#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/94/7029463.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_7029463
loop_
_publ_author_name
'Shakirova, Julia R.'
'Grachova, Elena V.'
'Karttunen, Antti J.'
'Gurzhiy, Vladislav V.'
'Tunik, Sergey P.'
'Koshevoy, Igor O.'
_publ_section_title
;
 Metallophilicity-assisted assembly of phosphine-based cage molecules.
;
_journal_issue                   16
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              6236
_journal_page_last               6243
_journal_paper_doi               10.1039/c3dt53645a
_journal_volume                  43
_journal_year                    2014
_chemical_formula_sum            'C260.47 H224.7 Au12 Cl8.95 F24 N4 P16'
_chemical_formula_weight         7043.03
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 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                 99.7320(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   30.2941(17)
_cell_length_b                   34.3378(19)
_cell_length_c                   26.6065(15)
_cell_measurement_reflns_used    9933
_cell_measurement_temperature    210(2)
_cell_measurement_theta_max      23.35
_cell_measurement_theta_min      2.23
_cell_volume                     27279(3)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      210(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω 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  0.0860
_diffrn_reflns_av_sigmaI/netI    0.1076
_diffrn_reflns_limit_h_max       35
_diffrn_reflns_limit_h_min       -36
_diffrn_reflns_limit_k_max       36
_diffrn_reflns_limit_k_min       -40
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            108842
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         0.90
_exptl_absorpt_coefficient_mu    6.673
_exptl_absorpt_correction_T_max  0.3127
_exptl_absorpt_correction_T_min  0.2271
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS; Bruker, 2007'
_exptl_crystal_colour            white
_exptl_crystal_density_diffrn    1.715
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             13486
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.12
_platon_squeeze_details
;
The unit cell contains disordered hexafluorophosphate ions
and dichloromethane molecules which have been treated
as a diffuse contribution to the overall scattering
without specific atom positions by SQUEEZE/PLATON.
;
_refine_diff_density_max         3.261
_refine_diff_density_min         -2.077
_refine_diff_density_rms         0.240
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.987
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1051
_refine_ls_number_reflns         24020
_refine_ls_number_restraints     35
_refine_ls_restrained_S_all      0.987
_refine_ls_R_factor_all          0.1276
_refine_ls_R_factor_gt           0.0677
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1298P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1993
_refine_ls_wR_factor_ref         0.2263
_reflns_number_gt                13167
_reflns_number_total             24020
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3dt53645a2.cif
_cod_data_source_block           pppau3tbu_0m
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/current/RSC/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 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_sg_symbol_H-M      C2/c
_cod_original_formula_sum        'C260.47 H224.70 Au12 Cl8.95 F24 N4 P16'
_cod_database_code               7029463
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -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 0.36101(3) 0.62590(2) 0.43233(3) 0.0488(2) Uani 1 1 d . . .
Au2 Au 0.36974(2) 0.69613(2) 0.49664(3) 0.04335(19) Uani 1 1 d . . .
Au3 Au 0.29040(2) 0.693568(19) 0.40902(2) 0.04119(18) Uani 1 1 d . . .
Au4 Au 0.70366(2) 0.92715(2) 0.49662(3) 0.04334(19) Uani 1 1 d . . .
Au5 Au 0.68838(2) 0.99693(2) 0.42647(3) 0.0461(2) Uani 1 1 d . . .
Au6 Au 0.75424(2) 0.92972(2) 0.40781(3) 0.0522(2) Uani 1 1 d . . .
P1 P 0.58799(18) 0.59852(14) 0.10988(18) 0.0532(13) Uani 1 1 d . . .
P2 P 0.42929(16) 0.73428(14) 0.52102(17) 0.0455(11) Uani 1 1 d . . .
P3 P 0.26674(14) 0.73482(13) 0.34525(16) 0.0387(10) Uani 1 1 d . . .
P4 P 0.65622(15) 0.88542(13) 0.52386(16) 0.0389(10) Uani 1 1 d . . .
P5 P 0.62954(17) 1.02567(13) 0.37867(16) 0.0458(12) Uani 1 1 d . . .
P6 P 0.76479(17) 0.88546(15) 0.34975(18) 0.0523(12) Uani 1 1 d . . .
N1 N 0.3186(5) 0.6591(4) 0.4688(5) 0.044(3) Uani 1 1 d . . .
N2 N 0.7424(4) 0.9670(4) 0.4653(5) 0.045(4) Uani 1 1 d . . .
C1 C 0.4802(9) 0.6190(7) -0.0010(7) 0.181(5) Uani 1 1 d G . .
H1 H 0.4754 0.6284 -0.0342 0.218 Uiso 1 1 calc R . .
C2 C 0.4443(7) 0.6060(8) 0.0207(9) 0.181(5) Uani 1 1 d G . .
H2 H 0.4154 0.6067 0.0020 0.218 Uiso 1 1 calc R . .
C3 C 0.4514(7) 0.5919(8) 0.0704(9) 0.181(5) Uani 1 1 d G . .
H3 H 0.4273 0.5832 0.0850 0.218 Uiso 1 1 calc R . .
C4 C 0.4945(9) 0.5908(8) 0.0984(7) 0.181(5) Uani 1 1 d G . .
H4 H 0.4993 0.5814 0.1316 0.218 Uiso 1 1 calc R . .
C5 C 0.5305(7) 0.6038(8) 0.0767(9) 0.181(5) Uani 1 1 d G . .
C6 C 0.5233(7) 0.6179(8) 0.0270(10) 0.181(5) Uani 1 1 d G . .
H6 H 0.5474 0.6266 0.0124 0.218 Uiso 1 1 calc R . .
C7 C 0.5989(9) 0.5471(6) 0.1218(10) 0.181(5) Uani 1 1 d G . .
C8 C 0.6226(8) 0.5351(7) 0.1686(9) 0.181(5) Uani 1 1 d G . .
H8 H 0.6351 0.5535 0.1925 0.218 Uiso 1 1 calc R . .
C9 C 0.6278(8) 0.4957(8) 0.1796(7) 0.181(5) Uani 1 1 d G . .
H9 H 0.6436 0.4877 0.2109 0.218 Uiso 1 1 calc R . .
C10 C 0.6091(8) 0.4682(6) 0.1439(10) 0.181(5) Uani 1 1 d G . .
H10 H 0.6126 0.4417 0.1513 0.218 Uiso 1 1 calc R . .
C11 C 0.5854(8) 0.4801(7) 0.0971(9) 0.181(5) Uani 1 1 d G . .
H11 H 0.5730 0.4617 0.0732 0.218 Uiso 1 1 calc R . .
C12 C 0.5803(8) 0.5196(8) 0.0861(8) 0.181(5) Uani 1 1 d G . .
H12 H 0.5644 0.5276 0.0548 0.218 Uiso 1 1 calc R . .
C13 C 0.4192(8) 0.7843(6) 0.5233(8) 0.070(2) Uani 1 1 d . . .
C14 C 0.4506(8) 0.8143(6) 0.5215(8) 0.070(2) Uani 1 1 d . . .
H14 H 0.4801 0.8072 0.5205 0.084 Uiso 1 1 calc R . .
C15 C 0.4405(8) 0.8533(6) 0.5211(7) 0.070(2) Uani 1 1 d . . .
H15 H 0.4618 0.8718 0.5162 0.084 Uiso 1 1 calc R . .
C16 C 0.3974(8) 0.8649(6) 0.5281(7) 0.070(2) Uani 1 1 d . . .
H16 H 0.3908 0.8910 0.5326 0.084 Uiso 1 1 calc R . .
C17 C 0.3654(8) 0.8370(6) 0.5283(7) 0.070(2) Uani 1 1 d . . .
H17 H 0.3361 0.8444 0.5294 0.084 Uiso 1 1 calc R . .
C18 C 0.3759(8) 0.7968(6) 0.5266(7) 0.070(2) Uani 1 1 d . . .
H18 H 0.3535 0.7784 0.5278 0.084 Uiso 1 1 calc R . .
C19 C 0.4584(5) 0.7207(5) 0.5836(4) 0.092(4) Uani 1 1 d G . .
C20 C 0.4716(5) 0.7476(4) 0.6222(6) 0.092(4) Uani 1 1 d G . .
H20 H 0.4663 0.7740 0.6161 0.110 Uiso 1 1 calc R . .
C21 C 0.4929(5) 0.7351(5) 0.6699(5) 0.092(4) Uani 1 1 d G . .
H21 H 0.5017 0.7532 0.6957 0.110 Uiso 1 1 calc R . .
C22 C 0.5009(4) 0.6957(5) 0.6790(4) 0.092(4) Uani 1 1 d G . .
H22 H 0.5151 0.6874 0.7109 0.110 Uiso 1 1 calc R . .
C23 C 0.4877(5) 0.6687(4) 0.6404(6) 0.092(4) Uani 1 1 d G . .
H23 H 0.4931 0.6424 0.6465 0.110 Uiso 1 1 calc R . .
C24 C 0.4665(5) 0.6812(5) 0.5927(5) 0.092(4) Uani 1 1 d G . .
H24 H 0.4576 0.6632 0.5669 0.110 Uiso 1 1 calc R . .
