#------------------------------------------------------------------------------
#$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $
#$Revision: 176729 $
#$URL: svn://www.crystallography.net/cod/cif/1/51/85/1518523.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_1518523
loop_
_publ_author_name
'Yoshida, Takuya'
'Yasuda, Yuta'
'Nagashima, Eri'
'Arai, Hidekazu'
'Matsunaga, Satoshi'
'Nomiya, Kenji'
_publ_section_title
;
 Various Oxygen-Centered Phosphanegold(I) Cluster Cations Formed by
 Polyoxometalate (POM)-Mediated Clusterization: Effects of POMs and
 Phosphanes
;
_journal_issue                   4
_journal_name_full               Inorganics
_journal_page_first              660
_journal_paper_doi               10.3390/inorganics2040660
_journal_volume                  2
_journal_year                    2014
_chemical_formula_sum            'C147 H147 Au7 O42 P8 W12'
_chemical_formula_weight         6418.37
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                104.8260(10)
_cell_angle_beta                 92.640(2)
_cell_angle_gamma                109.6850(10)
_cell_formula_units_Z            2
_cell_length_a                   17.7243(11)
_cell_length_b                   17.8341(10)
_cell_length_c                   31.7570(18)
_cell_measurement_reflns_used    6969
_cell_measurement_temperature    100
_cell_measurement_theta_max      28.28
_cell_measurement_theta_min      2.32
_cell_volume                     9040.0(9)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_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      100
_diffrn_detector_area_resol_mean 8.366
_diffrn_measured_fraction_theta_full 0.967
_diffrn_measured_fraction_theta_max 0.967
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0754
_diffrn_reflns_av_sigmaI/netI    0.2056
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       36
_diffrn_reflns_limit_l_min       -42
_diffrn_reflns_number            65587
_diffrn_reflns_theta_full        28.34
_diffrn_reflns_theta_max         28.34
_diffrn_reflns_theta_min         0.67
_exptl_absorpt_coefficient_mu    13.388
_exptl_absorpt_correction_T_max  0.7756
_exptl_absorpt_correction_T_min  0.4139
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'SADABS; Sheldrick, 1996'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    2.358
_exptl_crystal_density_meas      0
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             5852
_exptl_crystal_size_max          0.08
_exptl_crystal_size_mid          0.07
_exptl_crystal_size_min          0.02
_refine_diff_density_max         15.030
_refine_diff_density_min         -7.942
_refine_diff_density_rms         1.026
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.373
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1978
_refine_ls_number_reflns         43655
_refine_ls_number_restraints     4062
_refine_ls_restrained_S_all      1.312
_refine_ls_R_factor_all          0.2417
_refine_ls_R_factor_gt           0.1466
_refine_ls_shift/su_max          0.459
_refine_ls_shift/su_mean         0.010
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.2000P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3848
_refine_ls_wR_factor_ref         0.4614
_reflns_number_gt                21525
_reflns_number_total             43655
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            5.cif
_cod_data_source_block           yuy2371sp-1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/current/MDPI/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2935 2014-11-11 08:27:57Z andrius 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               1518523
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Au1 Au 0.56107(10) -0.07761(10) 0.69726(5) 0.0231(4) Uani 1 1 d .
Au2 Au 0.74276(10) -0.07541(9) 0.67632(5) 0.0198(3) Uani 1 1 d .
Au3 Au 0.65081(10) -0.09980(10) 0.77711(5) 0.0225(4) Uani 1 1 d .
Au4 Au 0.68775(10) 0.07503(10) 0.76347(5) 0.0236(4) Uani 1 1 d .
Au5 Au 0.85317(10) 0.12521(10) 0.73377(5) 0.0224(4) Uani 1 1 d .
Au6 Au 0.85801(10) -0.04086(9) 0.77775(5) 0.0201(3) Uani 1 1 d .
Au7 Au 0.89790(9) 0.13921(9) 0.83492(5) 0.0190(3) Uani 1 1 d .
C1 C 0.167(3) -0.375(3) 0.7297(16) 0.043(7) Uani 1 1 d U
H1A H 0.1885 -0.4155 0.7356 0.065 Uiso 1 1 calc R
H1B H 0.1181 -0.4033 0.7079 0.065 Uiso 1 1 calc R
H1C H 0.1538 -0.3447 0.7571 0.065 Uiso 1 1 calc R
C2 C 0.455(3) -0.272(3) 0.4726(16) 0.045(7) Uani 1 1 d U
H2A H 0.5088 -0.2479 0.4648 0.068 Uiso 1 1 calc R
H2B H 0.4153 -0.2604 0.4551 0.068 Uiso 1 1 calc R
H2C H 0.4399 -0.3322 0.4665 0.068 Uiso 1 1 calc R
C3 C 0.351(3) 0.191(3) 0.6692(18) 0.048(7) Uani 1 1 d U
H3A H 0.3055 0.1943 0.6849 0.072 Uiso 1 1 calc R
H3B H 0.3380 0.1880 0.6383 0.072 Uiso 1 1 calc R
H3C H 0.3992 0.2412 0.6829 0.072 Uiso 1 1 calc R
C4 C 0.607(3) -0.491(3) 0.5314(15) 0.036(7) Uani 1 1 d U
H4A H 0.6409 -0.5184 0.5156 0.054 Uiso 1 1 calc R
H4B H 0.5594 -0.4992 0.5111 0.054 Uiso 1 1 calc R
H4C H 0.5888 -0.5147 0.5554 0.054 Uiso 1 1 calc R
C5 C 0.791(3) 0.057(3) 0.4761(16) 0.041(7) Uani 1 1 d U
H5A H 0.8264 0.1156 0.4877 0.062 Uiso 1 1 calc R
H5B H 0.7349 0.0541 0.4694 0.062 Uiso 1 1 calc R
H5C H 0.8080 0.0311 0.4491 0.062 Uiso 1 1 calc R
C6 C 1.152(3) -0.071(3) 0.6519(14) 0.030(6) Uani 1 1 d U
H6A H 1.1835 -0.0525 0.6294 0.045 Uiso 1 1 calc R
H6B H 1.1516 -0.1262 0.6517 0.045 Uiso 1 1 calc R
H6C H 1.1771 -0.0315 0.6809 0.045 Uiso 1 1 calc R
C7 C 0.755(3) 0.108(3) 1.0082(17) 0.047(7) Uani 1 1 d U
H7A H 0.7270 0.1481 1.0116 0.071 Uiso 1 1 calc R
H7B H 0.8133 0.1381 1.0100 0.071 Uiso 1 1 calc R
H7C H 0.7454 0.0813 1.0317 0.071 Uiso 1 1 calc R
C8 C 0.254(3) -0.211(4) 0.8571(18) 0.048(7) Uani 1 1 d U
H8A H 0.2560 -0.1693 0.8846 0.072 Uiso 1 1 calc R
H8B H 0.2314 -0.2667 0.8610 0.072 Uiso 1 1 calc R
H8C H 0.2186 -0.2070 0.8336 0.072 Uiso 1 1 calc R
C9 C 0.711(3) -0.447(3) 0.8254(16) 0.041(7) Uani 1 1 d U
H9A H 0.7421 -0.4348 0.8543 0.061 Uiso 1 1 calc R
H9B H 0.7457 -0.4541 0.8025 0.061 Uiso 1 1 calc R
H9C H 0.6637 -0.4977 0.8200 0.061 Uiso 1 1 calc R
C10 C 0.556(3) 0.303(3) 0.6474(16) 0.045(7) Uani 1 1 d U
H10A H 0.5260 0.3389 0.6603 0.068 Uiso 1 1 calc R
H10B H 0.5175 0.2505 0.6279 0.068 Uiso 1 1 calc R
H10C H 0.5948 0.3313 0.6304 0.068 Uiso 1 1 calc R
C11 C 0.375(3) 0.102(3) 0.8921(17) 0.046(7) Uani 1 1 d U
H11A H 0.3935 0.1401 0.9221 0.069 Uiso 1 1 calc R
H11B H 0.3637 0.0449 0.8930 0.069 Uiso 1 1 calc R
H11C H 0.3264 0.1071 0.8795 0.069 Uiso 1 1 calc R
C12 C 0.939(3) 0.496(3) 0.9128(16) 0.041(7) Uani 1 1 d U
H12A H 0.9347 0.5432 0.9035 0.062 Uiso 1 1 calc R
H12B H 0.9877 0.4864 0.9040 0.062 Uiso 1 1 calc R
