#------------------------------------------------------------------------------
#$Date: 2024-02-04 13:44:02 +0200 (Sun, 04 Feb 2024) $
#$Revision: 289462 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/44/7714466.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_7714466
loop_
_publ_author_name
'Tschernuth, Florian S.'
'Kostenko, Arseni'
'Stigler, Sebastian'
'Gradenegger, Anna'
'Inoue, Shigeyoshi'
_publ_section_title
;
 A neutral germanium-centred hard and soft lewis superacid and its unique
 reactivity towards hydrosilanes.
;
_journal_issue                   1
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              74
_journal_page_last               81
_journal_paper_doi               10.1039/d3dt03626j
_journal_volume                  53
_journal_year                    2023
_chemical_compound_source        'see text'
_chemical_formula_moiety         '0.143(C12 F24 Ge O4)'
_chemical_formula_sum            'C1.71 F3.43 Ge0.14 O0.57'
_chemical_formula_weight         105.24
_chemical_name_systematic
;
1
;
_space_group_IT_number           4
_space_group_name_Hall           'P 2yb'
_space_group_name_H-M_alt        'P 1 21 1'
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_audit_update_record
;
2023-08-30 deposited with the CCDC.	2023-11-15 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            56
_cell_length_a                   18.7356(9)
_cell_length_b                   18.5219(10)
_cell_length_c                   11.6384(6)
_cell_measurement_reflns_used    14642
_cell_measurement_temperature    100
_cell_measurement_theta_max      2.06
_cell_measurement_theta_min      26.02
_cell_volume                     4038.7(4)
_computing_cell_refinement       'SAINT (Bruker, 2017)'
_computing_data_collection       'APEX III Control Software (Bruker, 2016)'
_computing_data_reduction        'SAINT (Bruker, 2017)'
_computing_molecular_graphics    'PLATON (Spek, 2011), MERCURY (Wood, 2020)'
_computing_publication_material  'PLATON (Spek, 2011)'
_computing_structure_refinement
'OLEX2 (Puschmann, 2015), SHELXL (Sheldrick, 2017), SHELXLE (Huebschle, 2011)'
_computing_structure_solution    'SHELXT (Sheldrick, 2015)'
_diffrn_ambient_temperature      100
_diffrn_detector_area_resol_mean 16
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker Photon CMOS'
_diffrn_measurement_method       'phi- and omega-rotation'
_diffrn_radiation_monochromator  'Helios optic'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_source         'IMS microsource'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0477
_diffrn_reflns_av_unetI/netI     0.0273
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            148566
_diffrn_reflns_reduction_process
;
;
_diffrn_reflns_theta_full        25.24
_diffrn_reflns_theta_max         26.02
_diffrn_reflns_theta_min         2.06
_exptl_absorpt_coefficient_mu    1.760
_exptl_absorpt_correction_T_max  0.745
_exptl_absorpt_correction_T_min  0.571
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS 2016/2, Bruker, 2016'
_exptl_crystal_colour            'clear colourless'
_exptl_crystal_density_diffrn    2.423
_exptl_crystal_density_method    'Not Measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2816
_exptl_crystal_size_max          0.258
_exptl_crystal_size_mid          0.245
_exptl_crystal_size_min          0.201
_refine_diff_density_max         1.684
_refine_diff_density_min         -0.809
_refine_diff_density_rms         0.183
_refine_ls_abs_structure_details 'Flack (1983)'
_refine_ls_abs_structure_Flack   0.061(4)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1838
_refine_ls_number_reflns         15897
_refine_ls_number_restraints     4213
_refine_ls_restrained_S_all      1.031
_refine_ls_R_factor_all          0.0892
_refine_ls_R_factor_gt           0.0840
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'W=1/[Σ²(FO²)+(0.1611P)²+20.2823P] WHERE P=(FO²+2FC²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2274
_refine_ls_wR_factor_ref         0.2352
_reflns_number_gt                14642
_reflns_number_total             15897
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            d3dt03626j2.cif
_cod_data_source_block           mo_tscfl26_2_0ma
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_absorpt_correction_type' value ' multi-scan' was
changed to 'multi-scan' in accordance with the
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 8170 2020-07-09 18:12:32Z antanas 

 Adding full bibliography for 7714462--7714466.cif.
;
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               7714466
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x,1/2+y,-z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_thermal_displace_type
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ge4 Ge Uani 0.25001(7) 0.27731(9) 0.82631(11) 1.000 0.0338(4) d . . .
Ge1 Ge Uani 0.55450(7) 0.57850(7) 0.49668(10) 1.000 0.0266(3) d U . .
Ge2 Ge Uani 0.25002(6) 0.77730(8) 0.75477(9) 1.000 0.0268(3) d U . .
Ge3 Ge Uani 0.05448(7) 0.47607(7) 0.50322(10) 1.000 0.0266(4) d U . .
F73 F Uani 0.2151(19) 0.0589(19) 0.834(3) 0.585(8) 0.067(7) d UP A 1
F73D F Uani 0.2518(17) 0.153(2) 0.980(3) 0.415(8) 0.072(8) d UP A 2
F74 F Uani 0.1136(12) 0.0556(10) 0.892(2) 0.585(8) 0.073(6) d UP A 1
F74D F Uani 0.151(3) 0.088(3) 0.998(4) 0.415(8) 0.104(10) d UP A 2
F75 F Uani 0.2000(13) 0.0705(12) 1.0105(19) 0.585(8) 0.066(6) d UP A 1
F75D F Uani 0.154(3) 0.197(3) 1.091(5) 0.415(8) 0.074(10) d UP A 2
F76 F Uani 0.0665(13) 0.1797(17) 1.014(2) 0.585(8) 0.076(7) d UP A 1
F76D F Uani 0.031(3) 0.250(3) 0.813(3) 0.415(8) 0.067(9) d UP A 2
F77 F Uani 0.1286(11) 0.2763(13) 0.9851(17) 0.585(8) 0.068(5) d UP A 1
F77D F Uani 0.0442(19) 0.224(3) 1.013(3) 0.415(8) 0.077(9) d UP A 2
F78 F Uani 0.1719(18) 0.181(2) 1.093(3) 0.585(8) 0.067(8) d UP A 1
F78D F Uani 0.0333(19) 0.136(2) 0.888(4) 0.415(8) 0.091(9) d UP A 2
F79 F Uani 0.1483(19) 0.1944(19) 0.572(3) 0.585(8) 0.074(9) d UP A 1
F79D F Uani 0.198(2) 0.0684(17) 0.646(3) 0.415(8) 0.086(9) d UP A 2
F80 F Uani 0.1314(17) 0.0925(12) 0.659(2) 0.585(8) 0.084(7) d UP A 1
F80D F Uani 0.123(2) 0.0490(19) 0.788(4) 0.415(8) 0.098(9) d UP A 2
F81 F Uani 0.2373(14) 0.1507(11) 0.6700(19) 0.585(8) 0.071(6) d UP A 1
F81D F Uani 0.232(3) 0.057(3) 0.812(5) 0.415(8) 0.079(10) d UP A 2
F82 F Uani 0.0255(13) 0.1480(15) 0.777(3) 0.585(8) 0.099(8) d UP A 1
F82D F Uani 0.174(3) 0.184(3) 0.561(4) 0.415(8) 0.070(10) d UP A 2
F83 F Uani 0.0405(14) 0.2288(16) 0.646(3) 0.585(8) 0.094(8) d UP A 1
F83D F Uani 0.1268(15) 0.2721(18) 0.674(2) 0.415(8) 0.063(7) d UP A 2
F84 F Uani 0.033(2) 0.257(3) 0.852(3) 0.585(8) 0.090(8) d UP A 1
F84D F Uani 0.0639(19) 0.165(2) 0.656(3) 0.415(8) 0.085(9) d UP A 2
F85 F Uani 0.343(2) 0.364(3) 1.089(3) 0.585(8) 0.074(8) d UP A 1
F85D F Uani 0.4536(19) 0.333(3) 1.012(3) 0.415(8) 0.080(9) d UP A 2
F86 F Uani 0.4333(13) 0.3737(17) 1.013(2) 0.585(8) 0.077(7) d UP A 1
F86D F Uani 0.477(2) 0.404(2) 0.871(4) 0.415(8) 0.100(10) d UP A 2
F87 F Uani 0.3723(11) 0.2818(13) 0.9853(17) 0.585(8) 0.066(5) d UP A 1
F87D F Uani 0.468(2) 0.305(3) 0.813(4) 0.415(8) 0.064(8) d UP A 2
F88 F Uani 0.2723(15) 0.4972(15) 0.832(3) 0.585(8) 0.064(7) d UP A 1
F88D F Uani 0.2480(17) 0.4012(19) 0.980(3) 0.415(8) 0.068(8) d UP A 2
F89 F Uani 0.3854(12) 0.4996(10) 0.891(2) 0.585(8) 0.074(7) d UP A 1
F89D F Uani 0.348(3) 0.470(2) 0.999(4) 0.415(8) 0.099(10) d UP A 2
F90 F Uani 0.3003(13) 0.4833(11) 1.0104(19) 0.585(8) 0.066(6) d UP A 1
F90D F Uani 0.324(3) 0.369(4) 1.094(5) 0.415(8) 0.074(10) d UP A 2
F91 F Uani 0.467(2) 0.298(2) 0.853(3) 0.585(8) 0.087(9) d UP A 1
F91D F Uani 0.3730(14) 0.2851(16) 0.673(2) 0.415(8) 0.057(6) d UP A 2
F92 F Uani 0.4736(14) 0.4078(15) 0.774(3) 0.585(8) 0.097(8) d UP A 1
F92D F Uani 0.4359(18) 0.387(2) 0.654(3) 0.415(8) 0.081(9) d UP A 2
F93 F Uani 0.4580(14) 0.3263(16) 0.646(3) 0.585(8) 0.094(8) d UP A 1
F93D F Uani 0.326(2) 0.370(3) 0.561(4) 0.415(8) 0.065(9) d UP A 2
F94 F Uani 0.3513(18) 0.3583(17) 0.572(3) 0.585(8) 0.067(8) d UP A 1
F94D F Uani 0.303(2) 0.4846(17) 0.645(3) 0.415(8) 0.081(8) d UP A 2
F95 F Uani 0.3663(18) 0.4626(11) 0.661(2) 0.585(8) 0.086(7) d UP A 1
F95D F Uani 0.3783(19) 0.5050(18) 0.785(3) 0.415(8) 0.081(7) d UP A 2
F96 F Uani 0.2621(13) 0.4034(11) 0.6682(19) 0.585(8) 0.070(6) d UP A 1
F96D F Uani 0.293(3) 0.495(4) 0.817(6) 0.415(8) 0.075(7) d UP A 2
O13 O Uani 0.2415(10) 0.1959(10) 0.9011(16) 0.585(8) 0.040(4) d UP A 1
O13D O Uani 0.1703(12) 0.2692(15) 0.899(2) 0.415(8) 0.041(5) d UP A 2
O14 O Uani 0.1676(12) 0.2704(12) 0.7521(18) 0.585(8) 0.055(5) d UP A 1
O14D O Uani 0.2435(14) 0.1962(15) 0.751(2) 0.415(8) 0.042(6) d UP A 2
O15 O Uani 0.2584(10) 0.3595(10) 0.9016(16) 0.585(8) 0.040(4) d UP A 1
O15D O Uani 0.3296(12) 0.2849(15) 0.899(2) 0.415(8) 0.040(5) d UP A 2
O16 O Uani 0.3331(12) 0.2848(12) 0.7530(19) 0.585(8) 0.055(5) d UP A 1
O16D O Uani 0.2560(15) 0.3599(16) 0.751(2) 0.415(8) 0.045(6) d UP A 2
F1 F Uani 0.5530(11) 0.6642(9) 0.2951(12) 1.000 0.096(5) d U . .