C25 C 0.2546(5) 0.7141(4) 0.2823(4) 0.081(3) Uani 1 1 d G . .
C26 C 0.2801(4) 0.6824(4) 0.2720(5) 0.081(3) Uani 1 1 d G . .
H26 H 0.3017 0.6721 0.2976 0.097 Uiso 1 1 calc R . .
C27 C 0.2734(5) 0.6661(4) 0.2235(5) 0.081(3) Uani 1 1 d G . .
H27 H 0.2905 0.6448 0.2167 0.097 Uiso 1 1 calc R . .
C28 C 0.2411(5) 0.6814(4) 0.1853(4) 0.081(3) Uani 1 1 d G . .
H28 H 0.2366 0.6705 0.1529 0.097 Uiso 1 1 calc R . .
C29 C 0.2155(4) 0.7131(4) 0.1956(5) 0.081(3) Uani 1 1 d G . .
H29 H 0.1939 0.7234 0.1701 0.097 Uiso 1 1 calc R . .
C30 C 0.2223(5) 0.7295(4) 0.2441(5) 0.081(3) Uani 1 1 d G . .
H30 H 0.2052 0.7507 0.2510 0.097 Uiso 1 1 calc R . .
C31 C 0.2176(6) 0.7626(6) 0.3495(7) 0.052(5) Uani 1 1 d . . .
C32 C 0.2109(6) 0.8003(6) 0.3301(7) 0.058(5) Uani 1 1 d . . .
H32 H 0.2332 0.8130 0.3162 0.069 Uiso 1 1 calc R . .
C33 C 0.1707(9) 0.8184(6) 0.3319(8) 0.079(7) Uani 1 1 d . . .
H33 H 0.1668 0.8440 0.3207 0.095 Uiso 1 1 calc R . .
C34 C 0.1354(7) 0.7997(7) 0.3501(8) 0.073(7) Uani 1 1 d . . .
H34 H 0.1074 0.8112 0.3484 0.088 Uiso 1 1 calc R . .
C35 C 0.1443(7) 0.7652(7) 0.3696(8) 0.072(6) Uani 1 1 d . . .
H35 H 0.1221 0.7530 0.3842 0.087 Uiso 1 1 calc R . .
C36 C 0.1830(6) 0.7460(6) 0.3702(8) 0.061(5) Uani 1 1 d . . .
H36 H 0.1867 0.7213 0.3846 0.073 Uiso 1 1 calc R . .
C37 C 0.3088(5) 0.7705(5) 0.3424(6) 0.041(4) Uani 1 1 d . . .
C38 C 0.3308(6) 0.7887(5) 0.3889(6) 0.046(4) Uani 1 1 d . . .
H38 H 0.3234 0.7808 0.4198 0.055 Uiso 1 1 calc R . .
C39 C 0.3631(6) 0.8180(5) 0.3888(6) 0.043(4) Uani 1 1 d . . .
H39 H 0.3763 0.8298 0.4191 0.052 Uiso 1 1 calc R . .
C40 C 0.3751(6) 0.8290(5) 0.3426(7) 0.047(4) Uani 1 1 d . . .
C41 C 0.3538(5) 0.8124(5) 0.2977(6) 0.041(4) Uani 1 1 d . . .
H41 H 0.3612 0.8208 0.2669 0.049 Uiso 1 1 calc R . .
C42 C 0.3217(6) 0.7835(5) 0.2974(6) 0.045(4) Uani 1 1 d . . .
H42 H 0.3084 0.7726 0.2665 0.054 Uiso 1 1 calc R . .
C43 C 0.6722(5) 0.8340(5) 0.5241(6) 0.039(4) Uani 1 1 d . . .
C44 C 0.6936(8) 0.8202(5) 0.4868(8) 0.066(6) Uani 1 1 d . . .
H44 H 0.7042 0.8374 0.4646 0.079 Uiso 1 1 calc R . .
C45 C 0.6988(8) 0.7855(9) 0.4826(8) 0.089(8) Uani 1 1 d . . .
H45 H 0.7122 0.7771 0.4555 0.107 Uiso 1 1 calc R . .
C46 C 0.6858(8) 0.7551(7) 0.5168(8) 0.075(7) Uani 1 1 d . . .
H46 H 0.6903 0.7287 0.5121 0.090 Uiso 1 1 calc R . .
C47 C 0.6668(7) 0.7692(6) 0.5554(8) 0.066(6) Uani 1 1 d . . .
H47 H 0.6591 0.7528 0.5803 0.079 Uiso 1 1 calc R . .
C48 C 0.6591(6) 0.8099(5) 0.5567(7) 0.050(5) Uani 1 1 d . . .
H48 H 0.6441 0.8198 0.5817 0.060 Uiso 1 1 calc R . .
C49 C 0.6443(6) 0.8954(5) 0.5861(6) 0.042(4) Uani 1 1 d . . .
C50 C 0.6814(7) 0.9071(6) 0.6229(8) 0.070(6) Uani 1 1 d . . .
H50 H 0.7091 0.9102 0.6129 0.084 Uiso 1 1 calc R . .
C51 C 0.6776(10) 0.9144(7) 0.6759(9) 0.092(8) Uani 1 1 d . . .
H51 H 0.7013 0.9231 0.7002 0.111 Uiso 1 1 calc R . .
C52 C 0.6321(9) 0.9065(7) 0.6876(8) 0.083(8) Uani 1 1 d . . .
H52 H 0.6271 0.9086 0.7211 0.099 Uiso 1 1 calc R . .
C53 C 0.5966(8) 0.8959(6) 0.6489(8) 0.073(7) Uani 1 1 d . . .
H53 H 0.5681 0.8925 0.6571 0.088 Uiso 1 1 calc R . .
C54 C 0.6025(7) 0.8904(5) 0.5997(7) 0.059(5) Uani 1 1 d . . .
H54 H 0.5783 0.8832 0.5751 0.071 Uiso 1 1 calc R . .
C55 C 0.6027(5) 0.8867(4) 0.4815(6) 0.034(4) Uani 1 1 d . . .
C56 C 0.5842(5) 0.9224(5) 0.4630(6) 0.039(4) Uani 1 1 d . . .
H56 H 0.5997 0.9453 0.4729 0.047 Uiso 1 1 calc R . .
C57 C 0.5442(5) 0.9246(5) 0.4308(6) 0.043(4) Uani 1 1 d . . .
H57 H 0.5319 0.9487 0.4202 0.051 Uiso 1 1 calc R . .
C58 C 0.5219(5) 0.8902(5) 0.4138(6) 0.039(4) Uani 1 1 d . . .
C59 C 0.5389(5) 0.8556(5) 0.4309(6) 0.043(4) Uani 1 1 d . . .
H59 H 0.5237 0.8328 0.4198 0.051 Uiso 1 1 calc R . .
C60 C 0.5795(6) 0.8533(5) 0.4655(6) 0.049(5) Uani 1 1 d . . .
H60 H 0.5906 0.8292 0.4775 0.058 Uiso 1 1 calc R . .
C61 C 0.4780(5) 0.8930(5) 0.3772(6) 0.041(4) Uani 1 1 d . . .
C62 C 0.4701(5) 0.7310(5) 0.4780(6) 0.041(4) Uani 1 1 d . . .
C63 C 0.5139(8) 0.7312(7) 0.4948(7) 0.080(7) Uani 1 1 d . . .
H63 H 0.5248 0.7312 0.5296 0.096 Uiso 1 1 calc R . .
C64 C 0.5449(7) 0.7314(7) 0.4589(8) 0.077(7) Uani 1 1 d . . .
H64 H 0.5755 0.7336 0.4705 0.092 Uiso 1 1 calc R . .
C65 C 0.5291(7) 0.7282(6) 0.4081(7) 0.060(5) Uani 1 1 d . . .
C66 C 0.4836(6) 0.7278(7) 0.3924(7) 0.079(8) Uani 1 1 d . . .
H66 H 0.4715 0.7276 0.3578 0.095 Uiso 1 1 calc R . .
C67 C 0.4565(7) 0.7276(7) 0.4287(8) 0.080(7) Uani 1 1 d . . .
H67 H 0.4259 0.7247 0.4175 0.096 Uiso 1 1 calc R . .
C68 C 0.4461(5) 0.8630(5) 0.3784(6) 0.048(5) Uani 1 1 d . . .
H68 H 0.4511 0.8445 0.4043 0.058 Uiso 1 1 calc R . .
C69 C 0.5593(6) 0.7276(6) 0.3708(7) 0.057(5) Uani 1 1 d . . .
C70 C 0.5926(6) 0.7549(6) 0.3755(7) 0.057(5) Uani 1 1 d . . .
H70 H 0.5947 0.7724 0.4024 0.069 Uiso 1 1 calc R . .
C71 C 0.6238(6) 0.7582(5) 0.3426(7) 0.050(5) Uani 1 1 d . . .
C72 C 0.6202(7) 0.7300(6) 0.3041(7) 0.061(6) Uani 1 1 d . . .
H72 H 0.6422 0.7292 0.2836 0.074 Uiso 1 1 calc R . .
C73 C 0.5844(8) 0.7024(5) 0.2947(7) 0.060(5) Uani 1 1 d . A .
