#------------------------------------------------------------------------------
#$Date: 2022-04-09 02:03:27 +0300 (Sat, 09 Apr 2022) $
#$Revision: 274441 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/70/99/7709949.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_7709949
loop_
_publ_author_name
'Schulz, Jiří'
'Císařová, Ivana'
'Gyepes, Róbert'
'Štěpnička, Petr'
_publ_section_title
;
 Metallation of a gold(I) metalloligand with P,C-bridging
 phosphinoferrocenyl groups enables the construction of defined
 multimetallic arrays.
;
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_paper_doi               10.1039/d2dt00850e
_journal_year                    2022
_chemical_formula_moiety         'C80 H102 Au4 Fe2 P4, 2(F6 Sb), 2(C6 H5 F)'
_chemical_formula_sum            'C92 H112 Au4 F14 Fe2 P4 Sb2'
_chemical_formula_weight         2750.76
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2017/1
_audit_update_record
;
2021-11-27 deposited with the CCDC.	2022-03-25 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 98.5330(10)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.3175(6)
_cell_length_b                   16.1547(6)
_cell_length_c                   37.8665(14)
_cell_measurement_reflns_used    9927
_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      27.46
_cell_measurement_theta_min      2.26
_cell_volume                     9266.3(6)
_computing_cell_refinement       'SAINT V8.40A (Bruker Nano, Inc., 2019)'
_computing_data_collection       'Bruker Instrument Service vV6.2.14'
_computing_data_reduction        'SAINT V8.40A (Bruker Nano, Inc., 2019)'
_computing_molecular_graphics    'PLATON (Spek, 2017)'
_computing_publication_material  'PLATON (Spek, 2017)'
_computing_structure_refinement  'SHELXL-2017/1 (Sheldrick, 2017)'
_computing_structure_solution    'XT, VERSION 2014/5'
_diffrn_ambient_temperature      120(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type
'Bruker D8 VENTURE Kappa Duo with PHOTON 1000'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  'Quazar Mo multilayer optic'
_diffrn_radiation_source         'I\mS micro-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0514
_diffrn_reflns_av_unetI/netI     0.0307
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.988
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       49
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            21734
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.988
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.528
_diffrn_reflns_theta_min         1.954
_exptl_absorpt_coefficient_mu    7.326
_exptl_absorpt_correction_T_max  0.72
_exptl_absorpt_correction_T_min  0.56
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'TWINABS - Bruker AXS scaling for twinned crystals - Version 2012/1'
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.972
_exptl_crystal_description       bar
_exptl_crystal_F_000             5280
_exptl_crystal_size_max          0.13
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.318
_refine_diff_density_min         -1.166
_refine_diff_density_rms         0.152
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.160
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1064
_refine_ls_number_reflns         21734
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.160
_refine_ls_R_factor_all          0.0366
_refine_ls_R_factor_gt           0.0321
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0148P)²+56.0900P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0669
_refine_ls_wR_factor_ref         0.0695
_reflns_Friedel_coverage         0.000
_reflns_number_gt                20412
_reflns_number_total             21734
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d2dt00850e3.cif
_cod_data_source_block           js629
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7709949
_shelx_shelxl_version_number     2017/1
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.449
_shelx_estimated_absorpt_t_max   0.711
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 0.37304(2) 0.81723(2) 0.70166(2) 0.01293(4) Uani 1 1 d . . . . .
Au2 Au 0.58099(2) 0.72799(2) 0.69853(2) 0.01222(4) Uani 1 1 d . . . . .
Au3 Au 0.28408(2) 0.82292(2) 0.63208(2) 0.01531(5) Uani 1 1 d . . . . .
Au4 Au 0.61493(2) 0.72706(2) 0.62867(2) 0.01561(5) Uani 1 1 d . . . . .
Fe1 Fe 0.34070(5) 0.64089(5) 0.71308(2) 0.01256(15) Uani 1 1 d . . . . .
Fe2 Fe 0.62675(5) 0.90068(5) 0.71367(2) 0.01248(15) Uani 1 1 d . . . . .
P1 P 0.55927(9) 0.62184(9) 0.73577(4) 0.0115(3) Uani 1 1 d . . . . .
P2 P 0.42740(9) 0.92038(9) 0.73977(4) 0.0128(3) Uani 1 1 d . . . . .
P3 P 0.22926(10) 0.91321(9) 0.58773(4) 0.0158(3) Uani 1 1 d . . . . .
P4 P 0.64158(10) 0.64043(9) 0.58361(4) 0.0156(3) Uani 1 1 d . . . . .
C1 C 0.3129(4) 0.7210(4) 0.66847(14) 0.0165(11) Uani 1 1 d . . . . .
C2 C 0.2335(4) 0.6831(4) 0.67848(15) 0.0183(12) Uani 1 1 d . . . . .
H2 H 0.185175 0.712381 0.685576 0.022 Uiso 1 1 calc R U . . .
C3 C 0.2396(4) 0.5963(4) 0.67596(16) 0.0205(12) Uani 1 1 d . . . . .
H3 H 0.196123 0.557399 0.680498 0.025 Uiso 1 1 calc R U . . .
C4 C 0.3234(4) 0.5772(4) 0.66534(15) 0.0191(12) Uani 1 1 d . . . . .
H4 H 0.345246 0.523276 0.661820 0.023 Uiso 1 1 calc R U . . .
C5 C 0.3680(4) 0.6527(4) 0.66097(14) 0.0171(11) Uani 1 1 d . . . . .
H5 H 0.425060 0.657423 0.654180 0.020 Uiso 1 1 calc R U . . .
C6 C 0.4529(3) 0.6190(3) 0.74962(14) 0.0113(10) Uani 1 1 d . . . . .
C7 C 0.4066(3) 0.6890(4) 0.76142(14) 0.0133(10) Uani 1 1 d . . . . .
H7 H 0.430292 0.742885 0.766089 0.016 Uiso 1 1 calc R U . . .
C8 C 0.3183(4) 0.6634(4) 0.76492(15) 0.0192(12) Uani 1 1 d . . . . .
H8 H 0.273077 0.697713 0.771555 0.023 Uiso 1 1 calc R U . . .
C9 C 0.3111(4) 0.5778(4) 0.75667(15) 0.0174(12) Uani 1 1 d . . . . .
H9 H 0.260152 0.544510 0.757278 0.021 Uiso 1 1 calc R U . . .
C10 C 0.3938(4) 0.5498(4) 0.74723(14) 0.0144(11) Uani 1 1 d . . . . .
H10 H 0.406979 0.494980 0.740574 0.017 Uiso 1 1 calc R U . . .
C11 C 0.6419(4) 0.6339(3) 0.77559(14) 0.0149(11) Uani 1 1 d . . . . .
C12 C 0.6222(4) 0.6370(4) 0.80972(15) 0.0204(12) Uani 1 1 d . . . . .
H12 H 0.563801 0.626055 0.814039 0.024 Uiso 1 1 calc R U . . .
C13 C 0.6885(5) 0.6563(4) 0.83828(17) 0.0299(15) Uani 1 1 d . . . . .
H13 H 0.674570 0.659731 0.861867 0.036 Uiso 1 1 calc R U . . .
C14 C 0.7727(5) 0.6702(4) 0.83216(18) 0.0298(15) Uani 1 1 d . . . . .
H14 H 0.817440 0.683118 0.851553 0.036 Uiso 1 1 calc R U . . .
C15 C 0.7934(4) 0.6657(4) 0.79794(18) 0.0250(14) Uani 1 1 d . . . . .
H15 H 0.852559 0.674417 0.794003 0.030 Uiso 1 1 calc R U . . .
C16 C 0.7287(4) 0.6486(4) 0.76939(17) 0.0203(12) Uani 1 1 d . . . . .
H16 H 0.742787 0.646857 0.745797 0.024 Uiso 1 1 calc R U . . .
C17 C 0.5690(4) 0.5178(3) 0.71934(14) 0.0141(11) Uani 1 1 d . . . . .
C18 C 0.5643(4) 0.5051(4) 0.68264(15) 0.0186(12) Uani 1 1 d . . . . .
H18 H 0.562361 0.551295 0.667015 0.022 Uiso 1 1 calc R U . . .
C19 C 0.5623(5) 0.4256(4) 0.66886(18) 0.0271(14) Uani 1 1 d . . . . .
H19 H 0.556872 0.417196 0.643799 0.033 Uiso 1 1 calc R U . . .
C20 C 0.5683(4) 0.3586(4) 0.69176(17) 0.0246(13) Uani 1 1 d . . . . .
H20 H 0.567426 0.304019 0.682329 0.030 Uiso 1 1 calc R U . . .
C21 C 0.5755(4) 0.3702(4) 0.72859(17) 0.0214(13) Uani 1 1 d . . . . .
H21 H 0.580007 0.323737 0.744150 0.026 Uiso 1 1 calc R U . . .
C22 C 0.5762(4) 0.4501(3) 0.74250(15) 0.0159(11) Uani 1 1 d . . . . .
