# Supplementary Information (SI) for RSC Advances.
# This journal is © The Royal Society of Chemistry 2024

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_try2_pl
_database_code_depnum_ccdc_archive 'CCDC 1990280'
loop_
_audit_author_name
_audit_author_address
'Peter Coburger'
;TU Munich
Germany
;
_audit_update_record             
;
2024-05-23 deposited with the CCDC.	2024-07-29 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C108 H120.13 Cl3 Fe3 O3 P3 Rh3'
_chemical_formula_weight         2141.70

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'
Cl Cl 0.1484 0.1585 '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'
Rh Rh -1.1178 0.9187 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 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. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   11.3518(3)
_cell_length_b                   15.4233(4)
_cell_length_c                   26.8182(6)
_cell_angle_alpha                89.060(2)
_cell_angle_beta                 85.478(2)
_cell_angle_gamma                89.870(2)
_cell_volume                     4680.1(2)
_cell_formula_units_Z            2
_cell_measurement_temperature    130
_cell_measurement_reflns_used    14861
_cell_measurement_theta_min      2.6150
_cell_measurement_theta_max      27.3070

_exptl_crystal_description       needle
_exptl_crystal_colour            'clear light orange'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.520
_exptl_crystal_F_000             2202
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.2000
_exptl_crystal_size_mid          0.0500
_exptl_crystal_size_min          0.0500
_exptl_absorpt_coefficient_mu    1.159
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.96924
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
; 
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      130
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'Enhance (Mo) X-ray Source'
_diffrn_measurement_device_type  'Xcalibur, Sapphire3, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean 16.3560
_diffrn_reflns_number            132832
_diffrn_reflns_av_unetI/netI     0.0733
_diffrn_reflns_av_R_equivalents  0.0985
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_l_min       -35
_diffrn_reflns_limit_l_max       35
_diffrn_reflns_theta_min         2.231
_diffrn_reflns_theta_max         28.282
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             23228
_reflns_number_gt                16560
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 _reflns_Friedel_fraction is defined as the number of unique 
 Friedel pairs measured divided by the number that would be 
 possible theoretically, ignoring centric projections and 
 systematic absences. 
;

_computing_data_collection       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
(compiled Aug 13 2014,18:06:01)
;
_computing_structure_solution    SHELXS
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0352P)²+7.6961P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         23228
_refine_ls_number_parameters     1149
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0938
_refine_ls_R_factor_gt           0.0588
_refine_ls_wR_factor_ref         0.1180
_refine_ls_wR_factor_gt          0.1057
_refine_ls_goodness_of_fit_ref   1.050
_refine_ls_restrained_S_all      1.050
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
C992 C 0.2144(13) 0.5485(9) 0.0682(5) 0.060(4) Uani 0.566(9) 1 d . . P A 1
H992 H 0.2548 0.5297 0.0970 0.072 Uiso 0.566(9) 1 calc R U P A 1
H991 H 0.2688 0.5444 0.0386 0.072 Uiso 0.566(9) 1 calc R U P A 1