C74 C 0.5550(6) 0.7022(5) 0.3293(7) 0.050(5) Uani 1 1 d . . .
H74 H 0.5314 0.6846 0.3246 0.060 Uiso 1 1 calc R . .
C75 C 0.5800(7) 1.0328(6) 0.4072(8) 0.066(2) Uani 1 1 d . . .
C76 C 0.5369(7) 1.0380(6) 0.3788(8) 0.066(2) Uani 1 1 d . . .
H76 H 0.5332 1.0380 0.3434 0.080 Uiso 1 1 calc R . .
C77 C 0.5005(8) 1.0432(6) 0.4019(8) 0.066(2) Uani 1 1 d . . .
H77 H 0.4726 1.0472 0.3820 0.080 Uiso 1 1 calc R . .
C78 C 0.5041(7) 1.0425(6) 0.4520(7) 0.066(2) Uani 1 1 d . . .
H78 H 0.4790 1.0454 0.4676 0.080 Uiso 1 1 calc R . .
C79 C 0.5469(7) 1.0372(6) 0.4811(8) 0.066(2) Uani 1 1 d . . .
H79 H 0.5500 1.0378 0.5165 0.080 Uiso 1 1 calc R . .
C80 C 0.5837(8) 1.0313(6) 0.4599(8) 0.066(2) Uani 1 1 d . . .
H80 H 0.6113 1.0264 0.4802 0.080 Uiso 1 1 calc R . .
C81 C 0.6447(6) 1.0720(3) 0.3557(5) 0.098(4) Uani 1 1 d G . .
C86 C 0.6870(5) 1.0748(4) 0.3422(6) 0.098(4) Uani 1 1 d G . .
H86 H 0.7060 1.0534 0.3459 0.118 Uiso 1 1 calc R . .
C85 C 0.7008(5) 1.1097(5) 0.3233(5) 0.098(4) Uani 1 1 d G . .
H85 H 0.7291 1.1116 0.3143 0.118 Uiso 1 1 calc R . .
C84 C 0.6723(6) 1.1417(3) 0.3178(5) 0.098(4) Uani 1 1 d G . .
H84 H 0.6815 1.1650 0.3051 0.118 Uiso 1 1 calc R . .
C83 C 0.6300(5) 1.1389(4) 0.3312(5) 0.098(4) Uani 1 1 d G . .
H83 H 0.6110 1.1603 0.3275 0.118 Uiso 1 1 calc R . .
C82 C 0.6162(5) 1.1040(5) 0.3502(5) 0.098(4) Uani 1 1 d G . .
H82 H 0.5879 1.1021 0.3591 0.118 Uiso 1 1 calc R . .
C87 C 0.6102(6) 0.9964(4) 0.3236(6) 0.035(4) Uani 1 1 d . . .
C88 C 0.5914(7) 1.0103(5) 0.2758(7) 0.056(5) Uani 1 1 d . . .
H88 H 0.5894 1.0371 0.2712 0.067 Uiso 1 1 calc R . .
C89 C 0.5762(7) 0.9875(5) 0.2363(7) 0.062(6) Uani 1 1 d . . .
H89 H 0.5645 0.9984 0.2048 0.075 Uiso 1 1 calc R . .
C90 C 0.5781(6) 0.9463(5) 0.2424(6) 0.044(4) Uani 1 1 d . . .
C91 C 0.5937(6) 0.9319(5) 0.2913(6) 0.049(5) Uani 1 1 d . . .
H91 H 0.5938 0.9053 0.2976 0.058 Uiso 1 1 calc R . .
C92 C 0.6088(6) 0.9577(5) 0.3299(6) 0.048(4) Uani 1 1 d . . .
H92 H 0.6186 0.9477 0.3624 0.057 Uiso 1 1 calc R . .
C93 C 0.7611(7) 0.8991(6) 0.2835(5) 0.124(5) Uani 1 1 d G . .
C94 C 0.7324(6) 0.8810(5) 0.2442(6) 0.124(5) Uani 1 1 d G . .
H94 H 0.7139 0.8608 0.2514 0.149 Uiso 1 1 calc R . .
C95 C 0.7313(6) 0.8930(6) 0.1941(5) 0.124(5) Uani 1 1 d G . .
H95 H 0.7121 0.8808 0.1677 0.149 Uiso 1 1 calc R . .
C96 C 0.7589(7) 0.9231(6) 0.1833(5) 0.124(5) Uani 1 1 d G . .
H96 H 0.7581 0.9311 0.1498 0.149 Uiso 1 1 calc R . .
C97 C 0.7876(6) 0.9412(5) 0.2226(6) 0.124(5) Uani 1 1 d G . .
H97 H 0.8060 0.9614 0.2154 0.149 Uiso 1 1 calc R . .
C98 C 0.7887(6) 0.9293(6) 0.2727(5) 0.124(5) Uani 1 1 d G . .
H98 H 0.8079 0.9414 0.2991 0.149 Uiso 1 1 calc R . .
C99 C 0.8197(8) 0.8621(8) 0.3636(9) 0.089(3) Uani 1 1 d . . .
C100 C 0.8415(8) 0.8500(7) 0.3267(9) 0.089(3) Uani 1 1 d . . .
H100 H 0.8294 0.8536 0.2925 0.107 Uiso 1 1 calc R . .
C101 C 0.8824(8) 0.8319(7) 0.3410(9) 0.089(3) Uani 1 1 d . . .
H101 H 0.9007 0.8269 0.3170 0.107 Uiso 1 1 calc R . .
C102 C 0.8959(8) 0.8213(8) 0.3913(9) 0.089(3) Uani 1 1 d . . .
H102 H 0.9207 0.8050 0.3993 0.107 Uiso 1 1 calc R . .
C103 C 0.8759(8) 0.8329(8) 0.4279(10) 0.089(3) Uani 1 1 d . . .
H103 H 0.8874 0.8272 0.4618 0.107 Uiso 1 1 calc R . .
C104 C 0.8365(8) 0.8543(8) 0.4148(9) 0.089(3) Uani 1 1 d . . .
H104 H 0.8213 0.8633 0.4401 0.107 Uiso 1 1 calc R . .
C105 C 0.7236(6) 0.8463(5) 0.3492(6) 0.048(5) Uani 1 1 d . . .
C106 C 0.7338(7) 0.8073(5) 0.3427(6) 0.055(5) Uani 1 1 d . . .
H106 H 0.7629 0.8006 0.3392 0.066 Uiso 1 1 calc R . .
C107 C 0.7029(7) 0.7788(6) 0.3412(7) 0.062(5) Uani 1 1 d . . .
H107 H 0.7107 0.7529 0.3374 0.075 Uiso 1 1 calc R . .
C108 C 0.6587(6) 0.7888(5) 0.3455(7) 0.048(4) Uani 1 1 d . . .
C109 C 0.6485(6) 0.8274(6) 0.3529(7) 0.060(5) Uani 1 1 d . . .
H109 H 0.6194 0.8337 0.3568 0.072 Uiso 1 1 calc R . .
C110 C 0.6801(6) 0.8573(5) 0.3548(6) 0.049(5) Uani 1 1 d . . .
H110 H 0.6727 0.8832 0.3595 0.059 Uiso 1 1 calc R . .
C112 C 0.5980(6) 0.6903(3) 0.2074(6) 0.087(3) Uani 1 1 d G A 1
H112 H 0.6068 0.7162 0.2064 0.105 Uiso 1 1 calc R A 1
C113 C 0.5991(6) 0.6663(4) 0.1656(5) 0.087(3) Uani 1 1 d G A 1
H113 H 0.6086 0.6761 0.1366 0.105 Uiso 1 1 calc R A 1
C114 C 0.5859(6) 0.6276(4) 0.1670(5) 0.087(3) Uani 1 1 d G . .
C115 C 0.5717(6) 0.6129(3) 0.2103(5) 0.087(3) Uani 1 1 d G A 1
H115 H 0.5629 0.5870 0.2113 0.105 Uiso 1 1 calc R A 1
C116 C 0.5706(6) 0.6370(4) 0.2521(4) 0.087(3) Uani 1 1 d G A 1
H116 H 0.5611 0.6272 0.2811 0.105 Uiso 1 1 calc R A 1
C111 C 0.5838(6) 0.6757(4) 0.2507(5) 0.087(3) Uani 1 1 d G . .
C117 C 0.7805(7) 0.9850(5) 0.4952(8) 0.060(5) Uani 1 1 d . . .
C118 C 0.8133(7) 0.9579(6) 0.5204(9) 0.088(8) Uani 1 1 d . . .
H11A H 0.8268 0.9443 0.4953 0.132 Uiso 1 1 calc R . .
H11B H 0.7989 0.9394 0.5395 0.132 Uiso 1 1 calc R . .
H11C H 0.8359 0.9717 0.5430 0.132 Uiso 1 1 calc R . .
C119 C 0.7627(7) 1.0092(6) 0.5376(8) 0.073(6) Uani 1 1 d . . .
H11D H 0.7468 0.9924 0.5571 0.109 Uiso 1 1 calc R . .
H11E H 0.7430 1.0293 0.5220 0.109 Uiso 1 1 calc R . .
H11F H 0.7876 1.0209 0.5598 0.109 Uiso 1 1 calc R . .
