uani 0.526(8) 1 d . . P B 1
C38A C 0.4529(4) 0.5867(9) -0.0935(15) 0.088(6) Uani 0.526(8) 1 d . . P B 1
C39A C 0.4116(3) 0.5728(5) -0.0280(9) 0.063(3) Uani 0.526(8) 1 d . . P B 1
C40A C 0.4086(3) 0.5825(4) 0.1283(11) 0.045(3) Uani 0.526(8) 1 d . . P B 1
C35B C 0.4503(7) 0.5817(5) 0.207(2) 0.039(4) Uani 0.474(8) 1 d . . P B 2
C36B C 0.4763(3) 0.5436(4) 0.1743(12) 0.058(3) Uani 0.474(8) 1 d . . P B 2
C37B C 0.4820(4) 0.5271(5) 0.0244(14) 0.069(4) Uani 0.474(8) 1 d . . P B 2
C38B C 0.4595(5) 0.5512(5) -0.0855(12) 0.056(3) Uani 0.474(8) 1 d . . P B 2
C39B C 0.4330(8) 0.5906(9) -0.060(3) 0.107(8) Uiso 0.474(8) 1 d . . P B 2
C40B C 0.4295(9) 0.6089(8) 0.0933(14) 0.145(12) Uani 0.474(8) 1 d . . P B 2
C41 C 0.38948(14) 0.5888(3) 0.5150(5) 0.0671(17) Uani 1 1 d . . . . .
C42 C 0.35524(17) 0.6215(3) 0.5485(6) 0.088(2) Uani 1 1 d . . . . .
H42 H 0.3578 0.6548 0.5211 0.105 Uiso 1 1 calc R U . . .
C43 C 0.31761(19) 0.6050(4) 0.6222(7) 0.114(3) Uani 1 1 d . . . . .
H43 H 0.2948 0.6274 0.6473 0.136 Uiso 1 1 calc R U . . .
C44 C 0.3130(2) 0.5574(5) 0.6589(8) 0.126(4) Uani 1 1 d . . . . .
H44 H 0.2868 0.5465 0.7070 0.151 Uiso 1 1 calc R U . . .
C45 C 0.3464(2) 0.5246(4) 0.6263(8) 0.117(3) Uani 1 1 d . . . . .
H45 H 0.3432 0.4914 0.6534 0.140 Uiso 1 1 calc R U . . .
C46 C 0.38456(18) 0.5401(3) 0.5543(6) 0.088(2) Uani 1 1 d . . . . .
H46 H 0.4074 0.5174 0.5318 0.106 Uiso 1 1 calc R U . . .
C47 C 0.6345(5) 0.7500 0.5612(19) 0.135(5) Uani 1 2 d S T P . .
C48 C 0.6015(9) 0.7500 0.672(3) 0.289(15) Uani 1 2 d S T P . .
C49 C 0.6071(7) 0.7500 0.819(2) 0.178(8) Uani 1 2 d S T P . .
C50 C 0.5771(6) 0.7500 0.940(3) 0.214(10) Uani 1 2 d S T P . .
C51 C 0.5805(8) 0.7500 1.082(2) 0.244(12) Uani 1 2 d S T P . .
C52 C 0.5504(5) 0.7500 1.211(2) 0.203(8) Uani 1 2 d S T P . .
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 for Crystallography
(Vol. C, Tables 4.2.6.8 and 6.1.1.4)
;
H H 0.0000 0.0000
;
International Tables for Crystallography
(Vol. C, Table 6.1.1.4)
;
Ge Ge 0.1547 1.8001
;
International Tables for Crystallography
(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
C1 Ge1 C1 98.5(2) 7_575 .
C1 Ge1 C17 109.53(14) 7_575 .
C1 Ge1 C17 109.53(14) . .
C1 Ge1 C11 109.71(14) 7_575 .
C1 Ge1 C11 109.71(14) . .
C17 Ge1 C11 118.1(2) . .
C5 Ge2 C4 104.58(16) . .
C5 Ge2 C23 112.25(16) . .
C4 Ge2 C23 105.82(16) . .
C5 Ge2 C29 108.73(16) . .
C4 Ge2 C29 110.39(17) . .
C23 Ge2 C29 114.57(16) . .
C35A Ge3 C9 100.3(4) . .