C993 C 0.1063(11) 0.4930(8) 0.0630(4) 0.056(3) Uani 0.566(9) 1 d . . P A 1
H993 H 0.0656 0.5137 0.0351 0.084 Uiso 0.566(9) 1 calc R U P A 1
H994 H 0.0545 0.4961 0.0930 0.084 Uiso 0.566(9) 1 calc R U P A 1
H995 H 0.1302 0.4339 0.0576 0.084 Uiso 0.566(9) 1 calc R U P A 1
C994 C 0.2146(9) 0.7780(7) 0.0975(4) 0.058(3) Uani 0.566(9) 1 d . . P A 1
H880 H 0.2768 0.8191 0.1007 0.087 Uiso 0.566(9) 1 calc R U P A 1
H881 H 0.1687 0.7714 0.1289 0.087 Uiso 0.566(9) 1 calc R U P A 1
H882 H 0.1646 0.7984 0.0725 0.087 Uiso 0.566(9) 1 calc R U P A 1
C995 C 0.2670(9) 0.6921(10) 0.0823(5) 0.062(4) Uani 0.566(9) 1 d . . P A 1
H5A H 0.3187 0.6986 0.0519 0.074 Uiso 0.566(9) 1 calc R U P A 1
H5B H 0.3126 0.6685 0.1084 0.074 Uiso 0.566(9) 1 calc R U P A 1
O91A O 0.1722(3) 0.6373(2) 0.07440(15) 0.0504(10) Uani 0.566(9) 1 d . . P A 1
C881 C 0.1340(12) 0.5552(9) 0.0592(5) 0.040(3) Uani 0.434(9) 1 d . . P A 2
H1A H 0.1212 0.5555 0.0239 0.048 Uiso 0.434(9) 1 calc R U P A 2
H1B H 0.0617 0.5374 0.0783 0.048 Uiso 0.434(9) 1 calc R U P A 2
C884 C 0.2950(13) 0.6473(11) 0.0616(7) 0.059(4) Uani 0.434(9) 1 d . . P A 2
H4A H 0.3294 0.6905 0.0820 0.071 Uiso 0.434(9) 1 calc R U P A 2
H4B H 0.3117 0.6622 0.0265 0.071 Uiso 0.434(9) 1 calc R U P A 2
C883 C 0.3359(12) 0.5586(9) 0.0736(8) 0.076(6) Uani 0.434(9) 1 d . . P A 2
H3A H 0.3628 0.5563 0.1070 0.091 Uiso 0.434(9) 1 calc R U P A 2
H3B H 0.4010 0.5421 0.0500 0.091 Uiso 0.434(9) 1 calc R U P A 2
C882 C 0.2335(13) 0.4983(11) 0.0701(5) 0.043(3) Uani 0.434(9) 1 d . . P A 2
H2A H 0.2500 0.4571 0.0435 0.052 Uiso 0.434(9) 1 calc R U P A 2
H2B H 0.2164 0.4667 0.1014 0.052 Uiso 0.434(9) 1 calc R U P A 2
O81B O 0.1722(3) 0.6373(2) 0.07440(15) 0.0504(10) Uani 0.434(9) 1 d . . P A 2
C1 C 0.6069(3) 0.0746(3) 0.38749(15) 0.0206(8) Uani 1 1 d . . . . .
C3 C 1.3730(5) 0.5546(4) 0.5208(2) 0.0532(16) Uani 1 1 d . . . . .
H3 H 1.3889 0.5557 0.5543 0.064 Uiso 1 1 calc R U . . .
C5 C 0.8839(3) 0.6277(3) 0.18153(15) 0.0215(8) Uani 1 1 d . . . . .
C7 C 0.6781(4) 0.2742(3) 0.36446(14) 0.0221(9) Uani 1 1 d . . . . .
H7 H 0.5940 0.2624 0.3729 0.027 Uiso 1 1 calc R U . . .
C8 C 0.8789(4) 0.2569(3) 0.34849(15) 0.0236(9) Uani 1 1 d . . . . .
H8 H 0.9581 0.2313 0.3446 0.028 Uiso 1 1 calc R U . . .
C9 C 1.0650(4) 0.6029(3) 0.41026(16) 0.0293(10) Uani 1 1 d . . . . .
H9 H 1.1093 0.6143 0.4371 0.035 Uiso 1 1 calc R U . . .
C10 C 1.3129(4) 0.4979(3) 0.22041(15) 0.0264(9) Uani 1 1 d . . . . .
H10 H 1.2963 0.5583 0.2295 0.032 Uiso 1 1 calc R U . . .
C11 C 0.9322(3) 0.5415(3) 0.19461(14) 0.0207(8) Uani 1 1 d . . . . .
C12 C 0.8572(4) 0.4713(3) 0.20555(15) 0.0232(9) Uani 1 1 d . . . . .
H12 H 0.7760 0.4791 0.2056 0.028 Uiso 1 1 calc R U . . .
C15 C 0.9316(4) 0.5727(3) 0.33054(16) 0.0246(9) Uani 1 1 d . . . . .
H15 H 0.8871 0.5635 0.3034 0.029 Uiso 1 1 calc R U . . .
C17 C 1.0539(4) 0.5297(3) 0.19500(15) 0.0240(9) Uani 1 1 d . . . . .
H17 H 1.1048 0.5760 0.1873 0.029 Uiso 1 1 calc R U . . .
C22 C 1.2284(3) 0.4358(3) 0.20830(15) 0.0238(9) Uani 1 1 d . . . . .
C23 C 0.7715(3) 0.2114(3) 0.36367(14) 0.0205(8) Uani 1 1 d . . . . .
C25 C 1.0520(4) 0.5606(3) 0.32556(16) 0.0239(9) Uani 1 1 d . . . . .
H25 H 1.0879 0.5430 0.2950 0.029 Uiso 1 1 calc R U . . .
C26 C 1.1213(4) 0.5742(3) 0.36536(16) 0.0246(9) Uani 1 1 d . . . . .
C28 C 0.7523(4) 0.1754(3) 0.24054(15) 0.0299(10) Uani 1 1 d . . . . .
H28 H 0.7494 0.1125 0.2461 0.036 Uiso 1 1 calc R U . . .
C29 C 0.9015(4) 0.3896(3) 0.21634(14) 0.0229(9) Uani 1 1 d . . . . .
C31 C 0.8576(4) 0.7601(3) 0.14324(16) 0.0261(9) Uani 1 1 d . . . . .
H31 H 0.8701 0.8112 0.1213 0.031 Uiso 1 1 calc R U . . .