C120 C 0.8028(7) 1.0115(6) 0.4630(9) 0.077(7) Uani 1 1 d . . .
H12A H 0.7815 1.0198 0.4341 0.116 Uiso 1 1 calc R . .
H12B H 0.8269 0.9979 0.4514 0.116 Uiso 1 1 calc R . .
H12C H 0.8144 1.0338 0.4827 0.116 Uiso 1 1 calc R . .
C121 C 0.2891(6) 0.6420(5) 0.5036(7) 0.052(5) Uani 1 1 d . . .
C122 C 0.2668(6) 0.6741(6) 0.5271(7) 0.056(5) Uani 1 1 d . . .
H12D H 0.2586 0.6944 0.5025 0.084 Uiso 1 1 calc R . .
H12E H 0.2870 0.6843 0.5558 0.084 Uiso 1 1 calc R . .
H12F H 0.2404 0.6643 0.5384 0.084 Uiso 1 1 calc R . .
C123 C 0.2544(7) 0.6163(5) 0.4683(8) 0.067(6) Uani 1 1 d . . .
H12G H 0.2429 0.5967 0.4883 0.100 Uiso 1 1 calc R . .
H12H H 0.2687 0.6041 0.4429 0.100 Uiso 1 1 calc R . .
H12I H 0.2302 0.6324 0.4520 0.100 Uiso 1 1 calc R . .
C124 C 0.3193(8) 0.6164(7) 0.5452(8) 0.083(7) Uani 1 1 d . . .
H12J H 0.3462 0.6304 0.5584 0.125 Uiso 1 1 calc R . .
H12K H 0.3270 0.5925 0.5300 0.125 Uiso 1 1 calc R . .
H12L H 0.3032 0.6107 0.5724 0.125 Uiso 1 1 calc R . .
C125 C 0.5295(5) 0.9207(5) 0.1617(6) 0.041(4) Uani 1 1 d . . .
H125 H 0.5087 0.9404 0.1630 0.050 Uiso 1 1 calc R . .
C126 C 0.5989(6) 0.8880(5) 0.1964(7) 0.053(5) Uani 1 1 d . . .
H126 H 0.6243 0.8861 0.2214 0.063 Uiso 1 1 calc R . .
C127 C 0.5686(6) 0.9188(5) 0.1989(6) 0.043(4) Uani 1 1 d . . .
C128 C 0.4081(6) 0.8605(5) 0.3423(6) 0.045(4) Uani 1 1 d . . .
P7 P 0.5000 0.8787(5) 0.7500 0.132(3) Uani 1 2 d SD . .
F1 F 0.5000 0.8339(6) 0.7500 0.132(3) Uani 1 2 d SD . .
F2 F 0.5000 0.9249(6) 0.7500 0.132(3) Uani 1 2 d SD . .
F3 F 0.4918(6) 0.8784(5) 0.6888(5) 0.132(3) Uani 1 1 d D . .
F4 F 0.4491(4) 0.8848(5) 0.7490(6) 0.132(3) Uani 1 1 d D . .
P8 P 0.3170(5) 0.3416(4) 0.5766(6) 0.183(3) Uani 0.95 1 d PD . .
F5 F 0.2870(8) 0.3065(5) 0.5826(9) 0.183(3) Uani 0.95 1 d PD . .
F6 F 0.3425(8) 0.3435(7) 0.6332(7) 0.183(3) Uani 0.95 1 d PD . .
F7 F 0.2807(6) 0.3698(5) 0.5895(9) 0.183(3) Uani 0.95 1 d PD . .
F8 F 0.2940(8) 0.3395(7) 0.5207(7) 0.183(3) Uani 0.95 1 d PD . .
F9 F 0.3599(7) 0.3181(5) 0.5621(9) 0.183(3) Uani 0.95 1 d PD . .
F10 F 0.3495(7) 0.3776(5) 0.5694(9) 0.183(3) Uani 0.95 1 d PD . .
P9 P 0.5683(6) 0.4057(5) 0.2767(6) 0.165(5) Uani 0.55 1 d PD . .
F11 F 0.5979(9) 0.4027(10) 0.3312(8) 0.165(5) Uani 0.55 1 d PD . .
F12 F 0.6090(8) 0.3993(8) 0.2512(9) 0.165(5) Uani 0.55 1 d PD . .
F13 F 0.5807(12) 0.4489(6) 0.2879(12) 0.165(5) Uani 0.55 1 d PD . .
F14 F 0.5397(9) 0.4157(10) 0.2231(8) 0.165(5) Uani 0.55 1 d PD . .
F15 F 0.5615(12) 0.3620(6) 0.2683(12) 0.165(5) Uani 0.55 1 d PD . .
F16 F 0.5259(8) 0.4096(9) 0.3010(10) 0.165(5) Uani 0.55 1 d PD . .
C129 C 0.1600(10) 0.5324(8) 0.6169(11) 0.125(2) Uani 0.80 1 d PD . .
H12M H 0.1882 0.5185 0.6199 0.150 Uiso 0.80 1 calc PR . .
H12N H 0.1577 0.5427 0.6503 0.150 Uiso 0.80 1 calc PR . .
Cl1 Cl 0.1179(4) 0.5001(3) 0.5999(4) 0.125(2) Uani 0.80 1 d PD . .
Cl2 Cl 0.1613(4) 0.5708(3) 0.5758(3) 0.125(2) Uani 0.80 1 d PD . .
C130 C 0.430(4) 0.459(3) 0.097(4) 0.148(8) Uani 0.30 1 d P . .
H13C H 0.4487 0.4560 0.1302 0.178 Uiso 0.30 1 calc PR . .
H13D H 0.3992 0.4554 0.0993 0.178 Uiso 0.30 1 calc PR . .
Cl3 Cl 0.4411(13) 0.5064(8) 0.0653(12) 0.148(8) Uani 0.30 1 d P . .
Cl4 Cl 0.4462(13) 0.4283(8) 0.0552(12) 0.148(8) Uani 0.30 1 d P . .
C131 C 0.4055(13) 0.1980(9) 0.2974(12) 0.090(11) Uani 0.712(12) 1 d P . .
H13E H 0.3784 0.1824 0.2930 0.108 Uiso 0.712(12) 1 calc PR . .
H13F H 0.4300 0.1811 0.2922 0.108 Uiso 0.712(12) 1 calc PR . .
Cl5 Cl 0.4157(4) 0.2150(3) 0.3580(4) 0.109(4) Uani 0.712(12) 1 d P . .
Cl6 Cl 0.3993(3) 0.2343(3) 0.2509(3) 0.089(3) Uani 0.712(12) 1 d P . .
C132 C 0.5000 0.526(3) 0.2500 0.107(6) Uani 0.30 2 d SP . .
H13G H 0.4793 0.5084 0.2629 0.129 Uiso 0.15 1 calc PR . .
H13H H 0.5207 0.5084 0.2371 0.129 Uiso 0.15 1 calc PR . .
Cl7 Cl 0.5281(10) 0.5363(6) 0.2989(8) 0.107(6) Uani 0.30 1 d P . .
Cl8 Cl 0.4641(18) 0.8087(19) 0.283(3) 0.08(2) Uani 0.06 1 d PD . .
Cl9 Cl 0.5505(9) 0.8094(19) 0.262(3) 0.08(2) Uani 0.06 1 d PD . .
C133 C 0.5000 0.832(2) 0.2500 0.08(2) Uani 0.06 2 d SPD . 2
C134 C 0.5000 0.787(2) 0.2500 0.08(2) Uani 0.06 2 d SPD . 1
Cl10 Cl 0.7977(11) 1.0505(9) 0.1883(13) 0.107(6) Uani 0.20 1 d PD . .
C135 C 0.8343(15) 1.046(4) 0.1482(14) 0.107(6) Uani 0.20 1 d PD . .
H13A H 0.8350 1.0701 0.1291 0.129 Uiso 0.20 1 calc PR . .
H13B H 0.8249 1.0253 0.1242 0.129 Uiso 0.20 1 calc PR . .
Cl11 Cl 0.8858(11) 1.0365(9) 0.1799(13) 0.107(6) Uani 0.20 1 d PD . .
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'
P P 0.1023 0.0942 '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'
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'
Cl Cl 0.1484 0.1585 '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(4) . 2_655
N1 Au1 Au2 44.0(4) . .
P1 Au1 Au2 128.85(13) 2_655 .
N1 Au1 Au3 40.0(4) . .
P1 Au1 Au3 135.01(13) 2_655 .
Au2 Au1 Au3 60.07(2) . .
N1 Au2 P2 174.2(4) . .
N1 Au2 Au1 44.8(4) . .
P2 Au2 Au1 129.63(12) . .
N1 Au2 Au3 41.8(4) . .
P2 Au2 Au3 136.96(12) . .
Au1 Au2 Au3 63.30(2) . .
N1 Au3 P3 173.7(4) . .
N1 Au3 Au2 41.7(4) . .
P3 Au3 Au2 132.20(11) . .
N1 Au3 Au1 40.6(4) . .
P3 Au3 Au1 137.55(11) . .
Au2 Au3 Au1 56.63(2) . .
N2 Au4 P4 174.1(4) . .
