#------------------------------------------------------------------------------
#$Date: 2016-02-16 22:30:59 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176467 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/97/4079796.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_4079796
loop_
_publ_author_name
'Zhao, Na'
'Zhang, Jinyuan'
'Yang, Ying'
'Chen, Guifang'
'Zhu, Hongping'
'Roesky, Herbert W.'
_publ_section_title
;
 Reactivity Studies of (Phenylethynyl)germylene LGeC≡CPh (L =
 HC[C(Me)N-2,6-iPr2C6H3]2) toward Pentafluorophenylcopper(I), -silver(I),
 and -gold(I) Complexes
;
_journal_issue                   3
_journal_name_full               Organometallics
_journal_page_first              762
_journal_paper_doi               10.1021/om300724t
_journal_volume                  32
_journal_year                    2013
_chemical_formula_sum            'C52.5 H50 Au Cu F10 Ge N2'
_chemical_formula_weight         1232.04
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 104.1190(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   14.3558(2)
_cell_length_b                   23.1550(3)
_cell_length_c                   15.5012(2)
_cell_measurement_reflns_used    11662
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      29.0621
_cell_measurement_theta_min      2.7044
_cell_volume                     4997.07(12)
_computing_cell_refinement       CrysAlisPro
_computing_data_collection       CrysAlisPro
_computing_data_reduction        CrysAlisPro
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_detector_area_resol_mean 16.1903
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Xcalibur, Sapphire3, Gemini ultra'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Enhanced (Mo) X-ray Source'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0442
_diffrn_reflns_av_sigmaI/netI    0.0501
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       26
_diffrn_reflns_limit_k_min       -28
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            30587
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         2.71
_exptl_absorpt_coefficient_mu    4.022
_exptl_absorpt_correction_T_max  0.6892
_exptl_absorpt_correction_T_min  0.5001
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   empirical
_exptl_crystal_colour            'light yellow'
_exptl_crystal_density_diffrn    1.638
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       rectanglar
_exptl_crystal_F_000             2436
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.680
_refine_diff_density_min         -0.560
_refine_diff_density_rms         0.106
_refine_ls_extinction_coef       0.00004(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.023
_refine_ls_hydrogen_treatment    'refined in a geometric riding mode'
_refine_ls_matrix_type           full
_refine_ls_number_parameters     618
_refine_ls_number_reflns         9812
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.029
_refine_ls_R_factor_all          0.0463
_refine_ls_R_factor_gt           0.0336
_refine_ls_shift/su_max          0.007
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0288P)²+1.1784P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0672
_refine_ls_wR_factor_ref         0.0715
_reflns_number_gt                8155
_reflns_number_total             9812
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om300724t_si_002.cif
_cod_data_source_block           Compound_6
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_cell_volume        4997.07(11)
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_original_formula_sum        'C52.50 H50 Au Cu F10 Ge N2'
_cod_database_code               4079796
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 1.096887(10) 1.327234(7) 0.106356(10) 0.02589(6) Uani 1 1 d . . .
Ge1 Ge 1.12389(2) 1.251816(17) 0.21220(3) 0.02035(10) Uani 1 1 d . . .
Cu1 Cu 1.07839(3) 1.16449(2) 0.37011(3) 0.02812(12) Uani 1 1 d . . .
N1 N 1.1756(2) 1.17773(13) 0.1922(2) 0.0209(7) Uani 1 1 d . . .
N2 N 1.22199(19) 1.26831(13) 0.3180(2) 0.0211(7) Uani 1 1 d . . .
F1 F 1.17891(18) 1.45606(11) 0.13224(17) 0.0508(7) Uani 1 1 d . . .
F2 F 1.16965(17) 1.54523(11) 0.02145(18) 0.0488(7) Uani 1 1 d . . .
F3 F 1.06958(19) 1.53580(11) -0.15055(18) 0.0543(7) Uani 1 1 d . . .
F4 F 0.97614(18) 1.43613(13) -0.20931(17) 0.0547(7) Uani 1 1 d . . .