C33 C 0.8214(4) 0.3148(3) 0.22548(14) 0.0227(9) Uani 1 1 d . . . . .
C34 C 1.1983(4) 0.3849(3) 0.33119(15) 0.0227(9) Uani 1 1 d . . . . .
H34 H 1.1139 0.3992 0.3324 0.027 Uiso 1 1 calc R U . . .
C35 C 0.8765(4) 0.5986(3) 0.37559(16) 0.0265(9) Uani 1 1 d . . . . .
H35 H 0.7949 0.6051 0.3792 0.032 Uiso 1 1 calc R U . . .
C36 C 0.8595(4) 0.7455(3) -0.07600(17) 0.0373(11) Uani 1 1 d . . . . .
H36 H 0.7893 0.7529 -0.0913 0.045 Uiso 1 1 calc R U . . .
C38 C 1.2481(4) 0.3028(3) 0.31976(15) 0.0262(9) Uani 1 1 d . . . . .
H38 H 1.2045 0.2506 0.3120 0.031 Uiso 1 1 calc R U . . .
C40 C 1.0996(4) 0.4487(3) 0.20693(15) 0.0238(9) Uani 1 1 d . . . . .
C42 C 0.7278(4) 0.3561(3) 0.34976(15) 0.0248(9) Uani 1 1 d . . . . .
H42 H 0.6842 0.4105 0.3465 0.030 Uiso 1 1 calc R U . . .
C43 C 0.5533(4) 0.0266(3) 0.42757(16) 0.0282(10) Uani 1 1 d . . . . .
H43 H 0.5982 0.0082 0.4533 0.034 Uiso 1 1 calc R U . . .
C44 C 0.6963(4) 0.3180(3) 0.23234(15) 0.0258(9) Uani 1 1 d . . . . .
H44 H 0.6478 0.3705 0.2311 0.031 Uiso 1 1 calc R U . . .
C47 C 0.8454(4) 0.0352(3) 0.47233(16) 0.0303(10) Uani 1 1 d . . . . .
H47 H 0.8637 -0.0144 0.4540 0.036 Uiso 1 1 calc R U . . .
C48 C 0.6376(4) 0.5661(3) 0.11660(17) 0.0336(11) Uani 1 1 d . . . . .
H48 H 0.5868 0.5384 0.1435 0.040 Uiso 1 1 calc R U . . .
C49 C 0.8555(4) 0.2260(3) 0.23076(16) 0.0271(9) Uani 1 1 d . . . . .
H49 H 0.9368 0.2040 0.2282 0.032 Uiso 1 1 calc R U . . .
C53 C 0.9636(4) 0.7280(3) -0.00249(17) 0.0313(10) Uani 1 1 d . . . . .
H53 H 0.9637 0.7250 0.0322 0.038 Uiso 1 1 calc R U . . .
C57 C 0.8579(4) 0.7399(3) -0.02409(17) 0.0284(10) Uani 1 1 d . . . . .
C59 C 1.3723(4) 0.3095(3) 0.32127(16) 0.0279(10) Uani 1 1 d . . . . .
H59 H 1.4295 0.2625 0.3147 0.034 Uiso 1 1 calc R U . . .
C64 C 0.5384(4) 0.0991(3) 0.34901(16) 0.0257(9) Uani 1 1 d . . . . .
H64 H 0.5730 0.1286 0.3211 0.031 Uiso 1 1 calc R U . . .
C69 C 1.4111(4) 0.3700(3) 0.20273(16) 0.0315(10) Uani 1 1 d . . . . .
H69 H 1.4737 0.3266 0.1976 0.038 Uiso 1 1 calc R U . . .
C72 C 0.6060(4) 0.7286(3) -0.02702(16) 0.0298(10) Uani 1 1 d . . . . .
C77 C 1.4262(4) 0.4574(3) 0.21707(16) 0.0295(10) Uani 1 1 d . . . . .
H77 H 1.5013 0.4850 0.2232 0.035 Uiso 1 1 calc R U . . .
C80 C 0.9354(4) 0.6885(3) 0.14580(15) 0.0243(9) Uani 1 1 d . . . . .
H80 H 1.0107 0.6814 0.1258 0.029 Uiso 1 1 calc R U . . .
C81 C 0.7945(3) 0.1054(3) 0.44960(15) 0.0225(9) Uani 1 1 d . . . . .
C85 C 0.4186(4) 0.0801(3) 0.35188(17) 0.0279(10) Uani 1 1 d . . . . .
H85 H 0.3733 0.0985 0.3263 0.034 Uiso 1 1 calc R U . . .
C87 C 1.4001(4) 0.3960(3) 0.33312(15) 0.0254(9) Uani 1 1 d . . . . .
H87 H 1.4794 0.4190 0.3366 0.031 Uiso 1 1 calc R U . . .
C89 C 0.7500(4) -0.0496(3) 0.30185(18) 0.0330(11) Uani 1 1 d . . . . .