N2 Au4 Au5 42.7(4) . .
P4 Au4 Au5 131.93(11) . .
N2 Au4 Au6 43.0(4) . .
P4 Au4 Au6 135.22(11) . .
Au5 Au4 Au6 62.61(2) . .
N2 Au5 P5 174.9(4) . .
N2 Au5 Au4 43.0(4) . .
P5 Au5 Au4 136.43(12) . .
N2 Au5 Au6 40.5(4) . .
P5 Au5 Au6 134.42(12) . .
Au4 Au5 Au6 58.74(2) . .
N2 Au6 P6 175.0(4) . .
N2 Au6 Au4 42.9(4) . .
P6 Au6 Au4 132.22(14) . .
N2 Au6 Au5 40.2(4) . .
P6 Au6 Au5 141.19(13) . .
Au4 Au6 Au5 58.65(2) . .
C7 P1 C5 108.2(12) . .
C7 P1 C114 114.6(10) . .
C5 P1 C114 100.6(11) . .
C7 P1 Au1 111.8(9) . 2_655
C5 P1 Au1 113.3(9) . 2_655
C114 P1 Au1 108.0(5) . 2_655
C13 P2 C19 106.4(9) . .
C13 P2 C62 102.9(9) . .
C19 P2 C62 106.5(7) . .
C13 P2 Au2 116.7(8) . .
C19 P2 Au2 111.1(6) . .
C62 P2 Au2 112.4(6) . .
C37 P3 C31 104.3(8) . .
C37 P3 C25 105.5(7) . .
C31 P3 C25 103.1(8) . .
C37 P3 Au3 109.2(6) . .
C31 P3 Au3 117.0(6) . .
C25 P3 Au3 116.5(5) . .
C49 P4 C55 105.8(8) . .
C49 P4 C43 106.1(7) . .
C55 P4 C43 103.6(7) . .
C49 P4 Au4 114.8(6) . .
C55 P4 Au4 109.8(5) . .
C43 P4 Au4 115.8(6) . .
C87 P5 C81 106.6(7) . .
C87 P5 C75 103.8(9) . .
C81 P5 C75 107.6(9) . .
C87 P5 Au5 109.6(6) . .
C81 P5 Au5 111.1(6) . .
C75 P5 Au5 117.3(7) . .
C93 P6 C99 102.4(11) . .
C93 P6 C105 104.6(8) . .
C99 P6 C105 106.0(11) . .
C93 P6 Au6 120.4(7) . .
C99 P6 Au6 113.1(8) . .
C105 P6 Au6 109.2(6) . .
C121 N1 Au2 120.7(10) . .
C121 N1 Au3 119.1(11) . .
Au2 N1 Au3 96.5(5) . .
C121 N1 Au1 123.4(10) . .
Au2 N1 Au1 91.2(5) . .
Au3 N1 Au1 99.5(6) . .
C117 N2 Au5 124.2(12) . .
C117 N2 Au4 121.4(12) . .
Au5 N2 Au4 94.4(5) . .
C117 N2 Au6 117.1(11) . .
Au5 N2 Au6 99.3(6) . .
Au4 N2 Au6 94.0(5) . .
C2 C1 C6 120.0 . .
C2 C1 H1 120.0 . .
C6 C1 H1 120.0 . .
C3 C2 C1 120.0 . .
C3 C2 H2 120.0 . .
C1 C2 H2 120.0 . .
C2 C3 C4 120.0 . .
C2 C3 H3 120.0 . .
C4 C3 H3 120.0 . .
C3 C4 C5 120.0 . .
C3 C4 H4 120.0 . .
C5 C4 H4 120.0 . .
C4 C5 C6 120.0 . .
C4 C5 P1 121.2(16) . .
C6 C5 P1 118.5(16) . .
C5 C6 C1 120.0 . .
C5 C6 H6 120.0 . .
C1 C6 H6 120.0 . .
C8 C7 C12 120.0 . .
C8 C7 P1 119.7(16) . .
C12 C7 P1 120.1(16) . .
C7 C8 C9 120.0 . .
C7 C8 H8 120.0 . .
C9 C8 H8 120.0 . .
C10 C9 C8 120.0 . .
C10 C9 H9 120.0 . .
C8 C9 H9 120.0 . .
C9 C10 C11 120.0 . .
C9 C10 H10 120.0 . .
C11 C10 H10 120.0 . .
C12 C11 C10 120.0 . .
C12 C11 H11 120.0 . .
C10 C11 H11 120.0 . .
C11 C12 C7 120.0 . .
C11 C12 H12 120.0 . .
C7 C12 H12 120.0 . .
C18 C13 C14 115(2) . .
C18 C13 P2 118.4(17) . .
C14 C13 P2 126.5(19) . .
C15 C14 C13 124(2) . .
C15 C14 H14 117.9 . .
C13 C14 H14 117.9 . .
C14 C15 C16 119(2) . .
C14 C15 H15 120.5 . .
C16 C15 H15 120.5 . .
C17 C16 C15 118(2) . .
C17 C16 H16 120.8 . .
C15 C16 H16 120.8 . .
C16 C17 C18 121(2) . .
C16 C17 H17 119.3 . .
C18 C17 H17 119.3 . .
C13 C18 C17 121(2) . .
C13 C18 H18 119.4 . .
C17 C18 H18 119.4 . .
C20 C19 C24 120.0 . .
C20 C19 P2 122.8(10) . .
C24 C19 P2 117.2(10) . .
C21 C20 C19 120.0 . .
C21 C20 H20 120.0 . .
C19 C20 H20 120.0 . .
C22 C21 C20 120.0 . .
C22 C21 H21 120.0 . .
C20 C21 H21 120.0 . .
C21 C22 C23 120.0 . .
C21 C22 H22 120.0 . .
C23 C22 H22 120.0 . .
C24 C23 C22 120.0 . .
C24 C23 H23 120.0 . .
C22 C23 H23 120.0 . .
C23 C24 C19 120.0 . .
C23 C24 H24 120.0 . .
C19 C24 H24 120.0 . .
C26 C25 C30 120.0 . .
C26 C25 P3 117.4(9) . .
C30 C25 P3 122.6(9) . .
C27 C26 C25 120.0 . .
C27 C26 H26 120.0 . .
C25 C26 H26 120.0 . .
C28 C27 C26 120.0 . .
C28 C27 H27 120.0 . .
C26 C27 H27 120.0 . .
C29 C28 C27 120.0 . .
C29 C28 H28 120.0 . .
C27 C28 H28 120.0 . .
C28 C29 C30 120.0 . .
C28 C29 H29 120.0 . .
C30 C29 H29 120.0 . .
C29 C30 C25 120.0 . .
C29 C30 H30 120.0 . .
C25 C30 H30 120.0 . .
C36 C31 C32 117.1(17) . .
C36 C31 P3 120.0(16) . .
C32 C31 P3 122.7(13) . .
C33 C32 C31 118.6(18) . .
C33 C32 H32 120.7 . .
C31 C32 H32 120.7 . .
C32 C33 C34 123(2) . .
C32 C33 H33 118.7 . .
C34 C33 H33 118.7 . .
C35 C34 C33 115.8(19) . .
C35 C34 H34 122.1 . .
C33 C34 H34 122.1 . .
C34 C35 C36 125(2) . .
C34 C35 H35 117.6 . .
C36 C35 H35 117.6 . .
C35 C36 C31 121(2) . .
C35 C36 H36 119.6 . .
C31 C36 H36 119.6 . .
C42 C37 C38 116.2(15) . .
C42 C37 P3 124.3(13) . .
C38 C37 P3 119.5(12) . .
C39 C38 C37 122.0(15) . .
C39 C38 H38 119.0 . .
C37 C38 H38 119.0 . .
C40 C39 C38 118.9(15) . .
C40 C39 H39 120.6 . .
C38 C39 H39 120.6 . .
C41 C40 C39 119.8(15) . .
C41 C40 C128 121.1(15) . .
C39 C40 C128 118.9(15) . .
C40 C41 C42 121.6(15) . .
C40 C41 H41 119.2 . .
C42 C41 H41 119.2 . .
C41 C42 C37 121.5(15) . .
C41 C42 H42 119.3 . .
C37 C42 H42 119.3 . .
C48 C43 C44 119.9(17) . .
C48 C43 P4 120.3(14) . .
C44 C43 P4 119.4(13) . .
C45 C44 C43 120(2) . .
C45 C44 H44 120.1 . .
C43 C44 H44 120.1 . .
C44 C45 C46 126(2) . .
C44 C45 H45 117.2 . .
C46 C45 H45 117.2 . .
C47 C46 C45 114(2) . .
C47 C46 H46 123.0 . .
C45 C46 H46 123.0 . .
C46 C47 C48 118(2) . .
C46 C47 H47 121.1 . .
C48 C47 H47 121.1 . .
C43 C48 C47 122.5(18) . .
C43 C48 H48 118.8 . .
C47 C48 H48 118.8 . .
C54 C49 C50 120.4(17) . .
C54 C49 P4 123.7(14) . .
C50 C49 P4 115.8(13) . .
C49 C50 C51 122(2) . .
C49 C50 H50 118.8 . .
C51 C50 H50 118.8 . .