H22 H 0.581582 0.458388 0.767560 0.019 Uiso 1 1 calc R U . . .
C31 C 0.6167(4) 0.8268(4) 0.66652(13) 0.0165(11) Uani 1 1 d . . . . .
C32 C 0.7040(4) 0.8618(4) 0.67669(15) 0.0153(11) Uani 1 1 d . . . . .
H32 H 0.756911 0.830778 0.682572 0.018 Uiso 1 1 calc R U . . .
C33 C 0.6983(4) 0.9489(4) 0.67650(16) 0.0187(12) Uani 1 1 d . . . . .
H33 H 0.746339 0.986421 0.681443 0.022 Uiso 1 1 calc R U . . .
C34 C 0.6071(4) 0.9706(4) 0.66752(14) 0.0178(12) Uani 1 1 d . . . . .
H34 H 0.583876 1.025206 0.665673 0.021 Uiso 1 1 calc R U . . .
C35 C 0.5577(4) 0.8968(3) 0.66190(14) 0.0162(11) Uani 1 1 d . . . . .
H35 H 0.495309 0.893755 0.655999 0.019 Uiso 1 1 calc R U . . .
C36 C 0.5456(4) 0.9195(3) 0.75160(14) 0.0140(11) Uani 1 1 d . . . . .
C37 C 0.5979(4) 0.8476(3) 0.76110(14) 0.0149(11) Uani 1 1 d . . . . .
H37 H 0.575803 0.793553 0.764266 0.018 Uiso 1 1 calc R U . . .
C38 C 0.6882(4) 0.8699(4) 0.76502(15) 0.0175(12) Uani 1 1 d . . . . .
H38 H 0.737068 0.833796 0.771061 0.021 Uiso 1 1 calc R U . . .
C39 C 0.6925(4) 0.9563(4) 0.75829(16) 0.0211(13) Uani 1 1 d . . . . .
H39 H 0.745066 0.987899 0.759006 0.025 Uiso 1 1 calc R U . . .
C40 C 0.6056(4) 0.9874(4) 0.75036(14) 0.0154(11) Uani 1 1 d . . . . .
H40 H 0.589640 1.043336 0.745124 0.018 Uiso 1 1 calc R U . . .
C41 C 0.3822(4) 0.9090(3) 0.78126(15) 0.0156(11) Uani 1 1 d . . . . .
C42 C 0.2931(4) 0.8878(4) 0.77961(17) 0.0235(13) Uani 1 1 d . . . . .
H42 H 0.257097 0.883175 0.757016 0.028 Uiso 1 1 calc R U . . .
C43 C 0.2569(5) 0.8737(4) 0.81018(19) 0.0278(15) Uani 1 1 d . . . . .
H43 H 0.196257 0.859627 0.808615 0.033 Uiso 1 1 calc R U . . .
C44 C 0.3090(5) 0.8800(4) 0.84325(19) 0.0325(16) Uani 1 1 d . . . . .
H44 H 0.283856 0.869835 0.864326 0.039 Uiso 1 1 calc R U . . .
C45 C 0.3975(5) 0.9010(4) 0.84582(17) 0.0293(15) Uani 1 1 d . . . . .
H45 H 0.433121 0.905431 0.868521 0.035 Uiso 1 1 calc R U . . .
C46 C 0.4334(4) 0.9156(4) 0.81487(15) 0.0202(12) Uani 1 1 d . . . . .
H46 H 0.493919 0.930349 0.816562 0.024 Uiso 1 1 calc R U . . .
C47 C 0.4078(3) 1.0257(3) 0.72473(15) 0.0136(11) Uani 1 1 d . . . . .
C48 C 0.4222(4) 1.0925(4) 0.74836(16) 0.0190(12) Uani 1 1 d . . . . .
H48 H 0.433818 1.083040 0.773379 0.023 Uiso 1 1 calc R U . . .
C49 C 0.4193(4) 1.1724(4) 0.73517(17) 0.0222(13) Uani 1 1 d . . . . .
H49 H 0.429365 1.217736 0.751220 0.027 Uiso 1 1 calc R U . . .
C50 C 0.4019(4) 1.1869(4) 0.69865(18) 0.0251(13) Uani 1 1 d . . . . .
H50 H 0.401325 1.242014 0.689826 0.030 Uiso 1 1 calc R U . . .
C51 C 0.3853(4) 1.1214(4) 0.67512(16) 0.0225(13) Uani 1 1 d . . . . .
H51 H 0.372144 1.131589 0.650186 0.027 Uiso 1 1 calc R U . . .
C52 C 0.3879(4) 1.0401(4) 0.68800(16) 0.0190(12) Uani 1 1 d . . . . .
H52 H 0.376121 0.994945 0.671906 0.023 Uiso 1 1 calc R U . . .
C61 C 0.3124(4) 0.9443(4) 0.56013(15) 0.0179(12) Uani 1 1 d . . . . .
H61 H 0.284076 0.983180 0.541285 0.022 Uiso 1 1 calc R U . . .
C62 C 0.3480(4) 0.8694(4) 0.54159(16) 0.0220(13) Uani 1 1 d . . . . .
H62A H 0.371376 0.827898 0.559799 0.026 Uiso 1 1 calc R U . . .
H62B H 0.299077 0.843420 0.525320 0.026 Uiso 1 1 calc R U . . .
C63 C 0.4211(4) 0.8947(4) 0.52028(17) 0.0267(14) Uani 1 1 d . . . . .
H63A H 0.444171 0.844874 0.509558 0.032 Uiso 1 1 calc R U . . .
H63B H 0.396507 0.932279 0.500652 0.032 Uiso 1 1 calc R U . . .
C64 C 0.4964(4) 0.9382(4) 0.54423(19) 0.0287(15) Uani 1 1 d . . . . .
H64A H 0.523692 0.899460 0.562941 0.034 Uiso 1 1 calc R U . . .
H64B H 0.542235 0.955237 0.529828 0.034 Uiso 1 1 calc R U . . .
C65 C 0.4619(4) 1.0136(5) 0.56154(19) 0.0305(15) Uani 1 1 d . . . . .
H65A H 0.438984 1.054172 0.542846 0.037 Uiso 1 1 calc R U . . .
H65B H 0.510868 1.040091 0.577604 0.037 Uiso 1 1 calc R U . . .
C66 C 0.3879(4) 0.9900(4) 0.58306(16) 0.0231(13) Uani 1 1 d . . . . .
H66A H 0.412624 0.954317 0.603364 0.028 Uiso 1 1 calc R U . . .
H66B H 0.364625 1.040812 0.592917 0.028 Uiso 1 1 calc R U . . .
C67 C 0.1944(4) 1.0086(4) 0.60815(15) 0.0193(12) Uani 1 1 d . . . . .
H67 H 0.248580 1.030817 0.623156 0.023 Uiso 1 1 calc R U . . .
C68 C 0.1595(5) 1.0785(4) 0.58312(17) 0.0288(15) Uani 1 1 d . . . . .
H68A H 0.104282 1.060434 0.568158 0.035 Uiso 1 1 calc R U . . .
H68B H 0.203225 1.091181 0.567065 0.035 Uiso 1 1 calc R U . . .
C69 C 0.1416(6) 1.1564(4) 0.6036(2) 0.0358(17) Uani 1 1 d . . . . .
H69A H 0.116012 1.199459 0.586484 0.043 Uiso 1 1 calc R U . . .
H69B H 0.197905 1.177929 0.616527 0.043 Uiso 1 1 calc R U . . .
C70 C 0.0779(5) 1.1392(5) 0.6303(2) 0.0352(16) Uani 1 1 d . . . . .
H70A H 0.018983 1.125169 0.617153 0.042 Uiso 1 1 calc R U . . .
H70B H 0.071873 1.189524 0.644612 0.042 Uiso 1 1 calc R U . . .
C71 C 0.1117(5) 1.0675(5) 0.65513(19) 0.0369(18) Uani 1 1 d . . . . .
H71A H 0.167102 1.084308 0.670293 0.044 Uiso 1 1 calc R U . . .
H71B H 0.067560 1.054861 0.671009 0.044 Uiso 1 1 calc R U . . .
C72 C 0.1286(5) 0.9899(5) 0.63423(18) 0.0326(16) Uani 1 1 d . . . . .
H72A H 0.072234 0.969923 0.620700 0.039 Uiso 1 1 calc R U . . .
H72B H 0.152668 0.945745 0.651027 0.039 Uiso 1 1 calc R U . . .
C73 C 0.1325(4) 0.8699(4) 0.55908(15) 0.0203(12) Uani 1 1 d . . . . .
H73 H 0.080638 0.880223 0.571716 0.024 Uiso 1 1 calc R U . . .
C74 C 0.1108(4) 0.9112(4) 0.52224(16) 0.0246(14) Uani 1 1 d . . . . .
H74A H 0.105177 0.971727 0.525212 0.029 Uiso 1 1 calc R U . . .
H74B H 0.159289 0.900876 0.508196 0.029 Uiso 1 1 calc R U . . .