F2 F Uani 0.5376(15) 0.6216(11) 0.1247(15) 1.000 0.130(7) d U . .
F3 F Uani 0.6348(15) 0.6097(19) 0.194(3) 1.000 0.172(10) d U . .
F4 F Uani 0.6375(8) 0.4772(12) 0.1804(15) 1.000 0.111(6) d U . .
F5 F Uani 0.5332(7) 0.4687(11) 0.1160(11) 1.000 0.101(6) d U . .
F6 F Uani 0.5698(15) 0.4086(14) 0.267(2) 1.000 0.139(8) d U . .
F7 F Uani 0.4270(12) 0.6517(11) 0.2390(19) 1.000 0.119(6) d U . .
F8 F Uani 0.3502(9) 0.5710(13) 0.2859(16) 1.000 0.115(6) d U . .
F9 F Uani 0.4204(11) 0.5444(11) 0.1424(13) 1.000 0.109(6) d U . .
F10 F Uani 0.3843(13) 0.4740(16) 0.422(2) 1.000 0.143(8) d U . .
F11 F Uani 0.4889(10) 0.4325(8) 0.4360(12) 1.000 0.096(5) d U . .
F12 F Uani 0.4253(11) 0.4258(9) 0.2774(13) 1.000 0.100(6) d U . .
F13 F Uani 0.6796(8) 0.7133(8) 0.7926(11) 1.000 0.084(5) d U . .
F14 F Uani 0.6463(10) 0.7825(11) 0.6495(14) 1.000 0.106(5) d U . .
F15 F Uani 0.7195(10) 0.6947(12) 0.6280(15) 1.000 0.112(6) d U . .
F16 F Uani 0.4701(8) 0.6644(10) 0.6794(15) 1.000 0.091(5) d U . .
F17 F Uani 0.5174(12) 0.7644(11) 0.6322(17) 1.000 0.117(6) d U . .
F18 F Uani 0.5308(8) 0.7268(9) 0.8009(14) 1.000 0.094(5) d U . .
F19 F Uani 0.6720(12) 0.4813(10) 0.7101(16) 1.000 0.113(6) d U . .
F20 F Uani 0.7221(8) 0.5741(11) 0.7664(12) 1.000 0.097(5) d U . .
F21 F Uani 0.6989(8) 0.5611(10) 0.5821(12) 1.000 0.094(5) d U . .
F22 F Uani 0.5053(7) 0.5885(10) 0.8465(11) 1.000 0.086(4) d U . .
F23 F Uani 0.6090(7) 0.6188(7) 0.9028(9) 1.000 0.068(4) d U . .
F24 F Uani 0.5857(10) 0.5090(9) 0.8611(11) 1.000 0.089(5) d U . .
O1 O Uani 0.5951(7) 0.5344(8) 0.3842(11) 1.000 0.061(3) d U . .
O2 O Uani 0.4702(7) 0.5835(8) 0.4289(11) 1.000 0.059(3) d U . .
O3 O Uani 0.5899(8) 0.6611(7) 0.5404(11) 1.000 0.058(3) d U . .
O4 O Uani 0.5538(8) 0.5444(8) 0.6363(11) 1.000 0.060(3) d U . .
C37 C Uani 0.1701(17) 0.1732(17) 0.892(3) 0.585(8) 0.044(4) d UP A 1
C37D C Uani 0.142(3) 0.199(3) 0.893(4) 0.415(8) 0.049(5) d UP A 2
C38 C Uani 0.1408(18) 0.2019(18) 0.766(3) 0.585(8) 0.052(5) d UP A 1
C38D C Uani 0.172(3) 0.171(3) 0.765(4) 0.415(8) 0.050(5) d UP A 2
C39 C Uani 0.1769(17) 0.0862(16) 0.902(3) 0.585(8) 0.052(5) d UP A 1
C39D C Uani 0.184(3) 0.152(3) 0.997(5) 0.415(8) 0.067(6) d UP A 2
C40 C Uani 0.1280(19) 0.206(2) 0.989(3) 0.585(8) 0.059(5) d UP A 1
C40D C Uani 0.058(3) 0.200(3) 0.902(5) 0.415(8) 0.064(6) d UP A 2
C41 C Uani 0.166(3) 0.159(2) 0.665(3) 0.585(8) 0.067(5) d UP A 1
C41D C Uani 0.184(3) 0.082(3) 0.756(5) 0.415(8) 0.067(6) d UP A 2
C42 C Uani 0.049(2) 0.212(3) 0.777(5) 0.585(8) 0.075(6) d UP A 1
C42D C Uani 0.134(3) 0.192(3) 0.668(4) 0.415(8) 0.058(6) d UP A 2
C43 C Uani 0.3309(17) 0.3818(17) 0.890(3) 0.585(8) 0.043(4) d UP A 1
C43D C Uani 0.357(3) 0.355(3) 0.893(4) 0.415(8) 0.049(5) d UP A 2
C44 C Uani 0.3596(18) 0.3522(18) 0.768(3) 0.585(8) 0.052(5) d UP A 1
C44D C Uani 0.330(3) 0.384(3) 0.763(4) 0.415(8) 0.052(5) d UP A 2
C45 C Uani 0.3714(19) 0.350(2) 0.990(3) 0.585(8) 0.058(5) d UP A 1
C45D C Uani 0.440(3) 0.355(3) 0.907(5) 0.415(8) 0.065(6) d UP A 2
C46 C Uani 0.3239(18) 0.4686(16) 0.903(3) 0.585(8) 0.056(5) d UP A 1
C46D C Uani 0.322(3) 0.400(3) 0.996(5) 0.415(8) 0.066(6) d UP A 2
C47 C Uani 0.446(2) 0.345(3) 0.769(4) 0.585(8) 0.076(6) d UP A 1
C47D C Uani 0.367(3) 0.362(3) 0.667(4) 0.415(8) 0.056(6) d UP A 2
C48 C Uani 0.336(2) 0.3929(19) 0.670(3) 0.585(8) 0.062(5) d UP A 1
C48D C Uani 0.321(3) 0.472(3) 0.753(5) 0.415(8) 0.068(6) d UP A 2
F25 F Uani 0.1368(9) 0.7031(11) 0.4741(12) 1.000 0.092(5) d U . .
F26 F Uani 0.1787(7) 0.7670(13) 0.3499(8) 1.000 0.099(6) d U . .
F27 F Uani 0.0985(8) 0.8058(11) 0.4622(13) 1.000 0.102(6) d U . .
F28 F Uani 0.2307(8) 0.8969(10) 0.4228(13) 1.000 0.094(5) d U . .
F29 F Uani 0.2601(10) 0.9054(9) 0.6020(16) 1.000 0.092(5) d U . .
F30 F Uani 0.1541(9) 0.9084(10) 0.5535(15) 1.000 0.099(5) d U . .
F31 F Uani 0.3462(9) 0.6457(10) 0.5546(15) 1.000 0.097(5) d U . .
F32 F Uani 0.2679(8) 0.6558(10) 0.4243(13) 1.000 0.096(6) d U . .
F33 F Uani 0.2409(9) 0.6481(9) 0.6012(15) 1.000 0.089(5) d U . .
F34 F Uani 0.4013(8) 0.7491(11) 0.4624(13) 1.000 0.099(6) d U . .
F35 F Uani 0.3639(9) 0.8534(10) 0.4753(11) 1.000 0.092(5) d U . .
F36 F Uani 0.3205(7) 0.7880(13) 0.3496(8) 1.000 0.095(6) d U . .
F37 F Uani 0.1575(11) 0.6775(10) 1.0285(12) 1.000 0.102(5) d U . .
F38 F Uani 0.2370(9) 0.7086(7) 1.1596(9) 1.000 0.078(5) d U . .
F39 F Uani 0.2425(13) 0.6209(8) 1.0446(13) 1.000 0.111(6) d U . .
F40 F Uani 0.3691(8) 0.7498(11) 1.0832(11) 1.000 0.101(6) d U . .
F41 F Uani 0.3768(7) 0.7676(12) 0.9005(11) 1.000 0.093(5) d U . .
F42 F Uani 0.3609(12) 0.6571(12) 0.9502(17) 1.000 0.123(7) d U . .
F43 F Uani 0.1232(7) 0.7825(14) 0.9017(11) 1.000 0.103(6) d U . .
F44 F Uani 0.1392(12) 0.8975(12) 0.9510(17) 1.000 0.125(7) d U . .
F45 F Uani 0.1315(8) 0.8049(12) 1.0830(12) 1.000 0.104(6) d U . .
F46 F Uani 0.2592(14) 0.9333(9) 1.0462(14) 1.000 0.116(6) d U . .
F47 F Uani 0.3440(11) 0.8769(10) 1.0271(13) 1.000 0.104(5) d U . .
F48 F Uani 0.2623(9) 0.8466(7) 1.1591(9) 1.000 0.076(4) d U . .
C1 C Uani 0.5476(13) 0.5351(14) 0.2881(18) 1.000 0.068(4) d U . .
C2 C Uani 0.4726(12) 0.5455(13) 0.3248(17) 1.000 0.064(4) d U . .
C3 C Uani 0.5725(18) 0.6100(17) 0.228(2) 1.000 0.089(5) d U . .
C4 C Uani 0.5735(14) 0.4749(19) 0.212(2) 1.000 0.087(4) d U . .