H12C H 0.9418 0.5092 0.9449 0.062 Uiso 1 1 calc R
C13 C 0.614(3) 0.092(3) 0.5337(17) 0.045(7) Uani 1 1 d U
H13A H 0.6131 0.1350 0.5200 0.067 Uiso 1 1 calc R
H13B H 0.5635 0.0715 0.5453 0.067 Uiso 1 1 calc R
H13C H 0.6209 0.0457 0.5116 0.067 Uiso 1 1 calc R
C14 C 0.970(3) 0.571(3) 0.7895(16) 0.041(7) Uani 1 1 d U
H14A H 0.9533 0.6003 0.7709 0.061 Uiso 1 1 calc R
H14B H 1.0291 0.5947 0.7975 0.061 Uiso 1 1 calc R
H14C H 0.9445 0.5768 0.8162 0.061 Uiso 1 1 calc R
C15 C 1.151(3) 0.133(3) 0.5833(16) 0.037(7) Uani 1 1 d U
H15A H 1.1840 0.1075 0.5962 0.056 Uiso 1 1 calc R
H15B H 1.1872 0.1832 0.5772 0.056 Uiso 1 1 calc R
H15C H 1.1184 0.0935 0.5559 0.056 Uiso 1 1 calc R
C16 C 1.255(3) -0.071(3) 0.7690(16) 0.042(7) Uani 1 1 d U
H16A H 1.2724 -0.1110 0.7792 0.062 Uiso 1 1 calc R
H16B H 1.2862 -0.0147 0.7873 0.062 Uiso 1 1 calc R
H16C H 1.2628 -0.0764 0.7383 0.062 Uiso 1 1 calc R
C17 C 0.854(3) -0.195(3) 0.9670(15) 0.038(7) Uani 1 1 d U
H17A H 0.9047 -0.1621 0.9871 0.057 Uiso 1 1 calc R
H17B H 0.8387 -0.2534 0.9655 0.057 Uiso 1 1 calc R
H17C H 0.8111 -0.1748 0.9778 0.057 Uiso 1 1 calc R
C18 C 0.700(3) -0.476(3) 0.6457(16) 0.042(7) Uani 1 1 d U
H18A H 0.6561 -0.5074 0.6591 0.063 Uiso 1 1 calc R
H18B H 0.7349 -0.5076 0.6365 0.063 Uiso 1 1 calc R
H18C H 0.6769 -0.4658 0.6200 0.063 Uiso 1 1 calc R
C19 C 1.227(3) 0.531(3) 0.8601(15) 0.031(6) Uani 1 1 d U
H19A H 1.1966 0.5579 0.8470 0.047 Uiso 1 1 calc R
H19B H 1.2630 0.5151 0.8398 0.047 Uiso 1 1 calc R
H19C H 1.2599 0.5693 0.8879 0.047 Uiso 1 1 calc R
C20 C 0.846(3) 0.346(3) 1.0600(14) 0.031(6) Uani 1 1 d U
H20A H 0.8520 0.4047 1.0648 0.046 Uiso 1 1 calc R
H20B H 0.8748 0.3409 1.0856 0.046 Uiso 1 1 calc R
H20C H 0.7887 0.3119 1.0561 0.046 Uiso 1 1 calc R
C21 C 1.166(3) 0.006(3) 0.9396(14) 0.027(6) Uani 1 1 d U
H21A H 1.1803 -0.0227 0.9123 0.041 Uiso 1 1 calc R
H21B H 1.1320 -0.0350 0.9529 0.041 Uiso 1 1 calc R
H21C H 1.2153 0.0421 0.9602 0.041 Uiso 1 1 calc R
C22 C 0.362(3) -0.188(3) 0.6816(15) 0.036(4) Uani 1 1 d U
C23 C 0.385(3) -0.217(3) 0.7118(15) 0.036(4) Uani 1 1 d U
H23 H 0.4402 -0.2015 0.7226 0.043 Uiso 1 1 calc R
C24 C 0.317(3) -0.278(3) 0.7292(15) 0.036(4) Uani 1 1 d U
H24 H 0.3304 -0.2960 0.7532 0.043 Uiso 1 1 calc R
C25 C 0.239(3) -0.304(3) 0.7096(15) 0.036(4) Uani 1 1 d U
C26 C 0.223(3) -0.271(3) 0.6711(15) 0.036(4) Uani 1 1 d U
H26 H 0.1700 -0.2907 0.6552 0.044 Uiso 1 1 calc R
C27 C 0.278(3) -0.218(3) 0.6612(15) 0.035(4) Uani 1 1 d U
H27 H 0.2653 -0.1962 0.6388 0.042 Uiso 1 1 calc R
C28 C 0.434(3) -0.171(3) 0.6078(16) 0.040(4) Uani 1 1 d U
C29 C 0.386(3) -0.246(3) 0.5846(16) 0.042(4) Uani 1 1 d U
H29 H 0.3429 -0.2753 0.5977 0.050 Uiso 1 1 calc R
C30 C 0.394(3) -0.284(3) 0.5445(16) 0.041(4) Uani 1 1 d U
H30 H 0.3619 -0.3410 0.5317 0.050 Uiso 1 1 calc R
C31 C 0.455(3) -0.236(3) 0.5175(16) 0.040(4) Uani 1 1 d U
C32 C 0.505(3) -0.157(3) 0.5391(16) 0.041(4) Uani 1 1 d U
H32 H 0.5448 -0.1226 0.5262 0.050 Uiso 1 1 calc R
C33 C 0.491(3) -0.133(3) 0.5848(16) 0.042(4) Uani 1 1 d U
H33 H 0.5278 -0.0797 0.6017 0.050 Uiso 1 1 calc R
C34 C 0.412(3) -0.021(3) 0.6591(16) 0.040(4) Uani 1 1 d U
C35 C 0.376(3) -0.014(3) 0.6271(16) 0.040(5) Uani 1 1 d U
H35 H 0.3585 -0.0589 0.6009 0.048 Uiso 1 1 calc R
C36 C 0.361(3) 0.054(3) 0.6274(17) 0.042(5) Uani 1 1 d U
H36 H 0.3462 0.0661 0.6015 0.050 Uiso 1 1 calc R
C37 C 0.370(3) 0.109(3) 0.6717(17) 0.041(5) Uani 1 1 d U
C38 C 0.403(3) 0.106(3) 0.7004(16) 0.040(5) Uani 1 1 d U
H38 H 0.4262 0.1546 0.7248 0.049 Uiso 1 1 calc R
C39 C 0.413(3) 0.031(3) 0.7018(17) 0.041(5) Uani 1 1 d U
H39 H 0.4203 0.0174 0.7283 0.049 Uiso 1 1 calc R
C40 C 0.737(3) -0.232(3) 0.5937(14) 0.030(4) Uani 1 1 d U
C41 C 0.778(3) -0.287(3) 0.5803(14) 0.030(4) Uani 1 1 d U
H41 H 0.8357 -0.2682 0.5856 0.036 Uiso 1 1 calc R
C42 C 0.735(3) -0.367(3) 0.5602(14) 0.030(4) Uani 1 1 d U
H42 H 0.7638 -0.4039 0.5525 0.036 Uiso 1 1 calc R
C43 C 0.655(3) -0.399(3) 0.5502(14) 0.031(4) Uani 1 1 d U
C44 C 0.610(3) -0.341(3) 0.5686(14) 0.032(4) Uani 1 1 d U
H44 H 0.5523 -0.3611 0.5653 0.038 Uiso 1 1 calc R
C45 C 0.655(3) -0.258(3) 0.5903(14) 0.031(4) Uani 1 1 d U
H45 H 0.6294 -0.2205 0.6025 0.037 Uiso 1 1 calc R
C46 C 0.794(3) -0.071(3) 0.5752(14) 0.032(4) Uani 1 1 d U
C47 C 0.854(3) 0.007(3) 0.5758(15) 0.034(4) Uani 1 1 d U
H47 H 0.9022 0.0335 0.5967 0.041 Uiso 1 1 calc R
C48 C 0.840(3) 0.037(3) 0.5489(15) 0.036(4) Uani 1 1 d U
H48 H 0.8708 0.0949 0.5576 0.043 Uiso 1 1 calc R
C49 C 0.794(3) 0.014(3) 0.5085(15) 0.036(4) Uani 1 1 d U
C50 C 0.737(3) -0.062(3) 0.5068(15) 0.036(4) Uani 1 1 d U
H50 H 0.6952 -0.0881 0.4823 0.043 Uiso 1 1 calc R
C51 C 0.736(3) -0.106(3) 0.5391(14) 0.034(4) Uani 1 1 d U
H51 H 0.6953 -0.1589 0.5353 0.041 Uiso 1 1 calc R
C52 C 0.904(3) -0.105(3) 0.6273(14) 0.028(3) Uani 1 1 d U
C53 C 0.947(3) -0.075(3) 0.6710(14) 0.027(4) Uani 1 1 d U
H53 H 0.9183 -0.0647 0.6952 0.033 Uiso 1 1 calc R
C54 C 1.025(3) -0.062(3) 0.6787(14) 0.027(4) Uani 1 1 d U
H54 H 1.0517 -0.0429 0.7082 0.032 Uiso 1 1 calc R
C55 C 1.071(3) -0.075(3) 0.6427(14) 0.028(4) Uani 1 1 d U
C56 C 1.029(3) -0.107(3) 0.6009(14) 0.026(4) Uani 1 1 d U
H56 H 1.0557 -0.1179 0.5763 0.032 Uiso 1 1 calc R
C57 C 0.944(3) -0.125(3) 0.5945(14) 0.028(4) Uani 1 1 d U
H57 H 0.9153 -0.1513 0.5656 0.034 Uiso 1 1 calc R
C58 C 0.654(3) -0.079(3) 0.8873(16) 0.037(4) Uani 1 1 d U
C59 C 0.630(3) -0.088(3) 0.9219(16) 0.039(4) Uani 1 1 d U
H59 H 0.5881 -0.1388 0.9208 0.046 Uiso 1 1 calc R
C60 C 0.662(3) -0.028(3) 0.9638(16) 0.039(4) Uani 1 1 d U
H60 H 0.6411 -0.0367 0.9898 0.047 Uiso 1 1 calc R
C61 C 0.724(3) 0.045(3) 0.9648(16) 0.039(4) Uani 1 1 d U
C62 C 0.758(3) 0.062(3) 0.9245(15) 0.039(4) Uani 1 1 d U
H62 H 0.8008 0.1123 0.9251 0.047 Uiso 1 1 calc R
C63 C 0.721(3) -0.003(3) 0.8857(16) 0.038(4) Uani 1 1 d U
H63 H 0.7379 0.0020 0.8583 0.045 Uiso 1 1 calc R
C64 C 0.504(3) -0.175(3) 0.8333(16) 0.038(4) Uani 1 1 d U
C65 C 0.470(3) -0.118(3) 0.8352(16) 0.041(4) Uani 1 1 d U
H65 H 0.5044 -0.0650 0.8337 0.049 Uiso 1 1 calc R
C66 C 0.395(3) -0.125(3) 0.8390(16) 0.040(4) Uani 1 1 d U
H66 H 0.3777 -0.0810 0.8381 0.047 Uiso 1 1 calc R
C67 C 0.344(3) -0.194(3) 0.8440(16) 0.040(4) Uani 1 1 d U
C68 C 0.374(3) -0.260(3) 0.8493(16) 0.041(4) Uani 1 1 d U
H68 H 0.3417 -0.3082 0.8564 0.049 Uiso 1 1 calc R
C69 C 0.456(3) -0.244(3) 0.8428(16) 0.040(4) Uani 1 1 d U
H69 H 0.4789 -0.2837 0.8454 0.048 Uiso 1 1 calc R
C70 C 0.635(3) -0.240(3) 0.8306(15) 0.037(4) Uani 1 1 d U
C71 C 0.647(3) -0.286(3) 0.7916(16) 0.037(4) Uani 1 1 d U
H71 H 0.6429 -0.2680 0.7662 0.045 Uiso 1 1 calc R
C72 C 0.667(3) -0.360(3) 0.7868(16) 0.038(4) Uani 1 1 d U
H72 H 0.6675 -0.3956 0.7590 0.046 Uiso 1 1 calc R
C73 C 0.684(3) -0.374(3) 0.8243(16) 0.038(4) Uani 1 1 d U