C35A Ge3 C8 113.6(5) . .
C9 Ge3 C8 105.4(2) . .
C35A Ge3 C41 118.3(6) . .
C9 Ge3 C41 108.5(3) . .
C8 Ge3 C41 109.43(19) . .
C9 Ge3 C35B 115.8(5) . .
C8 Ge3 C35B 103.3(5) . .
C41 Ge3 C35B 113.8(6) . .
C2 C1 Ge1 167.7(3) . .
C1 C2 C3 179.5(4) . .
C4 C3 C2 178.9(4) . .
C3 C4 Ge2 175.6(3) . .
C6 C5 Ge2 173.6(4) . .
C5 C6 C7 177.0(5) . .
C8 C7 C6 177.9(5) . .
C7 C8 Ge3 174.0(5) . .
C10 C9 Ge3 178.2(5) . .
C9 C10 C10 179.5(4) . 7_575
C16 C11 C12 117.9(6) . .
C16 C11 Ge1 119.7(4) . .
C12 C11 Ge1 122.4(5) . .
C11 C12 C13 120.4(8) . .
C11 C12 H12 119.8 . .
C13 C12 H12 119.8 . .
C14 C13 C12 120.9(8) . .
C14 C13 H13 119.6 . .
C12 C13 H13 119.6 . .
C15 C14 C13 118.9(7) . .
C15 C14 H14 120.6 . .
C13 C14 H14 120.6 . .
C14 C15 C16 121.1(8) . .
C14 C15 H15 119.5 . .
C16 C15 H15 119.5 . .
C11 C16 C15 120.9(7) . .
C11 C16 H16 119.6 . .
C15 C16 H16 119.6 . .
C22 C17 C18 117.5(7) . .
C22 C17 Ge1 122.8(6) . .
C18 C17 Ge1 119.7(5) . .
C19 C18 C17 120.4(8) . .
C19 C18 H18 119.8 . .
C17 C18 H18 119.8 . .
C20 C19 C18 120.1(9) . .
C20 C19 H19 119.9 . .
C18 C19 H19 119.9 . .
C20 C21 C22 120.5(12) . .
C20 C21 H21 119.8 . .
C22 C21 H21 119.8 . .
C17 C22 C21 121.4(11) . .
C17 C22 H22 119.3 . .
C21 C22 H22 119.3 . .
C19 C20 C21 120.0(9) . .
C19 C20 H20 116(4) . .
C21 C20 H20 124(4) . .
C28 C23 C24 117.1(4) . .
C28 C23 Ge2 120.8(4) . .
C24 C23 Ge2 121.8(3) . .
C23 C24 C25 121.8(4) . .
C23 C24 H24 119.1 . .
C25 C24 H24 119.1 . .
C26 C25 C24 120.4(5) . .
C26 C25 H25 119.8 . .
C24 C25 H25 119.8 . .
C25 C26 C27 118.3(5) . .
C25 C26 H26 120.9 . .
C27 C26 H26 120.9 . .
C26 C27 C28 121.2(5) . .
C26 C27 H27 119.4 . .
C28 C27 H27 119.4 . .
C23 C28 C27 120.6(5) . .
C23 C28 H28 119.7 . .
C27 C28 H28 119.7 . .
C34 C29 C30 117.8(4) . .
C34 C29 Ge2 122.4(3) . .
C30 C29 Ge2 119.7(4) . .
C29 C30 C31 120.2(6) . .
C29 C30 H30 119.9 . .
C31 C30 H30 119.9 . .
C32 C31 C30 121.0(6) . .
C32 C31 H31 119.5 . .
C30 C31 H31 119.5 . .
C33 C32 C31 119.1(5) . .
C33 C32 H32 120.4 . .
C31 C32 H32 120.4 . .
C32 C33 C34 120.8(5) . .
C32 C33 H33 119.6 . .
C34 C33 H33 119.6 . .
C29 C34 C33 121.0(4) . .
C29 C34 H34 119.5 . .
C33 C34 H34 119.5 . .
C36A C35A C40A 120.4(14) . .
C36A C35A Ge3 119.8(12) . .
C40A C35A Ge3 119.6(11) . .
C35A C36A C37A 119.1(11) . .
C38A C37A C36A 119.5(10) . .
C37A C38A C39A 125.9(11) . .
