#------------------------------------------------------------------------------
#$Date: 2019-11-24 07:05:08 +0200 (Sun, 24 Nov 2019) $
#$Revision: 237056 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/08/78/4087860.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_4087860
loop_
_publ_author_name
'Hueber, Damien'
'Hoffmann, Marie'
'de Frémont, Pierre'
'Pale, Patrick'
'Blanc, Aurélien'
_publ_section_title
;
 Polyoxometalate-Gold(I)/H+ Complexes: Air-Stable, Efficient, Polyvalent,
 and Bifunctional Catalysts
;
_journal_issue                   20
_journal_name_full               Organometallics
_journal_page_first              5065
_journal_paper_doi               10.1021/acs.organomet.5b00656
_journal_volume                  34
_journal_year                    2015
_chemical_formula_moiety         'O40 Si W12, 4(C5 H12 Au N P), 4(C2 H3 N)'
_chemical_formula_sum            'C28 H60 Au4 N8 O40 P4 Si W12'
_chemical_formula_weight         4294.87
_chemical_name_common            '[(PMe)3Au(MeCN)]4-(POM)2'
_space_group_crystal_system      monoclinic
_space_group_IT_number           13
_space_group_name_Hall           '-P 2yc'
_space_group_name_H-M_alt        'P 1 2/c 1'
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      13
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/6
_cell_angle_alpha                90
_cell_angle_beta                 130.0020(10)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   16.1463(4)
_cell_length_b                   12.7690(2)
_cell_length_c                   23.6131(5)
_cell_measurement_reflns_used    24529
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      27.485
_cell_measurement_theta_min      0.998
_cell_volume                     3729.27(15)
_computing_cell_refinement       'HKL Scalepack (Otwinowski & Minor 1997)'
_computing_data_collection       'Collect (Bruker AXS BV, 1997-2004)'
_computing_data_reduction
'HKL Denzo and Scalepack (Otwinowski & Minor 1997)'
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_structure_solution    'Sir 97'
_diffrn_ambient_temperature      173(2)
_diffrn_detector_area_resol_mean 9
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  KappaCCD
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1140
_diffrn_reflns_av_unetI/netI     0.0608
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            34092
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.998
_diffrn_reflns_theta_min         2.526
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    26.438
_exptl_absorpt_correction_T_max  0.0229
_exptl_absorpt_correction_T_min  0.0031
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
[c.f. r.h. blessing, acta cryst. (1995), a51, 33-38]
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    3.825
_exptl_crystal_description       Plate
_exptl_crystal_F_000             3764
_exptl_crystal_recrystallization_method Acetonitrile
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.04
_refine_diff_density_max         1.491
_refine_diff_density_min         -1.837
_refine_diff_density_rms         0.354
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.143
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     440
_refine_ls_number_reflns         7336
_refine_ls_number_restraints     17
_refine_ls_restrained_S_all      1.142
_refine_ls_R_factor_all          0.0631
_refine_ls_R_factor_gt           0.0532
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0671P)²+17.4215P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1346
_refine_ls_wR_factor_ref         0.1395
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6304
_reflns_number_total             7336
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            om5b00656_si_007.cif
_cod_data_source_block           compound_5a
_cod_original_cell_volume        3729.27(14)
_cod_original_sg_symbol_H-M      'P 2/c'
_cod_database_code               4087860
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelxl_version_number           2014/6
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 0.09243(6) 0.49575(5) 0.23519(3) 0.06179(19) Uani 1 1 d . . . . .
Au2 Au 0.07121(5) 0.00356(5) 0.22808(3) 0.05266(17) Uani 1 1 d . . . . .
P1 P -0.0109(4) 0.6049(4) 0.1400(3) 0.0633(11) Uani 1 1 d D . . . .
P2 P -0.0274(3) 0.1120(3) 0.1313(2) 0.0525(9) Uani 1 1 d . . . . .