C75 C 0.0242(4) 0.8764(5) 0.50221(18) 0.0304(15) Uani 1 1 d . . . . .
H75A H -0.024764 0.889354 0.515667 0.037 Uiso 1 1 calc R U . . .
H75B H 0.011193 0.902926 0.478452 0.037 Uiso 1 1 calc R U . . .
C76 C 0.0303(5) 0.7835(5) 0.49765(18) 0.0317(16) Uani 1 1 d . . . . .
H76A H 0.076297 0.770774 0.482638 0.038 Uiso 1 1 calc R U . . .
H76B H -0.026745 0.762226 0.485298 0.038 Uiso 1 1 calc R U . . .
C77 C 0.0530(5) 0.7408(5) 0.53369(18) 0.0340(17) Uani 1 1 d . . . . .
H77A H 0.059867 0.680643 0.529937 0.041 Uiso 1 1 calc R U . . .
H77B H 0.003902 0.748681 0.547685 0.041 Uiso 1 1 calc R U . . .
C78 C 0.1388(4) 0.7756(4) 0.55485(17) 0.0252(14) Uani 1 1 d . . . . .
H78A H 0.149627 0.749342 0.578726 0.030 Uiso 1 1 calc R U . . .
H78B H 0.189089 0.762094 0.542206 0.030 Uiso 1 1 calc R U . . .
C81 C 0.6919(4) 0.5447(4) 0.60375(15) 0.0202(12) Uani 1 1 d . . . . .
H81 H 0.646862 0.519307 0.617011 0.024 Uiso 1 1 calc R U . . .
C82 C 0.7721(5) 0.5642(4) 0.63195(17) 0.0311(15) Uani 1 1 d . . . . .
H82A H 0.819266 0.589544 0.620282 0.037 Uiso 1 1 calc R U . . .
H82B H 0.754919 0.604445 0.649430 0.037 Uiso 1 1 calc R U . . .
C83 C 0.8067(5) 0.4847(5) 0.65137(19) 0.0363(17) Uani 1 1 d . . . . .
H83A H 0.860002 0.497979 0.668598 0.044 Uiso 1 1 calc R U . . .
H83B H 0.761333 0.463012 0.665031 0.044 Uiso 1 1 calc R U . . .
C84 C 0.8294(5) 0.4183(5) 0.6259(2) 0.0386(18) Uani 1 1 d . . . . .
H84A H 0.848592 0.367451 0.639388 0.046 Uiso 1 1 calc R U . . .
H84B H 0.878834 0.437557 0.613788 0.046 Uiso 1 1 calc R U . . .
C85 C 0.7496(5) 0.3992(4) 0.5981(2) 0.0393(18) Uani 1 1 d . . . . .
H85A H 0.702202 0.375195 0.610023 0.047 Uiso 1 1 calc R U . . .
H85B H 0.766097 0.357805 0.580970 0.047 Uiso 1 1 calc R U . . .
C86 C 0.7151(5) 0.4778(4) 0.57773(18) 0.0277(14) Uani 1 1 d . . . . .
H86A H 0.661979 0.464091 0.560484 0.033 Uiso 1 1 calc R U . . .
H86B H 0.760724 0.499299 0.564139 0.033 Uiso 1 1 calc R U . . .
C87 C 0.7206(4) 0.6895(4) 0.55774(14) 0.0180(12) Uani 1 1 d . . . . .
H87 H 0.780386 0.679932 0.571760 0.022 Uiso 1 1 calc R U . . .
C88 C 0.7240(4) 0.6524(4) 0.52052(15) 0.0224(13) Uani 1 1 d . . . . .
H88A H 0.735861 0.592199 0.522756 0.027 Uiso 1 1 calc R U . . .
H88B H 0.666138 0.660064 0.505320 0.027 Uiso 1 1 calc R U . . .
C89 C 0.7965(5) 0.6943(4) 0.50292(17) 0.0296(15) Uani 1 1 d . . . . .
H89A H 0.854877 0.682645 0.517085 0.035 Uiso 1 1 calc R U . . .
H89B H 0.796280 0.671375 0.478662 0.035 Uiso 1 1 calc R U . . .
C90 C 0.7819(5) 0.7880(5) 0.50046(17) 0.0306(16) Uani 1 1 d . . . . .
H90A H 0.830384 0.813869 0.489725 0.037 Uiso 1 1 calc R U . . .
H90B H 0.725793 0.799653 0.484663 0.037 Uiso 1 1 calc R U . . .
C91 C 0.7788(5) 0.8258(5) 0.53694(18) 0.0312(15) Uani 1 1 d . . . . .
H91A H 0.765691 0.885668 0.534218 0.037 Uiso 1 1 calc R U . . .
H91B H 0.837167 0.819668 0.551882 0.037 Uiso 1 1 calc R U . . .
C92 C 0.7086(5) 0.7844(4) 0.55556(17) 0.0278(14) Uani 1 1 d . . . . .
H92A H 0.649423 0.797313 0.542355 0.033 Uiso 1 1 calc R U . . .
H92B H 0.711723 0.807124 0.579989 0.033 Uiso 1 1 calc R U . . .
C93 C 0.5431(4) 0.6083(4) 0.55299(15) 0.0195(12) Uani 1 1 d . . . . .
H93 H 0.562070 0.570244 0.534714 0.023 Uiso 1 1 calc R U . . .
C94 C 0.4959(4) 0.6826(4) 0.53364(16) 0.0219(12) Uani 1 1 d . . . . .
H94A H 0.536460 0.710892 0.519479 0.026 Uiso 1 1 calc R U . . .
H94B H 0.479792 0.722444 0.551452 0.026 Uiso 1 1 calc R U . . .
C95 C 0.4116(4) 0.6554(5) 0.50858(19) 0.0311(16) Uani 1 1 d . . . . .
H95A H 0.381433 0.704913 0.497184 0.037 Uiso 1 1 calc R U . . .
H95B H 0.428336 0.619547 0.489467 0.037 Uiso 1 1 calc R U . . .
C96 C 0.3486(4) 0.6086(5) 0.5290(2) 0.0366(18) Uani 1 1 d . . . . .
H96A H 0.327192 0.645959 0.546551 0.044 Uiso 1 1 calc R U . . .
H96B H 0.296938 0.589313 0.512137 0.044 Uiso 1 1 calc R U . . .
C97 C 0.3954(5) 0.5347(4) 0.5482(2) 0.0339(16) Uani 1 1 d . . . . .
H97A H 0.411842 0.495056 0.530357 0.041 Uiso 1 1 calc R U . . .
H97B H 0.354612 0.506199 0.562157 0.041 Uiso 1 1 calc R U . . .
C98 C 0.4791(4) 0.5611(4) 0.57347(17) 0.0263(14) Uani 1 1 d . . . . .
H98A H 0.462361 0.596841 0.592593 0.032 Uiso 1 1 calc R U . . .
H98B H 0.508985 0.511340 0.584805 0.032 Uiso 1 1 calc R U . . .
Sb1 Sb -0.03553(3) 0.77967(3) 0.66171(2) 0.02603(9) Uani 1 1 d . . . . .
F1 F 0.0315(4) 0.8012(4) 0.62575(14) 0.0724(18) Uani 1 1 d . . . . .
F2 F 0.0033(3) 0.6697(3) 0.66366(14) 0.0535(13) Uani 1 1 d . . . . .
F3 F 0.0608(3) 0.8079(3) 0.69628(12) 0.0470(12) Uani 1 1 d . . . . .
F4 F -0.0727(3) 0.8895(3) 0.66194(15) 0.0581(14) Uani 1 1 d . . . . .
F5 F -0.1321(4) 0.7531(4) 0.62774(13) 0.0716(18) Uani 1 1 d . . . . .
F6 F -0.1021(3) 0.7550(3) 0.69804(12) 0.0470(12) Uani 1 1 d . . . . .
Sb2 Sb 0.43666(3) 0.27148(3) 0.58828(2) 0.02791(10) Uani 1 1 d . . . . .
F7 F 0.4050(3) 0.3160(3) 0.63043(11) 0.0409(10) Uani 1 1 d . . . . .
F8 F 0.3505(3) 0.1891(3) 0.58863(11) 0.0382(10) Uani 1 1 d . . . . .
F9 F 0.3531(4) 0.3405(3) 0.56202(12) 0.0542(14) Uani 1 1 d . . . . .
F10 F 0.5233(3) 0.3534(3) 0.58784(11) 0.0466(12) Uani 1 1 d . . . . .
F11 F 0.5192(3) 0.2033(3) 0.61608(13) 0.0488(12) Uani 1 1 d . . . . .
F12 F 0.4665(4) 0.2269(3) 0.54637(12) 0.0561(14) Uani 1 1 d . . . . .
F1S F 0.7598(4) 1.2076(4) 0.54467(15) 0.0710(17) Uani 1 1 d . . . . .
C1S C 0.7675(6) 1.1366(5) 0.5630(2) 0.0428(19) Uani 1 1 d . . . . .