C38A C39A C40A 114.1(10) . .
C35A C40A C39A 120.4(10) . .
C36B C35B C40B 120.8(16) . .
C36B C35B Ge3 126.2(12) . .
C40B C35B Ge3 112.7(11) . .
C35B C36B C37B 121.6(12) . .
C38B C37B C36B 117.9(11) . .
C38B C37B C37B 119.9(12) . 5_665
C36B C37B C37B 122.2(13) . 5_665
C37B C38B C39B 123.6(13) . .
C38B C39B C40B 117.9(18) . .
C35B C40B C39B 117.9(16) . .
C46 C41 C42 118.9(5) . .
C46 C41 Ge3 121.4(4) . .
C42 C41 Ge3 119.6(5) . .
C43 C42 C41 119.6(8) . .
C43 C42 H42 120.2 . .
C41 C42 H42 120.2 . .
C44 C43 C42 121.0(8) . .
C44 C43 H43 119.5 . .
C42 C43 H43 119.5 . .
C43 C44 C45 120.2(7) . .
C43 C44 H44 119.9 . .
C45 C44 H44 119.9 . .
C44 C45 C46 120.2(9) . .
C44 C45 H45 119.9 . .
C46 C45 H45 119.9 . .
C45 C46 C41 120.1(7) . .
C45 C46 H46 120.0 . .
C41 C46 H46 120.0 . .
C49 C48 C47 127(3) . .
C48 C49 C50 133(2) . .
C51 C50 C49 136(2) . .
C50 C51 C52 137(2) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ge1 C1 1.915(4) 7_575
Ge1 C1 1.915(4) .
Ge1 C17 1.919(5) .
Ge1 C11 1.929(5) .
Ge2 C5 1.904(4) .
Ge2 C4 1.905(4) .
Ge2 C23 1.924(4) .
Ge2 C29 1.929(4) .
Ge3 C35A 1.871(18) .
Ge3 C9 1.903(8) .
Ge3 C8 1.907(4) .
Ge3 C41 1.926(5) .
Ge3 C35B 2.036(19) .
C1 C2 1.196(5) .
C2 C3 1.374(5) .
C3 C4 1.202(5) .
C5 C6 1.204(5) .
C6 C7 1.376(5) .
C7 C8 1.201(6) .
C9 C10 1.188(8) .
C10 C10 1.420(15) 7_575
C11 C16 1.346(9) .
C11 C12 1.355(8) .
C12 C13 1.393(11) .
C12 H12 0.9500 .
C13 C14 1.343(13) .
C13 H13 0.9500 .
C14 C15 1.321(12) .
C14 H14 0.9500 .
C15 C16 1.395(10) .
C15 H15 0.9500 .
C16 H16 0.9500 .
C17 C22 1.320(12) .
C17 C18 1.400(9) .
C18 C19 1.378(13) .
C18 H18 0.9500 .
C19 C20 1.325(12) .
C19 H19 0.9500 .
C21 C20 1.343(15) .
C21 C22 1.385(16) .
C21 H21 0.9500 .
C22 H22 0.9500 .
C20 H20 0.77(9) .
C23 C28 1.342(6) .
C23 C24 1.360(6) .
C24 C25 1.377(7) .
C24 H24 0.9500 .
C25 C26 1.327(7) .
C25 H25 0.9500 .
C26 C27 1.352(8) .
C26 H26 0.9500 .
C27 C28 1.383(8) .
C27 H27 0.9500 .
C28 H28 0.9500 .
C29 C34 1.357(6) .
C29 C30 1.371(6) .
C30 C31 1.391(8) .
C30 H30 0.9500 .
C31 C32 1.342(8) .
C31 H31 0.9500 .
C32 C33 1.340(7) .
C32 H32 0.9500 .
C33 C34 1.389(6) .
C33 H33 0.9500 .
C34 H34 0.9500 .
C35A C36A 1.39(2) .
C35A C40A 1.42(2) .
C36A C37A 1.418(13) .
C37A C38A 1.307(16) .
C38A C39A 1.429(17) .
C39A C40A 1.430(13) .
C35B C36B 1.343(18) .
C35B C40B 1.41(2) .
C36B C37B 1.429(15) .
C37B C38B 1.366(18) .
C37B C37B 1.90(2) 5_665
C38B C39B 1.37(3) .