N1 N 0.2061(12) 0.4102(12) 0.3271(7) 0.071(4) Uani 1 1 d . . . . .
N2 N 0.1863(11) -0.0839(11) 0.3225(7) 0.059(3) Uani 1 1 d . . . . .
C11 C 0.334(3) 0.6577(19) 0.1306(18) 0.140(13) Uani 1 1 d D . . . .
H11A H 0.3291 0.7272 0.1437 0.210 Uiso 1 1 calc R U . . .
H11B H 0.4047 0.6478 0.1453 0.210 Uiso 1 1 calc R U . . .
H11C H 0.3232 0.6075 0.1554 0.210 Uiso 1 1 calc R U . . .
C1A C -0.1434(18) 0.622(3) 0.1084(18) 0.095(6) Uani 0.73(2) 1 d D . P A 1
H1A1 H -0.1415 0.6225 0.1498 0.143 Uiso 0.73(2) 1 calc R U P A 1
H1A2 H -0.1720 0.6876 0.0824 0.143 Uiso 0.73(2) 1 calc R U P A 1
H1A3 H -0.1886 0.5659 0.0756 0.143 Uiso 0.73(2) 1 calc R U P A 1
C2A C 0.043(2) 0.7345(16) 0.1690(15) 0.095(6) Uani 0.73(2) 1 d D . P A 1
H2A1 H 0.0430 0.7561 0.2080 0.143 Uiso 0.73(2) 1 calc R U P A 1
H2A2 H 0.1156 0.7354 0.1866 0.143 Uiso 0.73(2) 1 calc R U P A 1
H2A3 H -0.0008 0.7818 0.1280 0.143 Uiso 0.73(2) 1 calc R U P A 1
C3A C 0.005(3) 0.602(3) 0.0727(15) 0.095(6) Uani 0.73(2) 1 d D . P A 1
H3A1 H 0.0803 0.5921 0.0966 0.143 Uiso 0.73(2) 1 calc R U P A 1
H3A2 H -0.0361 0.5450 0.0390 0.143 Uiso 0.73(2) 1 calc R U P A 1
H3A3 H -0.0196 0.6667 0.0458 0.143 Uiso 0.73(2) 1 calc R U P A 1
C1B C -0.147(3) 0.560(7) 0.072(4) 0.095(6) Uani 0.27(2) 1 d D . P A 2
H1B1 H -0.1834 0.5633 0.0912 0.143 Uiso 0.27(2) 1 calc R U P A 2
H1B2 H -0.1832 0.6045 0.0287 0.143 Uiso 0.27(2) 1 calc R U P A 2
H1B3 H -0.1462 0.4896 0.0582 0.143 Uiso 0.27(2) 1 calc R U P A 2
C2B C -0.062(7) 0.715(4) 0.155(4) 0.095(6) Uani 0.27(2) 1 d D . P A 2
H2B1 H -0.0362 0.7138 0.2045 0.143 Uiso 0.27(2) 1 calc R U P A 2
H2B2 H -0.0377 0.7784 0.1474 0.143 Uiso 0.27(2) 1 calc R U P A 2
H2B3 H -0.1395 0.7134 0.1206 0.143 Uiso 0.27(2) 1 calc R U P A 2
C3B C -0.033(8) 0.570(8) 0.058(3) 0.095(6) Uani 0.27(2) 1 d D . P A 2
H3B1 H 0.0046 0.5062 0.0665 0.143 Uiso 0.27(2) 1 calc R U P A 2
H3B2 H -0.1093 0.5598 0.0186 0.143 Uiso 0.27(2) 1 calc R U P A 2
H3B3 H -0.0074 0.6249 0.0454 0.143 Uiso 0.27(2) 1 calc R U P A 2
C4 C 0.2800(15) 0.3831(13) 0.3842(10) 0.061(4) Uani 1 1 d . . . . .
C5 C 0.3772(14) 0.3505(13) 0.4570(9) 0.066(5) Uani 1 1 d . . . . .