C5 C Uani 0.4138(15) 0.5790(17) 0.250(2) 1.000 0.083(4) d U . .
O5 O Uani 0.1823(6) 0.7781(10) 0.6529(8) 1.000 0.055(3) d U . .
O6 O Uani 0.3176(6) 0.7787(10) 0.6523(8) 1.000 0.055(3) d U . .
C6 C Uani 0.4431(15) 0.4650(14) 0.3620(19) 1.000 0.078(4) d U . .
O7 O Uani 0.2486(8) 0.7092(7) 0.8559(10) 1.000 0.053(4) d U . .
C7 C Uani 0.5988(11) 0.6645(10) 0.6581(15) 1.000 0.056(3) d U . .
C8 C Uani 0.6003(10) 0.5853(10) 0.7047(14) 1.000 0.051(3) d U . .
O8 O Uani 0.2508(8) 0.8456(7) 0.8570(10) 1.000 0.052(3) d U . .
C9 C Uani 0.6638(15) 0.7144(15) 0.686(2) 1.000 0.080(4) d U . .
C10 C Uani 0.5271(13) 0.7043(15) 0.700(2) 1.000 0.075(4) d U . .
C11 C Uani 0.6771(13) 0.5533(14) 0.6933(19) 1.000 0.073(4) d U . .
C12 C Uani 0.5743(11) 0.5769(12) 0.8330(15) 1.000 0.061(3) d U . .
F49 F Uani 0.0050(7) 0.4655(10) 0.1531(11) 1.000 0.086(5) d U . .
F50 F Uani 0.1094(7) 0.4358(7) 0.0970(8) 1.000 0.069(4) d U . .
F51 F Uani 0.0853(10) 0.5462(8) 0.1392(11) 1.000 0.089(5) d U . .
F52 F Uani 0.1724(12) 0.5723(10) 0.2923(16) 1.000 0.111(6) d U . .
F53 F Uani 0.2221(8) 0.4788(11) 0.2343(13) 1.000 0.099(5) d U . .
F54 F Uani 0.1988(8) 0.4911(10) 0.4187(12) 1.000 0.093(5) d U . .
F55 F Uani 0.0182(12) 0.2908(10) 0.3688(17) 1.000 0.115(7) d U . .
F56 F Uani 0.0299(8) 0.3279(9) 0.1979(14) 1.000 0.094(5) d U . .
F57 F Uani -0.0299(7) 0.3893(10) 0.3208(14) 1.000 0.089(5) d U . .
F58 F Uani 0.1492(11) 0.2755(12) 0.3517(14) 1.000 0.113(6) d U . .
F59 F Uani 0.2225(10) 0.3634(12) 0.3706(15) 1.000 0.119(6) d U . .
F60 F Uani 0.1792(8) 0.3403(8) 0.2067(10) 1.000 0.084(5) d U . .
F61 F Uani -0.0725(11) 0.6300(9) 0.7238(13) 1.000 0.105(6) d U . .
F62 F Uani -0.1171(12) 0.5834(16) 0.584(2) 1.000 0.146(8) d U . .
F63 F Uani -0.0112(10) 0.6217(8) 0.5636(12) 1.000 0.093(5) d U . .
F64 F Uani -0.0738(12) 0.4044(11) 0.7603(19) 1.000 0.120(7) d U . .
F65 F Uani -0.1486(10) 0.4816(14) 0.7166(15) 1.000 0.116(7) d U . .
F66 F Uani -0.0791(11) 0.5090(11) 0.8576(12) 1.000 0.110(6) d U . .
F67 F Uani 0.0338(7) 0.5844(12) 0.8843(11) 1.000 0.105(6) d U . .
F68 F Uani 0.0682(14) 0.6456(14) 0.733(2) 1.000 0.137(8) d U . .
F69 F Uani 0.1376(8) 0.5747(12) 0.8213(15) 1.000 0.111(6) d U . .
F70 F Uani 0.1395(13) 0.4392(16) 0.793(2) 1.000 0.153(9) d U . .
F71 F Uani 0.0538(10) 0.3881(9) 0.7050(13) 1.000 0.091(5) d U . .
F72 F Uani 0.0356(16) 0.4327(14) 0.8732(15) 1.000 0.146(8) d U . .
O9 O Uani 0.0527(8) 0.5096(8) 0.3628(11) 1.000 0.064(4) d U . .
O10 O Uani 0.0904(8) 0.3929(7) 0.4607(11) 1.000 0.059(3) d U . .
O11 O Uani -0.0299(6) 0.4721(8) 0.5714(10) 1.000 0.056(3) d U . .
O12 O Uani 0.0947(7) 0.5211(8) 0.6150(12) 1.000 0.061(4) d U . .
C13 C Uani 0.2114(9) 0.7958(12) 0.5407(13) 1.000 0.055(3) d U . .
C14 C Uani 0.2887(9) 0.7592(12) 0.5403(13) 1.000 0.055(3) d U . .
C15 C Uani 0.1552(10) 0.7642(16) 0.4576(14) 1.000 0.065(4) d U . .
C16 C Uani 0.2155(14) 0.8784(16) 0.530(2) 1.000 0.079(5) d U . .
C17 C Uani 0.2837(14) 0.6756(16) 0.529(2) 1.000 0.079(5) d U . .
C18 C Uani 0.3448(9) 0.7916(16) 0.4572(14) 1.000 0.064(4) d U . .
C19 C Uani 0.2655(10) 0.7374(9) 0.9649(13) 1.000 0.046(3) d U . .
C20 C Uani 0.2348(10) 0.8174(9) 0.9649(13) 1.000 0.046(3) d U . .
C21 C Uani 0.2325(16) 0.6830(12) 1.0536(17) 1.000 0.074(4) d U . .
C22 C Uani 0.3436(13) 0.7292(16) 0.9767(19) 1.000 0.075(4) d U . .
C23 C Uani 0.1567(13) 0.8242(16) 0.9777(19) 1.000 0.076(4) d U . .
C24 C Uani 0.2672(16) 0.8714(12) 1.0563(17) 1.000 0.076(4) d U . .
C25 C Uani 0.1002(11) 0.4699(10) 0.2952(15) 1.000 0.053(4) d U . .
C26 C Uani 0.0971(11) 0.3900(11) 0.3418(16) 1.000 0.057(4) d U . .
C27 C Uani 0.0739(11) 0.4782(13) 0.1657(16) 1.000 0.063(4) d U . .
C28 C Uani 0.1774(13) 0.5003(13) 0.3070(19) 1.000 0.070(4) d U . .
C29 C Uani 0.0275(13) 0.3500(14) 0.302(2) 1.000 0.073(4) d U . .
C30 C Uani 0.1634(15) 0.3391(16) 0.314(2) 1.000 0.083(5) d U . .
C31 C Uani -0.0271(12) 0.5089(12) 0.6742(17) 1.000 0.062(4) d U . .
C32 C Uani 0.0482(12) 0.5226(14) 0.7116(18) 1.000 0.068(4) d U . .
C33 C Uani -0.0564(14) 0.5904(14) 0.6373(19) 1.000 0.074(5) d U . .
C34 C Uani -0.0853(15) 0.4743(16) 0.751(2) 1.000 0.081(5) d U . .
C35 C Uani 0.0738(14) 0.5753(19) 0.793(2) 1.000 0.090(5) d U . .
C36 C Uani 0.0739(18) 0.4445(17) 0.772(2) 1.000 0.090(5) d U . .