H89 H 0.6785 -0.0138 0.3025 0.040 Uiso 1 1 calc R U . . .
C91 C 0.7917(4) 0.5917(3) 0.05770(16) 0.0290(10) Uani 1 1 d . . . . .
H91 H 0.8659 0.5850 0.0368 0.035 Uiso 1 1 calc R U . . .
C92 C 1.2907(3) 0.4440(3) 0.33942(15) 0.0226(9) Uani 1 1 d . . . . .
C93 C 0.3664(4) 0.0344(3) 0.39186(17) 0.0297(10) Uani 1 1 d . . . . .
H93 H 0.2859 0.0223 0.3938 0.036 Uiso 1 1 calc R U . . .
C97 C 0.7739(4) 0.6630(3) 0.20148(15) 0.0244(9) Uani 1 1 d . . . . .
H97 H 0.7190 0.6356 0.2270 0.029 Uiso 1 1 calc R U . . .
C99 C 0.6532(4) 0.2325(3) 0.24146(16) 0.0283(10) Uani 1 1 d . . . . .
H99 H 0.5700 0.2157 0.2478 0.034 Uiso 1 1 calc R U . . .
C101 C 1.0701(5) 0.7259(3) -0.0829(2) 0.0446(13) Uani 1 1 d . . . . .
H101 H 1.1408 0.7200 -0.1026 0.053 Uiso 1 1 calc R U . . .
C102 C 0.7138(4) 0.6642(3) 0.05697(16) 0.0261(9) Uani 1 1 d . . . . .
C105 C 0.6791(4) 1.0047(3) 0.09721(18) 0.0358(11) Uani 1 1 d . . . . .
H105 H 0.6185 0.9983 0.1251 0.043 Uiso 1 1 calc R U . . .
C106 C 0.4354(4) 0.0063(3) 0.42956(17) 0.0321(10) Uani 1 1 d . . . . .
H106 H 0.4014 -0.0265 0.4563 0.039 Uiso 1 1 calc R U . . .
C107 C 1.2717(4) 0.7563(3) 0.3288(2) 0.0367(12) Uani 1 1 d . . . . .
H107 H 1.2165 0.7418 0.3577 0.044 Uiso 1 1 calc R U . . .
C108 C 0.8707(4) 0.9336(3) 0.03801(18) 0.0339(11) Uani 1 1 d . . . . .
H108 H 0.9277 0.8857 0.0361 0.041 Uiso 1 1 calc R U . . .
C109 C 0.6172(4) 0.6479(3) 0.09431(16) 0.0302(10) Uani 1 1 d . . . . .
H109 H 0.5496 0.6861 0.1024 0.036 Uiso 1 1 calc R U . . .
C110 C 0.7579(4) 0.7447(3) 0.17747(16) 0.0271(9) Uani 1 1 d . . . . .
H110 H 0.6900 0.7835 0.1836 0.032 Uiso 1 1 calc R U . . .
C111 C 0.9958(4) -0.0477(3) 0.27447(18) 0.0369(12) Uani 1 1 d . . . . .
H111 H 1.0686 -0.0153 0.2651 0.044 Uiso 1 1 calc R U . . .
C112 C 1.0233(4) 0.3794(3) 0.21742(15) 0.0232(9) Uani 1 1 d . . . . .
H112 H 1.0539 0.3254 0.2253 0.028 Uiso 1 1 calc R U . . .
C114 C 0.8510(4) 0.3449(3) 0.34054(16) 0.0258(9) Uani 1 1 d . . . . .
H114 H 0.9076 0.3906 0.3296 0.031 Uiso 1 1 calc R U . . .
C115 C 0.7912(5) 0.1814(3) 0.52694(18) 0.0447(13) Uani 1 1 d . . . . .
H115 H 0.7725 0.2306 0.5455 0.054 Uiso 1 1 calc R U . . .
C121 C 0.8694(4) 0.0377(3) 0.52215(17) 0.0354(11) Uani 1 1 d . . . . .
H121 H 0.9024 -0.0102 0.5373 0.043 Uiso 1 1 calc R U . . .
C126 C 1.2896(4) 0.3569(3) 0.19745(15) 0.0281(10) Uani 1 1 d . . . . .
H126 H 1.2534 0.3023 0.1884 0.034 Uiso 1 1 calc R U . . .
C127 C 0.7637(4) -0.0958(3) 0.3466(2) 0.0339(11) Uani 1 1 d . . . . .
H127 H 0.6997 -0.0855 0.3725 0.041 Uiso 1 1 calc R U . . .
C129 C 0.7445(4) 0.5320(3) 0.09476(17) 0.0328(11) Uani 1 1 d . . . . .
H129 H 0.7804 0.4767 0.1038 0.039 Uiso 1 1 calc R U . . .