H5A H 0.3652 0.2834 0.4690 0.098 Uiso 1 1 calc R U . . .
H5B H 0.3941 0.4010 0.4933 0.098 Uiso 1 1 calc R U . . .
H5C H 0.4364 0.3457 0.4568 0.098 Uiso 1 1 calc R U . . .
C6 C -0.0067(14) 0.0953(15) 0.0664(10) 0.068(4) Uani 1 1 d . . . . .
H6A H 0.0694 0.0953 0.0919 0.102 Uiso 1 1 calc R U . . .
H6B H -0.0376 0.0300 0.0409 0.102 Uiso 1 1 calc R U . . .
H6C H -0.0407 0.1517 0.0313 0.102 Uiso 1 1 calc R U . . .
C7 C 0.0146(14) 0.2470(13) 0.1619(10) 0.064(4) Uani 1 1 d . . . . .
H7A H 0.0063 0.2638 0.1977 0.096 Uiso 1 1 calc R U . . .
H7B H 0.0890 0.2551 0.1839 0.096 Uiso 1 1 calc R U . . .
H7C H -0.0294 0.2932 0.1203 0.096 Uiso 1 1 calc R U . . .
C8 C -0.1727(10) 0.1110(13) 0.0781(8) 0.052(3) Uani 1 1 d . . . . .
H8A H -0.1883 0.1198 0.1108 0.079 Uiso 1 1 calc R U . . .
H8B H -0.2049 0.1672 0.0429 0.079 Uiso 1 1 calc R U . . .
H8C H -0.2017 0.0454 0.0525 0.079 Uiso 1 1 calc R U . . .
C9 C 0.2674(14) -0.1043(13) 0.3768(10) 0.057(4) Uani 1 1 d . . . . .
C10 C 0.3707(15) -0.1344(16) 0.4455(9) 0.077(6) Uani 1 1 d . . . . .
H10A H 0.4192 -0.1525 0.4367 0.115 Uiso 1 1 calc R U . . .
H10B H 0.3613 -0.1937 0.4659 0.115 Uiso 1 1 calc R U . . .
H10C H 0.4002 -0.0770 0.4798 0.115 Uiso 1 1 calc R U . . .
N3 N 0.208(3) 0.638(3) 0.0014(18) 0.27(3) Uani 1 1 d D . . . .
C12 C 0.261(2) 0.6451(17) 0.0591(15) 0.095(8) Uani 1 1 d D . . . .
Si1 Si 0.5000 0.1432(3) 0.2500 0.0371(10) Uani 1 2 d S T P . .
W1 W 0.55263(5) 0.34167(4) 0.37388(3) 0.04557(16) Uani 1 1 d . . . . .
W2 W 0.34974(5) 0.13402(4) 0.31079(3) 0.04415(16) Uani 1 1 d . . . . .
W3 W 0.53328(4) -0.05457(4) 0.36771(3) 0.04437(16) Uani 1 1 d . . . . .
W4 W 0.30271(4) -0.05101(4) 0.19143(3) 0.04386(15) Uani 1 1 d . . . . .
W5 W 0.26160(5) 0.15254(4) 0.06415(3) 0.04579(16) Uani 1 1 d . . . . .
W6 W 0.29782(5) 0.33670(4) 0.17944(3) 0.04594(16) Uani 1 1 d . . . . .
O1 O 0.4298(7) 0.3744(7) 0.2754(5) 0.046(2) Uani 1 1 d . . . . .
O2 O 0.5464(9) 0.4355(7) 0.4227(6) 0.056(3) Uani 1 1 d . . . . .
O3 O 0.4618(8) 0.2325(7) 0.3662(5) 0.044(2) Uani 1 1 d . . . . .
O4 O 0.2767(8) 0.1605(7) 0.3393(6) 0.051(2) Uani 1 1 d . . . . .
O5 O 0.2589(8) 0.0260(7) 0.2369(5) 0.047(2) Uani 1 1 d . . . . .