F5 F 0.98230(16) 1.34698(11) -0.09938(16) 0.0408(6) Uani 1 1 d . . .
F6 F 1.1091(2) 1.18509(13) 0.5740(2) 0.0700(9) Uani 1 1 d . . .
F7 F 1.1531(3) 1.11013(16) 0.7109(2) 0.0865(11) Uani 1 1 d . . .
F8 F 1.1627(3) 0.99527(14) 0.6801(2) 0.0819(10) Uani 1 1 d . . .
F9 F 1.1283(2) 0.95569(12) 0.5102(2) 0.0725(9) Uani 1 1 d . . .
F10 F 1.0831(2) 1.02946(12) 0.37325(19) 0.0603(8) Uani 1 1 d . . .
C1 C 1.2387(3) 1.08303(16) 0.2497(3) 0.0315(10) Uani 1 1 d . . .
H1A H 1.2600 1.0792 0.1946 0.047 Uiso 1 1 calc R . .
H1B H 1.1817 1.0590 0.2462 0.047 Uiso 1 1 calc R . .
H1C H 1.2902 1.0705 0.3002 0.047 Uiso 1 1 calc R . .
C2 C 1.2144(2) 1.14525(16) 0.2625(3) 0.0226(8) Uani 1 1 d . . .
C3 C 1.2349(2) 1.16688(16) 0.3500(2) 0.0220(8) Uani 1 1 d . . .
H3A H 1.2785 1.1404 0.3924 0.026 Uiso 1 1 calc R . .
C4 C 1.2549(2) 1.22554(16) 0.3734(2) 0.0219(8) Uani 1 1 d . . .
C5 C 1.3147(3) 1.23677(19) 0.4660(3) 0.0356(10) Uani 1 1 d . . .
H5A H 1.3293 1.2781 0.4732 0.053 Uiso 1 1 calc R . .
H5B H 1.3748 1.2148 0.4757 0.053 Uiso 1 1 calc R . .
H5C H 1.2791 1.2247 0.5094 0.053 Uiso 1 1 calc R . .
C11 C 1.1580(3) 1.15461(17) 0.1031(3) 0.0283(9) Uani 1 1 d . . .
C12 C 1.0775(3) 1.11812(18) 0.0726(3) 0.0316(10) Uani 1 1 d . . .
C13 C 1.0644(3) 1.0947(2) -0.0121(3) 0.0470(13) Uani 1 1 d . . .
H13A H 1.0109 1.0702 -0.0346 0.056 Uiso 1 1 calc R . .
C14 C 1.1274(4) 1.1062(2) -0.0637(3) 0.0585(15) Uani 1 1 d . . .
H14A H 1.1181 1.0887 -0.1206 0.070 Uiso 1 1 calc R . .
C15 C 1.2043(4) 1.1431(2) -0.0339(3) 0.0534(13) Uani 1 1 d . . .
H15A H 1.2459 1.1517 -0.0713 0.064 Uiso 1 1 calc R . .
C16 C 1.2214(3) 1.16778(19) 0.0506(3) 0.0384(11) Uani 1 1 d . . .
C21 C 1.2419(2) 1.32844(16) 0.3420(3) 0.0256(9) Uani 1 1 d . . .
C22 C 1.3086(3) 1.35882(18) 0.3064(3) 0.0311(10) Uani 1 1 d . . .
C23 C 1.3231(3) 1.41637(18) 0.3289(3) 0.0369(11) Uani 1 1 d . . .
H23A H 1.3681 1.4380 0.3063 0.044 Uiso 1 1 calc R . .
C24 C 1.2734(3) 1.44337(19) 0.3838(3) 0.0410(12) Uani 1 1 d . . .
H24A H 1.2849 1.4830 0.3987 0.049 Uiso 1 1 calc R . .
C25 C 1.2079(3) 1.41313(18) 0.4165(3) 0.0350(10) Uani 1 1 d . . .
H25A H 1.1738 1.4321 0.4537 0.042 Uiso 1 1 calc R . .