C74 C 0.675(3) -0.330(3) 0.8632(16) 0.037(4) Uani 1 1 d U
H74 H 0.6909 -0.3420 0.8891 0.044 Uiso 1 1 calc R
C75 C 0.644(3) -0.267(3) 0.8668(16) 0.037(4) Uani 1 1 d U
H75 H 0.6282 -0.2435 0.8938 0.044 Uiso 1 1 calc R
C76 C 0.635(3) 0.228(3) 0.7516(16) 0.039(4) Uani 1 1 d U
C77 C 0.611(3) 0.178(3) 0.7055(16) 0.041(4) Uani 1 1 d U
H77 H 0.6158 0.1251 0.6977 0.049 Uiso 1 1 calc R
C78 C 0.584(3) 0.201(3) 0.6748(16) 0.040(4) Uani 1 1 d U
H78 H 0.5561 0.1606 0.6479 0.048 Uiso 1 1 calc R
C79 C 0.595(3) 0.288(3) 0.6794(16) 0.040(4) Uani 1 1 d U
C80 C 0.617(3) 0.337(3) 0.7239(16) 0.040(4) Uani 1 1 d U
H80 H 0.6208 0.3932 0.7314 0.048 Uiso 1 1 calc R
C81 C 0.634(3) 0.304(3) 0.7582(16) 0.040(4) Uani 1 1 d U
H81 H 0.6465 0.3390 0.7876 0.049 Uiso 1 1 calc R
C82 C 0.584(3) 0.171(3) 0.8216(16) 0.040(4) Uani 1 1 d U
C83 C 0.512(3) 0.191(3) 0.8167(17) 0.042(4) Uani 1 1 d U
H83 H 0.5094 0.2232 0.7976 0.050 Uiso 1 1 calc R
C84 C 0.441(3) 0.162(3) 0.8410(16) 0.042(4) Uani 1 1 d U
H84 H 0.3940 0.1751 0.8375 0.050 Uiso 1 1 calc R
C85 C 0.447(3) 0.127(3) 0.8617(17) 0.044(4) Uani 1 1 d U
C86 C 0.514(3) 0.109(3) 0.8756(17) 0.042(4) Uani 1 1 d U
H86 H 0.5153 0.0881 0.9001 0.051 Uiso 1 1 calc R
C87 C 0.578(3) 0.124(3) 0.8527(16) 0.042(4) Uani 1 1 d U
H87 H 0.6197 0.1034 0.8574 0.050 Uiso 1 1 calc R
C88 C 0.740(3) 0.272(3) 0.8335(15) 0.037(4) Uani 1 1 d U
C89 C 0.820(3) 0.299(3) 0.8197(15) 0.035(4) Uani 1 1 d U
H89 H 0.8296 0.2679 0.7928 0.042 Uiso 1 1 calc R
C90 C 0.878(3) 0.366(3) 0.8447(15) 0.036(4) Uani 1 1 d U
H90 H 0.9300 0.3857 0.8356 0.044 Uiso 1 1 calc R
C91 C 0.860(3) 0.414(3) 0.8899(16) 0.037(4) Uani 1 1 d U
C92 C 0.787(3) 0.391(3) 0.8964(16) 0.036(4) Uani 1 1 d U
H92 H 0.7728 0.4207 0.9223 0.043 Uiso 1 1 calc R
C93 C 0.729(3) 0.327(3) 0.8683(15) 0.035(4) Uani 1 1 d U
H93 H 0.6746 0.3199 0.8729 0.042 Uiso 1 1 calc R
C94 C 0.798(3) 0.178(3) 0.6440(16) 0.038(4) Uani 1 1 d U
C95 C 0.739(3) 0.093(3) 0.6331(16) 0.039(4) Uani 1 1 d U
H95 H 0.7399 0.0565 0.6502 0.047 Uiso 1 1 calc R
C96 C 0.680(3) 0.068(3) 0.5965(16) 0.039(4) Uani 1 1 d U
H96 H 0.6382 0.0145 0.5884 0.047 Uiso 1 1 calc R
C97 C 0.684(3) 0.127(3) 0.5703(16) 0.039(4) Uani 1 1 d U
C98 C 0.738(3) 0.203(3) 0.5832(16) 0.039(4) Uani 1 1 d U
H98 H 0.7350 0.2413 0.5678 0.047 Uiso 1 1 calc R
C99 C 0.801(3) 0.230(3) 0.6200(15) 0.038(4) Uani 1 1 d U
H99 H 0.8428 0.2837 0.6270 0.046 Uiso 1 1 calc R
C100 C 0.907(3) 0.313(3) 0.7176(16) 0.038(4) Uani 1 1 d U
C101 C 0.849(3) 0.344(3) 0.7231(15) 0.038(4) Uani 1 1 d U
H101 H 0.7937 0.3083 0.7135 0.045 Uiso 1 1 calc R
C102 C 0.870(3) 0.430(3) 0.7437(15) 0.037(4) Uani 1 1 d U
H102 H 0.8291 0.4534 0.7428 0.044 Uiso 1 1 calc R
C103 C 0.944(3) 0.479(3) 0.7643(16) 0.038(4) Uani 1 1 d U
C104 C 1.013(3) 0.447(3) 0.7559(15) 0.038(4) Uani 1 1 d U
H104 H 1.0687 0.4819 0.7657 0.046 Uiso 1 1 calc R
C105 C 0.988(3) 0.361(3) 0.7319(15) 0.038(4) Uani 1 1 d U
H105 H 1.0277 0.3364 0.7257 0.046 Uiso 1 1 calc R
C106 C 0.973(3) 0.197(3) 0.6593(15) 0.034(4) Uani 1 1 d U
C107 C 0.995(3) 0.226(3) 0.6289(15) 0.034(4) Uani 1 1 d U
H107 H 0.9680 0.2578 0.6200 0.041 Uiso 1 1 calc R
C108 C 1.059(3) 0.215(3) 0.6067(15) 0.035(4) Uani 1 1 d U
H108 H 1.0789 0.2431 0.5855 0.042 Uiso 1 1 calc R
C109 C 1.091(3) 0.158(3) 0.6183(15) 0.034(4) Uani 1 1 d U
C110 C 1.073(3) 0.130(3) 0.6523(15) 0.034(4) Uani 1 1 d U
H110 H 1.1013 0.0996 0.6623 0.041 Uiso 1 1 calc R
C111 C 1.008(3) 0.146(3) 0.6740(15) 0.033(4) Uani 1 1 d U
H111 H 0.9892 0.1235 0.6973 0.040 Uiso 1 1 calc R
C112 C 0.999(3) -0.127(3) 0.7790(15) 0.035(4) Uani 1 1 d U
C113 C 1.058(3) -0.062(3) 0.8109(15) 0.036(4) Uani 1 1 d U
H113 H 1.0414 -0.0356 0.8365 0.043 Uiso 1 1 calc R
C114 C 1.147(3) -0.032(3) 0.8073(15) 0.036(4) Uani 1 1 d U
H114 H 1.1859 0.0181 0.8256 0.043 Uiso 1 1 calc R
C115 C 1.165(3) -0.090(3) 0.7727(15) 0.036(4) Uani 1 1 d U
C116 C 1.110(3) -0.158(3) 0.7413(15) 0.035(4) Uani 1 1 d U
H116 H 1.1248 -0.1893 0.7164 0.043 Uiso 1 1 calc R
C117 C 1.032(3) -0.176(3) 0.7495(15) 0.036(4) Uani 1 1 d U
H117 H 0.9949 -0.2294 0.7328 0.043 Uiso 1 1 calc R
C118 C 0.883(3) -0.160(3) 0.8379(15) 0.033(4) Uani 1 1 d U
C119 C 0.928(3) -0.206(3) 0.8533(14) 0.032(4) Uani 1 1 d U
H119 H 0.9626 -0.2274 0.8364 0.039 Uiso 1 1 calc R
C120 C 0.914(3) -0.215(3) 0.8955(14) 0.032(4) Uani 1 1 d U
H120 H 0.9414 -0.2443 0.9073 0.039 Uiso 1 1 calc R
C121 C 0.865(3) -0.184(3) 0.9207(14) 0.032(4) Uani 1 1 d U
C122 C 0.836(3) -0.132(3) 0.9045(14) 0.032(4) Uani 1 1 d U
H122 H 0.8103 -0.1001 0.9233 0.039 Uiso 1 1 calc R
C123 C 0.841(3) -0.124(3) 0.8599(14) 0.032(4) Uani 1 1 d U
H123 H 0.8153 -0.0934 0.8484 0.039 Uiso 1 1 calc R
C124 C 0.840(3) -0.245(3) 0.7427(15) 0.035(4) Uani 1 1 d U
C125 C 0.856(3) -0.316(3) 0.7401(15) 0.036(4) Uani 1 1 d U
H125 H 0.8996 -0.3129 0.7598 0.043 Uiso 1 1 calc R
C126 C 0.814(3) -0.386(3) 0.7121(15) 0.036(4) Uani 1 1 d U
H126 H 0.8259 -0.4341 0.7129 0.043 Uiso 1 1 calc R
C127 C 0.749(3) -0.394(3) 0.6787(15) 0.037(4) Uani 1 1 d U
C128 C 0.730(3) -0.324(3) 0.6828(15) 0.035(4) Uani 1 1 d U
H128 H 0.6816 -0.3284 0.6668 0.042 Uiso 1 1 calc R
C129 C 0.782(3) -0.246(3) 0.7100(15) 0.036(4) Uani 1 1 d U
H129 H 0.7785 -0.1959 0.7065 0.044 Uiso 1 1 calc R
C130 C 1.062(3) 0.312(3) 0.8829(14) 0.030(5) Uani 1 1 d U
C131 C 1.064(3) 0.311(3) 0.8394(14) 0.031(5) Uani 1 1 d U
H131 H 1.0318 0.2639 0.8160 0.038 Uiso 1 1 calc R
C132 C 1.118(3) 0.384(3) 0.8317(15) 0.032(5) Uani 1 1 d U
H132 H 1.1220 0.3873 0.8025 0.039 Uiso 1 1 calc R
C133 C 1.168(3) 0.453(3) 0.8688(14) 0.031(4) Uani 1 1 d U
C134 C 1.162(3) 0.451(3) 0.9083(14) 0.031(4) Uani 1 1 d U
H134 H 1.1937 0.4980 0.9318 0.038 Uiso 1 1 calc R
C135 C 1.108(3) 0.381(3) 0.9185(15) 0.031(5) Uani 1 1 d U
H135 H 1.1038 0.3797 0.9480 0.037 Uiso 1 1 calc R
C136 C 0.946(3) 0.256(3) 0.9447(14) 0.028(4) Uani 1 1 d U
C137 C 0.873(3) 0.271(3) 0.9465(14) 0.029(4) Uani 1 1 d U
H137 H 0.8383 0.2514 0.9194 0.034 Uiso 1 1 calc R
C138 C 0.850(3) 0.306(3) 0.9770(14) 0.028(4) Uani 1 1 d U
H138 H 0.8074 0.3257 0.9732 0.034 Uiso 1 1 calc R
C139 C 0.885(3) 0.316(3) 1.0161(14) 0.028(4) Uani 1 1 d U
C140 C 0.957(3) 0.300(3) 1.0204(14) 0.028(4) Uani 1 1 d U
H140 H 0.9853 0.3100 1.0488 0.034 Uiso 1 1 calc R
C141 C 0.986(3) 0.271(3) 0.9845(13) 0.027(4) Uani 1 1 d U
H141 H 1.0346 0.2606 0.9870 0.033 Uiso 1 1 calc R
C142 C 1.041(3) 0.156(3) 0.9088(13) 0.026(4) Uani 1 1 d U
C143 C 1.130(3) 0.190(3) 0.9113(12) 0.023(4) Uani 1 1 d U
H143 H 1.1606 0.2412 0.9063 0.028 Uiso 1 1 calc R
C144 C 1.164(3) 0.134(3) 0.9221(13) 0.026(4) Uani 1 1 d U
H144 H 1.2214 0.1490 0.9244 0.031 Uiso 1 1 calc R
C145 C 1.120(3) 0.058(3) 0.9295(13) 0.024(4) Uani 1 1 d U