C131 C 0.6361(4) 1.0309(3) 0.05340(17) 0.0329(11) Uani 1 1 d . . . . .
H131 H 0.5504 1.0398 0.0554 0.040 Uiso 1 1 calc R U . . .
C134 C 0.9434(4) 0.6146(3) 0.41508(18) 0.0333(11) Uani 1 1 d . . . . .
H134 H 0.9068 0.6333 0.4452 0.040 Uiso 1 1 calc R U . . .
C140 C 1.3228(4) 0.5525(3) 0.42147(17) 0.0293(10) Uani 1 1 d . . . . .
C143 C 1.0690(4) 0.7206(3) -0.03166(19) 0.0385(12) Uani 1 1 d . . . . .
H143 H 1.1393 0.7120 -0.0166 0.046 Uiso 1 1 calc R U . . .
C145 C 1.2400(4) 0.7227(3) 0.28375(19) 0.0363(11) Uani 1 1 d . . . . .
H145 H 1.1675 0.6881 0.2872 0.044 Uiso 1 1 calc R U . . .
C146 C 1.2895(4) 0.4844(4) 0.45373(18) 0.0403(12) Uani 1 1 d . . . . .
H146 H 1.2494 0.4374 0.4419 0.048 Uiso 1 1 calc R U . . .
C147 C 0.8161(4) 0.9493(3) -0.00643(18) 0.0340(11) Uani 1 1 d . . . . .
H147 H 0.8424 0.9100 -0.0335 0.041 Uiso 1 1 calc R U . . .
C148 C 1.4421(5) 0.8529(4) 0.2957(3) 0.068(2) Uani 1 1 d . . . . .
H14A H 1.4992 0.8904 0.3096 0.082 Uiso 1 1 calc R U . . .
H14B H 1.4155 0.8817 0.2662 0.082 Uiso 1 1 calc R U . . .
C151 C 0.7658(5) 0.1787(3) 0.47713(17) 0.0400(12) Uani 1 1 d . . . . .
H151 H 0.7298 0.2258 0.4624 0.048 Uiso 1 1 calc R U . . .
C152 C 0.5663(6) 0.6453(4) -0.0307(2) 0.067(2) Uani 1 1 d . . . . .
H152 H 0.5975 0.6013 -0.0116 0.081 Uiso 1 1 calc R U . . .
C154 C 0.4357(5) 0.6879(5) -0.0910(2) 0.0565(17) Uani 1 1 d . . . . .
H154 H 0.3792 0.6740 -0.1129 0.068 Uiso 1 1 calc R U . . .
C155 C 0.2775(8) 0.1202(5) 0.2262(3) 0.092(3) Uani 1 1 d . . . . .
H15C H 0.2442 0.0965 0.2579 0.110 Uiso 1 1 calc R U . . .
H15D H 0.3150 0.1751 0.2324 0.110 Uiso 1 1 calc R U . . .
C156 C 0.0328(6) 0.2879(5) 0.4595(3) 0.083(2) Uani 1 1 d . . . . .
H15A H -0.0066 0.2589 0.4885 0.099 Uiso 1 1 calc R U . . .
H15B H 0.0225 0.2528 0.4304 0.099 Uiso 1 1 calc R U . . .
C161 C 0.5580(5) 0.7912(3) -0.05553(19) 0.0430(13) Uani 1 1 d . . . . .
H161 H 0.5825 0.8484 -0.0533 0.052 Uiso 1 1 calc R U . . .
C164 C 0.9400(5) -0.1898(3) 0.3194(2) 0.0502(15) Uani 1 1 d . . . . .
H16A H 0.9902 -0.2324 0.3342 0.060 Uiso 1 1 calc R U . . .
H16B H 0.9234 -0.2102 0.2867 0.060 Uiso 1 1 calc R U . . .
C165 C 0.4725(5) 0.7708(4) -0.0881(2) 0.0553(16) Uani 1 1 d . . . . .
H165 H 0.4411 0.8140 -0.1077 0.066 Uiso 1 1 calc R U . . .
C171 C 0.8440(4) 0.1116(4) 0.54899(18) 0.0417(13) Uani 1 1 d . . . . .
H171 H 0.8625 0.1144 0.5821 0.050 Uiso 1 1 calc R U . . .
C174 C 1.2601(5) 0.7683(4) 0.2338(2) 0.0501(14) Uani 1 1 d . . . . .
H17A H 1.2571 0.8304 0.2388 0.060 Uiso 1 1 calc R U . . .
H17B H 1.1966 0.7534 0.2133 0.060 Uiso 1 1 calc R U . . .
C180 C 0.7048(5) 1.0874(3) 0.0150(2) 0.0454(13) Uani 1 1 d . . . . .
H18A H 0.6503 1.1257 -0.0008 0.054 Uiso 1 1 calc R U . . .