C26 C 1.1904(3) 1.35509(17) 0.3964(3) 0.0284(9) Uani 1 1 d . . .
C31 C 1.0312(2) 1.22072(16) 0.2738(2) 0.0228(8) Uani 1 1 d . . .
C32 C 0.9577(3) 1.20627(17) 0.2943(3) 0.0260(9) Uani 1 1 d . . .
C33 C 0.8585(3) 1.19928(18) 0.2982(3) 0.0288(9) Uani 1 1 d . . .
C34 C 0.7916(3) 1.2405(2) 0.2608(3) 0.0371(11) Uani 1 1 d . . .
H34A H 0.8111 1.2739 0.2342 0.044 Uiso 1 1 calc R . .
C35 C 0.6966(3) 1.2335(2) 0.2619(3) 0.0508(14) Uani 1 1 d . . .
H35A H 0.6511 1.2625 0.2368 0.061 Uiso 1 1 calc R . .
C36 C 0.6673(3) 1.1854(2) 0.2985(4) 0.0586(15) Uani 1 1 d . . .
H36A H 0.6014 1.1805 0.2975 0.070 Uiso 1 1 calc R . .
C37 C 0.7335(3) 1.1437(2) 0.3373(4) 0.0633(17) Uani 1 1 d . . .
H37A H 0.7134 1.1103 0.3634 0.076 Uiso 1 1 calc R . .
C38 C 0.8295(3) 1.1511(2) 0.3375(4) 0.0473(13) Uani 1 1 d . . .
H38A H 0.8756 1.1230 0.3648 0.057 Uiso 1 1 calc R . .
C41 C 1.0822(3) 1.39671(17) 0.0215(3) 0.0258(9) Uani 1 1 d . . .
C42 C 1.1277(3) 1.44874(18) 0.0480(3) 0.0319(10) Uani 1 1 d . . .
C43 C 1.1244(3) 1.49516(17) -0.0080(3) 0.0311(10) Uani 1 1 d . . .
C44 C 1.0739(3) 1.49126(18) -0.0947(3) 0.0316(10) Uani 1 1 d . . .
C45 C 1.0262(3) 1.44055(19) -0.1237(3) 0.0316(10) Uani 1 1 d . . .
C46 C 1.0314(2) 1.39558(17) -0.0659(3) 0.0270(9) Uani 1 1 d . . .
C51 C 1.0943(3) 1.11069(19) 0.4678(3) 0.0322(10) Uani 1 1 d . . .
C52 C 1.1123(3) 1.1275(2) 0.5550(3) 0.0453(12) Uani 1 1 d . . .
C53 C 1.1347(4) 1.0906(2) 0.6264(3) 0.0522(13) Uani 1 1 d . . .
C54 C 1.1400(4) 1.0323(2) 0.6111(3) 0.0527(14) Uani 1 1 d . . .
C55 C 1.1225(3) 1.0128(2) 0.5256(3) 0.0445(12) Uani 1 1 d . . .
C56 C 1.0998(3) 1.0522(2) 0.4571(3) 0.0385(11) Uani 1 1 d . . .
C121 C 1.0055(3) 1.10588(17) 0.1263(3) 0.0320(10) Uani 1 1 d . . .
H12A H 1.0349 1.1174 0.1892 0.038 Uiso 1 1 calc R . .
C122 C 0.9769(3) 1.04274(19) 0.1265(4) 0.0517(13) Uani 1 1 d . . .
H12B H 1.0348 1.0188 0.1441 0.077 Uiso 1 1 calc R . .
H12C H 0.9406 1.0316 0.0668 0.077 Uiso 1 1 calc R . .
H12D H 0.9370 1.0370 0.1689 0.077 Uiso 1 1 calc R . .
C123 C 0.9161(3) 1.1433(2) 0.0921(3) 0.0446(12) Uani 1 1 d . . .
H12E H 0.9343 1.1841 0.0976 0.067 Uiso 1 1 calc R . .
H12F H 0.8694 1.1355 0.1273 0.067 Uiso 1 1 calc R . .