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'
F F 0.0171 0.0103 ' 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'
O O 0.0106 0.0060 ' 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_2
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
O13 Ge4 O14 95.8(9) . . . yes
O13 Ge4 O15 120.4(9) . . . yes
O13 Ge4 O16 112.7(9) . . . yes
O14 Ge4 O15 112.5(9) . . . yes
O14 Ge4 O16 122.2(10) . . . yes
O15 Ge4 O16 95.3(9) . . . yes
O13D Ge4 O14D 96.4(12) . . . yes
O13D Ge4 O15D 121.1(11) . . . yes
O13D Ge4 O16D 112.0(13) . . . yes
O14D Ge4 O15D 112.2(12) . . . yes
O14D Ge4 O16D 120.1(11) . . . yes
O15D Ge4 O16D 96.8(13) . . . yes
O2 Ge1 O4 115.4(7) . . . yes
O3 Ge1 O4 92.8(6) . . . yes
O1 Ge1 O2 94.6(6) . . . yes
O1 Ge1 O3 118.1(7) . . . yes
O1 Ge1 O4 122.7(7) . . . yes
O2 Ge1 O3 115.1(7) . . . yes
O6 Ge2 O7 119.3(7) . . . yes
O6 Ge2 O8 116.9(7) . . . yes
O5 Ge2 O8 117.9(7) . . . yes
O5 Ge2 O7 117.4(7) . . . yes
O5 Ge2 O6 93.7(5) . . . yes
O7 Ge2 O8 93.7(6) . . . yes
O10 Ge3 O11 115.7(7) . . . yes
O9 Ge3 O12 122.9(7) . . . yes
O9 Ge3 O10 93.2(6) . . . yes
O9 Ge3 O11 114.6(6) . . . yes
O11 Ge3 O12 94.2(6) . . . yes
O10 Ge3 O12 118.2(7) . . . yes
F96D F95D C48D 38(4) . . . yes
F95D F96D C48D 51(4) . . . yes
Ge4 O13 C37 107.9(17) . . . yes
Ge4 O13D C37D 113(3) . . . yes
Ge4 O14 C38 109.1(19) . . . yes
Ge4 O14D C38D 107(3) . . . yes
Ge4 O15 C43 106.7(17) . . . yes
Ge4 O15D C43D 112(3) . . . yes
Ge4 O16 C44 109(2) . . . yes
Ge4 O16D C44D 106(3) . . . yes
Ge1 O1 C1 108.4(13) . . . yes
Ge1 O2 C2 109.3(12) . . . yes
Ge1 O3 C7 112.1(11) . . . yes
Ge1 O4 C8 109.2(11) . . . yes
O13 C37 C39 103(2) . . . yes
O13 C37 C38 107(2) . . . yes
C38 C37 C40 111(3) . . . no
C39 C37 C40 113(3) . . . no
C38 C37 C39 114(3) . . . no
O13 C37 C40 109(3) . . . yes
C39D C37D C40D 115(4) . . . no
O13D C37D C39D 105(4) . . . yes
C38D C37D C40D 113(4) . . . no
C38D C37D C39D 109(4) . . . no
O13D C37D C38D 102(4) . . . yes
O13D C37D C40D 111(4) . . . yes
C37 C38 C41 115(3) . . . no
O14 C38 C37 106(3) . . . yes
O14 C38 C41 106(3) . . . yes
O14 C38 C42 106(3) . . . yes
C37 C38 C42 107(3) . . . no
C41 C38 C42 115(3) . . . no
O14D C38D C41D 101(4) . . . yes
C41D C38D C42D 107(4) . . . no
O14D C38D C37D 108(4) . . . yes
C37D C38D C41D 114(4) . . . no
C37D C38D C42D 118(5) . . . no
O14D C38D C42D 107(4) . . . yes
F73 C39 F74 108(3) . . . yes
F74 C39 C37 111(2) . . . yes
F73 C39 C37 115(3) . . . yes
F74 C39 F75 106(3) . . . yes
F75 C39 C37 108(3) . . . yes
F73 C39 F75 110(3) . . . yes
F74D C39D F75D 108(5) . . . yes
F75D C39D C37D 94(4) . . . yes
F73D C39D C37D 110(4) . . . yes
F73D C39D F74D 118(5) . . . yes
F73D C39D F75D 119(5) . . . yes
F74D C39D C37D 104(5) . . . yes
F76 C40 F77 113(3) . . . yes
F77 C40 C37 112(3) . . . yes
F77 C40 F78 109(3) . . . yes
F76 C40 F78 101(3) . . . yes
F78 C40 C37 101(3) . . . yes
F76 C40 C37 119(3) . . . yes
F78D C40D C37D 110(5) . . . yes
F76D C40D F77D 113(5) . . . yes
F77D C40D F78D 110(5) . . . yes
F77D C40D C37D 105(4) . . . yes
F76D C40D F78D 112(5) . . . yes
F76D C40D C37D 108(4) . . . yes
F79 C41 C38 108(4) . . . yes
F81 C41 C38 110(3) . . . yes
F79 C41 F80 107(4) . . . yes
F80 C41 F81 111(3) . . . yes
F79 C41 F81 110(4) . . . yes
F80 C41 C38 111(3) . . . yes
F79D C41D C38D 106(4) . . . yes
F81D C41D C38D 117(5) . . . yes
F79D C41D F81D 108(5) . . . yes
F80D C41D F81D 108(5) . . . yes
F79D C41D F80D 110(5) . . . yes
F80D C41D C38D 109(4) . . . yes
F82 C42 F84 123(5) . . . yes
F82 C42 C38 104(3) . . . yes
F82 C42 F83 99(4) . . . yes
F83 C42 C38 93(3) . . . yes
F83 C42 F84 122(5) . . . yes
F84 C42 C38 111(4) . . . yes
F84D C42D C38D 117(5) . . . yes
F82D C42D C38D 114(5) . . . yes
F83D C42D C38D 107(4) . . . yes
F82D C42D F84D 111(4) . . . yes
F83D C42D F84D 106(4) . . . yes
F82D C42D F83D 101(4) . . . yes
C44 C43 C45 112(3) . . . no
O15 C43 C45 107(3) . . . yes
C44 C43 C46 117(3) . . . no
O15 C43 C46 102(2) . . . yes
C45 C43 C46 111(3) . . . no
O15 C43 C44 108(2) . . . yes
O15D C43D C46D 107(4) . . . yes
C44D C43D C46D 113(4) . . . no
C45D C43D C46D 109(4) . . . no
C44D C43D C45D 113(4) . . . no
O15D C43D C45D 111(4) . . . yes
O15D C43D C44D 103(4) . . . yes
C43 C44 C48 115(3) . . . no
C43 C44 C47 111(3) . . . no
O16 C44 C43 108(3) . . . yes
C47 C44 C48 111(3) . . . no
O16 C44 C48 106(3) . . . yes
O16 C44 C47 107(3) . . . yes
C47D C44D C48D 107(4) . . . no
C43D C44D C47D 119(5) . . . no
O16D C44D C48D 102(4) . . . yes
O16D C44D C43D 106(4) . . . yes
C43D C44D C48D 114(4) . . . no
O16D C44D C47D 108(4) . . . yes
F86 C45 F87 110(3) . . . yes
F85 C45 F86 97(3) . . . yes
F86 C45 C43 119(3) . . . yes
F85 C45 F87 104(4) . . . yes
F87 C45 C43 111(3) . . . yes
F85 C45 C43 114(3) . . . yes
F85D C45D F87D 114(5) . . . yes
F86D C45D F87D 91(4) . . . yes
F85D C45D C43D 107(4) . . . yes
F86D C45D C43D 122(5) . . . yes
F85D C45D F86D 116(5) . . . yes
F87D C45D C43D 106(4) . . . yes
F89 C46 F90 108(3) . . . yes
F88 C46 F90 104(3) . . . yes
F88 C46 F89 113(3) . . . yes
F90 C46 C43 108(3) . . . yes
F89 C46 C43 111(3) . . . yes
F88 C46 C43 113(3) . . . yes
F89D C46D C43D 111(5) . . . yes
F90D C46D C43D 115(5) . . . yes
F89D C46D F90D 113(6) . . . yes
F88D C46D C43D 108(4) . . . yes
F88D C46D F89D 110(5) . . . yes
F88D C46D F90D 99(5) . . . yes
F91 C47 F93 120(4) . . . yes
F92 C47 F93 101(4) . . . yes
F91 C47 C44 110(3) . . . yes
F93 C47 C44 99(3) . . . yes
F92 C47 C44 109(4) . . . yes
F91 C47 F92 116(4) . . . yes
F91D C47D C44D 107(4) . . . yes
F91D C47D F93D 101(4) . . . yes
F91D C47D F92D 105(4) . . . yes
F92D C47D F93D 111(4) . . . yes
F93D C47D C44D 113(5) . . . yes
F92D C47D C44D 117(5) . . . yes
F94 C48 F95 107(3) . . . yes
F95 C48 F96 106(3) . . . yes
F95 C48 C44 115(3) . . . yes
F96 C48 C44 113(3) . . . yes
F94 C48 F96 105(3) . . . yes
F94 C48 C44 111(3) . . . yes
F95D C48D F96D 91(6) . . . yes
F96D C48D C44D 115(6) . . . yes
F95D C48D C44D 111(4) . . . yes
F94D C48D F95D 114(5) . . . yes
F94D C48D C44D 106(4) . . . yes
F94D C48D F96D 120(6) . . . yes
O1 C1 C4 104.7(19) . . . yes
C2 C1 C3 107(2) . . . no
C2 C1 C4 125(2) . . . no
C3 C1 C4 107(2) . . . no
O1 C1 C2 111.5(17) . . . yes
O1 C1 C3 99.6(18) . . . yes
O2 C2 C5 105.3(19) . . . yes
C1 C2 C5 124.7(19) . . . no
O2 C2 C1 110.2(18) . . . yes
O2 C2 C6 102.5(16) . . . yes
C5 C2 C6 106(2) . . . no
C1 C2 C6 106(2) . . . no
F3 C3 C1 114(3) . . . yes
F2 C3 C1 112(2) . . . yes
F2 C3 F3 100(3) . . . yes
F1 C3 F2 105(2) . . . yes
F1 C3 C1 108(2) . . . yes
F1 C3 F3 117(3) . . . yes
F4 C4 F6 102(3) . . . yes
F4 C4 C1 117(3) . . . yes
F4 C4 F5 107.1(19) . . . yes
F5 C4 C1 112(2) . . . yes
F6 C4 C1 112(2) . . . yes
F5 C4 F6 106(3) . . . yes
Ge2 O5 C13 110.0(9) . . . yes
F7 C5 C2 109(2) . . . yes