H18B H 0.7591 1.1232 0.0317 0.054 Uiso 1 1 calc R U . . .
C182 C 0.1942(8) 0.0625(6) 0.1597(3) 0.096(3) Uani 1 1 d . . . . .
H18Q H 0.1270 0.0243 0.1667 0.116 Uiso 1 1 calc R U . . .
H18W H 0.1934 0.0839 0.1255 0.116 Uiso 1 1 calc R U . . .
C183 C 1.3837(4) 0.6215(3) 0.4397(2) 0.0429(13) Uani 1 1 d . . . . .
H183 H 1.4084 0.6674 0.4185 0.051 Uiso 1 1 calc R U . . .
C185 C 0.8238(4) -0.1828(3) 0.3521(2) 0.0475(14) Uani 1 1 d . . . . .
H18C H 0.7708 -0.2282 0.3432 0.057 Uiso 1 1 calc R U . . .
H18D H 0.8395 -0.1919 0.3869 0.057 Uiso 1 1 calc R U . . .
C189 C 0.7733(5) 1.0358(3) -0.0247(2) 0.0484(14) Uani 1 1 d . . . . .
H18E H 0.8410 1.0697 -0.0379 0.058 Uiso 1 1 calc R U . . .
H18F H 0.7237 1.0264 -0.0519 0.058 Uiso 1 1 calc R U . . .
C192 C 1.3378(5) 0.8402(3) 0.3337(2) 0.0535(16) Uani 1 1 d . . . . .
H19A H 1.2833 0.8881 0.3305 0.064 Uiso 1 1 calc R U . . .
H19B H 1.3656 0.8422 0.3669 0.064 Uiso 1 1 calc R U . . .
C195 C 1.3151(4) 0.4854(4) 0.50315(19) 0.0497(15) Uani 1 1 d . . . . .
H195 H 1.2930 0.4390 0.5244 0.060 Uiso 1 1 calc R U . . .
C196 C 1.0049(4) -0.1057(3) 0.31330(19) 0.0355(11) Uani 1 1 d . . . . .
H196 H 1.0824 -0.1063 0.3270 0.043 Uiso 1 1 calc R U . . .
C197 C 0.8000(5) 1.0223(4) 0.1129(2) 0.0507(14) Uani 1 1 d . . . . .
H19C H 0.8116 0.9875 0.1426 0.061 Uiso 1 1 calc R U . . .
H19D H 0.8042 1.0827 0.1221 0.061 Uiso 1 1 calc R U . . .
C200 C 0.9663(5) 0.7399(4) -0.10502(19) 0.0469(14) Uani 1 1 d . . . . .
H200 H 0.9675 0.7456 -0.1396 0.056 Uiso 1 1 calc R U . . .
C205 C 0.8991(4) 1.0039(3) 0.0742(2) 0.0432(13) Uani 1 1 d . . . . .
H20A H 0.9683 0.9866 0.0909 0.052 Uiso 1 1 calc R U . . .
H20B H 0.9185 1.0569 0.0553 0.052 Uiso 1 1 calc R U . . .
C214 C 0.4800(7) 0.6258(5) -0.0627(3) 0.087(3) Uani 1 1 d . . . . .
H214 H 0.4530 0.5691 -0.0643 0.104 Uiso 1 1 calc R U . . .
C218 C 0.9157(4) -0.0565(4) 0.23269(18) 0.0453(13) Uani 1 1 d . . . . .
H21A H 0.9489 -0.0991 0.2094 0.054 Uiso 1 1 calc R U . . .
H21B H 0.9128 -0.0014 0.2148 0.054 Uiso 1 1 calc R U . . .
C223 C 0.3009(12) 0.0165(7) 0.1658(4) 0.157(5) Uani 1 1 d . . . . .
H22C H 0.3494 0.0155 0.1343 0.189 Uiso 1 1 calc R U . . .
H22D H 0.2836 -0.0428 0.1765 0.189 Uiso 1 1 calc R U . . .
C226 C 0.7901(4) -0.0836(4) 0.25059(19) 0.0446(13) Uani 1 1 d . . . . .
H22A H 0.7364 -0.0625 0.2267 0.054 Uiso 1 1 calc R U . . .
H22B H 0.7856 -0.1464 0.2515 0.054 Uiso 1 1 calc R U . . .
C228 C 1.5018(4) 0.7685(4) 0.2806(3) 0.0542(16) Uani 1 1 d . . . . .
H228 H 1.5849 0.7641 0.2878 0.065 Uiso 1 1 calc R U . . .
C233 C 1.4727(5) 0.7228(4) 0.2403(2) 0.0558(17) Uani 1 1 d . . . . .
H233 H 1.5392 0.6906 0.2240 0.067 Uiso 1 1 calc R U . . .
C236 C 1.4076(5) 0.6219(4) 0.4897(2) 0.0556(17) Uani 1 1 d . . . . .