H12G H 0.8876 1.1341 0.0295 0.067 Uiso 1 1 calc R . .
C161 C 1.3069(3) 1.2071(2) 0.0846(3) 0.0473(13) Uani 1 1 d . . .
H16A H 1.2954 1.2289 0.1368 0.057 Uiso 1 1 calc R . .
C162 C 1.3207(4) 1.2510(3) 0.0160(4) 0.0794(19) Uani 1 1 d . . .
H16B H 1.2613 1.2731 -0.0053 0.119 Uiso 1 1 calc R . .
H16C H 1.3366 1.2309 -0.0342 0.119 Uiso 1 1 calc R . .
H16D H 1.3731 1.2773 0.0431 0.119 Uiso 1 1 calc R . .
C163 C 1.3988(4) 1.1714(3) 0.1172(4) 0.0780(19) Uani 1 1 d . . .
H16E H 1.3911 1.1454 0.1649 0.117 Uiso 1 1 calc R . .
H16F H 1.4532 1.1974 0.1397 0.117 Uiso 1 1 calc R . .
H16G H 1.4107 1.1486 0.0677 0.117 Uiso 1 1 calc R . .
C221 C 1.3624(3) 1.3300(2) 0.2456(3) 0.0452(12) Uani 1 1 d . . .
H22A H 1.3155 1.3045 0.2044 0.054 Uiso 1 1 calc R . .
C222 C 1.4016(4) 1.3724(3) 0.1875(4) 0.0713(18) Uani 1 1 d . . .
H22B H 1.3487 1.3956 0.1524 0.107 Uiso 1 1 calc R . .
H22C H 1.4322 1.3509 0.1475 0.107 Uiso 1 1 calc R . .
H22D H 1.4489 1.3978 0.2255 0.107 Uiso 1 1 calc R . .
C223 C 1.4427(3) 1.2915(2) 0.2959(4) 0.0671(17) Uani 1 1 d . . .
H22E H 1.4155 1.2599 0.3239 0.101 Uiso 1 1 calc R . .
H22F H 1.4866 1.3142 0.3419 0.101 Uiso 1 1 calc R . .
H22G H 1.4780 1.2757 0.2546 0.101 Uiso 1 1 calc R . .
C261 C 1.1131(3) 1.32511(18) 0.4314(3) 0.0367(11) Uani 1 1 d . . .
H26A H 1.1153 1.2830 0.4174 0.044 Uiso 1 1 calc R . .
C262 C 1.1288(4) 1.3310(2) 0.5323(3) 0.0522(13) Uani 1 1 d . . .
H26B H 1.1938 1.3182 0.5616 0.078 Uiso 1 1 calc R . .
H26C H 1.0818 1.3072 0.5524 0.078 Uiso 1 1 calc R . .
H26D H 1.1207 1.3715 0.5474 0.078 Uiso 1 1 calc R . .
C263 C 1.0145(3) 1.3479(2) 0.3824(4) 0.0515(14) Uani 1 1 d . . .
H26E H 1.0073 1.3446 0.3181 0.077 Uiso 1 1 calc R . .
H26F H 1.0086 1.3885 0.3982 0.077 Uiso 1 1 calc R . .
H26G H 0.9643 1.3251 0.3996 0.077 Uiso 1 1 calc R . .
C61 C 0.8535(16) 1.4999(11) -0.6498(16) 0.064(6) Uiso 0.25 1 d PD A 2
C62 C 0.8943(12) 1.4920(6) -0.5857(10) 0.072(4) Uiso 0.50 1 d PD . 2
C63 C 0.8895(8) 1.4682(5) -0.5007(8) 0.060(3) Uiso 0.50 1 d PD B 2
C64 C 0.9835(9) 1.4750(4) -0.4275(8) 0.041(2) Uiso 0.50 1 d PD . 2
C61A C 0.8457(16) 1.4827(11) -0.5986(17) 0.058(6) Uiso 0.25 1 d PD . 1
C62A C 0.9517(11) 1.4995(7) -0.5463(11) 0.090(4) Uiso 0.50 1 d PD . 1
C63A C 0.9463(10) 1.4754(6) -0.4660(10) 0.063(3) Uiso 0.50 1 d PD . 1
C64A C 1.0397(12) 1.4853(7) -0.3993(11) 0.088(4) Uiso 0.50 1 d PD . 1
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'
N N 0.0061 0.0033 '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'
Cu Cu 0.3201 1.2651 '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'
Au Au -2.0133 8.8022 '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
C41 Au1 Ge1 175.21(11) . .