C50 C51 C52 114(2) . .
C50 C51 H51 123.2 . .
C52 C51 H51 123.2 . .
C53 C52 C51 121(2) . .
C53 C52 H52 119.5 . .
C51 C52 H52 119.5 . .
C54 C53 C52 122(2) . .
C54 C53 H53 119.0 . .
C52 C53 H53 119.0 . .
C53 C54 C49 121(2) . .
C53 C54 H54 119.7 . .
C49 C54 H54 119.7 . .
C60 C55 C56 117.9(14) . .
C60 C55 P4 122.0(12) . .
C56 C55 P4 120.1(12) . .
C57 C56 C55 121.9(15) . .
C57 C56 H56 119.0 . .
C55 C56 H56 119.0 . .
C56 C57 C58 119.1(16) . .
C56 C57 H57 120.5 . .
C58 C57 H57 120.5 . .
C59 C58 C57 120.2(15) . .
C59 C58 C61 121.3(15) . .
C57 C58 C61 118.5(14) . .
C58 C59 C60 120.7(16) . .
C58 C59 H59 119.6 . .
C60 C59 H59 119.6 . .
C55 C60 C59 120.1(15) . .
C55 C60 H60 119.9 . .
C59 C60 H60 119.9 . .
C125 C61 C68 119.1(15) 2_655 .
C125 C61 C58 122.4(14) 2_655 .
C68 C61 C58 117.9(14) . .
C67 C62 C63 117.7(17) . .
C67 C62 P2 120.0(14) . .
C63 C62 P2 122.2(13) . .
C62 C63 C64 120.0(18) . .
C62 C63 H63 120.0 . .
C64 C63 H63 120.0 . .
C65 C64 C63 120(2) . .
C65 C64 H64 120.1 . .
C63 C64 H64 120.1 . .
C64 C65 C66 118.1(17) . .
C64 C65 C69 121(2) . .
C66 C65 C69 120.3(17) . .
C67 C66 C65 118.4(18) . .
C67 C66 H66 120.8 . .
C65 C66 H66 120.8 . .
C62 C67 C66 125.4(19) . .
C62 C67 H67 117.3 . .
C66 C67 H67 117.3 . .
C128 C68 C61 121.7(15) . .
C128 C68 H68 119.2 . .
C61 C68 H68 119.2 . .
C70 C69 C74 118.0(17) . .
C70 C69 C65 117.7(18) . .
C74 C69 C65 124.2(17) . .
C69 C70 C71 124.4(18) . .
C69 C70 H70 117.8 . .
C71 C70 H70 117.8 . .
C70 C71 C72 115.1(17) . .
C70 C71 C108 125.3(16) . .
C72 C71 C108 119.6(16) . .
C71 C72 C73 123.3(17) . .
C71 C72 H72 118.3 . .
C73 C72 H72 118.3 . .
C74 C73 C72 116.0(17) . .
C74 C73 C111 126.8(18) . .
C72 C73 C111 117.1(17) . .
C73 C74 C69 122.6(17) . .
C73 C74 H74 118.7 . .
C69 C74 H74 118.7 . .
C80 C75 C76 117(2) . .
C80 C75 P5 119.1(17) . .
C76 C75 P5 123.5(16) . .
C77 C76 C75 121(2) . .
C77 C76 H76 119.2 . .
C75 C76 H76 119.3 . .
C78 C77 C76 121(2) . .
C78 C77 H77 119.3 . .
C76 C77 H77 119.3 . .
C77 C78 C79 118(2) . .
C77 C78 H78 121.0 . .
C79 C78 H78 121.0 . .
C80 C79 C78 123(2) . .
C80 C79 H79 118.7 . .
C78 C79 H79 118.7 . .
C79 C80 C75 119(2) . .
C79 C80 H80 120.5 . .
C75 C80 H80 120.5 . .
C86 C81 C82 120.0 . .
C86 C81 P5 116.8(10) . .
C82 C81 P5 123.2(10) . .
C85 C86 C81 120.0 . .
C85 C86 H86 120.0 . .
C81 C86 H86 120.0 . .
C86 C85 C84 120.0 . .
C86 C85 H85 120.0 . .
C84 C85 H85 120.0 . .
C85 C84 C83 120.0 . .
C85 C84 H84 120.0 . .
C83 C84 H84 120.0 . .
C82 C83 C84 120.0 . .
C82 C83 H83 120.0 . .
C84 C83 H83 120.0 . .
C83 C82 C81 120.0 . .
C83 C82 H82 120.0 . .
C81 C82 H82 120.0 . .
C92 C87 C88 116.1(15) . .
C92 C87 P5 117.8(12) . .
C88 C87 P5 125.6(12) . .
C89 C88 C87 123.8(17) . .
C89 C88 H88 118.1 . .
C87 C88 H88 118.1 . .
C88 C89 C90 119.5(17) . .
C88 C89 H89 120.3 . .
C90 C89 H89 120.3 . .
C91 C90 C89 117.3(15) . .
C91 C90 C127 119.3(16) . .
C89 C90 C127 123.0(15) . .
C92 C91 C90 119.0(16) . .
C92 C91 H91 120.5 . .
C90 C91 H91 120.5 . .
C87 C92 C91 123.9(16) . .
C87 C92 H92 118.1 . .
C91 C92 H92 118.1 . .
C94 C93 C98 120.0 . .
C94 C93 P6 123.0(10) . .
C98 C93 P6 117.0(10) . .
C93 C94 C95 120.0 . .
C93 C94 H94 120.0 . .
C95 C94 H94 120.0 . .
C96 C95 C94 120.0 . .
C96 C95 H95 120.0 . .
C94 C95 H95 120.0 . .
C95 C96 C97 120.0 . .
C95 C96 H96 120.0 . .
C97 C96 H96 120.0 . .
C98 C97 C96 120.0 . .
C98 C97 H97 120.0 . .
C96 C97 H97 120.0 . .
C97 C98 C93 120.0 . .
C97 C98 H98 120.0 . .
C93 C98 H98 120.0 . .
C100 C99 C104 121(2) . .
C100 C99 P6 122(2) . .
C104 C99 P6 116.7(18) . .
C99 C100 C101 118(2) . .
C99 C100 H100 121.0 . .
C101 C100 H100 121.0 . .
C102 C101 C100 119(2) . .
C102 C101 H101 120.3 . .
C100 C101 H101 120.3 . .
C103 C102 C101 123(2) . .
C103 C102 H102 118.4 . .
C101 C102 H102 118.4 . .
C102 C103 C104 118(2) . .
C102 C103 H103 121.2 . .
C104 C103 H103 121.2 . .
C103 C104 C99 120(2) . .
C103 C104 H104 120.0 . .
C99 C104 H104 120.0 . .
C106 C105 C110 120.4(17) . .
C106 C105 P6 122.7(15) . .
C110 C105 P6 116.9(14) . .
C107 C106 C105 122.2(19) . .
C107 C106 H106 118.9 . .
C105 C106 H106 118.9 . .
C106 C107 C108 119.1(19) . .
C106 C107 H107 120.5 . .
C108 C107 H107 120.5 . .
C109 C108 C107 119.0(18) . .
C109 C108 C71 120.7(16) . .
C107 C108 C71 120.3(17) . .
C108 C109 C110 122.7(17) . .
C108 C109 H109 118.6 . .
C110 C109 H109 118.6 . .
C109 C110 C105 116.6(16) . .
C109 C110 H110 121.7 . .
C105 C110 H110 121.7 . .
C113 C112 C111 120.0 . .
C113 C112 H112 120.0 . .
C111 C112 H112 120.0 . .
C112 C113 C114 120.0 . .
C112 C113 H113 120.0 . .
C114 C113 H113 120.0 . .
C115 C114 C113 120.0 . .
C115 C114 P1 123.4(8) . .
C113 C114 P1 116.6(8) . .
C116 C115 C114 120.0 . .
C116 C115 H115 120.0 . .
C114 C115 H115 120.0 . .
C115 C116 C111 120.0 . .
C115 C116 H116 120.0 . .
C111 C116 H116 120.0 . .
C116 C111 C112 120.0 . .
C116 C111 C73 122.2(11) . .
C112 C111 C73 117.7(11) . .
N2 C117 C118 114.0(16) . .
N2 C117 C120 110.2(17) . .
C118 C117 C120 108.5(19) . .
N2 C117 C119 106.8(15) . .
C118 C117 C119 107.6(19) . .
C120 C117 C119 109.6(16) . .
C117 C118 H11A 109.5 . .
C117 C118 H11B 109.5 . .
H11A C118 H11B 109.5 . .
C117 C118 H11C 109.5 . .
H11A C118 H11C 109.5 . .
H11B C118 H11C 109.5 . .
C117 C119 H11D 109.5 . .
C117 C119 H11E 109.5 . .
H11D C119 H11E 109.5 . .
C117 C119 H11F 109.5 . .
H11D C119 H11F 109.5 . .
H11E C119 H11F 109.5 . .
C117 C120 H12A 109.5 . .
C117 C120 H12B 109.5 . .
H12A C120 H12B 109.5 . .
C117 C120 H12C 109.5 . .
H12A C120 H12C 109.5 . .