O6 O 0.4396(8) 0.0247(7) 0.3772(5) 0.049(2) Uani 1 1 d . . . . .
O7 O 0.5780(9) -0.1491(8) 0.4336(6) 0.054(3) Uani 1 1 d . . . . .
O8 O 0.6389(7) 0.0536(6) 0.4231(5) 0.045(2) Uani 1 1 d . . . . .
O9 O 0.4421(7) 0.0694(7) 0.2723(5) 0.043(2) Uani 1 1 d . . . . .
O10 O 0.6758(8) 0.2614(7) 0.4533(5) 0.050(2) Uani 1 1 d . . . . .
O11 O 0.5898(7) 0.2156(7) 0.3192(5) 0.045(2) Uani 1 1 d . . . . .
O12 O 0.1472(8) 0.1271(8) -0.0257(5) 0.053(2) Uani 1 1 d . . . . .
O13 O 0.3926(7) -0.0884(7) 0.1672(5) 0.043(2) Uani 1 1 d . . . . .
O14 O 0.2480(7) 0.0565(6) 0.1193(5) 0.0409(19) Uani 1 1 d . . . . .
O15 O 0.4052(7) -0.1245(7) 0.2844(5) 0.045(2) Uani 1 1 d . . . . .
O16 O 0.2026(8) -0.1451(7) 0.1437(6) 0.055(3) Uani 1 1 d . . . . .
O17 O 0.2063(8) 0.2603(7) 0.0895(5) 0.051(2) Uani 1 1 d . . . . .
O18 O 0.6454(8) 0.4093(7) 0.3621(5) 0.046(2) Uani 1 1 d . . . . .
O19 O 0.2867(8) 0.2307(7) 0.2293(5) 0.047(2) Uani 1 1 d . . . . .
O20 O 0.2095(8) 0.4305(7) 0.1659(6) 0.054(3) Uani 1 1 d . . . . .
C14 C 0.343(3) 0.634(3) 0.343(2) 0.120(12) Uani 1 1 d D . . . .
C13 C 0.362(3) 0.6273(14) 0.2967(17) 0.130(12) Uani 1 1 d D . . . .
H13A H 0.3103 0.5806 0.2572 0.195 Uiso 1 1 calc R U . . .
H13B H 0.4336 0.6009 0.3221 0.195 Uiso 1 1 calc R U . . .
H13C H 0.3553 0.6954 0.2769 0.195 Uiso 1 1 calc R U . . .
N4 N 0.337(3) 0.638(2) 0.386(2) 0.167(15) Uani 1 1 d D . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Au Au -2.0133 8.8022 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 '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'
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
W W -0.8490 6.8722 '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'
H H 0.0000 0.0000 '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
N1 Au1 P1 171.2(5) . .
N2 Au2 P2 170.0(4) . .
N2 Au2 Au2 89.2(4) . 2
P2 Au2 Au2 98.58(11) . 2
C3A P1 C1A 117.4(16) . .
C3B P1 C2B 128(4) . .
C3B P1 C1B 70(4) . .
C2B P1 C1B 89(4) . .
C3A P1 C2A 92.8(17) . .
C1A P1 C2A 101.8(15) . .
C3A P1 Au1 116.5(12) . .
C1A P1 Au1 114.9(10) . .
C3B P1 Au1 116(3) . .
C2B P1 Au1 116(2) . .
C1B P1 Au1 114(3) . .
C2A P1 Au1 109.2(9) . .
C6 P2 C8 106.1(8) . .
C6 P2 C7 103.1(9) . .
C8 P2 C7 105.5(8) . .
C6 P2 Au2 113.7(6) . .
C8 P2 Au2 117.2(5) . .
C7 P2 Au2 110.0(6) . .
C4 N1 Au1 165.1(15) . .
C9 N2 Au2 157.9(14) . .
C12 C11 H11A 109.5 . .