C2S C 0.6933(5) 1.1011(6) 0.5733(2) 0.044(2) Uani 1 1 d . . . . .
H2S H 0.637341 1.127627 0.569196 0.052 Uiso 1 1 calc R U . . .
C3S C 0.7048(5) 1.0241(5) 0.59003(17) 0.0329(17) Uani 1 1 d . . . . .
H3S H 0.654796 0.995378 0.595961 0.040 Uiso 1 1 calc R U . . .
C4S C 0.7872(6) 0.9888(5) 0.5981(2) 0.0417(19) Uani 1 1 d . . . . .
H4S H 0.793658 0.939146 0.611685 0.050 Uiso 1 1 calc R U . . .
C5S C 0.8612(7) 1.0242(6) 0.5869(2) 0.056(2) Uani 1 1 d . . . . .
H5S H 0.916993 0.997378 0.590499 0.067 Uiso 1 1 calc R U . . .
C6S C 0.8495(6) 1.1011(6) 0.5700(2) 0.046(2) Uani 1 1 d . . . . .
H6S H 0.898992 1.129106 0.563250 0.056 Uiso 1 1 calc R U . . .
F2S F -0.0908(4) 0.4770(5) 0.54130(16) 0.087(2) Uani 1 1 d . . . . .
C7S C -0.0079(5) 0.4994(6) 0.5558(2) 0.047(2) Uani 1 1 d . . . . .
C8S C 0.0014(6) 0.5582(6) 0.5817(2) 0.045(2) Uani 1 1 d . . . . .
H8S H -0.048626 0.582849 0.589551 0.054 Uiso 1 1 calc R U . . .
C9S C 0.0862(6) 0.5810(5) 0.5961(2) 0.0386(18) Uani 1 1 d . . . . .
H9S H 0.094680 0.621816 0.614347 0.046 Uiso 1 1 calc R U . . .
C10S C 0.1588(5) 0.5453(5) 0.58447(19) 0.0343(16) Uani 1 1 d . . . . .
H10S H 0.216688 0.562664 0.594113 0.041 Uiso 1 1 calc R U . . .
C11S C 0.1467(5) 0.4843(6) 0.5587(2) 0.049(2) Uani 1 1 d . . . . .
H11S H 0.196295 0.458243 0.551147 0.059 Uiso 1 1 calc R U . . .
C12S C 0.0617(6) 0.4608(7) 0.5439(2) 0.057(3) Uani 1 1 d . . . . .
H12S H 0.052316 0.419179 0.526052 0.068 Uiso 1 1 calc R U . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 '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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Fe Fe 0.3463 0.8444 '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'
Sb Sb -0.5866 1.5461 '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
_geom_angle_publ_flag
C1 Au1 P2 175.14(17) . . ?
C1 Au1 Au3 49.82(14) . . ?
P2 Au1 Au3 131.06(4) . . ?
C1 Au1 Fe1 46.21(14) . . ?
P2 Au1 Fe1 132.08(4) . . ?
Au3 Au1 Fe1 95.854(17) . . ?
C31 Au2 P1 173.42(16) . . ?
C31 Au2 Au4 50.10(15) . . ?
P1 Au2 Au4 130.77(4) . . ?
C31 Au2 Fe2 46.99(15) . . ?
P1 Au2 Fe2 130.75(4) . . ?
Au4 Au2 Fe2 96.854(17) . . ?
C1 Au3 P3 167.59(15) . . ?
C1 Au3 Au1 48.91(14) . . ?
P3 Au3 Au1 142.28(4) . . ?
C31 Au4 P4 165.25(16) . . ?
C31 Au4 Au2 49.16(15) . . ?
P4 Au4 Au2 142.57(4) . . ?
C10 Fe1 C9 41.2(2) . . ?
C10 Fe1 C2 147.7(2) . . ?
C9 Fe1 C2 115.2(2) . . ?
C10 Fe1 C3 111.6(2) . . ?
C9 Fe1 C3 98.1(2) . . ?
C2 Fe1 C3 40.0(2) . . ?
C10 Fe1 C4 100.5(2) . . ?
C9 Fe1 C4 116.3(2) . . ?
C2 Fe1 C4 67.7(2) . . ?
C3 Fe1 C4 40.7(2) . . ?
C10 Fe1 C6 40.7(2) . . ?
C9 Fe1 C6 68.8(2) . . ?
C2 Fe1 C6 170.5(2) . . ?
C3 Fe1 C6 149.5(2) . . ?
C4 Fe1 C6 119.1(2) . . ?
C10 Fe1 C8 68.6(2) . . ?
C9 Fe1 C8 40.3(2) . . ?
C2 Fe1 C8 108.4(2) . . ?
C3 Fe1 C8 119.6(2) . . ?
C4 Fe1 C8 154.0(2) . . ?
C6 Fe1 C8 68.6(2) . . ?
C10 Fe1 C5 123.1(2) . . ?
C9 Fe1 C5 155.2(2) . . ?
C2 Fe1 C5 67.7(2) . . ?
C3 Fe1 C5 67.8(2) . . ?
C4 Fe1 C5 40.0(2) . . ?
C6 Fe1 C5 112.6(2) . . ?
C8 Fe1 C5 164.5(2) . . ?
C10 Fe1 C7 67.8(2) . . ?
C9 Fe1 C7 67.5(2) . . ?
C2 Fe1 C7 131.7(2) . . ?
C3 Fe1 C7 159.7(2) . . ?
C4 Fe1 C7 158.4(2) . . ?
C6 Fe1 C7 40.4(2) . . ?
C8 Fe1 C7 40.3(2) . . ?
C5 Fe1 C7 130.7(2) . . ?
C10 Fe1 C1 163.0(2) . . ?
C9 Fe1 C1 154.7(2) . . ?
C2 Fe1 C1 40.9(2) . . ?
C3 Fe1 C1 68.2(2) . . ?
C4 Fe1 C1 67.8(2) . . ?
C6 Fe1 C1 133.2(2) . . ?
C8 Fe1 C1 127.2(2) . . ?
C5 Fe1 C1 40.1(2) . . ?
C7 Fe1 C1 118.8(2) . . ?
C10 Fe1 Au1 137.00(16) . . ?
C9 Fe1 Au1 131.66(17) . . ?
C2 Fe1 Au1 73.81(17) . . ?
C3 Fe1 Au1 111.42(17) . . ?
C4 Fe1 Au1 110.95(17) . . ?
C6 Fe1 Au1 97.05(15) . . ?
C8 Fe1 Au1 91.39(17) . . ?
C5 Fe1 Au1 73.15(16) . . ?
C7 Fe1 Au1 72.54(15) . . ?
C1 Fe1 Au1 46.25(15) . . ?
C40 Fe2 C39 40.6(2) . . ?
C40 Fe2 C36 41.1(2) . . ?
C39 Fe2 C36 68.4(2) . . ?
C40 Fe2 C33 111.2(2) . . ?
C39 Fe2 C33 98.7(2) . . ?
C36 Fe2 C33 149.2(2) . . ?
C40 Fe2 C32 147.2(2) . . ?
C39 Fe2 C32 115.7(2) . . ?
C36 Fe2 C32 170.7(2) . . ?
C33 Fe2 C32 40.0(2) . . ?
C40 Fe2 C34 100.6(2) . . ?
C39 Fe2 C34 116.8(2) . . ?
C36 Fe2 C34 118.9(2) . . ?
C33 Fe2 C34 40.6(2) . . ?
C32 Fe2 C34 67.6(2) . . ?
C40 Fe2 C35 123.6(2) . . ?
C39 Fe2 C35 155.5(2) . . ?
C36 Fe2 C35 112.7(2) . . ?
C33 Fe2 C35 67.4(2) . . ?
C32 Fe2 C35 67.3(2) . . ?
C34 Fe2 C35 39.7(2) . . ?
C40 Fe2 C38 67.9(2) . . ?
C39 Fe2 C38 40.2(2) . . ?
C36 Fe2 C38 67.7(2) . . ?
C33 Fe2 C38 120.9(2) . . ?
C32 Fe2 C38 109.5(2) . . ?
C34 Fe2 C38 155.0(2) . . ?
C35 Fe2 C38 164.3(2) . . ?
C40 Fe2 C37 67.7(2) . . ?
C39 Fe2 C37 67.2(2) . . ?
C36 Fe2 C37 40.2(2) . . ?
C33 Fe2 C37 160.2(2) . . ?
C32 Fe2 C37 132.3(2) . . ?
C34 Fe2 C37 157.9(2) . . ?
C35 Fe2 C37 130.6(2) . . ?
C38 Fe2 C37 39.5(2) . . ?
C40 Fe2 C31 163.4(2) . . ?
C39 Fe2 C31 154.6(2) . . ?
C36 Fe2 C31 133.7(2) . . ?
C33 Fe2 C31 67.7(2) . . ?
C32 Fe2 C31 40.4(2) . . ?
C34 Fe2 C31 67.3(2) . . ?