C146 C 1.037(3) 0.033(3) 0.9251(13) 0.025(4) Uani 1 1 d U
H146 H 1.0063 -0.0178 0.9302 0.030 Uiso 1 1 calc R
C147 C 0.994(3) 0.083(3) 0.9133(13) 0.025(4) Uani 1 1 d U
H147 H 0.9369 0.0642 0.9089 0.029 Uiso 1 1 calc R
O1 O 0.6789(15) -0.0456(15) 0.7236(8) 0.015(4) Uani 1 1 d U
O2 O 0.8287(15) 0.0585(15) 0.7767(8) 0.014(4) Uani 1 1 d U
O3 O 0.579(2) 0.386(3) 0.8471(12) 0.054(4) Uani 1 1 d U
O4 O 0.417(3) 0.583(3) 0.8693(13) 0.057(4) Uani 1 1 d U
O5 O 0.286(3) 0.293(3) 0.8676(13) 0.057(4) Uani 1 1 d U
O6 O 0.803(3) 0.601(3) 0.9781(13) 0.056(4) Uani 1 1 d U
O7 O 0.643(2) 0.806(3) 0.9943(12) 0.054(4) Uani 1 1 d U
O8 O 0.659(3) 0.294(3) 0.9793(13) 0.057(4) Uani 1 1 d U
O9 O 0.514(3) 0.501(3) 0.8813(13) 0.057(3) Uani 1 1 d U
O10 O 0.375(3) 0.458(3) 0.8972(13) 0.058(3) Uani 1 1 d U
O11 O 0.445(3) 0.355(3) 0.8987(13) 0.058(3) Uani 1 1 d U
O12 O 0.648(3) 0.509(3) 0.9281(13) 0.056(3) Uani 1 1 d U
O13 O 0.542(2) 0.664(3) 0.9386(13) 0.056(3) Uani 1 1 d U
O14 O 0.395(3) 0.614(3) 0.9471(13) 0.058(3) Uani 1 1 d U
O15 O 0.284(3) 0.389(3) 0.9542(13) 0.057(3) Uani 1 1 d U
O16 O 0.602(3) 0.376(3) 0.9224(13) 0.057(3) Uani 1 1 d U
O17 O 0.677(2) 0.662(3) 0.9789(12) 0.054(3) Uani 1 1 d U
O18 O 0.504(3) 0.285(3) 0.9833(13) 0.059(4) Uani 1 1 d U
O19 O 0.690(3) 0.461(3) 0.9934(13) 0.057(3) Uani 1 1 d U
O20 O 0.645(2) 0.724(3) 1.0483(12) 0.053(4) Uani 1 1 d U
O21 O 0.463(3) 0.462(3) 0.9479(13) 0.057(3) Uani 1 1 d U
O22 O 0.426(3) 0.431(3) 0.9909(13) 0.058(3) Uani 1 1 d U
O23 O 0.562(3) 0.348(3) 0.9411(13) 0.058(3) Uani 1 1 d U
O24 O -0.251(2) 0.387(2) 0.5800(11) 0.047(4) Uani 1 1 d U
O25 O -0.042(2) 0.695(2) 0.6418(11) 0.046(4) Uani 1 1 d U
O26 O 0.032(2) 0.437(2) 0.6516(11) 0.048(4) Uani 1 1 d U
O27 O 0.081(2) 0.249(2) 0.5111(11) 0.040(4) Uani 1 1 d U
O28 O 0.209(2) 0.804(2) 0.5629(11) 0.042(4) Uani 1 1 d U
O29 O 0.294(2) 0.555(2) 0.5711(11) 0.047(4) Uani 1 1 d U
O30 O -0.126(2) 0.548(2) 0.5829(11) 0.046(3) Uani 1 1 d U
O31 O 0.021(2) 0.574(2) 0.6208(11) 0.046(2) Uani 1 1 d U
O32 O -0.091(2) 0.414(2) 0.5903(11) 0.046(3) Uani 1 1 d U
O33 O -0.179(2) 0.325(2) 0.5102(11) 0.047(3) Uani 1 1 d U
O34 O -0.226(2) 0.441(2) 0.5113(11) 0.047(3) Uani 1 1 d U
O35 O -0.079(2) 0.655(2) 0.5617(11) 0.046(3) Uani 1 1 d U
O36 O 0.076(2) 0.687(2) 0.5885(11) 0.045(3) Uani 1 1 d U
O37 O 0.131(2) 0.514(2) 0.5944(11) 0.047(3) Uani 1 1 d U
O38 O 0.030(2) 0.367(2) 0.5626(11) 0.047(3) Uani 1 1 d U
O39 O 0.154(2) 0.416(2) 0.5235(11) 0.047(3) Uani 1 1 d U
O40 O 0.067(2) 0.734(2) 0.5128(11) 0.043(3) Uani 1 1 d U
O41 O 0.192(2) 0.644(2) 0.5641(11) 0.044(3) Uani 1 1 d U
O42 O 0.046(2) 0.465(2) 0.5270(11) 0.047(3) Uani 1 1 d U
O43 O -0.088(2) 0.442(2) 0.4966(11) 0.048(3) Uani 1 1 d U
P1 P 0.4375(7) -0.1152(8) 0.6614(4) 0.032(3) Uani 1 1 d .
P2 P 0.7967(7) -0.1203(7) 0.6173(3) 0.026(2) Uani 1 1 d .
P3 P 0.6124(7) -0.1500(7) 0.8320(4) 0.029(3) Uani 1 1 d .
P4 P 0.6613(6) 0.1881(6) 0.7935(3) 0.022(2) Uani 1 1 d .
P5 P 0.8809(8) 0.2015(8) 0.6891(4) 0.031(3) Uani 1 1 d .
P6 P 0.8967(7) -0.1445(7) 0.7835(3) 0.022(2) Uani 1 1 d .
P7 P 0.9858(6) 0.2193(6) 0.8944(3) 0.0159(19) Uani 1 1 d .
P8 P 0.5000 0.5000 1.0000 0.026(4) Uani 1 2 d S
P9 P 0.0000 0.5000 0.5000 0.017(3) Uani 1 2 d S
W1 W 0.55627(13) 0.42404(13) 0.89638(7) 0.0370(5) Uani 1 1 d .
W2 W 0.44828(13) 0.56242(16) 0.90871(7) 0.0416(5) Uani 1 1 d .
W3 W 0.34990(10) 0.35482(11) 0.91139(7) 0.0313(4) Uani 1 1 d .
W4 W 0.70714(10) 0.56863(10) 0.98461(5) 0.0215(4) Uani 1 1 d .
W5 W 0.60004(10) 0.70745(11) 0.99642(5) 0.0246(4) Uani 1 1 d .
W6 W 0.60658(12) 0.36007(13) 0.98760(6) 0.0321(5) Uani 1 1 d .
W7 W -0.16968(12) 0.42754(12) 0.55345(6) 0.0333(5) Uani 1 1 d .
W8 W -0.02714(11) 0.63300(10) 0.59830(5) 0.0237(4) Uani 1 1 d .
W9 W 0.02635(14) 0.46015(11) 0.60290(5) 0.0329(5) Uani 1 1 d .
W10 W 0.05576(12) 0.32870(11) 0.50507(6) 0.0284(4) Uani 1 1 d .
W11 W 0.14180(11) 0.70653(10) 0.54386(5) 0.0258(4) Uani 1 1 d .
W12 W 0.19724(12) 0.53489(12) 0.55021(6) 0.0348(5) Uani 1 1 d .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 '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'
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
O1 Au1 P1 173.6(7) . .
O1 Au1 Au4 44.4(7) . .
P1 Au1 Au4 139.0(3) . .
O1 Au1 Au3 43.7(7) . .
P1 Au1 Au3 141.1(4) . .
Au4 Au1 Au3 60.49(5) . .
O1 Au1 Au2 34.4(7) . .
P1 Au1 Au2 139.2(3) . .
Au4 Au1 Au2 71.86(5) . .
Au3 Au1 Au2 70.66(5) . .
O1 Au2 P2 171.5(8) . .
O1 Au2 Au1 35.5(7) . .
P2 Au2 Au1 136.3(3) . .
O1 Au3 P3 174.3(7) . .
O1 Au3 Au4 43.6(6) . .
P3 Au3 Au4 132.8(3) . .
O1 Au3 Au1 40.8(7) . .
P3 Au3 Au1 134.6(3) . .
Au4 Au3 Au1 59.00(5) . .
O1 Au4 P4 163.2(7) . .
O1 Au4 Au5 81.9(7) . .
P4 Au4 Au5 109.2(3) . .
O1 Au4 Au1 41.7(7) . .
P4 Au4 Au1 121.5(3) . .
Au5 Au4 Au1 113.18(6) . .
O1 Au4 Au3 44.0(7) . .
P4 Au4 Au3 137.1(3) . .
Au5 Au4 Au3 107.13(6) . .
Au1 Au4 Au3 60.51(5) . .
O2 Au5 P5 178.0(7) . .
O2 Au5 Au4 59.1(7) . .
P5 Au5 Au4 120.8(3) . .
O2 Au5 Au7 38.6(7) . .
P5 Au5 Au7 139.6(3) . .
Au4 Au5 Au7 77.86(6) . .
O2 Au6 P6 175.7(7) . .
O2 Au6 Au7 41.4(7) . .
P6 Au6 Au7 134.3(3) . .
O2 Au7 P7 172.0(7) . .
O2 Au7 Au6 40.3(7) . .
P7 Au7 Au6 133.5(3) . .
O2 Au7 Au5 37.4(7) . .
P7 Au7 Au5 141.8(3) . .
Au6 Au7 Au5 70.11(5) . .
C25 C1 H1A 109.5 . .
C25 C1 H1B 109.5 . .
H1A C1 H1B 109.5 . .
C25 C1 H1C 109.5 . .
H1A C1 H1C 109.5 . .
H1B C1 H1C 109.5 . .
C31 C2 H2A 109.5 . .
C31 C2 H2B 109.5 . .
H2A C2 H2B 109.5 . .
C31 C2 H2C 109.5 . .
H2A C2 H2C 109.5 . .
H2B C2 H2C 109.5 . .
C37 C3 H3A 109.5 . .
C37 C3 H3B 109.4 . .
H3A C3 H3B 109.5 . .
C37 C3 H3C 109.5 . .
H3A C3 H3C 109.5 . .
H3B C3 H3C 109.5 . .
C43 C4 H4A 109.5 . .
C43 C4 H4B 109.5 . .
H4A C4 H4B 109.5 . .
C43 C4 H4C 109.5 . .
H4A C4 H4C 109.5 . .
H4B C4 H4C 109.5 . .
C49 C5 H5A 109.5 . .
C49 C5 H5B 109.5 . .
H5A C5 H5B 109.5 . .
C49 C5 H5C 109.5 . .
H5A C5 H5C 109.5 . .
H5B C5 H5C 109.5 . .
C55 C6 H6A 109.4 . .
C55 C6 H6B 109.5 . .
H6A C6 H6B 109.5 . .
C55 C6 H6C 109.5 . .
H6A C6 H6C 109.5 . .
H6B C6 H6C 109.5 . .
C61 C7 H7A 109.5 . .
C61 C7 H7B 109.4 . .
H7A C7 H7B 109.5 . .
C61 C7 H7C 109.5 . .
H7A C7 H7C 109.5 . .
H7B C7 H7C 109.5 . .
C67 C8 H8A 109.5 . .
C67 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
C67 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
C73 C9 H9A 109.5 . .
C73 C9 H9B 109.4 . .
H9A C9 H9B 109.5 . .
C73 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
C79 C10 H10A 109.5 . .
C79 C10 H10B 109.4 . .
H10A C10 H10B 109.5 . .
C79 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
C85 C11 H11A 109.5 . .
C85 C11 H11B 109.4 . .
H11A C11 H11B 109.5 . .
C85 C11 H11C 109.5 . .
H11A C11 H11C 109.5 . .
H11B C11 H11C 109.5 . .
C91 C12 H12A 109.5 . .