N2 Ge1 N1 94.80(12) . .
N2 Ge1 C31 95.82(14) . .
N1 Ge1 C31 94.92(14) . .
N2 Ge1 Au1 114.06(9) . .
N1 Ge1 Au1 123.46(9) . .
C31 Ge1 Au1 126.54(10) . .
C51 Cu1 C31 166.57(16) . .
C51 Cu1 C32 131.76(16) . .
C31 Cu1 C32 34.94(14) . .
C51 Cu1 C3 100.71(14) . .
C31 Cu1 C3 92.70(14) . .
C32 Cu1 C3 127.42(14) . .
C2 N1 C11 121.0(3) . .
C2 N1 Ge1 118.2(3) . .
C11 N1 Ge1 120.0(2) . .
C4 N2 C21 122.4(3) . .
C4 N2 Ge1 118.6(2) . .
C21 N2 Ge1 117.8(2) . .
C2 C1 H1A 109.5 . .
C2 C1 H1B 109.5 . .
H1A C1 H1B 109.5 . .
C2 C1 H1C 109.5 . .
H1A C1 H1C 109.5 . .
H1B C1 H1C 109.5 . .
N1 C2 C3 122.4(3) . .
N1 C2 C1 119.9(3) . .
C3 C2 C1 117.7(3) . .
C2 C3 C4 124.7(4) . .
C2 C3 Cu1 97.9(2) . .
C4 C3 Cu1 97.4(2) . .
C2 C3 H3A 111.4 . .
C4 C3 H3A 111.4 . .
Cu1 C3 H3A 111.4 . .
N2 C4 C3 122.2(3) . .
N2 C4 C5 121.4(3) . .
C3 C4 C5 116.3(3) . .
C4 C5 H5A 109.5 . .
C4 C5 H5B 109.5 . .
H5A C5 H5B 109.5 . .
C4 C5 H5C 109.5 . .
H5A C5 H5C 109.5 . .
H5B C5 H5C 109.5 . .
C16 C11 C12 122.1(4) . .
C16 C11 N1 119.3(4) . .
C12 C11 N1 118.5(4) . .
C13 C12 C11 117.3(4) . .
C13 C12 C121 119.8(4) . .
C11 C12 C121 122.9(4) . .
C14 C13 C12 121.2(4) . .
C14 C13 H13A 119.4 . .
C12 C13 H13A 119.4 . .
C13 C14 C15 120.7(5) . .
C13 C14 H14A 119.6 . .
C15 C14 H14A 119.6 . .
C14 C15 C16 120.7(5) . .
C14 C15 H15A 119.7 . .
C16 C15 H15A 119.7 . .
C11 C16 C15 117.9(4) . .
C11 C16 C161 121.2(4) . .
C15 C16 C161 120.9(4) . .
C26 C21 C22 121.9(4) . .
C26 C21 N2 118.7(3) . .
C22 C21 N2 119.4(4) . .
C23 C22 C21 117.3(4) . .
C23 C22 C221 121.0(4) . .
C21 C22 C221 121.7(4) . .
C22 C23 C24 121.5(4) . .
C22 C23 H23A 119.3 . .
C24 C23 H23A 119.3 . .
C25 C24 C23 120.1(4) . .
C25 C24 H24A 120.0 . .
C23 C24 H24A 120.0 . .
C24 C25 C26 121.1(4) . .
C24 C25 H25A 119.5 . .