C35 Fe2 C31 40.0(2) . . ?
C38 Fe2 C31 127.7(2) . . ?
C37 Fe2 C31 119.3(2) . . ?
C40 Fe2 Au2 137.44(16) . . ?
C39 Fe2 Au2 131.23(18) . . ?
C36 Fe2 Au2 97.25(16) . . ?
C33 Fe2 Au2 111.37(17) . . ?
C32 Fe2 Au2 73.73(16) . . ?
C34 Fe2 Au2 110.90(17) . . ?
C35 Fe2 Au2 73.30(16) . . ?
C38 Fe2 Au2 91.01(17) . . ?
C37 Fe2 Au2 72.63(15) . . ?
C31 Fe2 Au2 46.69(15) . . ?
C6 P1 C17 101.7(3) . . ?
C6 P1 C11 108.1(3) . . ?
C17 P1 C11 107.5(3) . . ?
C6 P1 Au2 115.16(18) . . ?
C17 P1 Au2 117.44(18) . . ?
C11 P1 Au2 106.48(19) . . ?
C36 P2 C47 101.6(3) . . ?
C36 P2 C41 106.4(3) . . ?
C47 P2 C41 107.5(3) . . ?
C36 P2 Au1 114.27(18) . . ?
C47 P2 Au1 117.47(19) . . ?
C41 P2 Au1 108.86(19) . . ?
C61 P3 C67 106.2(3) . . ?
C61 P3 C73 109.6(3) . . ?
C67 P3 C73 107.9(3) . . ?
C61 P3 Au3 112.50(19) . . ?
C67 P3 Au3 108.86(19) . . ?
C73 P3 Au3 111.5(2) . . ?
C93 P4 C81 106.2(3) . . ?
C93 P4 C87 109.2(3) . . ?
C81 P4 C87 108.2(3) . . ?
C93 P4 Au4 115.0(2) . . ?
C81 P4 Au4 108.3(2) . . ?
C87 P4 Au4 109.68(19) . . ?
C5 C1 C2 105.3(5) . . ?
C5 C1 Fe1 68.7(3) . . ?
C2 C1 Fe1 67.3(3) . . ?
C5 C1 Au1 117.5(4) . . ?
C2 C1 Au1 117.3(4) . . ?
Fe1 C1 Au1 87.54(19) . . ?
C5 C1 Au3 122.0(4) . . ?
C2 C1 Au3 112.8(4) . . ?
Fe1 C1 Au3 167.3(3) . . ?
Au1 C1 Au3 81.3(2) . . ?
C3 C2 C1 109.4(5) . . ?
C3 C2 Fe1 70.0(3) . . ?
C1 C2 Fe1 71.8(3) . . ?
C3 C2 H2 125.3 . . ?
C1 C2 H2 125.3 . . ?
Fe1 C2 H2 124.5 . . ?
C2 C3 C4 107.7(5) . . ?
C2 C3 Fe1 70.0(3) . . ?
C4 C3 Fe1 69.7(3) . . ?
C2 C3 H3 126.1 . . ?
C4 C3 H3 126.1 . . ?
Fe1 C3 H3 125.8 . . ?
C5 C4 C3 108.3(5) . . ?
C5 C4 Fe1 70.9(3) . . ?
C3 C4 Fe1 69.6(3) . . ?
C5 C4 H4 125.8 . . ?
C3 C4 H4 125.8 . . ?
Fe1 C4 H4 125.3 . . ?
C4 C5 C1 109.2(5) . . ?
C4 C5 Fe1 69.1(3) . . ?
C1 C5 Fe1 71.2(3) . . ?
C4 C5 H5 125.4 . . ?
C1 C5 H5 125.4 . . ?
Fe1 C5 H5 125.8 . . ?
C10 C6 C7 107.3(5) . . ?
C10 C6 P1 126.6(4) . . ?
C7 C6 P1 125.8(4) . . ?
C10 C6 Fe1 68.7(3) . . ?
C7 C6 Fe1 71.0(3) . . ?
P1 C6 Fe1 120.2(3) . . ?
C8 C7 C6 108.4(5) . . ?
C8 C7 Fe1 68.8(3) . . ?
C6 C7 Fe1 68.6(3) . . ?
C8 C7 H7 125.8 . . ?
C6 C7 H7 125.8 . . ?
Fe1 C7 H7 128.4 . . ?
C9 C8 C7 107.7(5) . . ?
C9 C8 Fe1 68.9(3) . . ?
C7 C8 Fe1 71.0(3) . . ?
C9 C8 H8 126.2 . . ?
C7 C8 H8 126.2 . . ?
Fe1 C8 H8 125.6 . . ?
C8 C9 C10 108.5(5) . . ?
C8 C9 Fe1 70.9(3) . . ?
C10 C9 Fe1 69.4(3) . . ?
C8 C9 H9 125.7 . . ?
C10 C9 H9 125.7 . . ?
Fe1 C9 H9 125.6 . . ?
C6 C10 C9 108.1(5) . . ?
C6 C10 Fe1 70.5(3) . . ?
C9 C10 Fe1 69.4(3) . . ?
C6 C10 H10 126.0 . . ?
C9 C10 H10 126.0 . . ?
Fe1 C10 H10 125.6 . . ?
C12 C11 C16 119.8(5) . . ?
C12 C11 P1 124.0(5) . . ?
C16 C11 P1 115.9(4) . . ?
C11 C12 C13 120.0(6) . . ?
C11 C12 H12 120.0 . . ?
C13 C12 H12 120.0 . . ?
C14 C13 C12 120.0(6) . . ?
C14 C13 H13 120.0 . . ?
C12 C13 H13 120.0 . . ?
C13 C14 C15 120.4(6) . . ?
C13 C14 H14 119.8 . . ?
C15 C14 H14 119.8 . . ?
C14 C15 C16 120.4(6) . . ?
C14 C15 H15 119.8 . . ?
C16 C15 H15 119.8 . . ?
C15 C16 C11 119.3(6) . . ?
C15 C16 H16 120.3 . . ?
C11 C16 H16 120.3 . . ?
C18 C17 C22 119.9(5) . . ?
C18 C17 P1 119.0(4) . . ?
C22 C17 P1 121.0(4) . . ?
C19 C18 C17 120.4(6) . . ?
C19 C18 H18 119.8 . . ?
C17 C18 H18 119.8 . . ?
C20 C19 C18 119.7(6) . . ?
C20 C19 H19 120.2 . . ?
C18 C19 H19 120.2 . . ?
C19 C20 C21 120.7(6) . . ?
C19 C20 H20 119.7 . . ?
C21 C20 H20 119.7 . . ?
C22 C21 C20 119.8(5) . . ?
C22 C21 H21 120.1 . . ?
C20 C21 H21 120.1 . . ?
C21 C22 C17 119.5(5) . . ?
C21 C22 H22 120.2 . . ?
C17 C22 H22 120.2 . . ?
C35 C31 C32 105.2(5) . . ?
C35 C31 Au2 116.7(4) . . ?
C32 C31 Au2 116.5(4) . . ?
C35 C31 Fe2 68.2(3) . . ?
C32 C31 Fe2 67.1(3) . . ?
Au2 C31 Fe2 86.31(19) . . ?
C35 C31 Au4 124.1(4) . . ?
C32 C31 Au4 112.8(4) . . ?
Au2 C31 Au4 80.7(2) . . ?
Fe2 C31 Au4 165.3(3) . . ?
C33 C32 C31 109.5(5) . . ?
C33 C32 Fe2 70.0(3) . . ?
C31 C32 Fe2 72.5(3) . . ?
C33 C32 H32 125.3 . . ?
C31 C32 H32 125.3 . . ?
Fe2 C32 H32 123.9 . . ?
C32 C33 C34 107.7(5) . . ?
C32 C33 Fe2 70.0(3) . . ?
C34 C33 Fe2 69.8(3) . . ?
C32 C33 H33 126.2 . . ?
C34 C33 H33 126.2 . . ?
Fe2 C33 H33 125.6 . . ?
C35 C34 C33 108.2(5) . . ?
C35 C34 Fe2 70.9(3) . . ?
C33 C34 Fe2 69.6(3) . . ?
C35 C34 H34 125.9 . . ?
C33 C34 H34 125.9 . . ?
Fe2 C34 H34 125.2 . . ?
C34 C35 C31 109.4(5) . . ?
C34 C35 Fe2 69.3(3) . . ?
C31 C35 Fe2 71.8(3) . . ?
C34 C35 H35 125.3 . . ?
C31 C35 H35 125.3 . . ?
Fe2 C35 H35 125.1 . . ?
C37 C36 C40 107.0(5) . . ?
C37 C36 P2 125.2(4) . . ?
C40 C36 P2 127.6(4) . . ?
C37 C36 Fe2 71.4(3) . . ?
C40 C36 Fe2 68.5(3) . . ?
P2 C36 Fe2 121.1(3) . . ?
C38 C37 C36 108.8(5) . . ?
C38 C37 Fe2 70.0(3) . . ?