H236 H 1.4475 0.6686 0.5019 0.067 Uiso 1 1 calc R U . . .
C238 C -0.0224(6) 0.3782(5) 0.4523(3) 0.080(2) Uani 1 1 d . . . . .
H23C H 0.0140 0.4054 0.4225 0.120 Uiso 1 1 calc R U . . .
H23D H -0.0098 0.4133 0.4807 0.120 Uiso 1 1 calc R U . . .
H23E H -0.1057 0.3722 0.4493 0.120 Uiso 1 1 calc R U . . .
C242 C 1.3780(5) 0.7453(4) 0.2058(2) 0.0652(18) Uani 1 1 d . . . . .
H24A H 1.3666 0.6964 0.1844 0.078 Uiso 1 1 calc R U . . .
H24B H 1.4045 0.7941 0.1845 0.078 Uiso 1 1 calc R U . . .
C249 C 0.2132(7) 0.2171(5) 0.4669(4) 0.105(3) Uani 1 1 d . . . . .
H24C H 0.2089 0.1888 0.4351 0.126 Uiso 1 1 calc R U . . .
H24D H 0.1753 0.1799 0.4929 0.126 Uiso 1 1 calc R U . . .
C367 C 0.3404(7) 0.2310(6) 0.4767(5) 0.169(6) Uani 1 1 d . . . . .
H36A H 0.3894 0.1911 0.4574 0.253 Uiso 1 1 calc R U . . .
H36B H 0.3499 0.2215 0.5116 0.253 Uiso 1 1 calc R U . . .
H36C H 0.3630 0.2894 0.4674 0.253 Uiso 1 1 calc R U . . .
C777 C 0.3633(11) 0.0614(7) 0.2038(4) 0.159(5) Uani 1 1 d . . . . .
H77A H 0.3895 0.0205 0.2285 0.191 Uiso 1 1 calc R U . . .
H77B H 0.4313 0.0925 0.1885 0.191 Uiso 1 1 calc R U . . .
Cl19 Cl 1.05795(9) 0.08126(7) 0.36112(4) 0.0298(2) Uani 1 1 d . . . . .
Cl20 Cl 0.50388(11) 0.84983(8) 0.08149(5) 0.0457(3) Uani 1 1 d . . . . .
Cl22 Cl 1.56726(10) 0.57664(8) 0.31627(5) 0.0442(3) Uani 1 1 d . . . . .
Fe8 Fe 1.31522(5) 0.39490(4) 0.26898(2) 0.02190(13) Uani 1 1 d . . . . .
Fe9 Fe 0.77312(5) 0.64900(4) 0.12624(2) 0.02227(13) Uani 1 1 d . . . . .
Fe10 Fe 0.76422(5) 0.26744(4) 0.29442(2) 0.02088(13) Uani 1 1 d . . . . .
P14 P 0.76509(9) 0.09948(7) 0.38382(4) 0.0200(2) Uani 1 1 d . . . . .
P15 P 0.71989(10) 0.75652(7) 0.01468(4) 0.0248(2) Uani 1 1 d . . . . .
P18 P 1.28142(9) 0.55625(7) 0.35741(4) 0.0250(2) Uani 1 1 d . . . . .
Rh2 Rh 0.69202(3) 0.89339(2) 0.04697(2) 0.02600(8) Uani 1 1 d . . . . .
Rh4 Rh 0.88893(3) 0.00516(2) 0.33921(2) 0.02214(8) Uani 1 1 d . . . . .
Rh5 Rh 1.38995(3) 0.65657(2) 0.30793(2) 0.03238(10) Uani 1 1 d . . . . .
O136 O 0.1546(4) 0.2966(3) 0.46604(19) 0.0814(15) Uani 1 1 d . . . . .
O166 O 0.1865(5) 0.1337(4) 0.1934(2) 0.1006(19) Uani 1 1 d . . . . .


_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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
C992 O91A 1.457(13) . ?
C992 C993 1.515(19) . ?
C992 H992 0.9700 . ?
C992 H991 0.9700 . ?
C993 H993 0.9600 . ?
C993 H994 0.9600 . ?
C993 H995 0.9600 . ?
C994 C995 1.500(17) . ?
C994 H880 0.9600 . ?
C994 H881 0.9600 . ?
C994 H882 0.9600 . ?
C995 O91A 1.402(12) . ?
C995 H5A 0.9700 . ?
C995 H5B 0.9700 . ?
C881 O81B 1.416(14) . ?
C881 C882 1.47(2) . ?
C881 H1A 0.9700 . ?
C881 H1B 0.9700 . ?
C884 O81B 1.417(15) . ?
C884 C883 1.48(2) . ?
C884 H4A 0.9700 . ?
C884 H4B 0.9700 . ?
C883 C882 1.50(2) . ?
C883 H3A 0.9700 . ?