C26 C25 H25A 119.5 . .
C25 C26 C21 118.1(4) . .
C25 C26 C261 118.1(4) . .
C21 C26 C261 123.8(4) . .
C32 C31 Ge1 164.4(3) . .
C32 C31 Cu1 77.3(3) . .
Ge1 C31 Cu1 117.62(17) . .
C31 C32 C33 164.2(4) . .
C31 C32 Cu1 67.7(2) . .
C33 C32 Cu1 128.0(3) . .
C34 C33 C38 119.4(4) . .
C34 C33 C32 119.7(4) . .
C38 C33 C32 120.9(4) . .
C35 C34 C33 120.2(4) . .
C35 C34 H34A 119.9 . .
C33 C34 H34A 119.9 . .
C36 C35 C34 120.6(4) . .
C36 C35 H35A 119.7 . .
C34 C35 H35A 119.7 . .
C35 C36 C37 120.1(4) . .
C35 C36 H36A 119.9 . .
C37 C36 H36A 119.9 . .
C36 C37 C38 119.3(5) . .
C36 C37 H37A 120.3 . .
C38 C37 H37A 120.3 . .
C33 C38 C37 120.3(4) . .
C33 C38 H38A 119.8 . .
C37 C38 H38A 119.8 . .
C46 C41 C42 114.1(4) . .
C46 C41 Au1 124.3(3) . .
C42 C41 Au1 121.6(3) . .
F1 C42 C43 116.2(4) . .
F1 C42 C41 120.3(4) . .
C43 C42 C41 123.5(4) . .
F2 C43 C44 119.0(4) . .
F2 C43 C42 121.1(4) . .
C44 C43 C42 119.9(4) . .
F3 C44 C43 121.0(4) . .
F3 C44 C45 120.3(4) . .
C43 C44 C45 118.6(4) . .
F4 C45 C46 121.2(4) . .
F4 C45 C44 119.2(4) . .
C46 C45 C44 119.6(4) . .
F5 C46 C45 116.2(3) . .
F5 C46 C41 119.5(4) . .
C45 C46 C41 124.3(4) . .
C56 C51 C52 113.5(4) . .
C56 C51 Cu1 122.9(3) . .
C52 C51 Cu1 123.2(3) . .
F6 C52 C51 118.8(4) . .
F6 C52 C53 116.5(5) . .
C51 C52 C53 124.7(5) . .
F7 C53 C52 121.7(5) . .
F7 C53 C54 119.3(5) . .
C52 C53 C54 118.9(5) . .
F8 C54 C55 120.8(5) . .
F8 C54 C53 120.0(5) . .
C55 C54 C53 119.1(4) . .
F9 C55 C54 119.4(4) . .
F9 C55 C56 121.7(5) . .
C54 C55 C56 118.9(5) . .
F10 C56 C51 119.6(4) . .
F10 C56 C55 115.6(4) . .
C51 C56 C55 124.8(5) . .
C12 C121 C122 113.9(4) . .
C12 C121 C123 109.4(4) . .
C122 C121 C123 110.0(3) . .
C12 C121 H12A 107.8 . .
C122 C121 H12A 107.8 . .
C123 C121 H12A 107.8 . .
C121 C122 H12B 109.5 . .
C121 C122 H12C 109.5 . .
H12B C122 H12C 109.5 . .
C121 C122 H12D 109.5 . .
H12B C122 H12D 109.5 . .
H12C C122 H12D 109.5 . .
C121 C123 H12E 109.5 . .
C121 C123 H12F 109.5 . .
H12E C123 H12F 109.5 . .
C121 C123 H12G 109.5 . .
H12E C123 H12G 109.5 . .
H12F C123 H12G 109.5 . .
C16 C161 C162 113.0(4) . .
C16 C161 C163 110.5(4) . .
C162 C161 C163 110.0(4) . .
C16 C161 H16A 107.7 . .
C162 C161 H16A 107.7 . .
C163 C161 H16A 107.7 . .
C161 C162 H16B 109.5 . .