C36 C37 Fe2 68.4(3) . . ?
C38 C37 H37 125.6 . . ?
C36 C37 H37 125.6 . . ?
Fe2 C37 H37 127.5 . . ?
C37 C38 C39 107.6(5) . . ?
C37 C38 Fe2 70.4(3) . . ?
C39 C38 Fe2 68.1(3) . . ?
C37 C38 H38 126.2 . . ?
C39 C38 H38 126.2 . . ?
Fe2 C38 H38 126.9 . . ?
C40 C39 C38 108.6(5) . . ?
C40 C39 Fe2 69.3(3) . . ?
C38 C39 Fe2 71.7(3) . . ?
C40 C39 H39 125.7 . . ?
C38 C39 H39 125.7 . . ?
Fe2 C39 H39 124.9 . . ?
C39 C40 C36 108.0(5) . . ?
C39 C40 Fe2 70.1(3) . . ?
C36 C40 Fe2 70.3(3) . . ?
C39 C40 H40 126.0 . . ?
C36 C40 H40 126.0 . . ?
Fe2 C40 H40 125.1 . . ?
C46 C41 C42 118.1(5) . . ?
C46 C41 P2 123.1(4) . . ?
C42 C41 P2 118.7(5) . . ?
C43 C42 C41 121.0(6) . . ?
C43 C42 H42 119.5 . . ?
C41 C42 H42 119.5 . . ?
C42 C43 C44 120.0(6) . . ?
C42 C43 H43 120.0 . . ?
C44 C43 H43 120.0 . . ?
C43 C44 C45 120.4(6) . . ?
C43 C44 H44 119.8 . . ?
C45 C44 H44 119.8 . . ?
C46 C45 C44 119.2(6) . . ?
C46 C45 H45 120.4 . . ?
C44 C45 H45 120.4 . . ?
C45 C46 C41 121.2(6) . . ?
C45 C46 H46 119.4 . . ?
C41 C46 H46 119.4 . . ?
C52 C47 C48 119.9(5) . . ?
C52 C47 P2 118.1(4) . . ?
C48 C47 P2 121.5(4) . . ?
C49 C48 C47 119.7(6) . . ?
C49 C48 H48 120.1 . . ?
C47 C48 H48 120.1 . . ?
C48 C49 C50 120.6(6) . . ?
C48 C49 H49 119.7 . . ?
C50 C49 H49 119.7 . . ?
C51 C50 C49 120.1(6) . . ?
C51 C50 H50 119.9 . . ?
C49 C50 H50 119.9 . . ?
C50 C51 C52 120.1(6) . . ?
C50 C51 H51 120.0 . . ?
C52 C51 H51 120.0 . . ?
C47 C52 C51 119.5(6) . . ?
C47 C52 H52 120.2 . . ?
C51 C52 H52 120.2 . . ?
C66 C61 C62 110.5(5) . . ?
C66 C61 P3 109.8(4) . . ?
C62 C61 P3 111.6(4) . . ?
C66 C61 H61 108.3 . . ?
C62 C61 H61 108.3 . . ?
P3 C61 H61 108.3 . . ?
C63 C62 C61 111.5(5) . . ?
C63 C62 H62A 109.3 . . ?
C61 C62 H62A 109.3 . . ?
C63 C62 H62B 109.3 . . ?
C61 C62 H62B 109.3 . . ?
H62A C62 H62B 108.0 . . ?
C64 C63 C62 110.9(5) . . ?
C64 C63 H63A 109.5 . . ?
C62 C63 H63A 109.5 . . ?
C64 C63 H63B 109.5 . . ?
C62 C63 H63B 109.5 . . ?
H63A C63 H63B 108.0 . . ?
C65 C64 C63 110.2(6) . . ?
C65 C64 H64A 109.6 . . ?
C63 C64 H64A 109.6 . . ?
C65 C64 H64B 109.6 . . ?
C63 C64 H64B 109.6 . . ?
H64A C64 H64B 108.1 . . ?
C64 C65 C66 111.2(6) . . ?
C64 C65 H65A 109.4 . . ?
C66 C65 H65A 109.4 . . ?
C64 C65 H65B 109.4 . . ?
C66 C65 H65B 109.4 . . ?
H65A C65 H65B 108.0 . . ?
C61 C66 C65 111.9(5) . . ?
C61 C66 H66A 109.2 . . ?
C65 C66 H66A 109.2 . . ?
C61 C66 H66B 109.2 . . ?
C65 C66 H66B 109.2 . . ?
H66A C66 H66B 107.9 . . ?
C68 C67 C72 110.0(5) . . ?
C68 C67 P3 117.2(4) . . ?
C72 C67 P3 111.3(4) . . ?
C68 C67 H67 105.8 . . ?
C72 C67 H67 105.8 . . ?
P3 C67 H67 105.8 . . ?
C67 C68 C69 111.7(5) . . ?
C67 C68 H68A 109.3 . . ?
C69 C68 H68A 109.3 . . ?
C67 C68 H68B 109.3 . . ?
C69 C68 H68B 109.3 . . ?
H68A C68 H68B 107.9 . . ?
C68 C69 C70 111.5(6) . . ?
C68 C69 H69A 109.3 . . ?
C70 C69 H69A 109.3 . . ?
C68 C69 H69B 109.3 . . ?
C70 C69 H69B 109.3 . . ?
H69A C69 H69B 108.0 . . ?
C69 C70 C71 110.7(6) . . ?
C69 C70 H70A 109.5 . . ?
C71 C70 H70A 109.5 . . ?
C69 C70 H70B 109.5 . . ?
C71 C70 H70B 109.5 . . ?
H70A C70 H70B 108.1 . . ?
C72 C71 C70 111.7(6) . . ?
C72 C71 H71A 109.3 . . ?
C70 C71 H71A 109.3 . . ?
C72 C71 H71B 109.3 . . ?
C70 C71 H71B 109.3 . . ?
H71A C71 H71B 107.9 . . ?
C71 C72 C67 110.4(6) . . ?
C71 C72 H72A 109.6 . . ?
C67 C72 H72A 109.6 . . ?
C71 C72 H72B 109.6 . . ?
C67 C72 H72B 109.6 . . ?
H72A C72 H72B 108.1 . . ?
C78 C73 C74 110.1(5) . . ?
C78 C73 P3 112.4(4) . . ?
C74 C73 P3 114.6(4) . . ?
C78 C73 H73 106.4 . . ?
C74 C73 H73 106.4 . . ?
P3 C73 H73 106.4 . . ?
C75 C74 C73 110.2(5) . . ?
C75 C74 H74A 109.6 . . ?
C73 C74 H74A 109.6 . . ?
C75 C74 H74B 109.6 . . ?
C73 C74 H74B 109.6 . . ?
H74A C74 H74B 108.1 . . ?
C76 C75 C74 110.9(5) . . ?
C76 C75 H75A 109.5 . . ?
C74 C75 H75A 109.5 . . ?
C76 C75 H75B 109.5 . . ?
C74 C75 H75B 109.5 . . ?
H75A C75 H75B 108.1 . . ?
C75 C76 C77 110.9(6) . . ?
C75 C76 H76A 109.5 . . ?
C77 C76 H76A 109.5 . . ?
C75 C76 H76B 109.5 . . ?
C77 C76 H76B 109.5 . . ?
H76A C76 H76B 108.0 . . ?
C76 C77 C78 111.3(6) . . ?
C76 C77 H77A 109.4 . . ?
C78 C77 H77A 109.4 . . ?
C76 C77 H77B 109.4 . . ?
C78 C77 H77B 109.4 . . ?
H77A C77 H77B 108.0 . . ?
C73 C78 C77 110.7(5) . . ?
C73 C78 H78A 109.5 . . ?
C77 C78 H78A 109.5 . . ?
C73 C78 H78B 109.5 . . ?
C77 C78 H78B 109.5 . . ?
H78A C78 H78B 108.1 . . ?
C82 C81 C86 110.7(5) . . ?
C82 C81 P4 111.0(4) . . ?
C86 C81 P4 116.5(4) . . ?
C82 C81 H81 106.0 . . ?
C86 C81 H81 106.0 . . ?
P4 C81 H81 106.0 . . ?
C83 C82 C81 110.2(6) . . ?
C83 C82 H82A 109.6 . . ?
C81 C82 H82A 109.6 . . ?
C83 C82 H82B 109.6 . . ?
C81 C82 H82B 109.6 . . ?
H82A C82 H82B 108.1 . . ?
C84 C83 C82 112.5(6) . . ?
C84 C83 H83A 109.1 . . ?
C82 C83 H83A 109.1 . . ?
C84 C83 H83B 109.1 . . ?
C82 C83 H83B 109.1 . . ?
H83A C83 H83B 107.8 . . ?
C83 C84 C85 110.3(6) . . ?
C83 C84 H84A 109.6 . . ?
C85 C84 H84A 109.6 . . ?
C83 C84 H84B 109.6 . . ?
C85 C84 H84B 109.6 . . ?