F7 C5 F8 108(3) . . . yes
F7 C5 F9 110(2) . . . yes
F8 C5 C2 116(2) . . . yes
F9 C5 C2 105(2) . . . yes
F8 C5 F9 109(2) . . . yes
F12 C6 C2 113.7(18) . . . yes
F11 C6 F12 114(2) . . . yes
F11 C6 C2 111(2) . . . yes
F10 C6 C2 108(2) . . . yes
F10 C6 F11 104(2) . . . yes
F10 C6 F12 105(2) . . . yes
Ge2 O6 C14 109.8(10) . . . yes
O3 C7 C10 102.8(16) . . . yes
O3 C7 C9 109.1(16) . . . yes
C8 C7 C10 109.9(16) . . . no
O3 C7 C8 107.7(14) . . . yes
C9 C7 C10 108.5(17) . . . no
Ge2 O7 C19 109.9(10) . . . yes
C8 C7 C9 117.9(17) . . . no
O4 C8 C7 107.4(14) . . . yes
O4 C8 C11 108.6(16) . . . yes
C7 C8 C11 110.1(16) . . . no
C7 C8 C12 114.5(15) . . . no
Ge2 O8 C20 110.0(10) . . . yes
C11 C8 C12 109.1(15) . . . no
O4 C8 C12 107.0(15) . . . yes
F15 C9 C7 111(2) . . . yes
F14 C9 C7 107(2) . . . yes
F13 C9 C7 112(2) . . . yes
F13 C9 F15 108(2) . . . yes
F14 C9 F15 107(2) . . . yes
F13 C9 F14 112(2) . . . yes
F18 C10 C7 113.1(19) . . . yes
F16 C10 F17 104(2) . . . yes
F16 C10 F18 114(2) . . . yes
F16 C10 C7 111(2) . . . yes
F17 C10 C7 107.9(19) . . . yes
F17 C10 F18 106(2) . . . yes
F19 C11 F21 105(2) . . . yes
F21 C11 C8 108.4(17) . . . yes
F20 C11 C8 116.3(19) . . . yes
F19 C11 F20 105(2) . . . yes
F20 C11 F21 114(2) . . . yes
F19 C11 C8 107(2) . . . yes
F23 C12 F24 109.5(16) . . . yes
F22 C12 F23 108.6(17) . . . yes
F22 C12 C8 113.5(15) . . . yes
F24 C12 C8 106.2(16) . . . yes
F23 C12 C8 112.3(16) . . . yes
F22 C12 F24 106.5(18) . . . yes
Ge3 O9 C25 109.1(11) . . . yes
Ge3 O10 C26 110.5(12) . . . yes
Ge3 O11 C31 109.6(12) . . . yes
Ge3 O12 C32 109.8(12) . . . yes
O5 C13 C14 104.3(13) . . . yes
C14 C13 C16 112.1(17) . . . no
C15 C13 C16 111.1(18) . . . no
O5 C13 C15 102.8(14) . . . yes
O5 C13 C16 108.4(16) . . . yes
C14 C13 C15 117.1(17) . . . no
O6 C14 C13 103.2(13) . . . yes
O6 C14 C17 110.2(16) . . . yes
O6 C14 C18 102.1(14) . . . yes
C13 C14 C17 111.6(17) . . . no
C13 C14 C18 116.9(16) . . . no
C17 C14 C18 111.9(18) . . . no
F25 C15 F26 106(2) . . . yes
F25 C15 F27 108.4(19) . . . yes
F25 C15 C13 117.0(18) . . . yes
F26 C15 F27 106.5(18) . . . yes
F27 C15 C13 108(2) . . . yes
F26 C15 C13 110.5(16) . . . yes
F29 C16 F30 106(2) . . . yes
F29 C16 C13 112(2) . . . yes
F28 C16 C13 110(2) . . . yes
F28 C16 F30 106(2) . . . yes
F28 C16 F29 112(2) . . . yes
F30 C16 C13 111(2) . . . yes
F31 C17 F32 107(2) . . . yes
F31 C17 F33 104(2) . . . yes
F32 C17 C14 112(2) . . . yes
F33 C17 C14 112(2) . . . yes
F31 C17 C14 110(2) . . . yes
F32 C17 F33 111(2) . . . yes
F34 C18 C14 107(2) . . . yes
F34 C18 F35 108.5(17) . . . yes
F34 C18 F36 106.7(18) . . . yes
F36 C18 C14 109.6(16) . . . yes
F35 C18 F36 108(2) . . . yes
F35 C18 C14 117.1(18) . . . yes
O7 C19 C21 105.4(14) . . . yes
C20 C19 C22 117.0(17) . . . no
O7 C19 C22 105.6(15) . . . yes
C20 C19 C21 117.1(15) . . . no
O7 C19 C20 105.3(13) . . . yes
C21 C19 C22 105.3(18) . . . no
O8 C20 C23 105.8(15) . . . yes
O8 C20 C24 106.7(14) . . . yes
O8 C20 C19 105.8(13) . . . yes
C19 C20 C24 116.8(15) . . . no
C23 C20 C24 105.0(17) . . . no
C19 C20 C23 116.0(17) . . . no
F38 C21 F39 115.2(19) . . . yes
F38 C21 C19 111.0(18) . . . yes
F39 C21 C19 121(2) . . . yes
F37 C21 F38 106(2) . . . yes
F37 C21 F39 94(2) . . . yes
F37 C21 C19 107.3(17) . . . yes
F40 C22 F41 107(2) . . . yes
F40 C22 F42 112(2) . . . yes
F40 C22 C19 113.4(18) . . . yes
F42 C22 C19 108(2) . . . yes
F41 C22 F42 105(2) . . . yes
F41 C22 C19 110.8(19) . . . yes
F43 C23 F44 107(2) . . . yes
F44 C23 F45 111(2) . . . yes
F43 C23 F45 106(2) . . . yes
F43 C23 C20 110.5(19) . . . yes
F45 C23 C20 114.4(19) . . . yes
F44 C23 C20 107(2) . . . yes
F46 C24 C20 120(2) . . . yes
F46 C24 F48 116(2) . . . yes
F48 C24 C20 111.9(18) . . . yes
F47 C24 F48 108(2) . . . yes
F47 C24 C20 105.2(16) . . . yes
F46 C24 F47 92(2) . . . yes
O9 C25 C26 106.1(15) . . . yes
O9 C25 C27 106.6(15) . . . yes
O9 C25 C28 110.6(16) . . . yes
C26 C25 C27 113.9(16) . . . no
C26 C25 C28 110.1(16) . . . no
C27 C25 C28 109.6(16) . . . no
O10 C26 C25 108.0(15) . . . yes
O10 C26 C29 103.7(16) . . . yes
O10 C26 C30 107.2(16) . . . yes
C25 C26 C29 111.8(17) . . . no
C25 C26 C30 117.2(18) . . . no
C29 C26 C30 108.0(18) . . . no
F49 C27 F50 108.9(18) . . . yes
F49 C27 F51 107.7(19) . . . yes
F49 C27 C25 113.0(16) . . . yes
F50 C27 F51 110.5(17) . . . yes
F50 C27 C25 111.4(17) . . . yes
F51 C27 C25 105.3(16) . . . yes
F52 C28 F53 106(2) . . . yes
F52 C28 F54 105.3(19) . . . yes
F52 C28 C25 106.4(19) . . . yes
F53 C28 F54 114(2) . . . yes
F53 C28 C25 116.4(19) . . . yes
F54 C28 C25 108.1(17) . . . yes
F55 C29 F56 107(2) . . . yes
F55 C29 F57 104(2) . . . yes
F55 C29 C26 108.6(19) . . . yes
F56 C29 F57 111(2) . . . yes
F56 C29 C26 113.7(19) . . . yes
F57 C29 C26 112(2) . . . yes
F58 C30 F59 108(2) . . . yes
F58 C30 F60 113(2) . . . yes
F58 C30 C26 108(2) . . . yes
F59 C30 F60 106(2) . . . yes
F59 C30 C26 110(2) . . . yes
F60 C30 C26 112(2) . . . yes
O11 C31 C32 111.8(17) . . . yes
O11 C31 C33 102.3(15) . . . yes
O11 C31 C34 105.6(18) . . . yes
C32 C31 C33 103.4(18) . . . no
C32 C31 C34 124.4(18) . . . no
C33 C31 C34 107.0(19) . . . no
O12 C32 C31 110.1(17) . . . yes
O12 C32 C35 109.2(19) . . . yes
O12 C32 C36 98.0(18) . . . yes
C31 C32 C35 128(2) . . . no
C31 C32 C36 104(2) . . . no
C35 C32 C36 102(2) . . . no
F61 C33 F62 103(2) . . . yes
F61 C33 F63 114(2) . . . yes
F61 C33 C31 113.2(18) . . . yes
F62 C33 F63 107(2) . . . yes
F62 C33 C31 109(2) . . . yes
F63 C33 C31 110.5(19) . . . yes
F64 C34 F65 107(3) . . . yes
F64 C34 F66 111(2) . . . yes
F64 C34 C31 110(2) . . . yes
F65 C34 F66 108(2) . . . yes
F65 C34 C31 116(2) . . . yes
F66 C34 C31 105(2) . . . yes
F67 C35 F68 103(3) . . . yes
F67 C35 F69 110(2) . . . yes
F67 C35 C32 115(2) . . . yes
F68 C35 F69 102(2) . . . yes
F68 C35 C32 105(2) . . . yes
F69 C35 C32 119(3) . . . yes
F70 C36 F71 109(3) . . . yes
F70 C36 F72 109(2) . . . yes
F70 C36 C32 115(3) . . . yes
F71 C36 F72 103(2) . . . yes
F71 C36 C32 110(2) . . . yes
F72 C36 C32 110(2) . . . yes
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ge4 O13 1.748(19) . . yes
Ge4 O14 1.77(2) . . yes
Ge4 O15 1.764(19) . . yes
Ge4 O16 1.78(2) . . yes
Ge4 O13D 1.72(2) . . yes
Ge4 O14D 1.74(3) . . yes
Ge4 O15D 1.72(2) . . yes
Ge4 O16D 1.77(3) . . yes
Ge1 O2 1.768(13) . . yes
Ge1 O3 1.743(13) . . yes
Ge1 O4 1.743(13) . . yes
Ge1 O1 1.720(13) . . yes
Ge2 O5 1.737(10) . . yes
Ge2 O7 1.725(12) . . yes
Ge2 O8 1.737(12) . . yes
Ge2 O6 1.740(10) . . yes
Ge3 O10 1.752(13) . . yes
Ge3 O11 1.770(11) . . yes
Ge3 O9 1.749(13) . . yes
Ge3 O12 1.719(14) . . yes
F73 C39 1.18(5) . . yes
F73D C39D 1.29(6) . . yes
F74 C39 1.32(4) . . yes
F74D C39D 1.34(8) . . yes
F75 C39 1.37(4) . . yes
F75D C39D 1.49(8) . . yes