C161 C162 H16C 109.5 . .
H16B C162 H16C 109.5 . .
C161 C162 H16D 109.5 . .
H16B C162 H16D 109.5 . .
H16C C162 H16D 109.5 . .
C161 C163 H16E 109.5 . .
C161 C163 H16F 109.5 . .
H16E C163 H16F 109.5 . .
C161 C163 H16G 109.5 . .
H16E C163 H16G 109.5 . .
H16F C163 H16G 109.5 . .
C22 C221 C223 112.3(4) . .
C22 C221 C222 113.7(4) . .
C223 C221 C222 109.8(4) . .
C22 C221 H22A 106.9 . .
C223 C221 H22A 106.9 . .
C222 C221 H22A 106.9 . .
C221 C222 H22B 109.5 . .
C221 C222 H22C 109.5 . .
H22B C222 H22C 109.5 . .
C221 C222 H22D 109.5 . .
H22B C222 H22D 109.5 . .
H22C C222 H22D 109.5 . .
C221 C223 H22E 109.5 . .
C221 C223 H22F 109.5 . .
H22E C223 H22F 109.5 . .
C221 C223 H22G 109.5 . .
H22E C223 H22G 109.5 . .
H22F C223 H22G 109.5 . .
C26 C261 C263 109.6(4) . .
C26 C261 C262 112.7(4) . .
C263 C261 C262 111.4(4) . .
C26 C261 H26A 107.7 . .
C263 C261 H26A 107.7 . .
C262 C261 H26A 107.7 . .
C261 C262 H26B 109.5 . .
C261 C262 H26C 109.5 . .
H26B C262 H26C 109.5 . .
C261 C262 H26D 109.5 . .
H26B C262 H26D 109.5 . .
H26C C262 H26D 109.5 . .
C261 C263 H26E 109.5 . .
C261 C263 H26F 109.5 . .
H26E C263 H26F 109.5 . .
C261 C263 H26G 109.5 . .
H26E C263 H26G 109.5 . .
H26F C263 H26G 109.5 . .
C61 C62 C63 143(2) . .
C61 C62 C64 109(2) . 3_784
C63 C62 C64 107.9(11) . 3_784
C62 C63 C64 113.7(11) . .
C63 C64 C62 138.3(9) . 3_784
C62A C61A C64A 31.6(8) . 3_784
C64A C62A C63A 175(2) 3_784 .
C64A C62A C63A 69.2(15) 3_784 3_784
C63A C62A C63A 107.4(13) . 3_784
C64A C62A C61A 87.3(19) 3_784 .
C63A C62A C61A 96.0(15) . .
C63A C62A C61A 156.6(18) 3_784 .
C64A C62A C62A 119(2) 3_784 3_784
C63A C62A C62A 58.0(11) . 3_784
C63A C62A C62A 49.4(9) 3_784 3_784
C61A C62A C62A 154(2) . 3_784
C62A C63A C64A 108.9(12) . .
C62A C63A C62A 72.6(13) . 3_784
C64A C63A C62A 36.4(8) . 3_784
C62A C64A C63A 74.4(15) 3_784 .
C62A C64A C61A 61.1(16) 3_784 3_784
C63A C64A C61A 135.5(15) . 3_784
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Au1 C41 2.056(4) .
Au1 Ge1 2.3625(4) .
Ge1 N2 1.921(3) .
Ge1 N1 1.924(3) .
Ge1 C31 1.955(4) .
Cu1 C51 1.931(4) .
Cu1 C31 1.973(4) .
Cu1 C32 2.080(4) .
Cu1 C3 2.343(3) .
N1 C2 1.329(5) .
N1 C11 1.445(5) .
N2 C4 1.321(5) .
N2 C21 1.452(4) .
F1 C42 1.344(4) .
F2 C43 1.353(4) .
F3 C44 1.338(4) .
F4 C45 1.351(4) .
F5 C46 1.362(4) .
F6 C52 1.368(5) .
F7 C53 1.349(6) .
F8 C54 1.348(5) .