C12 C11 H11B 109.5 . .
H11A C11 H11B 109.5 . .
C12 C11 H11C 109.5 . .
H11A C11 H11C 109.5 . .
H11B C11 H11C 109.5 . .
P1 C1A H1A1 109.5 . .
P1 C1A H1A2 109.5 . .
H1A1 C1A H1A2 109.5 . .
P1 C1A H1A3 109.5 . .
H1A1 C1A H1A3 109.5 . .
H1A2 C1A H1A3 109.5 . .
P1 C2A H2A1 109.5 . .
P1 C2A H2A2 109.5 . .
H2A1 C2A H2A2 109.5 . .
P1 C2A H2A3 109.5 . .
H2A1 C2A H2A3 109.5 . .
H2A2 C2A H2A3 109.5 . .
P1 C3A H3A1 109.5 . .
P1 C3A H3A2 109.5 . .
H3A1 C3A H3A2 109.5 . .
P1 C3A H3A3 109.5 . .
H3A1 C3A H3A3 109.5 . .
H3A2 C3A H3A3 109.5 . .
P1 C1B H1B1 109.5 . .
P1 C1B H1B2 109.5 . .
H1B1 C1B H1B2 109.5 . .
P1 C1B H1B3 109.5 . .
H1B1 C1B H1B3 109.5 . .
H1B2 C1B H1B3 109.5 . .
P1 C2B H2B1 109.5 . .
P1 C2B H2B2 109.5 . .
H2B1 C2B H2B2 109.5 . .
P1 C2B H2B3 109.5 . .
H2B1 C2B H2B3 109.5 . .
H2B2 C2B H2B3 109.5 . .
P1 C3B H3B1 109.5 . .
P1 C3B H3B2 109.5 . .
H3B1 C3B H3B2 109.5 . .
P1 C3B H3B3 109.5 . .
H3B1 C3B H3B3 109.5 . .
H3B2 C3B H3B3 109.5 . .
N1 C4 C5 178(2) . .
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 . .
P2 C6 H6A 109.5 . .
P2 C6 H6B 109.5 . .
H6A C6 H6B 109.5 . .
P2 C6 H6C 109.5 . .
H6A C6 H6C 109.5 . .
H6B C6 H6C 109.5 . .
P2 C7 H7A 109.5 . .
P2 C7 H7B 109.5 . .
H7A C7 H7B 109.5 . .
P2 C7 H7C 109.5 . .
H7A C7 H7C 109.5 . .
H7B C7 H7C 109.5 . .
P2 C8 H8A 109.5 . .
P2 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
P2 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
N2 C9 C10 177.9(19) . .
C9 C10 H10A 109.5 . .
C9 C10 H10B 109.5 . .
H10A C10 H10B 109.5 . .
C9 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
N3 C12 C11 174(5) . .
O11 Si1 O11 109.7(7) 2_655 .
O11 Si1 O9 109.3(4) 2_655 .
O11 Si1 O9 109.5(5) . .
O11 Si1 O9 109.5(5) 2_655 2_655
O11 Si1 O9 109.3(4) . 2_655
O9 Si1 O9 109.6(7) . 2_655
O2 W1 O1 101.8(5) . .
O2 W1 O18 100.1(5) . .
O1 W1 O18 91.3(4) . .
O2 W1 O10 100.8(5) . .
O1 W1 O10 157.2(4) . .
O18 W1 O10 88.0(4) . .
O2 W1 O3 101.4(5) . .
O1 W1 O3 85.0(4) . .
O18 W1 O3 158.6(4) . .
O10 W1 O3 87.4(4) . .
O2 W1 O11 171.4(4) . .
O1 W1 O11 85.0(4) . .
O18 W1 O11 74.3(3) . .
O10 W1 O11 72.8(4) . .
O3 W1 O11 84.4(4) . .
O4 W2 O3 101.0(4) . .
O4 W2 O6 100.0(4) . .