C91 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
C91 C12 H12C 109.4 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
C97 C13 H13A 109.4 . .
C97 C13 H13B 109.5 . .
H13A C13 H13B 109.5 . .
C97 C13 H13C 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
C103 C14 H14A 109.5 . .
C103 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
C103 C14 H14C 109.4 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
C109 C15 H15A 109.5 . .
C109 C15 H15B 109.5 . .
H15A C15 H15B 109.5 . .
C109 C15 H15C 109.5 . .
H15A C15 H15C 109.5 . .
H15B C15 H15C 109.5 . .
C115 C16 H16A 109.4 . .
C115 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
C115 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
C121 C17 H17A 109.5 . .
C121 C17 H17B 109.5 . .
H17A C17 H17B 109.5 . .
C121 C17 H17C 109.5 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
C127 C18 H18A 109.5 . .
C127 C18 H18B 109.5 . .
H18A C18 H18B 109.5 . .
C127 C18 H18C 109.4 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
C133 C19 H19A 109.5 . .
C133 C19 H19B 109.5 . .
H19A C19 H19B 109.5 . .
C133 C19 H19C 109.5 . .
H19A C19 H19C 109.5 . .
H19B C19 H19C 109.5 . .
C139 C20 H20A 109.5 . .
C139 C20 H20B 109.5 . .
H20A C20 H20B 109.5 . .
C139 C20 H20C 109.5 . .
H20A C20 H20C 109.5 . .
H20B C20 H20C 109.5 . .
C145 C21 H21A 109.5 . .
C145 C21 H21B 109.5 . .
H21A C21 H21B 109.5 . .
C145 C21 H21C 109.5 . .
H21A C21 H21C 109.5 . .
H21B C21 H21C 109.5 . .
C23 C22 C27 122(5) . .
C23 C22 P1 119(4) . .
C27 C22 P1 119(4) . .
C22 C23 C24 117(5) . .
C22 C23 H23 121.2 . .
C24 C23 H23 121.3 . .
C25 C24 C23 119(4) . .
C25 C24 H24 120.5 . .
C23 C24 H24 120.5 . .
C24 C25 C26 117(5) . .
C24 C25 C1 117(4) . .
C26 C25 C1 126(4) . .
C27 C26 C25 120(5) . .
C27 C26 H26 120.0 . .
C25 C26 H26 120.0 . .
C26 C27 C22 124(5) . .
C26 C27 H27 117.9 . .
C22 C27 H27 118.0 . .
C29 C28 C33 113(5) . .
C29 C28 P1 131(5) . .
C33 C28 P1 116(4) . .
C28 C29 C30 125(6) . .
C28 C29 H29 117.8 . .
C30 C29 H29 117.7 . .
C29 C30 C31 121(5) . .
C29 C30 H30 119.4 . .
C31 C30 H30 119.2 . .
C32 C31 C2 121(5) . .
C32 C31 C30 117(4) . .
C2 C31 C30 122(5) . .
C31 C32 C33 111(5) . .
C31 C32 H32 124.4 . .
C33 C32 H32 124.5 . .
C28 C33 C32 133(5) . .
C28 C33 H33 113.8 . .
C32 C33 H33 113.7 . .
C35 C34 C39 119(5) . .
C35 C34 P1 126(4) . .
C39 C34 P1 113(4) . .
C34 C35 C36 123(5) . .
C34 C35 H35 118.5 . .
C36 C35 H35 118.5 . .
C35 C36 C37 113(5) . .
C35 C36 H36 123.4 . .
C37 C36 H36 123.4 . .
C38 C37 C36 124(6) . .
C38 C37 C3 123(5) . .
C36 C37 C3 110(4) . .
C37 C38 C39 121(6) . .
C37 C38 H38 119.6 . .
C39 C38 H38 119.6 . .
C38 C39 C34 113(5) . .
C38 C39 H39 123.7 . .
C34 C39 H39 123.7 . .
C45 C40 C41 122(5) . .
C45 C40 P2 119(3) . .
C41 C40 P2 118(4) . .
C42 C41 C40 119(4) . .
C42 C41 H41 120.7 . .
C40 C41 H41 120.7 . .
C41 C42 C43 125(4) . .
C41 C42 H42 117.7 . .
C43 C42 H42 117.7 . .
C42 C43 C4 124(4) . .
C42 C43 C44 116(4) . .
C4 C43 C44 118(4) . .
C45 C44 C43 118(4) . .
C45 C44 H44 121.0 . .
C43 C44 H44 121.0 . .
C40 C45 C44 119(4) . .
C40 C45 H45 120.4 . .
C44 C45 H45 120.4 . .
C51 C46 C47 114(4) . .
C51 C46 P2 123(4) . .
C47 C46 P2 123(3) . .
C48 C47 C46 116(5) . .
C48 C47 H47 122.2 . .
C46 C47 H47 122.1 . .
C47 C48 C49 140(6) . .
C47 C48 H48 110.0 . .
C49 C48 H48 110.1 . .
C50 C49 C48 103(4) . .
C50 C49 C5 123(5) . .
C48 C49 C5 133(5) . .
C49 C50 C51 125(5) . .
C49 C50 H50 117.4 . .
C51 C50 H50 117.3 . .
C46 C51 C50 120(5) . .
C46 C51 H51 120.1 . .
C50 C51 H51 120.1 . .
C57 C52 C53 118(4) . .
C57 C52 P2 121(3) . .
C53 C52 P2 121(3) . .
C54 C53 C52 121(4) . .
C54 C53 H53 119.3 . .
C52 C53 H53 119.3 . .
C53 C54 C55 121(4) . .
C53 C54 H54 119.4 . .
C55 C54 H54 119.5 . .
C56 C55 C6 123(4) . .
C56 C55 C54 116(4) . .
C6 C55 C54 119(4) . .
C55 C56 C57 120(4) . .
C55 C56 H56 119.7 . .
C57 C56 H56 119.8 . .
C52 C57 C56 122(4) . .
C52 C57 H57 118.8 . .
C56 C57 H57 118.8 . .
C59 C58 C63 122(5) . .
C59 C58 P3 127(5) . .
C63 C58 P3 111(4) . .
C58 C59 C60 124(6) . .
C58 C59 H59 118.0 . .
C60 C59 H59 118.0 . .
C61 C60 C59 117(5) . .
C61 C60 H60 121.5 . .
C59 C60 H60 121.4 . .
C60 C61 C7 117(5) . .
C60 C61 C62 123(5) . .
C7 C61 C62 120(5) . .
C63 C62 C61 113(5) . .
C63 C62 H62 123.4 . .
C61 C62 H62 123.4 . .
C62 C63 C58 120(5) . .
C62 C63 H63 119.9 . .
C58 C63 H63 119.9 . .
C65 C64 C69 114(5) . .
C65 C64 P3 122(5) . .
C69 C64 P3 123(4) . .
C66 C65 C64 128(6) . .
C66 C65 H65 115.9 . .
C64 C65 H65 116.0 . .
C65 C66 C67 120(5) . .
C65 C66 H66 120.0 . .
C67 C66 H66 119.9 . .
C66 C67 C68 119(5) . .
C66 C67 C8 128(5) . .
C68 C67 C8 111(5) . .
C69 C68 C67 114(5) . .
C69 C68 H68 123.2 . .
C67 C68 H68 123.2 . .
C64 C69 C68 124(5) . .
C64 C69 H69 117.9 . .
C68 C69 H69 117.9 . .
C71 C70 C75 116(5) . .
C71 C70 P3 120(4) . .
C75 C70 P3 125(4) . .
C70 C71 C72 124(5) . .
C70 C71 H71 117.9 . .
C72 C71 H71 117.9 . .
C73 C72 C71 114(5) . .
C73 C72 H72 122.9 . .
C71 C72 H72 122.8 . .
C74 C73 C72 124(5) . .
C74 C73 C9 115(4) . .
C72 C73 C9 121(4) . .
C73 C74 C75 121(5) . .
C73 C74 H74 119.5 . .
C75 C74 H74 119.5 . .
C70 C75 C74 119(5) . .
C70 C75 H75 120.4 . .
C74 C75 H75 120.4 . .
C81 C76 C77 113(5) . .
C81 C76 P4 125(4) . .
C77 C76 P4 123(4) . .
C78 C77 C76 125(5) . .
C78 C77 H77 117.7 . .
C76 C77 H77 117.6 . .
C77 C78 C79 123(5) . .
C77 C78 H78 118.7 . .
C79 C78 H78 118.7 . .
C10 C79 C80 127(5) . .
C10 C79 C78 117(5) . .
C80 C79 C78 111(4) . .
C79 C80 C81 122(5) . .
C79 C80 H80 118.9 . .
C81 C80 H80 118.9 . .
C76 C81 C80 124(5) . .
C76 C81 H81 117.8 . .
C80 C81 H81 117.9 . .
C83 C82 C87 111(5) . .
C83 C82 P4 128(4) . .
C87 C82 P4 121(4) . .
C82 C83 C84 122(5) . .
C82 C83 H83 118.9 . .
C84 C83 H83 118.8 . .
C85 C84 C83 116(6) . .
C85 C84 H84 121.9 . .
C83 C84 H84 121.9 . .
C84 C85 C86 130(7) . .
C84 C85 C11 117(6) . .
C86 C85 C11 111(5) . .
C87 C86 C85 118(5) . .
C87 C86 H86 121.2 . .
C85 C86 H86 121.1 . .
C86 C87 C82 121(5) . .
C86 C87 H87 119.6 . .
C82 C87 H87 119.5 . .
C93 C88 C89 115(5) . .
C93 C88 P4 126(4) . .
C89 C88 P4 116(3) . .
C90 C89 C88 120(4) . .
C90 C89 H89 120.0 . .
C88 C89 H89 120.0 . .
C89 C90 C91 118(5) . .
C89 C90 H90 120.8 . .
C91 C90 H90 120.8 . .
C92 C91 C90 116(5) . .
C92 C91 C12 133(5) . .
C90 C91 C12 109(4) . .
C91 C92 C93 122(5) . .
C91 C92 H92 118.8 . .
C93 C92 H92 118.8 . .
C92 C93 C88 126(5) . .
C92 C93 H93 117.1 . .
C88 C93 H93 117.1 . .
C99 C94 C95 124(5) . .
C99 C94 P5 122(4) . .
C95 C94 P5 114(4) . .
C96 C95 C94 117(5) . .
C96 C95 H95 121.7 . .
C94 C95 H95 121.6 . .
C95 C96 C97 118(5) . .
C95 C96 H96 120.8 . .
C97 C96 H96 120.8 . .
C98 C97 C96 120(5) . .
C98 C97 C13 128(5) . .
C96 C97 C13 111(5) . .
C97 C98 C99 123(5) . .
C97 C98 H98 118.6 . .
C99 C98 H98 118.6 . .
C94 C99 C98 117(5) . .
C94 C99 H99 121.3 . .
C98 C99 H99 121.4 . .
C101 C100 C105 123(5) . .
C101 C100 P5 120(4) . .
C105 C100 P5 117(4) . .
C100 C101 C102 119(5) . .
C100 C101 H101 120.4 . .
C102 C101 H101 120.4 . .
C103 C102 C101 122(5) . .
C103 C102 H102 118.8 . .