F76 C40 1.28(4) . . yes
F76D C40D 1.48(7) . . yes
F77 C40 1.30(4) . . yes
F77D C40D 1.39(7) . . yes
F78 C40 1.54(5) . . yes
F78D C40D 1.28(7) . . yes
F79 C41 1.31(5) . . yes
F79D C41D 1.33(7) . . yes
F80 C41 1.39(5) . . yes
F80D C41D 1.35(7) . . yes
F81 C41 1.35(6) . . yes
F81D C41D 1.20(8) . . yes
F82 C42 1.27(6) . . yes
F82D C42D 1.46(7) . . yes
F83 C42 1.56(7) . . yes
F83D C42D 1.49(6) . . yes
F84 C42 1.24(7) . . yes
F84D C42D 1.41(7) . . yes
F85 C45 1.30(5) . . yes
F85D C45D 1.31(7) . . yes
F86 C45 1.27(4) . . yes
F86D C45D 1.22(7) . . yes
F87 C45 1.26(4) . . yes
F87D C45D 1.53(8) . . yes
F88 C46 1.38(5) . . yes
F88D C46D 1.40(6) . . yes
F89 C46 1.30(4) . . yes
F89D C46D 1.39(7) . . yes
F90 C46 1.35(4) . . yes
F90D C46D 1.28(8) . . yes
F91 C47 1.37(6) . . yes
F91D C47D 1.43(6) . . yes
F92 C47 1.27(6) . . yes
F92D C47D 1.38(7) . . yes
F93 C47 1.49(6) . . yes
F93D C47D 1.46(7) . . yes
F94 C48 1.34(5) . . yes
F94D C48D 1.32(7) . . yes
F95 C48 1.41(4) . . yes
F95D C48D 1.29(7) . . yes
F95D F96D 1.65(7) . . yes
F96 C48 1.40(4) . . yes
F96D C48D 1.01(9) . . yes
O13 C37 1.41(4) . . yes
O13D C37D 1.41(6) . . yes
O14 C38 1.37(4) . . yes
O14D C38D 1.43(6) . . yes
O15 C43 1.43(4) . . yes
O15D C43D 1.40(6) . . yes
O16 C44 1.36(4) . . yes
O16D C44D 1.46(6) . . yes
F1 C3 1.32(3) . . yes
F2 C3 1.39(3) . . yes
F3 C3 1.23(4) . . yes
F4 C4 1.26(3) . . yes
F5 C4 1.35(3) . . yes
F6 C4 1.39(4) . . yes
F7 C5 1.38(4) . . yes
F8 C5 1.27(3) . . yes
F9 C5 1.41(3) . . yes
F10 C6 1.32(4) . . yes
F11 C6 1.36(3) . . yes
F12 C6 1.27(3) . . yes
F13 C9 1.28(3) . . yes
F14 C9 1.37(3) . . yes
F15 C9 1.30(3) . . yes
F16 C10 1.32(3) . . yes
F17 C10 1.38(3) . . yes
F18 C10 1.25(3) . . yes
F19 C11 1.35(3) . . yes
F20 C11 1.26(3) . . yes
F21 C11 1.37(3) . . yes
F22 C12 1.32(2) . . yes
F23 C12 1.30(2) . . yes
F24 C12 1.32(3) . . yes
O1 C1 1.43(3) . . yes
O2 C2 1.40(2) . . yes
O3 C7 1.38(2) . . yes
O4 C8 1.40(2) . . yes
C37 C39 1.62(4) . . no
C37 C38 1.65(5) . . no
C37 C40 1.51(5) . . no
C37D C40D 1.58(8) . . no
C37D C39D 1.69(8) . . no
C37D C38D 1.68(7) . . no
C38 C42 1.74(5) . . no
C38 C41 1.50(5) . . no
C38D C42D 1.39(7) . . no
C38D C41D 1.67(8) . . no
C43 C45 1.51(5) . . no
C43 C46 1.62(4) . . no
C43 C44 1.61(5) . . no
C43D C44D 1.68(7) . . no
C43D C46D 1.60(8) . . no
C43D C45D 1.56(8) . . no
C44 C48 1.44(5) . . no
C44 C47 1.62(5) . . no
C44D C47D 1.38(7) . . no
C44D C48D 1.64(8) . . no
F25 C15 1.20(3) . . yes
F26 C15 1.330(19) . . yes
F27 C15 1.31(3) . . yes
F28 C16 1.33(3) . . yes
F29 C16 1.29(3) . . yes
F30 C16 1.31(3) . . yes
F31 C17 1.33(3) . . yes
F32 C17 1.31(3) . . yes
F33 C17 1.27(3) . . yes
F34 C18 1.32(3) . . yes
F35 C18 1.22(3) . . yes
F36 C18 1.334(19) . . yes
F37 C21 1.44(4) . . yes
F38 C21 1.32(2) . . yes
F39 C21 1.17(3) . . yes
F40 C22 1.38(3) . . yes
F41 C22 1.30(3) . . yes
F42 C22 1.41(4) . . yes
F43 C23 1.33(3) . . yes
F44 C23 1.43(4) . . yes
F45 C23 1.36(3) . . yes
F46 C24 1.16(3) . . yes
F47 C24 1.48(4) . . yes
F48 C24 1.29(2) . . yes
C1 C2 1.48(3) . . no
C1 C3 1.62(4) . . no
C1 C4 1.50(4) . . no
C2 C6 1.65(4) . . no
C2 C5 1.54(3) . . no
O5 C13 1.453(19) . . yes
O6 C14 1.457(19) . . yes
C7 C8 1.56(3) . . no
O7 C19 1.41(2) . . yes
C7 C9 1.56(3) . . no
C7 C10 1.61(3) . . no
O8 C20 1.39(2) . . yes
C8 C11 1.56(3) . . no
C8 C12 1.58(2) . . no
F49 C27 1.32(2) . . yes
F50 C27 1.30(2) . . yes
F51 C27 1.31(3) . . yes
F52 C28 1.35(3) . . yes
F53 C28 1.26(3) . . yes
F54 C28 1.37(3) . . yes
F55 C29 1.36(3) . . yes
F56 C29 1.28(3) . . yes
F57 C29 1.32(3) . . yes
F58 C30 1.29(4) . . yes
F59 C30 1.37(3) . . yes
F60 C30 1.28(3) . . yes
F61 C33 1.28(3) . . yes
F62 C33 1.30(3) . . yes
F63 C33 1.34(3) . . yes
F64 C34 1.32(4) . . yes
F65 C34 1.26(3) . . yes
F66 C34 1.40(3) . . yes
F67 C35 1.31(3) . . yes
F68 C35 1.48(4) . . yes
F69 C35 1.24(3) . . yes
F70 C36 1.26(4) . . yes
F71 C36 1.36(3) . . yes
F72 C36 1.40(3) . . yes
O9 C25 1.40(2) . . yes
O10 C26 1.39(2) . . yes
O11 C31 1.38(2) . . yes
O12 C32 1.42(3) . . yes
C13 C15 1.55(3) . . no
C13 C16 1.54(4) . . no
C13 C14 1.60(3) . . no
C14 C18 1.55(3) . . no
C14 C17 1.56(4) . . no
C19 C20 1.59(2) . . no
C19 C21 1.57(3) . . no
C19 C22 1.48(3) . . no
C20 C23 1.48(3) . . no
C20 C24 1.58(3) . . no
C25 C26 1.58(3) . . no
C25 C27 1.59(3) . . no
C25 C28 1.56(3) . . no
C26 C29 1.57(3) . . no
C26 C30 1.59(4) . . no
C31 C32 1.50(3) . . no
C31 C33 1.66(3) . . no
C31 C34 1.55(3) . . no
C32 C35 1.44(4) . . no
C32 C36 1.68(4) . . no
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O14 Ge4 O13 C37 -14.4(19) . . . . no
O15 Ge4 O13 C37 105.9(19) . . . . no
O16 Ge4 O13 C37 -142.9(18) . . . . no
O13 Ge4 O14 C38 -12(2) . . . . no
O15 Ge4 O14 C38 -137.7(19) . . . . no
O16 Ge4 O14 C38 110(2) . . . . no
O13 Ge4 O15 C43 106.8(18) . . . . no
O14 Ge4 O15 C43 -141.6(18) . . . . no
O16 Ge4 O15 C43 -13.5(19) . . . . no
O13 Ge4 O16 C44 -137(2) . . . . no
O14 Ge4 O16 C44 110(2) . . . . no
O15 Ge4 O16 C44 -11(2) . . . . no
O2 Ge1 O3 C7 117.6(13) . . . . no
O4 Ge1 O3 C7 -2.2(14) . . . . no
O1 Ge1 O4 C8 107.3(12) . . . . no
O2 Ge1 O4 C8 -138.5(12) . . . . no
O3 Ge1 O4 C8 -19.0(13) . . . . no
O3 Ge1 O2 C2 129.2(13) . . . . no
O4 Ge1 O2 C2 -124.4(13) . . . . no
O1 Ge1 O3 C7 -131.9(13) . . . . no
O2 Ge1 O1 C1 10.1(14) . . . . no
O3 Ge1 O1 C1 -111.6(14) . . . . no
O4 Ge1 O1 C1 134.3(14) . . . . no
O1 Ge1 O2 C2 5.2(14) . . . . no
O6 Ge2 O8 C20 -138.3(12) . . . . no
O7 Ge2 O8 C20 -12.6(13) . . . . no
O8 Ge2 O5 C13 110.3(13) . . . . no
O8 Ge2 O6 C14 -140.1(13) . . . . no
O5 Ge2 O7 C19 -137.9(12) . . . . no
O6 Ge2 O7 C19 110.1(12) . . . . no
O8 Ge2 O7 C19 -13.7(13) . . . . no
O5 Ge2 O8 C20 111.3(12) . . . . no
O7 Ge2 O5 C13 -138.7(13) . . . . no
O5 Ge2 O6 C14 -16.1(15) . . . . no
O7 Ge2 O6 C14 108.3(13) . . . . no
O6 Ge2 O5 C13 -12.8(15) . . . . no
O10 Ge3 O12 C32 -112.4(14) . . . . no
O9 Ge3 O10 C26 -3.1(13) . . . . no
O11 Ge3 O10 C26 116.3(12) . . . . no
O12 Ge3 O11 C31 3.8(13) . . . . no
O9 Ge3 O12 C32 132.7(14) . . . . no
O10 Ge3 O9 C25 -20.4(13) . . . . no
O11 Ge3 O12 C32 9.7(14) . . . . no
O12 Ge3 O9 C25 106.4(13) . . . . no
O10 Ge3 O11 C31 127.8(13) . . . . no
O12 Ge3 O10 C26 -133.4(12) . . . . no
O9 Ge3 O11 C31 -125.5(13) . . . . no
O11 Ge3 O9 C25 -140.5(12) . . . . no
Ge4 O13 C37 C38 32(3) . . . . no
Ge4 O13 C37 C40 -88(3) . . . . no
Ge4 O13 C37 C39 151.9(19) . . . . no
Ge4 O14 C38 C42 143(3) . . . . no
Ge4 O14 C38 C37 30(3) . . . . no
Ge4 O14 C38 C41 -93(3) . . . . no
Ge4 O15 C43 C46 153.3(19) . . . . no
Ge4 O15 C43 C44 30(3) . . . . no
Ge4 O15 C43 C45 -90(2) . . . . no
Ge4 O16 C44 C43 29(3) . . . . no
Ge4 O16 C44 C47 148(2) . . . . no
Ge4 O16 C44 C48 -94(3) . . . . no
Ge1 O1 C1 C4 -160.0(16) . . . . no
Ge1 O1 C1 C3 89.8(17) . . . . no