O3 W2 O6 92.0(4) . .
O4 W2 O19 102.0(4) . .
O3 W2 O19 85.5(4) . .
O6 W2 O19 157.9(4) . .
O4 W2 O5 100.3(4) . .
O3 W2 O5 158.5(4) . .
O6 W2 O5 87.4(4) . .
O19 W2 O5 87.1(4) . .
O4 W2 O9 170.7(4) . .
O3 W2 O9 86.4(4) . .
O6 W2 O9 73.8(4) . .
O19 W2 O9 84.1(4) . .
O5 W2 O9 72.8(4) . .
O7 W3 O13 102.6(5) . 2_655
O7 W3 O8 102.5(4) . .
O13 W3 O8 85.8(4) 2_655 .
O7 W3 O15 98.6(4) . .
O13 W3 O15 90.8(4) 2_655 .
O8 W3 O15 158.8(4) . .
O7 W3 O6 99.6(5) . .
O13 W3 O6 157.7(4) 2_655 .
O8 W3 O6 87.9(4) . .
O15 W3 O6 87.4(4) . .
O7 W3 O9 169.7(4) . .
O13 W3 O9 85.3(4) 2_655 .
O8 W3 O9 84.4(4) . .
O15 W3 O9 74.5(3) . .
O6 W3 O9 72.9(3) . .
O16 W4 O5 101.4(5) . .
O16 W4 O14 102.5(4) . .
O5 W4 O14 90.3(4) . .
O16 W4 O13 101.6(5) . .
O5 W4 O13 157.0(4) . .
O14 W4 O13 85.3(4) . .
O16 W4 O15 99.3(4) . .
O5 W4 O15 88.1(4) . .
O14 W4 O15 158.0(4) . .
O13 W4 O15 87.7(4) . .
O16 W4 O9 171.3(5) . .
O5 W4 O9 73.3(4) . .
O14 W4 O9 84.6(3) . .
O13 W4 O9 83.8(4) . .
O15 W4 O9 73.9(3) . .
O12 W5 O14 102.6(4) . .
O12 W5 O8 101.3(4) . 2_655
O14 W5 O8 85.5(4) . 2_655
O12 W5 O10 99.7(5) . 2_655
O14 W5 O10 157.8(4) . 2_655
O8 W5 O10 90.5(4) 2_655 2_655
O12 W5 O17 99.9(5) . .
O14 W5 O17 88.1(4) . .
O8 W5 O17 158.7(4) 2_655 .
O10 W5 O17 87.8(4) 2_655 .
O12 W5 O11 170.8(4) . 2_655
O14 W5 O11 84.1(4) . 2_655
O8 W5 O11 85.4(4) 2_655 2_655
O10 W5 O11 73.7(4) 2_655 2_655
O17 W5 O11 73.7(4) . 2_655
O20 W6 O19 102.5(5) . .
O20 W6 O17 101.1(4) . .
O19 W6 O17 90.7(4) . .
O20 W6 O1 101.6(4) . .
O19 W6 O1 85.5(4) . .
O17 W6 O1 157.2(4) . .
O20 W6 O18 100.1(5) . 2_655
O19 W6 O18 157.2(4) . 2_655
O17 W6 O18 87.7(4) . 2_655
O1 W6 O18 87.2(4) . 2_655
O20 W6 O11 171.6(4) . 2_655
O19 W6 O11 84.4(4) . 2_655
O17 W6 O11 73.6(4) . 2_655
O1 W6 O11 83.6(4) . 2_655
O18 W6 O11 73.4(3) 2_655 2_655
W1 O1 W6 152.1(6) . .
W2 O3 W1 151.2(5) . .
W4 O5 W2 122.2(5) . .
W2 O6 W3 121.7(5) . .
W5 O8 W3 151.1(6) 2_655 .
Si1 O9 W2 124.1(5) . .
Si1 O9 W3 124.3(5) . .
W2 O9 W3 91.6(3) . .