F9 C55 1.351(5) .
F10 C56 1.368(5) .
C1 C2 1.506(5) .
C1 H1A 0.9800 .
C1 H1B 0.9800 .
C1 H1C 0.9800 .
C2 C3 1.409(5) .
C3 C4 1.417(5) .
C3 H3A 1.0000 .
C4 C5 1.504(5) .
C5 H5A 0.9800 .
C5 H5B 0.9800 .
C5 H5C 0.9800 .
C11 C16 1.393(6) .
C11 C12 1.416(5) .
C12 C13 1.391(6) .
C12 C121 1.504(6) .
C13 C14 1.372(7) .
C13 H13A 0.9500 .
C14 C15 1.383(7) .
C14 H14A 0.9500 .
C15 C16 1.395(6) .
C15 H15A 0.9500 .
C16 C161 1.516(6) .
C21 C26 1.394(5) .
C21 C22 1.405(6) .
C22 C23 1.380(6) .
C22 C221 1.512(6) .
C23 C24 1.386(6) .
C23 H23A 0.9500 .
C24 C25 1.365(6) .
C24 H24A 0.9500 .
C25 C26 1.389(5) .
C25 H25A 0.9500 .
C26 C261 1.518(6) .
C31 C32 1.221(5) .
C32 C33 1.449(5) .
C33 C34 1.378(5) .
C33 C38 1.382(6) .
C34 C35 1.378(6) .
C34 H34A 0.9500 .
C35 C36 1.363(7) .
C35 H35A 0.9500 .
C36 C37 1.386(7) .
C36 H36A 0.9500 .
C37 C38 1.388(6) .
C37 H37A 0.9500 .
C38 H38A 0.9500 .
C41 C46 1.373(5) .
C41 C42 1.384(5) .
C42 C43 1.375(6) .
C43 C44 1.365(6) .
C44 C45 1.379(6) .
C45 C46 1.363(5) .
C51 C56 1.369(6) .
C51 C52 1.370(6) .
C52 C53 1.373(7) .
C53 C54 1.376(7) .
C54 C55 1.363(7) .
C55 C56 1.377(6) .
C121 C122 1.519(6) .
C121 C123 1.531(5) .
C121 H12A 1.0000 .
C122 H12B 0.9800 .
C122 H12C 0.9800 .
C122 H12D 0.9800 .
C123 H12E 0.9800 .
C123 H12F 0.9800 .
C123 H12G 0.9800 .
C161 C162 1.520(7) .
C161 C163 1.533(7) .
C161 H16A 1.0000 .
C162 H16B 0.9800 .
C162 H16C 0.9800 .
C162 H16D 0.9800 .
C163 H16E 0.9800 .
C163 H16F 0.9800 .
C163 H16G 0.9800 .
C221 C223 1.514(7) .
C221 C222 1.528(7) .
C221 H22A 1.0000 .
C222 H22B 0.9800 .
C222 H22C 0.9800 .
C222 H22D 0.9800 .
C223 H22E 0.9800 .
C223 H22F 0.9800 .
C223 H22G 0.9800 .
C261 C263 1.527(6) .
C261 C262 1.531(6) .
C261 H26A 1.0000 .
C262 H26B 0.9800 .
C262 H26C 0.9800 .
C262 H26D 0.9800 .
C263 H26E 0.9800 .
C263 H26F 0.9800 .
C263 H26G 0.9800 .
C61 C62 1.04(2) .
C62 C63 1.445(17) .
C62 C64 1.878(18) 3_784
C63 C64 1.545(14) .
C64 C62 1.878(18) 3_784
C61A C62A 1.59(2) .
C61A C64A 1.81(3) 3_784
C62A C64A 0.950(19) 3_784
C62A C63A 1.383(17) .
C62A C63A 1.543(19) 3_784
C62A C62A 1.74(3) 3_784
C63A C64A 1.497(18) .
C63A C62A 1.543(19) 3_784
C64A C62A 0.950(19) 3_784
C64A C61A 1.81(3) 3_784