Ge1 O1 C1 C2 -22(2) . . . . no
Ge1 O2 C2 C6 94.0(16) . . . . no
Ge1 O2 C2 C5 -155.5(15) . . . . no
Ge1 O2 C2 C1 -19(2) . . . . no
Ge1 O3 C7 C10 -95.7(15) . . . . no
Ge1 O3 C7 C9 149.3(14) . . . . no
Ge1 O3 C7 C8 20.2(18) . . . . no
Ge1 O4 C8 C7 32.4(16) . . . . no
Ge1 O4 C8 C12 155.8(12) . . . . no
Ge1 O4 C8 C11 -86.6(15) . . . . no
C38 C37 C39 F74 -64(3) . . . . no
C39 C37 C40 F78 59(3) . . . . no
C38 C37 C39 F73 59(4) . . . . no
O13 C37 C40 F77 61(4) . . . . no
O13 C37 C40 F78 -55(3) . . . . no
C38 C37 C40 F76 79(4) . . . . no
C38 C37 C40 F77 -56(4) . . . . no
C38 C37 C40 F78 -172(3) . . . . no
C39 C37 C40 F76 -51(4) . . . . no
C39 C37 C40 F77 174(3) . . . . no
O13 C37 C39 F74 -178(3) . . . . no
O13 C37 C39 F75 66(3) . . . . no
C39 C37 C38 C41 -36(4) . . . . no
C39 C37 C38 C42 94(3) . . . . no
C38 C37 C39 F75 -179(3) . . . . no
O13 C37 C38 O14 -41(3) . . . . no
O13 C37 C38 C41 77(4) . . . . no
O13 C37 C38 C42 -154(3) . . . . no
C39 C37 C38 O14 -153(3) . . . . no
O13 C37 C40 F76 -164(3) . . . . no
C40 C37 C38 C42 -35(4) . . . . no
C40 C37 C38 O14 78(3) . . . . no
C40 C37 C38 C41 -165(3) . . . . no
O13 C37 C39 F73 -56(4) . . . . no
C40 C37 C39 F75 -51(3) . . . . no
C40 C37 C39 F73 -173(3) . . . . no
C40 C37 C39 F74 65(4) . . . . no
O14 C38 C41 F81 67(3) . . . . no
O14 C38 C41 F80 -169(3) . . . . no
C37 C38 C41 F79 -170(3) . . . . no
C41 C38 C42 F83 -44(4) . . . . no
C41 C38 C42 F84 -170(4) . . . . no
C37 C38 C42 F83 -174(3) . . . . no
O14 C38 C41 F79 -53(4) . . . . no
C42 C38 C41 F80 -52(4) . . . . no
C42 C38 C41 F81 -176(3) . . . . no
O14 C38 C42 F82 173(4) . . . . no
O14 C38 C42 F83 73(3) . . . . no
O14 C38 C42 F84 -52(5) . . . . no
C37 C38 C42 F82 -74(4) . . . . no
C37 C38 C41 F81 -50(4) . . . . no
C37 C38 C42 F84 61(5) . . . . no
C41 C38 C42 F82 56(5) . . . . no
C37 C38 C41 F80 74(4) . . . . no
C42 C38 C41 F79 64(5) . . . . no
C46 C43 C45 F86 -56(4) . . . . no
C46 C43 C45 F85 58(4) . . . . no
C44 C43 C45 F86 77(4) . . . . no
C46 C43 C45 F87 175(3) . . . . no
C46 C43 C44 O16 -153(3) . . . . no
C46 C43 C44 C47 90(4) . . . . no
C46 C43 C44 C48 -36(4) . . . . no
O15 C43 C45 F85 -52(4) . . . . no
O15 C43 C45 F86 -166(3) . . . . no
O15 C43 C45 F87 65(3) . . . . no
C44 C43 C45 F85 -170(4) . . . . no
C45 C43 C46 F88 -164(3) . . . . no
C44 C43 C45 F87 -53(4) . . . . no
C45 C43 C46 F90 -49(3) . . . . no
O15 C43 C46 F89 -178(3) . . . . no
O15 C43 C44 O16 -40(3) . . . . no
O15 C43 C44 C47 -157(3) . . . . no
O15 C43 C44 C48 77(3) . . . . no
C45 C43 C44 O16 78(3) . . . . no
C45 C43 C44 C47 -39(4) . . . . no
C45 C43 C44 C48 -165(3) . . . . no
O15 C43 C46 F88 -50(3) . . . . no
O15 C43 C46 F90 64(3) . . . . no
C44 C43 C46 F88 66(4) . . . . no
C44 C43 C46 F89 -61(4) . . . . no
C44 C43 C46 F90 -179(3) . . . . no
C45 C43 C46 F89 69(4) . . . . no
C47 C44 C48 F96 -177(3) . . . . no
C43 C44 C47 F92 -68(4) . . . . no
O16 C44 C47 F91 -57(4) . . . . no
O16 C44 C47 F92 175(3) . . . . no
O16 C44 C47 F93 70(4) . . . . no
C43 C44 C48 F94 -169(3) . . . . no
C43 C44 C47 F93 -173(3) . . . . no
C48 C44 C47 F91 -172(3) . . . . no
C43 C44 C47 F91 60(4) . . . . no
O16 C44 C48 F94 -51(4) . . . . no
O16 C44 C48 F95 -172(3) . . . . no
O16 C44 C48 F96 67(3) . . . . no
C47 C44 C48 F94 65(4) . . . . no
C43 C44 C48 F95 70(4) . . . . no
C43 C44 C48 F96 -51(4) . . . . no
C47 C44 C48 F95 -56(4) . . . . no
C48 C44 C47 F93 -45(4) . . . . no
C48 C44 C47 F92 61(4) . . . . no
O1 C1 C3 F3 63(3) . . . . no
O1 C1 C3 F1 -69(3) . . . . no
O1 C1 C3 F2 175(2) . . . . no
C2 C1 C3 F1 47(3) . . . . no
C2 C1 C3 F2 -69(3) . . . . no
C3 C1 C4 F6 166(2) . . . . no
C4 C1 C2 C6 44(3) . . . . no
O1 C1 C2 O2 27(3) . . . . no
O1 C1 C2 C5 154(2) . . . . no
O1 C1 C2 C6 -83(2) . . . . no
C3 C1 C2 O2 -81(2) . . . . no
C3 C1 C2 C5 46(3) . . . . no
C3 C1 C2 C6 169.1(17) . . . . no
C4 C1 C2 O2 154(2) . . . . no
C4 C1 C2 C5 -79(3) . . . . no
C2 C1 C4 F5 50(3) . . . . no
C2 C1 C4 F6 -69(3) . . . . no
C3 C1 C4 F4 49(3) . . . . no
C3 C1 C4 F5 -75(3) . . . . no
O1 C1 C4 F4 -56(3) . . . . no
O1 C1 C4 F5 180(2) . . . . no
O1 C1 C4 F6 61(3) . . . . no
C2 C1 C3 F3 179(3) . . . . no
C4 C1 C3 F1 -178(2) . . . . no
C4 C1 C3 F2 67(3) . . . . no
C4 C1 C3 F3 -45(3) . . . . no
C2 C1 C4 F4 174(2) . . . . no
C5 C2 C6 F12 55(3) . . . . no
O2 C2 C5 F8 -65(3) . . . . no
C5 C2 C6 F11 -175.4(19) . . . . no
C1 C2 C6 F10 164(2) . . . . no
C1 C2 C6 F11 50(2) . . . . no
C1 C2 C6 F12 -80(3) . . . . no
C5 C2 C6 F10 -62(2) . . . . no
C6 C2 C5 F7 165.7(19) . . . . no
O2 C2 C5 F7 58(2) . . . . no
C6 C2 C5 F9 -76(2) . . . . no
O2 C2 C5 F9 175.5(19) . . . . no
C1 C2 C5 F7 -71(3) . . . . no
C1 C2 C5 F8 167(2) . . . . no
C1 C2 C5 F9 47(3) . . . . no
O2 C2 C6 F10 49(2) . . . . no
C6 C2 C5 F8 44(3) . . . . no
O2 C2 C6 F12 165(2) . . . . no
O2 C2 C6 F11 -65(2) . . . . no
Ge2 O5 C13 C16 -84.8(17) . . . . no
Ge2 O5 C13 C14 34.8(18) . . . . no
Ge2 O5 C13 C15 157.5(15) . . . . no
Ge2 O6 C14 C18 158.6(14) . . . . no
Ge2 O6 C14 C13 36.9(18) . . . . no
Ge2 O6 C14 C17 -82.4(17) . . . . no
C8 C7 C9 F14 -172.4(16) . . . . no
O3 C7 C8 O4 -34(2) . . . . no
O3 C7 C8 C11 84.0(19) . . . . no
O3 C7 C8 C12 -152.7(16) . . . . no
C9 C7 C8 O4 -158.0(16) . . . . no
C9 C7 C8 C11 -40(2) . . . . no
C9 C7 C8 C12 83(2) . . . . no
C10 C7 C8 O4 77.1(18) . . . . no
C10 C7 C8 C11 -164.9(16) . . . . no
C10 C7 C8 C12 -42(2) . . . . no
O3 C7 C9 F13 -172.7(19) . . . . no
O3 C7 C9 F14 64(2) . . . . no
O3 C7 C9 F15 -52(2) . . . . no
C8 C7 C9 F13 -50(3) . . . . no
O3 C7 C10 F18 -165(2) . . . . no
C8 C7 C9 F15 71(2) . . . . no
C10 C7 C9 F13 76(2) . . . . no
C10 C7 C9 F14 -47(2) . . . . no
C10 C7 C9 F15 -162.9(19) . . . . no
O3 C7 C10 F16 65(2) . . . . no
O3 C7 C10 F17 -49(2) . . . . no
Ge2 O7 C19 C22 -92.0(16) . . . . no
C8 C7 C10 F16 -49(2) . . . . no
C8 C7 C10 F17 -162.8(17) . . . . no
C8 C7 C10 F18 80(2) . . . . no
C9 C7 C10 F16 -179.6(18) . . . . no
C9 C7 C10 F17 67(2) . . . . no
C9 C7 C10 F18 -50(3) . . . . no
Ge2 O7 C19 C21 156.9(14) . . . . no
Ge2 O7 C19 C20 32.4(16) . . . . no
O4 C8 C11 F20 -166.0(19) . . . . no
C11 C8 C12 F24 -50(2) . . . . no
C7 C8 C11 F20 77(2) . . . . no
O4 C8 C11 F21 64(2) . . . . no
C7 C8 C11 F19 -166.6(16) . . . . no
O4 C8 C11 F19 -49(2) . . . . no
Ge2 O8 C20 C19 31.7(16) . . . . no
Ge2 O8 C20 C23 -91.9(16) . . . . no
Ge2 O8 C20 C24 156.7(14) . . . . no
O4 C8 C12 F22 -50(2) . . . . no
O4 C8 C12 F23 -173.1(16) . . . . no
O4 C8 C12 F24 67.2(19) . . . . no
C7 C8 C12 F22 69(2) . . . . no
C7 C8 C12 F23 -54(2) . . . . no
C7 C8 C12 F24 -173.9(16) . . . . no
C11 C8 C12 F22 -166.8(19) . . . . no
C11 C8 C12 F23 70(2) . . . . no
C12 C8 C11 F21 -179.9(18) . . . . no
C7 C8 C11 F21 -53(2) . . . . no
C12 C8 C11 F19 67(2) . . . . no
C12 C8 C11 F20 -50(3) . . . . no