Si1 O9 W4 124.2(5) . .
W2 O9 W4 91.7(3) . .
W3 O9 W4 91.2(3) . .
W5 O10 W1 122.3(5) 2_655 .
Si1 O11 W5 124.8(5) . 2_655
Si1 O11 W6 124.9(5) . 2_655
W5 O11 W6 90.7(3) 2_655 2_655
Si1 O11 W1 124.5(5) . .
W5 O11 W1 91.1(3) 2_655 .
W6 O11 W1 90.5(3) 2_655 .
W3 O13 W4 151.7(5) 2_655 .
W5 O14 W4 152.3(5) . .
W3 O15 W4 120.4(4) . .
W6 O17 W5 122.0(5) . .
W1 O18 W6 121.8(5) . 2_655
W6 O19 W2 151.9(6) . .
N4 C14 C13 174(5) . .
C14 C13 H13A 109.5 . .
C14 C13 H13B 109.5 . .
H13A C13 H13B 109.5 . .
C14 C13 H13C 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Au1 N1 2.038(12) .
Au1 P1 2.227(4) .
Au2 N2 2.084(13) .
Au2 P2 2.235(4) .
Au2 Au2 3.0690(12) 2
P1 C3A 1.768(19) .
P1 C1A 1.770(19) .
P1 C3B 1.78(2) .
P1 C2B 1.78(2) .
P1 C1B 1.78(2) .
P1 C2A 1.79(2) .
P2 C6 1.779(18) .
P2 C8 1.814(14) .
P2 C7 1.824(16) .
N1 C4 1.14(2) .
N2 C9 1.13(2) .
C11 C12 1.31(3) .
C11 H11A 0.9600 .
C11 H11B 0.9600 .
C11 H11C 0.9600 .
C1A H1A1 0.9600 .
C1A H1A2 0.9600 .
C1A H1A3 0.9600 .
C2A H2A1 0.9600 .
C2A H2A2 0.9600 .
C2A H2A3 0.9600 .
C3A H3A1 0.9600 .
C3A H3A2 0.9600 .
C3A H3A3 0.9600 .
C1B H1B1 0.9600 .
C1B H1B2 0.9600 .
C1B H1B3 0.9600 .
C2B H2B1 0.9600 .
C2B H2B2 0.9600 .
C2B H2B3 0.9600 .
C3B H3B1 0.9600 .
C3B H3B2 0.9600 .
C3B H3B3 0.9600 .
C4 C5 1.46(2) .
C5 H5A 0.9600 .
C5 H5B 0.9600 .
C5 H5C 0.9600 .
C6 H6A 0.9600 .
C6 H6B 0.9600 .
C6 H6C 0.9600 .
C7 H7A 0.9600 .
C7 H7B 0.9600 .
C7 H7C 0.9600 .
C8 H8A 0.9600 .
C8 H8B 0.9600 .
C8 H8C 0.9600 .
C9 C10 1.44(2) .
C10 H10A 0.9600 .
C10 H10B 0.9600 .
C10 H10C 0.9600 .
N3 C12 1.05(3) .
Si1 O11 1.606(10) 2_655
Si1 O11 1.606(10) .
Si1 O9 1.634(9) .
Si1 O9 1.634(9) 2_655
W1 O2 1.711(9) .
W1 O1 1.894(9) .
W1 O18 1.899(9) .
W1 O10 1.931(9) .
W1 O3 1.945(9) .
W1 O11 2.370(9) .
W2 O4 1.725(10) .
W2 O3 1.877(8) .
W2 O6 1.894(9) .
W2 O19 1.934(9) .
W2 O5 1.951(9) .
W2 O9 2.340(9) .
W3 O7 1.718(10) .
W3 O13 1.888(9) 2_655
W3 O8 1.913(8) .
W3 O15 1.927(9) .
W3 O6 1.948(9) .
W3 O9 2.343(8) .
W4 O16 1.728(9) .