H12B C120 H12C 109.5 . .
C122 C121 N1 109.2(14) . .
C122 C121 C123 111.5(17) . .
N1 C121 C123 105.1(13) . .
C122 C121 C124 111.6(15) . .
N1 C121 C124 108.2(15) . .
C123 C121 C124 111.1(16) . .
C121 C122 H12D 109.5 . .
C121 C122 H12E 109.5 . .
H12D C122 H12E 109.5 . .
C121 C122 H12F 109.5 . .
H12D C122 H12F 109.5 . .
H12E C122 H12F 109.5 . .
C121 C123 H12G 109.5 . .
C121 C123 H12H 109.5 . .
H12G C123 H12H 109.5 . .
C121 C123 H12I 109.5 . .
H12G C123 H12I 109.5 . .
H12H C123 H12I 109.5 . .
C121 C124 H12J 109.5 . .
C121 C124 H12K 109.5 . .
H12J C124 H12K 109.5 . .
C121 C124 H12L 109.5 . .
H12J C124 H12L 109.5 . .
H12K C124 H12L 109.5 . .
C61 C125 C127 120.0(15) 2_655 .
C61 C125 H125 120.0 2_655 .
C127 C125 H125 120.0 . .
C128 C126 C127 122.0(16) 2_655 .
C128 C126 H126 119.0 2_655 .
C127 C126 H126 119.0 . .
C126 C127 C125 118.5(14) . .
C126 C127 C90 118.3(15) . .
C125 C127 C90 123.2(14) . .
C68 C128 C126 118.7(15) . 2_655
C68 C128 C40 122.2(14) . .
C126 C128 C40 119.2(15) 2_655 .
F1 P7 F4 97.8(9) . 2_656
F1 P7 F4 97.8(9) . .
F4 P7 F4 164.3(18) 2_656 .
F1 P7 F2 180.000(7) . .
F4 P7 F2 82.2(9) 2_656 .
F4 P7 F2 82.2(9) . .
F1 P7 F3 89.6(9) . 2_656
F4 P7 F3 90.0(8) 2_656 2_656
F4 P7 F3 90.1(8) . 2_656
F2 P7 F3 90.4(9) . 2_656
F1 P7 F3 89.6(9) . .
F4 P7 F3 90.1(8) 2_656 .
F4 P7 F3 90.0(8) . .
F2 P7 F3 90.4(9) . .
F3 P7 F3 179.2(17) 2_656 .
F5 P8 F8 83.3(15) . .
F5 P8 F7 90.7(10) . .
F8 P8 F7 91.2(14) . .
F5 P8 F6 97.9(16) . .
F8 P8 F6 177.7(16) . .
F7 P8 F6 90.8(14) . .
F5 P8 F10 178.2(13) . .
F8 P8 F10 96.1(15) . .
F7 P8 F10 91.0(9) . .
F6 P8 F10 82.6(14) . .
F5 P8 F9 98.4(13) . .
F8 P8 F9 89.9(14) . .
F7 P8 F9 170.9(13) . .
F6 P8 F9 88.0(14) . .
F10 P8 F9 79.9(9) . .
F12 P9 F15 83.8(19) . .
F12 P9 F16 176(2) . .
F15 P9 F16 92.5(13) . .
F12 P9 F13 92.2(13) . .
F15 P9 F13 174(2) . .
F16 P9 F13 91.7(19) . .
F12 P9 F11 91.3(11) . .
F15 P9 F11 96(2) . .
F16 P9 F11 90.3(10) . .
F13 P9 F11 79(2) . .
F12 P9 F14 89.6(10) . .
F15 P9 F14 92(2) . .
F16 P9 F14 89.4(10) . .
F13 P9 F14 93(2) . .
F11 P9 F14 171(2) . .
Cl1 C129 Cl2 115.5(14) . .
Cl1 C129 H12M 108.4 . .
Cl2 C129 H12M 108.4 . .
Cl1 C129 H12N 108.4 . .
Cl2 C129 H12N 108.4 . .
H12M C129 H12N 107.5 . .
Cl4 C130 Cl3 99(6) . .
Cl4 C130 H13C 111.9 . .
Cl3 C130 H13C 111.9 . .
Cl4 C130 H13D 111.9 . .
Cl3 C130 H13D 111.9 . .
H13C C130 H13D 109.6 . .
Cl5 C131 Cl6 114.2(18) . .
Cl5 C131 H13E 108.7 . .
Cl6 C131 H13E 108.7 . .
Cl5 C131 H13F 108.7 . .
Cl6 C131 H13F 108.7 . .
H13E C131 H13F 107.6 . .
Cl7 C132 Cl7 152(9) . 2_655
Cl7 C132 H13G 98.7 . .
Cl7 C132 H13G 98.7 2_655 .
Cl7 C132 H13H 98.7 . .
Cl7 C132 H13H 98.7 2_655 .
H13G C132 H13H 103.9 . .
Cl9 Cl8 C134 70(2) 2_655 .
Cl9 Cl8 C133 69(2) 2_655 .
C134 Cl8 C133 54(4) . .
Cl8 Cl9 C133 70(2) 2_655 .
Cl8 Cl9 C134 69(2) 2_655 .
C133 Cl9 C134 54(4) . .
Cl9 C133 Cl9 126(4) 2_655 .
Cl9 C133 Cl8 109.3(18) 2_655 2_655
Cl9 C133 Cl8 41(4) . 2_655
Cl9 C133 Cl8 41(4) 2_655 .
Cl9 C133 Cl8 109.3(18) . .
Cl8 C133 Cl8 125(4) 2_655 .
Cl8 C134 Cl8 127(4) . 2_655
Cl8 C134 Cl9 109.5(18) . .
Cl8 C134 Cl9 41(4) 2_655 .
Cl8 C134 Cl9 41(4) . 2_655
Cl8 C134 Cl9 109.5(18) 2_655 2_655
Cl9 C134 Cl9 125(4) . 2_655
Cl10 C135 Cl11 111.1(18) . .
Cl10 C135 H13A 109.4 . .
Cl11 C135 H13A 109.4 . .
Cl10 C135 H13B 109.4 . .
Cl11 C135 H13B 109.4 . .
H13A C135 H13B 108.0 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Au1 N1 2.075(14) .
Au1 P1 2.263(5) 2_655
Au1 Au2 2.9426(10) .
Au1 Au3 3.1480(10) .
Au2 N1 2.044(13) .
Au2 P2 2.235(5) .
Au2 Au3 3.0538(10) .
Au3 N1 2.050(13) .
Au3 P3 2.233(4) .
Au4 N2 2.067(13) .
Au4 P4 2.235(4) .
Au4 Au5 3.0243(10) .
Au4 Au6 3.0272(10) .
Au5 N2 2.056(14) .
Au5 P5 2.237(5) .
Au5 Au6 3.1445(11) .
Au6 N2 2.070(14) .
Au6 P6 2.228(5) .
P1 C7 1.815(19) .
P1 C5 1.825(17) .
P1 C114 1.829(10) .
P1 Au1 2.263(5) 2_655
P2 C13 1.75(2) .
P2 C19 1.809(11) .
P2 C62 1.826(16) .
P3 C37 1.779(16) .
P3 C31 1.788(18) .
P3 C25 1.799(10) .
P4 C49 1.787(17) .
P4 C55 1.812(16) .
P4 C43 1.830(17) .
P5 C87 1.792(15) .
P5 C81 1.792(10) .
P5 C75 1.81(2) .
P6 C93 1.809(12) .
P6 C99 1.83(2) .
P6 C105 1.833(17) .
N1 C121 1.51(2) .
N2 C117 1.43(2) .
C1 C2 1.3900 .
C1 C6 1.3900 .
C1 H1 0.9300 .
C2 C3 1.3900 .
C2 H2 0.9300 .
C3 C4 1.3900 .
C3 H3 0.9300 .
C4 C5 1.3900 .
C4 H4 0.9300 .
C5 C6 1.3900 .
C6 H6 0.9300 .
C7 C8 1.3900 .
C7 C12 1.3900 .
C8 C9 1.3900 .
C8 H8 0.9300 .
C9 C10 1.3900 .
C9 H9 0.9300 .
C10 C11 1.3900 .
C10 H10 0.9300 .
C11 C12 1.3900 .
C11 H11 0.9300 .
C12 H12 0.9300 .
C13 C18 1.40(3) .
C13 C14 1.41(3) .
C14 C15 1.37(3) .
C14 H14 0.9300 .
C15 C16 1.41(3) .
C15 H15 0.9300 .
C16 C17 1.36(3) .
C16 H16 0.9300 .
C17 C18 1.42(3) .
C17 H17 0.9300 .
C18 H18 0.9300 .
C19 C20 1.3900 .
C19 C24 1.3900 .
C20 C21 1.3900 .
C20 H20 0.9300 .
C21 C22 1.3900 .
C21 H21 0.9300 .
C22 C23 1.3900 .
C22 H22 0.9300 .
C23 C24 1.3900 .
C23 H23 0.9300 .
C24 H24 0.9300 .
C25 C26 1.3900 .
C25 C30 1.3900 .
C26 C27 1.3900 .
C26 H26 0.9300 .
C27 C28 1.3900 .