Ge3 O9 C25 C27 156.6(12) . . . . no
Ge3 O9 C25 C28 -84.4(16) . . . . no
Ge3 O9 C25 C26 34.9(17) . . . . no
Ge3 O10 C26 C25 22.7(18) . . . . no
Ge3 O10 C26 C29 -96.1(16) . . . . no
Ge3 O10 C26 C30 149.9(15) . . . . no
Ge3 O11 C31 C34 -153.8(15) . . . . no
Ge3 O11 C31 C32 -16(2) . . . . no
Ge3 O11 C31 C33 94.4(15) . . . . no
Ge3 O12 C32 C35 -165.4(17) . . . . no
Ge3 O12 C32 C36 88.6(16) . . . . no
Ge3 O12 C32 C31 -20(2) . . . . no
C15 C13 C16 F28 -58(2) . . . . no
C15 C13 C16 F29 177.5(18) . . . . no
C15 C13 C16 F30 60(2) . . . . no
O5 C13 C16 F30 -53(2) . . . . no
C14 C13 C16 F28 76(2) . . . . no
C14 C13 C16 F29 -49(2) . . . . no
C14 C13 C16 F30 -167.2(16) . . . . no
O5 C13 C14 O6 -45.1(19) . . . . no
O5 C13 C14 C17 73.1(18) . . . . no
O5 C13 C14 C18 -156.3(16) . . . . no
C15 C13 C14 O6 -157.9(16) . . . . no
C15 C13 C14 C17 -40(2) . . . . no
C15 C13 C14 C18 91(2) . . . . no
C16 C13 C14 O6 72.0(18) . . . . no
C16 C13 C14 C17 -169.8(16) . . . . no
C16 C13 C14 C18 -39(2) . . . . no
O5 C13 C15 F25 -49(2) . . . . no
O5 C13 C15 F26 -171(2) . . . . no
O5 C13 C15 F27 73(2) . . . . no
C14 C13 C15 F25 64(2) . . . . no
C14 C13 C15 F26 -58(3) . . . . no
C14 C13 C15 F27 -173.6(16) . . . . no
C16 C13 C15 F25 -165.2(19) . . . . no
C16 C13 C15 F26 73(3) . . . . no
C16 C13 C15 F27 -43(2) . . . . no
O5 C13 C16 F28 -169.9(16) . . . . no
O5 C13 C16 F29 65(2) . . . . no
C18 C14 C17 F32 -58(2) . . . . no
C18 C14 C17 F33 176.2(18) . . . . no
O6 C14 C18 F34 75(2) . . . . no
O6 C14 C18 F35 -47(2) . . . . no
O6 C14 C18 F36 -171(2) . . . . no
C13 C14 C18 F34 -173.7(16) . . . . no
C13 C14 C18 F35 65(2) . . . . no
C13 C14 C18 F36 -59(3) . . . . no
O6 C14 C17 F31 -52(2) . . . . no
O6 C14 C17 F32 -170.7(17) . . . . no
O6 C14 C17 F33 63(2) . . . . no
C13 C14 C17 F31 -166.1(16) . . . . no
C13 C14 C17 F32 75(2) . . . . no
C13 C14 C17 F33 -51(2) . . . . no
C18 C14 C17 F31 61(2) . . . . no
C17 C14 C18 F36 72(2) . . . . no
C17 C14 C18 F34 -43(2) . . . . no
C17 C14 C18 F35 -164.9(18) . . . . no
C22 C19 C20 O8 75.5(18) . . . . no
O7 C19 C21 F38 -172.0(19) . . . . no
O7 C19 C21 F39 49(3) . . . . no
C20 C19 C21 F37 60(2) . . . . no
C20 C19 C21 F38 -55(3) . . . . no
C22 C19 C20 C23 -167.6(17) . . . . no
C22 C19 C20 C24 -43(2) . . . . no
O7 C19 C21 F37 -56.5(19) . . . . no
O7 C19 C20 O8 -41.4(18) . . . . no
O7 C19 C20 C23 75.6(18) . . . . no
O7 C19 C20 C24 -159.8(16) . . . . no
C21 C19 C20 O8 -158.1(16) . . . . no
C21 C19 C20 C23 -41(2) . . . . no
C21 C19 C20 C24 83(2) . . . . no
C20 C19 C22 F41 -53(2) . . . . no
C20 C19 C22 F42 -167.6(15) . . . . no
C21 C19 C22 F40 -65(3) . . . . no
C21 C19 C22 F41 174.8(19) . . . . no
C21 C19 C22 F42 60(2) . . . . no
O7 C19 C22 F41 64(2) . . . . no
O7 C19 C22 F42 -51(2) . . . . no
C20 C19 C21 F39 166(2) . . . . no
C22 C19 C21 F37 -167.9(17) . . . . no
C22 C19 C21 F38 77(2) . . . . no
C22 C19 C21 F39 -62(3) . . . . no
O7 C19 C22 F40 -175.7(19) . . . . no
C20 C19 C22 F40 68(2) . . . . no
C23 C20 C24 F47 -168.0(17) . . . . no
C23 C20 C24 F48 75(2) . . . . no
O8 C20 C24 F48 -172.9(19) . . . . no
C19 C20 C24 F46 164(2) . . . . no
C19 C20 C24 F47 61.9(19) . . . . no
C19 C20 C24 F48 -55(3) . . . . no
C23 C20 C24 F46 -67(3) . . . . no
O8 C20 C23 F43 65(2) . . . . no
O8 C20 C23 F44 -51(2) . . . . no
O8 C20 C23 F45 -175(2) . . . . no
C19 C20 C23 F43 -52(2) . . . . no
C19 C20 C23 F44 -167.9(15) . . . . no
C19 C20 C23 F45 69(3) . . . . no
C24 C20 C23 F43 178.0(19) . . . . no
C24 C20 C23 F44 61.6(19) . . . . no
C24 C20 C23 F45 -62(3) . . . . no
O8 C20 C24 F46 46(3) . . . . no
O8 C20 C24 F47 -56.0(19) . . . . no
O9 C25 C26 O10 -38(2) . . . . no
O9 C25 C26 C29 75.9(19) . . . . no
O9 C25 C26 C30 -158.7(17) . . . . no
C27 C25 C26 O10 -154.5(16) . . . . no
C27 C25 C26 C29 -41(2) . . . . no
C27 C25 C26 C30 85(2) . . . . no
C28 C25 C26 O10 82.0(19) . . . . no
C28 C25 C26 C29 -164.5(17) . . . . no
C28 C25 C26 C30 -39(2) . . . . no
O9 C25 C27 F49 -49(2) . . . . no
O9 C25 C27 F50 -172.0(16) . . . . no
O9 C25 C27 F51 68(2) . . . . no
C26 C25 C27 F49 68(2) . . . . no
C26 C25 C27 F50 -55(2) . . . . no
C26 C25 C27 F51 -175.3(17) . . . . no
C28 C25 C27 F49 -168.8(19) . . . . no
C28 C25 C27 F50 68(2) . . . . no
C28 C25 C27 F51 -52(2) . . . . no
O9 C25 C28 F52 -49(2) . . . . no
O9 C25 C28 F53 -166.5(19) . . . . no
O9 C25 C28 F54 64(2) . . . . no
C26 C25 C28 F52 -165.6(16) . . . . no
C26 C25 C28 F53 77(2) . . . . no
C26 C25 C28 F54 -53(2) . . . . no
C27 C25 C28 F52 69(2) . . . . no
C27 C25 C28 F53 -49(3) . . . . no
C27 C25 C28 F54 -178.9(17) . . . . no
O10 C26 C29 F55 -47(2) . . . . no
O10 C26 C29 F56 -165.8(19) . . . . no
O10 C26 C29 F57 67(2) . . . . no
C25 C26 C29 F55 -163.2(18) . . . . no
C25 C26 C29 F56 78(2) . . . . no
C25 C26 C29 F57 -49(2) . . . . no
C30 C26 C29 F55 66(2) . . . . no
C30 C26 C29 F56 -52(3) . . . . no
C30 C26 C29 F57 -179.1(18) . . . . no
O10 C26 C30 F58 63(2) . . . . no
O10 C26 C30 F59 -55(2) . . . . no
O10 C26 C30 F60 -172.0(19) . . . . no
C25 C26 C30 F58 -175.7(17) . . . . no
C25 C26 C30 F59 67(2) . . . . no
C25 C26 C30 F60 -50(3) . . . . no
C29 C26 C30 F58 -48(2) . . . . no
C29 C26 C30 F59 -165.8(19) . . . . no
C29 C26 C30 F60 77(2) . . . . no
O11 C31 C32 O12 23(3) . . . . no
O11 C31 C32 C35 161(2) . . . . no
O11 C31 C32 C36 -81(2) . . . . no
C33 C31 C32 O12 -86(2) . . . . no
C33 C31 C32 C35 51(3) . . . . no
C33 C31 C32 C36 169.8(16) . . . . no
C34 C31 C32 O12 152(2) . . . . no
C34 C31 C32 C35 -71(4) . . . . no
C34 C31 C32 C36 48(3) . . . . no
O11 C31 C33 F61 166(2) . . . . no
O11 C31 C33 F62 52(2) . . . . no
O11 C31 C33 F63 -65(2) . . . . no
C32 C31 C33 F61 -77(2) . . . . no
C32 C31 C33 F62 168.7(19) . . . . no
C32 C31 C33 F63 52(2) . . . . no
C34 C31 C33 F61 56(3) . . . . no
C34 C31 C33 F62 -58(2) . . . . no
C34 C31 C33 F63 -175.4(18) . . . . no
O11 C31 C34 F64 57(2) . . . . no
O11 C31 C34 F65 -64(3) . . . . no
O11 C31 C34 F66 176.5(18) . . . . no
C32 C31 C34 F64 -75(3) . . . . no
C32 C31 C34 F65 164(2) . . . . no
C32 C31 C34 F66 45(3) . . . . no
C33 C31 C34 F64 165(2) . . . . no
C33 C31 C34 F65 44(3) . . . . no
C33 C31 C34 F66 -75(2) . . . . no
O12 C32 C35 F67 177(2) . . . . no
O12 C32 C35 F68 64(2) . . . . no
O12 C32 C35 F69 -49(3) . . . . no
C31 C32 C35 F67 40(4) . . . . no
C31 C32 C35 F68 -73(3) . . . . no
C31 C32 C35 F69 174(2) . . . . no
C36 C32 C35 F67 -80(3) . . . . no
C36 C32 C35 F68 167(2) . . . . no
C36 C32 C35 F69 54(3) . . . . no
O12 C32 C36 F70 56(3) . . . . no
O12 C32 C36 F71 -68(2) . . . . no
O12 C32 C36 F72 179(2) . . . . no
C31 C32 C36 F70 169(2) . . . . no
C31 C32 C36 F71 45(3) . . . . no
C31 C32 C36 F72 -68(3) . . . . no
C35 C32 C36 F70 -56(3) . . . . no
C35 C32 C36 F71 -180(2) . . . . no
C35 C32 C36 F72 68(3) . . . . no