H84A C84 H84B 108.1 . . ?
C84 C85 C86 111.1(6) . . ?
C84 C85 H85A 109.4 . . ?
C86 C85 H85A 109.4 . . ?
C84 C85 H85B 109.4 . . ?
C86 C85 H85B 109.4 . . ?
H85A C85 H85B 108.0 . . ?
C85 C86 C81 110.7(6) . . ?
C85 C86 H86A 109.5 . . ?
C81 C86 H86A 109.5 . . ?
C85 C86 H86B 109.5 . . ?
C81 C86 H86B 109.5 . . ?
H86A C86 H86B 108.1 . . ?
C88 C87 C92 110.9(5) . . ?
C88 C87 P4 115.6(4) . . ?
C92 C87 P4 111.9(4) . . ?
C88 C87 H87 105.9 . . ?
C92 C87 H87 105.9 . . ?
P4 C87 H87 105.9 . . ?
C89 C88 C87 110.5(5) . . ?
C89 C88 H88A 109.6 . . ?
C87 C88 H88A 109.6 . . ?
C89 C88 H88B 109.6 . . ?
C87 C88 H88B 109.6 . . ?
H88A C88 H88B 108.1 . . ?
C90 C89 C88 110.8(6) . . ?
C90 C89 H89A 109.5 . . ?
C88 C89 H89A 109.5 . . ?
C90 C89 H89B 109.5 . . ?
C88 C89 H89B 109.5 . . ?
H89A C89 H89B 108.1 . . ?
C91 C90 C89 111.5(6) . . ?
C91 C90 H90A 109.3 . . ?
C89 C90 H90A 109.3 . . ?
C91 C90 H90B 109.3 . . ?
C89 C90 H90B 109.3 . . ?
H90A C90 H90B 108.0 . . ?
C90 C91 C92 111.4(6) . . ?
C90 C91 H91A 109.4 . . ?
C92 C91 H91A 109.4 . . ?
C90 C91 H91B 109.4 . . ?
C92 C91 H91B 109.4 . . ?
H91A C91 H91B 108.0 . . ?
C91 C92 C87 111.9(6) . . ?
C91 C92 H92A 109.2 . . ?
C87 C92 H92A 109.2 . . ?
C91 C92 H92B 109.2 . . ?
C87 C92 H92B 109.2 . . ?
H92A C92 H92B 107.9 . . ?
C94 C93 C98 109.8(5) . . ?
C94 C93 P4 111.5(4) . . ?
C98 C93 P4 110.3(4) . . ?
C94 C93 H93 108.4 . . ?
C98 C93 H93 108.4 . . ?
P4 C93 H93 108.4 . . ?
C93 C94 C95 111.3(5) . . ?
C93 C94 H94A 109.4 . . ?
C95 C94 H94A 109.4 . . ?
C93 C94 H94B 109.4 . . ?
C95 C94 H94B 109.4 . . ?
H94A C94 H94B 108.0 . . ?
C96 C95 C94 111.3(6) . . ?
C96 C95 H95A 109.4 . . ?
C94 C95 H95A 109.4 . . ?
C96 C95 H95B 109.4 . . ?
C94 C95 H95B 109.4 . . ?
H95A C95 H95B 108.0 . . ?
C97 C96 C95 110.1(6) . . ?
C97 C96 H96A 109.6 . . ?
C95 C96 H96A 109.6 . . ?
C97 C96 H96B 109.6 . . ?
C95 C96 H96B 109.6 . . ?
H96A C96 H96B 108.2 . . ?
C96 C97 C98 111.7(6) . . ?
C96 C97 H97A 109.3 . . ?
C98 C97 H97A 109.3 . . ?
C96 C97 H97B 109.3 . . ?
C98 C97 H97B 109.3 . . ?
H97A C97 H97B 107.9 . . ?
C93 C98 C97 110.9(5) . . ?
C93 C98 H98A 109.5 . . ?
C97 C98 H98A 109.5 . . ?
C93 C98 H98B 109.5 . . ?
C97 C98 H98B 109.5 . . ?
H98A C98 H98B 108.0 . . ?
F1 Sb1 F5 90.3(3) . . ?
F1 Sb1 F4 91.6(3) . . ?
F5 Sb1 F4 90.6(3) . . ?
F1 Sb1 F2 90.0(3) . . ?
F5 Sb1 F2 91.4(3) . . ?
F4 Sb1 F2 177.5(2) . . ?
F1 Sb1 F6 178.4(3) . . ?
F5 Sb1 F6 89.7(2) . . ?
F4 Sb1 F6 90.0(2) . . ?
F2 Sb1 F6 88.5(2) . . ?
F1 Sb1 F3 90.2(2) . . ?
F5 Sb1 F3 179.1(3) . . ?
F4 Sb1 F3 88.6(2) . . ?
F2 Sb1 F3 89.5(2) . . ?
F6 Sb1 F3 89.8(2) . . ?
F12 Sb2 F9 90.7(3) . . ?
F12 Sb2 F8 89.6(2) . . ?
F9 Sb2 F8 90.0(2) . . ?
F12 Sb2 F10 90.1(2) . . ?
F9 Sb2 F10 90.2(2) . . ?
F8 Sb2 F10 179.6(2) . . ?
F12 Sb2 F11 91.2(2) . . ?
F9 Sb2 F11 178.0(2) . . ?
F8 Sb2 F11 89.8(2) . . ?
F10 Sb2 F11 90.0(2) . . ?
F12 Sb2 F7 179.3(2) . . ?
F9 Sb2 F7 88.9(2) . . ?
F8 Sb2 F7 89.72(19) . . ?
F10 Sb2 F7 90.54(19) . . ?
F11 Sb2 F7 89.2(2) . . ?
F1S C1S C6S 117.9(8) . . ?
F1S C1S C2S 119.4(8) . . ?
C6S C1S C2S 122.8(8) . . ?
C1S C2S C3S 116.4(8) . . ?
C1S C2S H2S 121.8 . . ?
C3S C2S H2S 121.8 . . ?
C4S C3S C2S 121.3(7) . . ?
C4S C3S H3S 119.3 . . ?
C2S C3S H3S 119.3 . . ?
C3S C4S C5S 121.6(8) . . ?
C3S C4S H4S 119.2 . . ?
C5S C4S H4S 119.2 . . ?
C4S C5S C6S 116.8(9) . . ?
C4S C5S H5S 121.6 . . ?
C6S C5S H5S 121.6 . . ?
C1S C6S C5S 120.9(8) . . ?
C1S C6S H6S 119.6 . . ?
C5S C6S H6S 119.6 . . ?
F2S C7S C8S 118.1(8) . . ?
F2S C7S C12S 118.3(8) . . ?
C8S C7S C12S 123.6(8) . . ?
C7S C8S C9S 117.6(7) . . ?
C7S C8S H8S 121.2 . . ?
C9S C8S H8S 121.2 . . ?
C10S C9S C8S 121.1(7) . . ?
C10S C9S H9S 119.5 . . ?
C8S C9S H9S 119.5 . . ?
C11S C10S C9S 119.5(7) . . ?
C11S C10S H10S 120.2 . . ?
C9S C10S H10S 120.2 . . ?
C10S C11S C12S 120.0(8) . . ?
C10S C11S H11S 120.0 . . ?
C12S C11S H11S 120.0 . . ?
C7S C12S C11S 118.1(8) . . ?
C7S C12S H12S 120.9 . . ?
C11S C12S H12S 120.9 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Au1 C1 2.122(5) . ?
Au1 P2 2.2795(14) . ?
Au1 Au3 2.7825(3) . ?
Au1 Fe1 2.9344(8) . ?
Au2 C31 2.124(6) . ?
Au2 P1 2.2756(14) . ?
Au2 Au4 2.7707(3) . ?
Au2 Fe2 2.9127(8) . ?
Au3 C1 2.151(5) . ?
Au3 P3 2.2880(14) . ?
Au4 C31 2.154(6) . ?
Au4 P4 2.2896(14) . ?
Fe1 C10 2.047(5) . ?
Fe1 C9 2.048(6) . ?
Fe1 C2 2.059(5) . ?
Fe1 C3 2.060(6) . ?
Fe1 C4 2.063(6) . ?
Fe1 C6 2.071(5) . ?
Fe1 C8 2.074(6) . ?
Fe1 C5 2.086(6) . ?
Fe1 C7 2.103(5) . ?
Fe1 C1 2.120(5) . ?
Fe2 C40 2.032(6) . ?
Fe2 C39 2.043(6) . ?
Fe2 C36 2.056(5) . ?
Fe2 C33 2.061(6) . ?
Fe2 C32 2.061(5) . ?
Fe2 C34 2.065(5) . ?
Fe2 C35 2.086(5) . ?
Fe2 C38 2.091(6) . ?
Fe2 C37 2.096(5) . ?
Fe2 C31 2.134(5) . ?
P1 C6 1.785(5) . ?
P1 C17 1.807(6) . ?
P1 C11 1.830(6) . ?