C39B C40B 1.47(3) .
C41 C46 1.390(9) .
C41 C42 1.403(8) .
C42 C43 1.391(8) .
C42 H42 0.9500 .
C43 C44 1.355(13) .
C43 H43 0.9500 .
C44 C45 1.382(12) .
C44 H44 0.9500 .
C45 C46 1.388(8) .
C45 H45 0.9500 .
C46 H46 0.9500 .
C47 C48 1.41(2) .
C48 C49 1.33(3) .
C49 C50 1.42(2) .
C50 C51 1.28(2) .
C51 C52 1.47(2) .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
C16 C11 C12 C13 0.000(1) . .
Ge1 C11 C12 C13 180.000(0) . .
C11 C12 C13 C14 0.000(1) . .
C12 C13 C14 C15 0.0 . .
C13 C14 C15 C16 0.0 . .
C12 C11 C16 C15 0.000(1) . .
Ge1 C11 C16 C15 180.000(0) . .
C14 C15 C16 C11 0.0 . .
C22 C17 C18 C19 -4.8(17) . .
Ge1 C17 C18 C19 176.0(8) . .
C17 C18 C19 C20 2.2(16) . .
C18 C17 C22 C21 4(3) . .
Ge1 C17 C22 C21 -176.8(16) . .
C20 C21 C22 C17 -1(3) . .
C18 C19 C20 C21 1(2) . .
C22 C21 C20 C19 -2(3) . .
C28 C23 C24 C25 6.2(9) . .
Ge2 C23 C24 C25 179.3(4) . .
C23 C24 C25 C26 0.2(9) . .
C24 C25 C26 C27 -6.7(11) . .
C25 C26 C27 C28 6.7(13) . .
C24 C23 C28 C27 -6.1(11) . .
Ge2 C23 C28 C27 -179.3(7) . .
C26 C27 C28 C23 -0.2(15) . .
C34 C29 C30 C31 0.6(11) . .
Ge2 C29 C30 C31 177.3(7) . .
C29 C30 C31 C32 1.9(14) . .
C30 C31 C32 C33 -3.5(13) . .
C31 C32 C33 C34 2.7(10) . .
C30 C29 C34 C33 -1.4(8) . .
Ge2 C29 C34 C33 -178.0(4) . .
C32 C33 C34 C29 -0.2(8) . .
C9 Ge3 C35A C36A 74.4(11) . .
C8 Ge3 C35A C36A -37.6(12) . .
C41 Ge3 C35A C36A -168.0(10) . .
C9 Ge3 C35A C40A -111.3(10) . .
C8 Ge3 C35A C40A 136.7(10) . .
C41 Ge3 C35A C40A 6.3(13) . .
C40A C35A C36A C37A 5(2) . .
Ge3 C35A C36A C37A 179.1(11) . .
C35A C36A C37A C38A 0(2) . .
C36A C37A C38A C39A -7(3) . .
C37A C38A C39A C40A 9(3) . .
C36A C35A C40A C39A -3(2) . .
Ge3 C35A C40A C39A -177.3(9) . .
C38A C39A C40A C35A -3.3(19) . .
C40B C35B C36B C37B -4(3) . .
Ge3 C35B C36B C37B -176.4(11) . .
C35B C36B C37B C38B -0.8(19) . .
C35B C36B C37B C37B -179.2(14) . 5_665
C36B C37B C38B C39B 2(2) . .
C37B C37B C38B C39B -179.9(17) 5_665 .
C37B C38B C39B C40B 2(3) . .
C36B C35B C40B C39B 7(4) . .
Ge3 C35B C40B C39B -179(2) . .
C38B C39B C40B C35B -6(4) . .
C46 C41 C42 C43 1.1(8) . .
Ge3 C41 C42 C43 -180.0(5) . .
C41 C42 C43 C44 -1.7(10) . .
C42 C43 C44 C45 1.5(12) . .
C43 C44 C45 C46 -0.8(12) . .
C44 C45 C46 C41 0.2(10) . .
C42 C41 C46 C45 -0.4(8) . .
Ge3 C41 C46 C45 -179.3(5) . .
C47 C48 C49 C50 180.000(6) . .
C48 C49 C50 C51 180.000(6) . .
C49 C50 C51 C52 180.000(6) . .