C101 C102 H102 118.8 . .
C102 C103 C104 119(4) . .
C102 C103 C14 126(5) . .
C104 C103 C14 115(4) . .
C105 C104 C103 114(5) . .
C105 C104 H104 122.9 . .
C103 C104 H104 122.9 . .
C100 C105 C104 121(5) . .
C100 C105 H105 119.5 . .
C104 C105 H105 119.4 . .
C107 C106 C111 122(5) . .
C107 C106 P5 127(4) . .
C111 C106 P5 110(4) . .
C106 C107 C108 125(5) . .
C106 C107 H107 117.7 . .
C108 C107 H107 117.7 . .
C107 C108 C109 115(4) . .
C107 C108 H108 122.7 . .
C109 C108 H108 122.7 . .
C110 C109 C108 123(4) . .
C110 C109 C15 126(4) . .
C108 C109 C15 111(4) . .
C109 C110 C111 118(5) . .
C109 C110 H110 121.1 . .
C111 C110 H110 121.1 . .
C106 C111 C110 118(4) . .
C106 C111 H111 121.2 . .
C110 C111 H111 121.2 . .
C117 C112 C113 112(4) . .
C117 C112 P6 128(4) . .
C113 C112 P6 119(3) . .
C112 C113 C114 124(4) . .
C112 C113 H113 117.9 . .
C114 C113 H113 117.8 . .
C115 C114 C113 111(4) . .
C115 C114 H114 124.6 . .
C113 C114 H114 124.6 . .
C116 C115 C114 127(5) . .
C116 C115 C16 117(4) . .
C114 C115 C16 116(4) . .
C117 C116 C115 114(4) . .
C117 C116 H116 123.1 . .
C115 C116 H116 123.1 . .
C116 C117 C112 129(5) . .
C116 C117 H117 115.6 . .
C112 C117 H117 115.6 . .
C123 C118 C119 126(4) . .
C123 C118 P6 117(4) . .
C119 C118 P6 117(3) . .
C120 C119 C118 113(4) . .
C120 C119 H119 123.3 . .
C118 C119 H119 123.2 . .
C121 C120 C119 125(4) . .
C121 C120 H120 117.7 . .
C119 C120 H120 117.7 . .
C120 C121 C122 115(4) . .
C120 C121 C17 122(4) . .
C122 C121 C17 122(4) . .
C121 C122 C123 123(4) . .
C121 C122 H122 118.3 . .
C123 C122 H122 118.3 . .
C118 C123 C122 116(4) . .
C118 C123 H123 121.8 . .
C122 C123 H123 121.8 . .
C125 C124 C129 119(4) . .
C125 C124 P6 123(4) . .
C129 C124 P6 118(4) . .
C126 C125 C124 123(5) . .
C126 C125 H125 118.7 . .
C124 C125 H125 118.7 . .
C125 C126 C127 121(5) . .
C125 C126 H126 119.2 . .
C127 C126 H126 119.3 . .
C128 C127 C126 116(4) . .
C128 C127 C18 122(5) . .
C126 C127 C18 122(4) . .
C127 C128 C129 121(5) . .
C127 C128 H128 119.4 . .
C129 C128 H128 119.4 . .
C128 C129 C124 118(5) . .
C128 C129 H129 121.2 . .
C124 C129 H129 121.2 . .
C131 C130 C135 124(5) . .
C131 C130 P7 117(4) . .
C135 C130 P7 119(3) . .
C130 C131 C132 116(4) . .
C130 C131 H131 122.2 . .
C132 C131 H131 122.1 . .
C131 C132 C133 120(4) . .
C131 C132 H132 120.2 . .
C133 C132 H132 120.2 . .
C134 C133 C132 121(5) . .
C134 C133 C19 120(4) . .
C132 C133 C19 119(4) . .
C133 C134 C135 122(5) . .
C133 C134 H134 118.9 . .
C135 C134 H134 118.9 . .
C130 C135 C134 117(4) . .
C130 C135 H135 121.5 . .
C134 C135 H135 121.5 . .
C141 C136 C137 113(4) . .
C141 C136 P7 121(3) . .
C137 C136 P7 126(3) . .
C138 C137 C136 129(4) . .
C138 C137 H137 115.4 . .
C136 C137 H137 115.4 . .
C137 C138 C139 117(5) . .
C137 C138 H138 121.3 . .
C139 C138 H138 121.2 . .
C138 C139 C140 119(4) . .
C138 C139 C20 121(4) . .
C140 C139 C20 120(4) . .
C141 C140 C139 119(4) . .
C141 C140 H140 120.5 . .
C139 C140 H140 120.5 . .
C140 C141 C136 121(4) . .
C140 C141 H141 119.7 . .
C136 C141 H141 119.7 . .
C147 C142 C143 128(4) . .
C147 C142 P7 116(3) . .
C143 C142 P7 116(3) . .
C144 C143 C142 110(4) . .
C144 C143 H143 125.0 . .
C142 C143 H143 125.1 . .
C145 C144 C143 125(4) . .
C145 C144 H144 117.3 . .
C143 C144 H144 117.3 . .
C146 C145 C144 118(4) . .
C146 C145 C21 124(4) . .
C144 C145 C21 118(4) . .
C145 C146 C147 123(4) . .
C145 C146 H146 118.7 . .
C147 C146 H146 118.7 . .
C142 C147 C146 116(4) . .
C142 C147 H147 122.1 . .
C146 C147 H147 122.1 . .
Au2 O1 Au1 110.1(11) . .
Au2 O1 Au4 129.4(13) . .
Au1 O1 Au4 93.9(10) . .
Au2 O1 Au3 126.9(12) . .
Au1 O1 Au3 95.4(10) . .
Au4 O1 Au3 92.4(9) . .
Au5 O2 Au6 127.9(12) . .
Au5 O2 Au7 104.0(11) . .
Au6 O2 Au7 98.2(10) . .
W2 O9 W1 134(2) . .
W2 O10 W3 144(2) . .
W3 O11 W1 146(2) . .
W1 O12 W4 145(2) . .
W5 O13 W2 134(2) . .
W2 O14 W6 134(2) . 2_667
W4 O15 W3 138(2) 2_667 .
O23 O16 W1 107(4) . .
O23 O16 W6 43(3) . .
W1 O16 W6 134(2) . .
W5 O17 W4 138(2) . .
W6 O18 W5 135(2) . 2_667
W6 O19 W4 140(2) . .
W5 O20 W3 135(2) . 2_667
P8 O21 O22 50.7(18) . .
P8 O21 W3 132(2) . .
O22 O21 W3 81(2) . .
P8 O21 W2 117(2) . .
O22 O21 W2 136(3) . .
W3 O21 W2 96.3(14) . .
P8 O21 W1 116(2) . .
O22 O21 W1 134(3) . .
W3 O21 W1 95.8(14) . .
W2 O21 W1 90.7(13) . .
P8 O22 O21 63(2) . .
P8 O22 W5 129(2) . 2_667
O21 O22 W5 128(3) . 2_667
P8 O22 W4 127(2) . 2_667
O21 O22 W4 125(3) . 2_667
W5 O22 W4 90.3(14) 2_667 2_667
O16 O23 W6 110(4) . .
O16 O23 W1 47(3) . .
W6 O23 W1 138(3) . .
W8 O30 W7 138(2) . .
W8 O31 W9 138(2) . .
W7 O32 W9 135(2) . .
W11 O33 W7 137(2) 2_566 .
W7 O34 W12 133(2) . 2_566
W8 O35 W10 132(2) . 2_566
W8 O36 W11 144(2) . .
W9 O37 W12 143(2) . .
W9 O38 W10 142(2) . .
W10 O39 W12 140(2) . .
W11 O40 W10 128.8(19) . 2_566
W11 O41 W12 142(2) . .
P9 O42 W10 127(2) . .
P9 O42 W9 123.7(19) . .
W10 O42 W9 93.6(13) . .
P9 O42 W12 120(2) . .
W10 O42 W12 92.1(12) . .
W9 O42 W12 90.8(12) . .
P9 O43 W7 129(2) . .
P9 O43 W11 124(2) . 2_566
W7 O43 W11 95.0(14) . 2_566
C28 P1 C22 103(2) . .
C28 P1 C34 107(2) . .
C22 P1 C34 113(2) . .
C28 P1 Au1 108.6(18) . .
C22 P1 Au1 112.7(16) . .
C34 P1 Au1 111.3(17) . .
C46 P2 C52 103(2) . .
C46 P2 C40 107(2) . .
C52 P2 C40 110(2) . .
C46 P2 Au2 114.7(15) . .
C52 P2 Au2 115.8(14) . .
C40 P2 Au2 106.4(15) . .
C70 P3 C64 109(2) . .
C70 P3 C58 106(2) . .
C64 P3 C58 101(2) . .
C70 P3 Au3 113.0(17) . .
C64 P3 Au3 111.3(17) . .
C58 P3 Au3 116.2(18) . .
C82 P4 C76 106(3) . .
C82 P4 C88 102(2) . .
C76 P4 C88 108(2) . .
C82 P4 Au4 113.3(19) . .
C76 P4 Au4 109.6(16) . .
C88 P4 Au4 116.7(16) . .
C100 P5 C94 104(2) . .
C100 P5 C106 105(2) . .
C94 P5 C106 104(2) . .
C100 P5 Au5 112.3(17) . .
C94 P5 Au5 115.9(18) . .
C106 P5 Au5 114.2(15) . .
C112 P6 C124 106(2) . .
C112 P6 C118 106(2) . .
C124 P6 C118 107(2) . .
C112 P6 Au6 114.5(18) . .
C124 P6 Au6 114.3(15) . .
C118 P6 Au6 109.0(15) . .
C136 P7 C142 104.5(19) . .
C136 P7 C130 108(2) . .
C142 P7 C130 108(2) . .
C136 P7 Au7 117.9(15) . .
C142 P7 Au7 106.3(14) . .
C130 P7 Au7 111.1(14) . .
O22 P8 O22 179.999(9) . 2_667
O22 P8 O21 67(2) . .
O22 P8 O21 113(2) 2_667 .
O22 P8 O21 113(2) . 2_667
O22 P8 O21 67(2) 2_667 2_667
O21 P8 O21 180.00(2) . 2_667
O42 P9 O42 179.998(18) 2_566 .
O42 P9 O43 78(2) 2_566 .
O42 P9 O43 102(2) . .
O42 P9 O43 102(2) 2_566 2_566
O42 P9 O43 78(2) . 2_566
O43 P9 O43 180(3) . 2_566
O3 W1 O16 95(2) . .
O3 W1 O12 107.2(19) . .
O16 W1 O12 77(2) . .
O3 W1 O9 97.2(18) . .
O16 W1 O9 165.0(18) . .
O12 W1 O9 91.5(18) . .
O3 W1 O11 107.5(19) . .
O16 W1 O11 97(2) . .
O12 W1 O11 145.1(17) . .
O9 W1 O11 87.7(18) . .
O3 W1 O23 112.1(18) . .
O16 W1 O23 26.4(16) . .
O12 W1 O23 91.3(17) . .
O9 W1 O23 148.2(16) . .
O11 W1 O23 72.4(17) . .
O3 W1 O21 153.5(17) . .
O16 W1 O21 104.0(17) . .