W4 O5 1.897(10) .
W4 O14 1.906(8) .
W4 O13 1.932(9) .
W4 O15 1.941(9) .
W4 O9 2.357(9) .
W5 O12 1.727(9) .
W5 O14 1.902(8) .
W5 O8 1.909(9) 2_655
W5 O10 1.912(10) 2_655
W5 O17 1.932(9) .
W5 O11 2.345(9) 2_655
W6 O20 1.727(9) .
W6 O19 1.878(9) .
W6 O17 1.901(9) .
W6 O1 1.923(9) .
W6 O18 1.953(9) 2_655
W6 O11 2.368(9) 2_655
O8 W5 1.909(9) 2_655
O10 W5 1.912(10) 2_655
O11 W5 2.345(9) 2_655
O11 W6 2.368(9) 2_655
O13 W3 1.888(9) 2_655
O18 W6 1.953(9) 2_655
C14 N4 1.06(3) .
C14 C13 1.32(3) .
C13 H13A 0.9600 .
C13 H13B 0.9600 .
C13 H13C 0.9600 .
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
O2 W1 O1 W6 -129.1(12) . .
O18 W1 O1 W6 130.4(12) . .
O10 W1 O1 W6 42.5(19) . .
O3 W1 O1 W6 -28.5(12) . .
O11 W1 O1 W6 56.3(12) . .
O4 W2 O3 W1 -132.3(11) . .
O6 W2 O3 W1 127.1(11) . .
O19 W2 O3 W1 -31.0(11) . .
O5 W2 O3 W1 39.1(19) . .
O9 W2 O3 W1 53.4(11) . .
O16 W4 O5 W2 171.5(6) . .
O14 W4 O5 W2 -85.7(6) . .
O13 W4 O5 W2 -7.2(14) . .
O15 W4 O5 W2 72.3(6) . .
O9 W4 O5 W2 -1.4(5) . .
O4 W2 O6 W3 172.6(6) . .
O3 W2 O6 W3 -85.8(6) . .
O19 W2 O6 W3 -3.1(15) . .
O5 W2 O6 W3 72.6(6) . .
O9 W2 O6 W3 -0.2(5) . .
O11 Si1 O9 W2 -61.1(7) 2_655 .
O11 Si1 O9 W2 59.1(6) . .
O9 Si1 O9 W2 178.9(7) 2_655 .
O11 Si1 O9 W3 178.6(5) 2_655 .
O11 Si1 O9 W3 -61.2(7) . .
O9 Si1 O9 W3 58.7(4) 2_655 .
O11 Si1 O9 W4 59.1(7) 2_655 .
O11 Si1 O9 W4 179.3(5) . .
O9 Si1 O9 W4 -60.9(4) 2_655 .
O11 Si1 O11 W5 178.7(7) 2_655 2_655
O9 Si1 O11 W5 58.8(7) . 2_655
O9 Si1 O11 W5 -61.2(7) 2_655 2_655
O11 Si1 O11 W6 -61.2(5) 2_655 2_655
O9 Si1 O11 W6 178.9(5) . 2_655
O9 Si1 O11 W6 58.9(7) 2_655 2_655
O11 Si1 O11 W1 58.4(4) 2_655 .
O9 Si1 O11 W1 -61.6(7) . .
O9 Si1 O11 W1 178.4(5) 2_655 .
O2 W1 O18 W6 172.2(6) . 2_655
O1 W1 O18 W6 -85.7(6) . 2_655
O10 W1 O18 W6 71.5(6) . 2_655
O3 W1 O18 W6 -6.3(15) . 2_655
O11 W1 O18 W6 -1.2(5) . 2_655
O20 W6 O19 W2 -127.6(12) . .
O17 W6 O19 W2 130.8(12) . .
O1 W6 O19 W2 -26.6(12) . .
O18 W6 O19 W2 45.1(19) 2_655 .
O11 W6 O19 W2 57.3(12) 2_655 .