P2 C36 1.800(6) . ?
P2 C47 1.805(6) . ?
P2 C41 1.818(6) . ?
P3 C61 1.834(6) . ?
P3 C67 1.838(6) . ?
P3 C73 1.841(6) . ?
P4 C93 1.836(6) . ?
P4 C81 1.842(6) . ?
P4 C87 1.845(6) . ?
C1 C5 1.443(8) . ?
C1 C2 1.462(8) . ?
C2 C3 1.409(8) . ?
C2 H2 0.9500 . ?
C3 C4 1.433(9) . ?
C3 H3 0.9500 . ?
C4 C5 1.419(8) . ?
C4 H4 0.9500 . ?
C5 H5 0.9500 . ?
C6 C10 1.433(8) . ?
C6 C7 1.440(7) . ?
C7 C8 1.438(8) . ?
C7 H7 0.9500 . ?
C8 C9 1.419(9) . ?
C8 H8 0.9500 . ?
C9 C10 1.440(8) . ?
C9 H9 0.9500 . ?
C10 H10 0.9500 . ?
C11 C12 1.371(8) . ?
C11 C16 1.404(8) . ?
C12 C13 1.404(8) . ?
C12 H12 0.9500 . ?
C13 C14 1.363(10) . ?
C13 H13 0.9500 . ?
C14 C15 1.381(10) . ?
C14 H14 0.9500 . ?
C15 C16 1.382(8) . ?
C15 H15 0.9500 . ?
C16 H16 0.9500 . ?
C17 C18 1.396(8) . ?
C17 C22 1.396(8) . ?
C18 C19 1.385(9) . ?
C18 H18 0.9500 . ?
C19 C20 1.382(9) . ?
C19 H19 0.9500 . ?
C20 C21 1.395(9) . ?
C20 H20 0.9500 . ?
C21 C22 1.393(8) . ?
C21 H21 0.9500 . ?
C22 H22 0.9500 . ?
C31 C35 1.442(8) . ?
C31 C32 1.451(8) . ?
C32 C33 1.410(8) . ?
C32 H32 0.9500 . ?
C33 C34 1.432(8) . ?
C33 H33 0.9500 . ?
C34 C35 1.411(8) . ?
C34 H34 0.9500 . ?
C35 H35 0.9500 . ?
C36 C37 1.426(8) . ?
C36 C40 1.436(8) . ?
C37 C38 1.416(8) . ?
C37 H37 0.9500 . ?
C38 C39 1.422(9) . ?
C38 H38 0.9500 . ?
C39 C40 1.412(8) . ?
C39 H39 0.9500 . ?
C40 H40 0.9500 . ?
C41 C46 1.396(8) . ?
C41 C42 1.399(8) . ?
C42 C43 1.375(9) . ?
C42 H42 0.9500 . ?
C43 C44 1.385(10) . ?
C43 H43 0.9500 . ?
C44 C45 1.388(11) . ?
C44 H44 0.9500 . ?
C45 C46 1.386(8) . ?
C45 H45 0.9500 . ?
C46 H46 0.9500 . ?
C47 C52 1.398(8) . ?
C47 C48 1.398(8) . ?
C48 C49 1.382(8) . ?
C48 H48 0.9500 . ?
C49 C50 1.389(9) . ?
C49 H49 0.9500 . ?
C50 C51 1.383(9) . ?
C50 H50 0.9500 . ?
C51 C52 1.400(8) . ?
C51 H51 0.9500 . ?
C52 H52 0.9500 . ?
C61 C66 1.529(8) . ?
C61 C62 1.539(8) . ?
C61 H61 1.0000 . ?
C62 C63 1.530(9) . ?
C62 H62A 0.9900 . ?
C62 H62B 0.9900 . ?
C63 C64 1.528(9) . ?
C63 H63A 0.9900 . ?
C63 H63B 0.9900 . ?
C64 C65 1.516(10) . ?
C64 H64A 0.9900 . ?
C64 H64B 0.9900 . ?
C65 C66 1.538(9) . ?
C65 H65A 0.9900 . ?
C65 H65B 0.9900 . ?
C66 H66A 0.9900 . ?
C66 H66B 0.9900 . ?
C67 C68 1.520(8) . ?
C67 C72 1.543(9) . ?
C67 H67 1.0000 . ?
C68 C69 1.525(9) . ?
C68 H68A 0.9900 . ?
C68 H68B 0.9900 . ?
C69 C70 1.529(11) . ?
C69 H69A 0.9900 . ?
C69 H69B 0.9900 . ?
C70 C71 1.534(10) . ?
C70 H70A 0.9900 . ?
C70 H70B 0.9900 . ?
C71 C72 1.524(10) . ?
C71 H71A 0.9900 . ?
C71 H71B 0.9900 . ?
C72 H72A 0.9900 . ?
C72 H72B 0.9900 . ?
C73 C78 1.537(9) . ?
C73 C74 1.537(8) . ?
C73 H73 1.0000 . ?
C74 C75 1.533(9) . ?
C74 H74A 0.9900 . ?
C74 H74B 0.9900 . ?
C75 C76 1.514(10) . ?
C75 H75A 0.9900 . ?
C75 H75B 0.9900 . ?
C76 C77 1.523(9) . ?
C76 H76A 0.9900 . ?
C76 H76B 0.9900 . ?
C77 C78 1.540(8) . ?
C77 H77A 0.9900 . ?
C77 H77B 0.9900 . ?
C78 H78A 0.9900 . ?
C78 H78B 0.9900 . ?
C81 C82 1.536(9) . ?
C81 C86 1.540(9) . ?
C81 H81 1.0000 . ?
C82 C83 1.535(9) . ?
C82 H82A 0.9900 . ?
C82 H82B 0.9900 . ?
C83 C84 1.518(11) . ?
C83 H83A 0.9900 . ?
C83 H83B 0.9900 . ?
C84 C85 1.522(11) . ?
C84 H84A 0.9900 . ?
C84 H84B 0.9900 . ?
C85 C86 1.537(9) . ?
C85 H85A 0.9900 . ?
C85 H85B 0.9900 . ?
C86 H86A 0.9900 . ?
C86 H86B 0.9900 . ?
C87 C88 1.540(8) . ?
C87 C92 1.545(9) . ?
C87 H87 1.0000 . ?
C88 C89 1.536(9) . ?
C88 H88A 0.9900 . ?
C88 H88B 0.9900 . ?
C89 C90 1.530(10) . ?
C89 H89A 0.9900 . ?
C89 H89B 0.9900 . ?
C90 C91 1.518(9) . ?
C90 H90A 0.9900 . ?
C90 H90B 0.9900 . ?
C91 C92 1.525(9) . ?
C91 H91A 0.9900 . ?
C91 H91B 0.9900 . ?
C92 H92A 0.9900 . ?
C92 H92B 0.9900 . ?
C93 C94 1.531(8) . ?
C93 C98 1.540(9) . ?
C93 H93 1.0000 . ?
C94 C95 1.548(9) . ?
C94 H94A 0.9900 . ?
C94 H94B 0.9900 . ?
C95 C96 1.524(10) . ?
C95 H95A 0.9900 . ?
C95 H95B 0.9900 . ?
C96 C97 1.522(10) . ?
C96 H96A 0.9900 . ?
C96 H96B 0.9900 . ?
C97 C98 1.542(9) . ?
C97 H97A 0.9900 . ?
C97 H97B 0.9900 . ?
C98 H98A 0.9900 . ?
C98 H98B 0.9900 . ?
Sb1 F1 1.856(5) . ?
Sb1 F5 1.860(5) . ?
Sb1 F4 1.863(5) . ?
Sb1 F2 1.872(5) . ?
Sb1 F6 1.873(4) . ?
Sb1 F3 1.878(4) . ?
Sb2 F12 1.860(4) . ?
Sb2 F9 1.869(5) . ?
Sb2 F8 1.876(4) . ?
Sb2 F10 1.876(4) . ?
Sb2 F11 1.877(4) . ?
Sb2 F7 1.879(4) . ?
F1S C1S 1.337(10) . ?
C1S C6S 1.370(12) . ?
C1S C2S 1.381(11) . ?
C2S C3S 1.396(11) . ?
C2S H2S 0.9500 . ?
C3S C4S 1.377(11) . ?
C3S H3S 0.9500 . ?
C4S C5S 1.392(13) . ?
C4S H4S 0.9500 . ?
C5S C6S 1.396(13) . ?
C5S H5S 0.9500 . ?
C6S H6S 0.9500 . ?
F2S C7S 1.356(9) . ?
C7S C8S 1.356(12) . ?
C7S C12S 1.367(12) . ?
C8S C9S 1.383(12) . ?
C8S H8S 0.9500 . ?
C9S C10S 1.382(11) . ?
C9S H9S 0.9500 . ?
C10S C11S 1.379(11) . ?
C10S H10S 0.9500 . ?
C11S C12S 1.391(12) . ?
C11S H11S 0.9500 . ?
C12S H12S 0.9500 . ?