O12 W1 O21 95.0(16) . .
O9 W1 O21 67.3(15) . .
O11 W1 O21 52.9(15) . .
O23 W1 O21 81.0(14) . .
O4 W2 O10 97(2) . .
O4 W2 O14 94(2) . .
O10 W2 O14 96.8(19) . .
O4 W2 O9 100.3(19) . .
O10 W2 O9 81.2(18) . .
O14 W2 O9 165.4(17) . .
O4 W2 O13 103(2) . .
O10 W2 O13 159.4(18) . .
O14 W2 O13 82.7(18) . .
O9 W2 O13 94.1(17) . .
O4 W2 O21 152.6(18) . .
O10 W2 O21 57.7(16) . .
O14 W2 O21 99.3(16) . .
O9 W2 O21 67.3(15) . .
O13 W2 O21 101.9(15) . .
O11 W3 O5 105.4(19) . .
O11 W3 O10 87.8(19) . .
O5 W3 O10 99.5(19) . .
O11 W3 O15 149.2(18) . .
O5 W3 O15 105.3(19) . .
O10 W3 O15 90.0(17) . .
O11 W3 O20 87.2(17) . 2_667
O5 W3 O20 104.7(18) . 2_667
O10 W3 O20 155.7(16) . 2_667
O15 W3 O20 82.3(16) . 2_667
O11 W3 O21 59.9(17) . .
O5 W3 O21 154.7(18) . .
O10 W3 O21 61.7(16) . .
O15 W3 O21 92.2(16) . .
O20 W3 O21 95.5(15) 2_667 .
O6 W4 O15 100.6(19) . 2_667
O6 W4 O12 106.1(18) . .
O15 W4 O12 153.3(18) 2_667 .
O6 W4 O19 102.2(19) . .
O15 W4 O19 87.8(17) 2_667 .
O12 W4 O19 86.1(17) . .
O6 W4 O17 101.3(19) . .
O15 W4 O17 87.9(17) 2_667 .
O12 W4 O17 87.4(17) . .
O19 W4 O17 156.5(18) . .
O6 W4 O22 160.9(17) . 2_667
O15 W4 O22 67.5(16) 2_667 2_667
O12 W4 O22 86.8(16) . 2_667
O19 W4 O22 92.4(16) . 2_667
O17 W4 O22 64.6(15) . 2_667
O7 W5 O20 96.5(19) . .
O7 W5 O17 102.5(19) . .
O20 W5 O17 84.3(18) . .
O7 W5 O13 96.4(18) . .
O20 W5 O13 167.0(19) . .
O17 W5 O13 91.2(17) . .
O7 W5 O18 98.4(18) . 2_667
O20 W5 O18 93.3(17) . 2_667
O17 W5 O18 159.2(18) . 2_667
O13 W5 O18 86.6(17) . 2_667
O7 W5 O22 164.2(17) . 2_667
O20 W5 O22 72.0(17) . 2_667
O17 W5 O22 66.4(16) . 2_667
O13 W5 O22 95.1(16) . 2_667
O18 W5 O22 93.2(16) 2_667 2_667
O23 W6 O8 106(2) . .
O23 W6 O18 74(2) . .
O8 W6 O18 100(2) . .
O23 W6 O19 99(2) . .
O8 W6 O19 100(2) . .
O18 W6 O19 159.7(18) . .
O23 W6 O14 147(2) . 2_667
O8 W6 O14 101.7(18) . 2_667
O18 W6 O14 85.1(18) . 2_667
O19 W6 O14 92.4(17) . 2_667
O23 W6 O16 26.7(18) . .
O8 W6 O16 97.5(17) . .
O18 W6 O16 99.9(17) . .
O19 W6 O16 75.8(17) . .
O14 W6 O16 159.0(16) 2_667 .
O34 W7 O24 96.5(18) . .
O34 W7 O32 166.7(16) . .
O24 W7 O32 96.0(17) . .
O34 W7 O33 83.9(16) . .
O24 W7 O33 97.8(17) . .
O32 W7 O33 90.1(15) . .
O34 W7 O30 91.4(16) . .
O24 W7 O30 105.6(16) . .
O32 W7 O30 89.4(16) . .
O33 W7 O30 156.6(16) . .
O34 W7 O43 72.8(15) . .
O24 W7 O43 159.6(15) . .
O32 W7 O43 94.0(14) . .
O33 W7 O43 64.4(14) . .
O30 W7 O43 92.3(14) . .
O35 W8 O25 97.0(18) . .
O35 W8 O31 157.8(17) . .
O25 W8 O31 103.6(17) . .
O35 W8 O30 73.8(18) . .
O25 W8 O30 101.6(17) . .
O31 W8 O30 93.6(17) . .
O35 W8 O36 99.2(18) . .
O25 W8 O36 105.6(18) . .
O31 W8 O36 83.5(17) . .
O30 W8 O36 152.6(15) . .
O26 W9 O38 102.6(17) . .
O26 W9 O37 107.4(17) . .
O38 W9 O37 86.7(16) . .
O26 W9 O32 95.6(17) . .
O38 W9 O32 89.7(16) . .
O37 W9 O32 156.9(16) . .
O26 W9 O31 103.4(16) . .
O38 W9 O31 154.0(15) . .
O37 W9 O31 84.8(16) . .
O32 W9 O31 88.7(15) . .
O26 W9 O42 160.7(15) . .
O38 W9 O42 61.2(14) . .
O37 W9 O42 63.6(14) . .
O32 W9 O42 94.8(14) . .
O31 W9 O42 93.1(13) . .
O27 W10 O39 101.2(17) . .
O27 W10 O38 99.6(16) . .
O39 W10 O38 86.5(16) . .
O27 W10 O40 98.3(16) . 2_566
O39 W10 O40 160.0(15) . 2_566
O38 W10 O40 85.5(15) . 2_566
O27 W10 O42 156.6(14) . .
O39 W10 O42 65.5(15) . .
O38 W10 O42 61.9(14) . .
O40 W10 O42 94.6(13) 2_566 .
O27 W10 O35 109.1(14) . 2_566
O39 W10 O35 83.1(15) . 2_566
O38 W10 O35 150.8(15) . 2_566
O40 W10 O35 95.2(13) 2_566 2_566
O42 W10 O35 89.0(13) . 2_566
O28 W11 O41 103.6(17) . .
O28 W11 O40 95.4(17) . .
O41 W11 O40 160.7(16) . .
O28 W11 O33 98.3(16) . 2_566
O41 W11 O33 87.0(15) . 2_566
O40 W11 O33 87.1(15) . 2_566
O28 W11 O36 107.1(16) . .
O41 W11 O36 84.2(16) . .
O40 W11 O36 93.4(15) . .
O33 W11 O36 154.4(16) 2_566 .
O28 W11 O43 158.1(15) . 2_566
O41 W11 O43 65.8(14) . 2_566
O40 W11 O43 95.2(14) . 2_566
O33 W11 O43 63.2(15) 2_566 2_566
O36 W11 O43 91.3(14) . 2_566
O29 W12 O37 108.2(17) . .
O29 W12 O41 102.1(17) . .
O37 W12 O41 87.8(15) . .
O29 W12 O39 103.9(17) . .
O37 W12 O39 86.3(16) . .
O41 W12 O39 153.9(16) . .
O29 W12 O34 95.4(16) . 2_566
O37 W12 O34 156.0(15) . 2_566
O41 W12 O34 82.6(14) . 2_566
O39 W12 O34 92.7(14) . 2_566
O29 W12 O42 162.0(16) . .
O37 W12 O42 62.0(14) . .
O41 W12 O42 92.9(14) . .
O39 W12 O42 62.0(14) . .
O34 W12 O42 96.4(13) 2_566 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Au1 O1 2.04(2) .
Au1 P1 2.221(11) .
Au1 Au4 3.064(2) .
Au1 Au3 3.112(2) .
Au1 Au2 3.308(2) .
Au2 O1 1.99(2) .
Au2 P2 2.233(11) .
Au3 O1 2.16(3) .
Au3 P3 2.190(13) .
Au3 Au4 3.111(2) .
Au4 O1 2.15(2) .
Au4 P4 2.211(9) .
Au4 Au5 3.034(2) .
Au5 O2 2.00(2) .
Au5 P5 2.171(13) .
Au5 Au7 3.199(2) .
Au6 O2 2.01(2) .
Au6 P6 2.221(10) .
Au6 Au7 3.078(2) .
Au7 O2 2.06(2) .
Au7 P7 2.211(9) .
C1 C25 1.74(7) .
C1 H1A 0.9800 .
C1 H1B 0.9800 .
C1 H1C 0.9800 .
C2 C31 1.40(7) .
C2 H2A 0.9801 .
C2 H2B 0.9801 .
C2 H2C 0.9801 .
C3 C37 1.63(7) .
C3 H3A 0.9800 .
C3 H3B 0.9800 .
C3 H3C 0.9800 .
C4 C43 1.51(6) .
C4 H4A 0.9800 .
C4 H4B 0.9800 .
C4 H4C 0.9800 .
C5 C49 1.45(7) .
C5 H5A 0.9800 .
C5 H5B 0.9800 .
C5 H5C 0.9800 .
C6 C55 1.42(6) .
C6 H6A 0.9800 .
C6 H6B 0.9800 .
C6 H6C 0.9800 .
C7 C61 1.48(7) .
C7 H7A 0.9800 .
C7 H7B 0.9800 .
C7 H7C 0.9800 .
C8 C67 1.63(7) .
C8 H8A 0.9800 .
C8 H8B 0.9800 .
C8 H8C 0.9800 .
C9 C73 1.54(7) .
C9 H9A 0.9800 .
C9 H9B 0.9800 .
C9 H9C 0.9800 .
C10 C79 1.34(7) .
C10 H10A 0.9800 .
C10 H10B 0.9800 .
C10 H10C 0.9800 .
C11 C85 1.64(8) .
C11 H11A 0.9800 .
C11 H11B 0.9800 .
C11 H11C 0.9800 .
C12 C91 1.61(7) .
C12 H12A 0.9800 .
C12 H12B 0.9800 .
C12 H12C 0.9800 .
C13 C97 1.49(7) .
C13 H13A 0.9800 .
C13 H13B 0.9800 .
C13 H13C 0.9800 .
C14 C103 1.52(7) .
C14 H14A 0.9800 .
C14 H14B 0.9800 .
C14 H14C 0.9800 .
C15 C109 1.66(6) .
C15 H15A 0.9800 .
C15 H15B 0.9800 .
C15 H15C 0.9800 .
C16 C115 1.53(7) .
C16 H16A 0.9800 .
C16 H16B 0.9800 .
C16 H16C 0.9800 .
C17 C121 1.54(7) .
C17 H17A 0.9800 .
C17 H17B 0.9800 .
C17 H17C 0.9800 .
C18 C127 1.50(7) .
C18 H18A 0.9800 .
C18 H18B 0.9800 .
C18 H18C 0.9800 .
C19 C133 1.53(6) .
C19 H19A 0.9800 .
C19 H19B 0.9800 .
C19 H19C 0.9800 .
C20 C139 1.63(6) .
C20 H20A 0.9800 .
C20 H20B 0.9800 .
C20 H20C 0.9800 .
C21 C145 1.49(6) .