C27 H27 0.9300 .
C28 C29 1.3900 .
C28 H28 0.9300 .
C29 C30 1.3900 .
C29 H29 0.9300 .
C30 H30 0.9300 .
C31 C36 1.38(2) .
C31 C32 1.40(3) .
C32 C33 1.37(3) .
C32 H32 0.9300 .
C33 C34 1.40(3) .
C33 H33 0.9300 .
C34 C35 1.30(3) .
C34 H34 0.9300 .
C35 C36 1.35(3) .
C35 H35 0.9300 .
C36 H36 0.9300 .
C37 C42 1.39(2) .
C37 C38 1.44(2) .
C38 C39 1.40(2) .
C38 H38 0.9300 .
C39 C40 1.39(2) .
C39 H39 0.9300 .
C40 C41 1.38(2) .
C40 C128 1.47(2) .
C41 C42 1.39(2) .
C41 H41 0.9300 .
C42 H42 0.9300 .
C43 C48 1.31(2) .
C43 C44 1.36(2) .
C44 C45 1.21(3) .
C44 H44 0.9300 .
C45 C46 1.48(3) .
C45 H45 0.9300 .
C46 C47 1.35(3) .
C46 H46 0.9300 .
C47 C48 1.42(2) .
C47 H47 0.9300 .
C48 H48 0.9300 .
C49 C54 1.39(2) .
C49 C50 1.42(3) .
C50 C51 1.46(3) .
C50 H50 0.9300 .
C51 C52 1.49(3) .
C51 H51 0.9300 .
C52 C53 1.41(3) .
C52 H52 0.9300 .
C53 C54 1.36(3) .
C53 H53 0.9300 .
C54 H54 0.9300 .
C55 C60 1.37(2) .
C55 C56 1.40(2) .
C56 C57 1.36(2) .
C56 H56 0.9300 .
C57 C58 1.40(2) .
C57 H57 0.9300 .
C58 C59 1.35(2) .
C58 C61 1.51(2) .
C59 C60 1.41(2) .
C59 H59 0.9300 .
C60 H60 0.9300 .
C61 C125 1.39(2) 2_655
C61 C68 1.42(2) .
C62 C67 1.31(2) .
C62 C63 1.33(3) .
C63 C64 1.45(3) .
C63 H63 0.9300 .
C64 C65 1.36(3) .
C64 H64 0.9300 .
C65 C66 1.37(3) .
C65 C69 1.46(2) .
C66 C67 1.37(3) .
C66 H66 0.9300 .
C67 H67 0.9300 .
C68 C128 1.37(2) .
C68 H68 0.9300 .
C69 C70 1.37(2) .
C69 C74 1.39(2) .
C70 C71 1.40(2) .
C70 H70 0.9300 .
C71 C72 1.40(2) .
C71 C108 1.48(2) .
C72 C73 1.43(3) .
C72 H72 0.9300 .
C73 C74 1.38(2) .
C73 C111 1.48(2) .
C74 H74 0.9300 .
C75 C80 1.39(3) .
C75 C76 1.40(3) .
C76 C77 1.36(3) .
C76 H76 0.9300 .
C77 C78 1.32(2) .
C77 H77 0.9300 .
C78 C79 1.41(3) .
C78 H78 0.9300 .
C79 C80 1.35(3) .
C79 H79 0.9300 .
C80 H80 0.9300 .
C81 C86 1.3900 .
C81 C82 1.3900 .
C86 C85 1.3900 .
C86 H86 0.9300 .
C85 C84 1.3900 .
C85 H85 0.9300 .
C84 C83 1.3900 .
C84 H84 0.9300 .
C83 C82 1.3900 .
C83 H83 0.9300 .
C82 H82 0.9300 .
C87 C92 1.34(2) .
C87 C88 1.39(2) .
C88 C89 1.33(2) .
C88 H88 0.9300 .
C89 C90 1.42(2) .
C89 H89 0.9300 .
C90 C91 1.40(2) .
C90 C127 1.48(2) .
C91 C92 1.37(2) .
C91 H91 0.9300 .
C92 H92 0.9300 .
C93 C94 1.3900 .
C93 C98 1.3900 .
C94 C95 1.3900 .
C94 H94 0.9300 .
C95 C96 1.3900 .
C95 H95 0.9300 .
C96 C97 1.3900 .
C96 H96 0.9300 .
C97 C98 1.3900 .
C97 H97 0.9300 .
C98 H98 0.9300 .
C99 C100 1.34(3) .
C99 C104 1.40(3) .
C100 C101 1.38(3) .
C100 H100 0.9300 .
C101 C102 1.38(3) .
C101 H101 0.9300 .
C102 C103 1.29(3) .
C102 H102 0.9300 .
C103 C104 1.40(3) .
C103 H103 0.9300 .
C104 H104 0.9300 .
C105 C106 1.39(2) .
C105 C110 1.40(2) .
C106 C107 1.35(3) .
C106 H106 0.9300 .
C107 C108 1.41(3) .
C107 H107 0.9300 .
C108 C109 1.38(2) .
C109 C110 1.40(2) .
C109 H109 0.9300 .
C110 H110 0.9300 .
C112 C113 1.3900 .
C112 C111 1.3900 .
C112 H112 0.9300 .
C113 C114 1.3900 .
C113 H113 0.9300 .
C114 C115 1.3900 .
C115 C116 1.3900 .
C115 H115 0.9300 .
C116 C111 1.3900 .
C116 H116 0.9300 .
C117 C118 1.44(3) .
C117 C120 1.49(3) .
C117 C119 1.57(3) .
C118 H11A 0.9600 .
C118 H11B 0.9600 .
C118 H11C 0.9600 .
C119 H11D 0.9600 .
C119 H11E 0.9600 .
C119 H11F 0.9600 .
C120 H12A 0.9600 .
C120 H12B 0.9600 .
C120 H12C 0.9600 .
C121 C122 1.49(2) .
C121 C123 1.56(3) .
C121 C124 1.58(3) .
C122 H12D 0.9600 .
C122 H12E 0.9600 .
C122 H12F 0.9600 .
C123 H12G 0.9600 .
C123 H12H 0.9600 .
C123 H12I 0.9600 .
C124 H12J 0.9600 .
C124 H12K 0.9600 .
C124 H12L 0.9600 .
C125 C61 1.39(2) 2_655
C125 C127 1.41(2) .
C125 H125 0.9300 .
C126 C128 1.39(2) 2_655
C126 C127 1.41(2) .
C126 H126 0.9300 .
C128 C126 1.39(2) 2_655
P7 F1 1.537(16) .
P7 F4 1.552(13) 2_656
P7 F4 1.552(13) .
P7 F2 1.586(16) .
P7 F3 1.605(13) 2_656
P7 F3 1.605(13) .
P8 F5 1.533(16) .
P8 F8 1.533(16) .
P8 F7 1.545(15) .
P8 F6 1.572(16) .
P8 F10 1.611(15) .
P8 F9 1.629(15) .
P9 F12 1.520(16) .
P9 F15 1.525(18) .
P9 F16 1.540(16) .
P9 F13 1.547(18) .
P9 F11 1.574(17) .
P9 F14 1.577(17) .
C129 Cl1 1.692(17) .
C129 Cl2 1.720(17) .
C129 H12M 0.9700 .
C129 H12N 0.9700 .
C130 Cl4 1.65(11) .
C130 Cl3 1.89(10) .
C130 H13C 0.9700 .
C130 H13D 0.9700 .
C131 Cl5 1.69(3) .
C131 Cl6 1.74(3) .
C131 H13E 0.9700 .
C131 H13F 0.9700 .
C132 Cl7 1.47(3) .
C132 Cl7 1.47(3) 2_655
C132 H13G 0.9700 .
C132 H13H 0.9700 .
Cl8 Cl9 1.20(11) 2_655
Cl8 C134 1.69(2) .
Cl8 C133 1.71(2) .
Cl9 Cl8 1.20(11) 2_655
Cl9 C133 1.69(2) .
Cl9 C134 1.70(2) .
C133 Cl9 1.69(2) 2_655
C133 Cl8 1.71(2) 2_655
C134 Cl8 1.69(2) 2_655
C134 Cl9 1.70(2) 2_655
Cl10 C135 1.67(2) .
C135 Cl11 1.68(2) .
C135 H13A 0.9700 .
C135 H13B 0.9700 .
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.045 0.095 0.621 7 1 ' '
2 0.045 0.905 0.121 7 1 ' '
3 0.239 0.485 0.791 91 16 ' '
4 0.239 0.515 0.291 91 16 ' '
5 0.261 0.015 0.209 91 16 ' '
6 0.261 0.985 0.709 91 16 ' '
7 0.455 0.405 0.379 7 1 ' '
8 0.455 0.595 0.879 7 1 ' '
9 0.545 0.405 0.121 7 1 ' '
10 0.545 0.595 0.621 7 1 ' '
11 0.739 0.015 0.291 91 16 ' '
12 0.739 0.985 0.791 91 16 ' '
13 0.761 0.485 0.709 91 16 ' '
14 0.761 0.515 0.209 91 16 ' '
15 0.955 0.095 0.879 7 1 ' '
16 0.955 0.905 0.379 7 1 ' '