C21 H21A 0.9800 .
C21 H21B 0.9800 .
C21 H21C 0.9800 .
C22 C23 1.31(7) .
C22 C27 1.45(7) .
C22 P1 1.79(5) .
C23 C24 1.55(7) .
C23 H23 0.9500 .
C24 C25 1.36(7) .
C24 H24 0.9500 .
C25 C26 1.55(7) .
C26 C27 1.22(7) .
C26 H26 0.9500 .
C27 H27 0.9500 .
C28 C29 1.31(7) .
C28 C33 1.37(7) .
C28 P1 1.73(5) .
C29 C30 1.32(7) .
C29 H29 0.9500 .
C30 C31 1.57(7) .
C30 H30 0.9500 .
C31 C32 1.36(7) .
C32 C33 1.47(7) .
C32 H32 0.9500 .
C33 H33 0.9500 .
C34 C35 1.23(7) .
C34 C39 1.43(7) .
C34 P1 1.90(5) .
C35 C36 1.32(7) .
C35 H35 0.9500 .
C36 C37 1.46(7) .
C36 H36 0.9500 .
C37 C38 1.08(6) .
C38 C39 1.42(7) .
C38 H38 0.9500 .
C39 H39 0.9500 .
C40 C45 1.34(6) .
C40 C41 1.42(6) .
C40 P2 1.84(5) .
C41 C42 1.33(6) .
C41 H41 0.9500 .
C42 C43 1.33(6) .
C42 H42 0.9500 .
C43 C44 1.53(6) .
C44 C45 1.39(6) .
C44 H44 0.9500 .
C45 H45 0.9500 .
C46 C51 1.36(6) .
C46 C47 1.45(7) .
C46 P2 1.78(5) .
C47 C48 1.17(6) .
C47 H47 0.9500 .
C48 C49 1.38(6) .
C48 H48 0.9500 .
C49 C50 1.38(7) .
C50 C51 1.43(7) .
C50 H50 0.9500 .
C51 H51 0.9500 .
C52 C57 1.33(6) .
C52 C53 1.43(6) .
C52 P2 1.83(5) .
C53 C54 1.33(6) .
C53 H53 0.9500 .
C54 C55 1.45(6) .
C54 H54 0.9500 .
C55 C56 1.38(6) .
C56 C57 1.41(6) .
C56 H56 0.9500 .
C57 H57 0.9500 .
C58 C59 1.23(7) .
C58 C63 1.48(7) .
C58 P3 1.83(5) .
C59 C60 1.43(7) .
C59 H59 0.9500 .
C60 C61 1.38(7) .
C60 H60 0.9500 .
C61 C62 1.50(7) .
C62 C63 1.41(7) .
C62 H62 0.9500 .
C63 H63 0.9500 .
C64 C65 1.34(7) .
C64 C69 1.35(7) .
C64 P3 1.83(5) .
C65 C66 1.29(7) .
C65 H65 0.9500 .
C66 C67 1.31(7) .
C66 H66 0.9500 .
C67 C68 1.48(7) .
C68 C69 1.42(7) .
C68 H68 0.9500 .
C69 H69 0.9500 .
C70 C71 1.37(6) .
C70 C75 1.38(7) .
C70 P3 1.77(5) .
C71 C72 1.45(7) .
C71 H71 0.9500 .
C72 C73 1.32(7) .
C72 H72 0.9500 .
C73 C74 1.33(6) .
C74 C75 1.40(7) .
C74 H74 0.9500 .
C75 H75 0.9500 .
C76 C81 1.32(7) .
C76 C77 1.46(7) .
C76 P4 1.77(5) .
C77 C78 1.28(7) .
C77 H77 0.9500 .
C78 C79 1.47(7) .
C78 H78 0.9500 .
C79 C80 1.41(7) .
C80 C81 1.43(7) .
C80 H80 0.9500 .
C81 H81 0.9500 .
C82 C83 1.44(7) .
C82 C87 1.43(7) .
C82 P4 1.66(5) .
C83 C84 1.52(8) .
C83 H83 0.9500 .
C84 C85 1.04(7) .
C84 H84 0.9500 .
C85 C86 1.41(7) .
C86 C87 1.36(7) .
C86 H86 0.9500 .
C87 H87 0.9500 .
C88 C93 1.36(6) .
C88 C89 1.45(7) .
C88 P4 1.81(5) .
C89 C90 1.32(7) .
C89 H89 0.9500 .
C90 C91 1.58(6) .
C90 H90 0.9500 .
C91 C92 1.27(7) .
C92 C93 1.32(7) .
C92 H92 0.9500 .
C93 H93 0.9500 .
C94 C99 1.34(7) .
C94 C95 1.47(7) .
C94 P5 1.86(5) .
C95 C96 1.40(7) .
C95 H95 0.9500 .
C96 C97 1.49(7) .
C96 H96 0.9500 .
C97 C98 1.31(7) .
C98 C99 1.44(7) .
C98 H98 0.9500 .
C99 H99 0.9500 .
C100 C101 1.31(7) .
C100 C105 1.39(7) .
C100 P5 1.85(5) .
C101 C102 1.42(7) .
C101 H101 0.9500 .
C102 C103 1.34(7) .
C102 H102 0.9500 .
C103 C104 1.52(7) .
C104 C105 1.43(7) .
C104 H104 0.9500 .
C105 H105 0.9500 .
C106 C107 1.23(6) .
C106 C111 1.41(6) .
C106 P5 1.93(5) .
C107 C108 1.39(6) .
C107 H107 0.9500 .
C108 C109 1.44(6) .
C108 H108 0.9500 .
C109 C110 1.32(7) .
C110 C111 1.44(6) .
C110 H110 0.9500 .
C111 H111 0.9500 .
C112 C117 1.40(6) .
C112 C113 1.40(7) .
C112 P6 1.76(5) .
C113 C114 1.50(7) .
C113 H113 0.9500 .
C114 C115 1.43(6) .
C114 H114 0.9500 .
C115 C116 1.38(7) .
C116 C117 1.36(7) .
C116 H116 0.9500 .
C117 H117 0.9500 .
C118 C123 1.25(6) .
C118 C119 1.47(6) .
C118 P6 1.83(5) .
C119 C120 1.41(6) .
C119 H119 0.9500 .
C120 C121 1.37(6) .
C120 H120 0.9500 .
C121 C122 1.40(6) .
C122 C123 1.46(6) .
C122 H122 0.9500 .
C123 H123 0.9500 .
C124 C125 1.38(7) .
C124 C129 1.41(6) .
C124 P6 1.83(5) .
C125 C126 1.28(7) .
C125 H125 0.9500 .
C126 C127 1.48(7) .
C126 H126 0.9500 .
C127 C128 1.37(7) .
C128 C129 1.41(7) .
C128 H128 0.9500 .
C129 H129 0.9500 .
C130 C131 1.38(6) .
C130 C135 1.40(6) .
C130 P7 1.89(5) .
C131 C132 1.42(7) .
C131 H131 0.9500 .
C132 C133 1.46(6) .
C132 H132 0.9500 .
C133 C134 1.27(6) .
C134 C135 1.42(7) .
C134 H134 0.9500 .
C135 H135 0.9500 .
C136 C141 1.33(6) .
C136 C137 1.40(6) .
C136 P7 1.83(4) .
C137 C138 1.18(6) .
C137 H137 0.9500 .
C138 C139 1.30(6) .
C138 H138 0.9500 .
C139 C140 1.41(6) .
C140 C141 1.32(6) .
C140 H140 0.9500 .
C141 H141 0.9500 .
C142 C147 1.33(6) .
C142 C143 1.49(6) .
C142 P7 1.85(4) .
C143 C144 1.43(6) .
C143 H143 0.9500 .
C144 C145 1.40(6) .
C144 H144 0.9500 .
C145 C146 1.38(6) .
C146 C147 1.44(6) .
C146 H146 0.9500 .
C147 H147 0.9500 .
O3 W1 1.66(4) .
O4 W2 1.52(4) .
O5 W3 1.64(4) .
O6 W4 1.65(4) .
O7 W5 1.69(4) .
O8 W6 1.70(4) .
O9 W2 1.94(4) .
O9 W1 1.92(4) .
O10 W2 1.81(4) .
O10 W3 1.92(4) .
O11 W3 1.75(4) .
O11 W1 1.96(4) .
O12 W1 1.84(4) .
O12 W4 1.88(4) .
O13 W5 1.89(4) .
O13 W2 1.97(4) .
O14 W2 1.83(4) .
O14 W6 2.01(4) 2_667
O15 W4 1.88(4) 2_667
O15 W3 1.94(4) .
O16 O23 1.03(5) .
O16 W1 1.70(4) .
O16 W6 2.16(4) .
O17 W5 1.85(4) .
O17 W4 1.95(4) .
O18 W6 1.83(4) .
O18 W5 2.01(4) 2_667
O19 W6 1.86(4) .
O19 W4 1.94(4) .
O20 W5 1.70(4) .
O20 W3 2.15(4) 2_667
O21 P8 1.63(4) .
O21 O22 1.69(6) .
O21 W3 2.26(4) .
O21 W2 2.50(4) .
O21 W1 2.51(4) .
O22 P8 1.42(4) .
O22 W5 2.49(4) 2_667
O22 W4 2.52(4) 2_667
O23 W6 1.57(4) .
O23 W1 2.23(4) .
O24 W7 1.75(4) .
O25 W8 1.63(3) .
O26 W9 1.71(4) .
O27 W10 1.69(3) .
O28 W11 1.67(4) .
O29 W12 1.70(4) .
O30 W8 1.83(4) .
O30 W7 1.97(4) .
O31 W8 1.82(4) .
O31 W9 1.99(4) .
O32 W7 1.90(4) .
O32 W9 1.94(4) .
O33 W11 1.89(3) 2_566
O33 W7 1.94(4) .
O34 W7 1.74(4) .
O34 W12 2.15(4) 2_566
O35 W8 1.65(4) .
O35 W10 2.25(4) 2_566
O36 W8 1.84(4) .
O36 W11 1.90(4) .
O37 W9 1.85(4) .
O37 W12 1.90(4) .
O38 W9 1.85(4) .
O38 W10 1.91(3) .
O39 W10 1.85(4) .
O39 W12 1.94(4) .
O40 W11 1.88(3) .
O40 W10 2.05(4) 2_566
O41 W11 1.85(4) .
O41 W12 1.93(4) .
O42 P9 1.54(4) .
O42 W10 2.41(4) .
O42 W9 2.47(4) .
O42 W12 2.52(4) .
O43 P9 1.54(4) .
O43 W7 2.37(4) .
O43 W11 2.45(4) 2_566
P8 O22 1.42(4) 2_667
P8 O21 1.63(4) 2_667
P9 O42 1.54(4) 2_566
P9 O43 1.54(4) 2_566
W3 O20 2.15(4) 2_667
W4 O15 1.88(4) 2_667
W4 O22 2.52(4) 2_667
W5 O18 2.01(4) 2_667
W5 O22 2.49(4) 2_667
W6 O14 2.01(4) 2_667
W10 O40 2.05(4) 2_566
W10 O35 2.25(4) 2_566
W11 O33 1.89(3) 2_566
W11 O43 2.45(4) 2_566
W12 O34 2.15(4) 2_566