C883 H3B 0.9700 . ?
C882 H2A 0.9700 . ?
C882 H2B 0.9700 . ?
C1 C64 1.388(6) . ?
C1 C43 1.394(6) . ?
C1 P14 1.832(4) . ?
C3 C236 1.361(9) . ?
C3 C195 1.365(8) . ?
C3 H3 0.9300 . ?
C5 C80 1.423(6) . ?
C5 C97 1.429(5) . ?
C5 C11 1.483(6) . ?
C5 Fe9 2.040(4) . ?
C7 C42 1.421(6) . ?
C7 C23 1.434(5) . ?
C7 Fe10 2.052(4) . ?
C7 H7 0.9800 . ?
C8 C114 1.410(6) . ?
C8 C23 1.436(5) . ?
C8 Fe10 2.028(4) . ?
C8 H8 0.9800 . ?
C9 C134 1.387(6) . ?
C9 C26 1.396(6) . ?
C9 H9 0.9300 . ?
C10 C22 1.417(6) . ?
C10 C77 1.426(6) . ?
C10 Fe8 2.039(4) . ?
C10 H10 0.9800 . ?
C11 C12 1.393(6) . ?
C11 C17 1.394(5) . ?
C12 C29 1.389(6) . ?
C12 H12 0.9300 . ?
C15 C25 1.375(6) . ?
C15 C35 1.380(6) . ?
C15 H15 0.9300 . ?
C17 C40 1.394(6) . ?
C17 H17 0.9300 . ?
C22 C126 1.423(6) . ?
C22 C40 1.478(6) . ?
C22 Fe8 2.058(4) . ?
C23 P14 1.801(4) . ?
C23 Fe10 2.043(4) . ?
C25 C26 1.393(6) . ?
C25 H25 0.9300 . ?
C26 P18 1.835(4) . ?
C28 C49 1.414(6) . ?
C28 C99 1.426(6) . ?
C28 Fe10 2.054(4) . ?
C28 H28 0.9800 . ?
C29 C112 1.393(5) . ?
C29 C33 1.476(6) . ?
C31 C80 1.417(6) . ?
C31 C110 1.417(6) . ?
C31 Fe9 2.041(4) . ?
C31 H31 0.9800 . ?
C33 C44 1.419(6) . ?
C33 C49 1.430(6) . ?
C33 Fe10 2.035(4) . ?
C34 C38 1.415(6) . ?
C34 C92 1.424(6) . ?
C34 Fe8 2.053(4) . ?
C34 H34 0.9800 . ?
C35 C134 1.377(6) . ?
C35 H35 0.9300 . ?
C36 C200 1.391(7) . ?
C36 C57 1.392(6) . ?
C36 H36 0.9300 . ?
C38 C59 1.418(6) . ?
C38 Fe8 2.057(4) . ?
C38 H38 0.9800 . ?
C40 C112 1.388(6) . ?
C42 C114 1.412(6) . ?
C42 Fe10 2.052(4) . ?
C42 H42 0.9800 . ?
C43 C106 1.373(6) . ?
C43 H43 0.9300 . ?
C44 C99 1.419(6) . ?
C44 Fe10 2.033(4) . ?
C44 H44 0.9800 . ?
C47 C81 1.382(6) . ?
C47 C121 1.386(6) . ?
C47 H47 0.9300 . ?
C48 C129 1.410(7) . ?
C48 C109 1.413(6) . ?
C48 Fe9 2.037(4) . ?
C48 H48 0.9800 . ?
C49 Fe10 2.037(4) . ?
C49 H49 0.9800 . ?
C53 C143 1.383(6) . ?
C53 C57 1.384(6) . ?
C53 H53 0.9300 . ?
C57 P15 1.830(4) . ?
C59 C87 1.419(6) . ?
C59 Fe8 2.050(4) . ?
C59 H59 0.9800 . ?
C64 C85 1.388(6) . ?
C64 H64 0.9300 . ?
C69 C126 1.412(6) . ?
C69 C77 1.422(7) . ?
C69 Fe8 2.050(4) . ?
C69 H69 0.9800 . ?
C72 C161 1.361(6) . ?
C72 C152 1.370(7) . ?
C72 P15 1.831(4) . ?
C77 Fe8 2.035(4) . ?
C77 H77 0.9800 . ?
C80 Fe9 2.051(4) . ?
C80 H80 0.9800 . ?
C81 C151 1.385(6) . ?
C81 P14 1.825(4) . ?
C85 C93 1.369(6) . ?
C85 H85 0.9300 . ?
C87 C92 1.444(5) . ?
C87 Fe8 2.037(4) . ?
C87 H87 0.9800 . ?
C89 C127 1.404(7) . ?
C89 C226 1.515(6) . ?
C89 Rh4 2.118(4) . ?
C89 H89 0.9800 . ?
C91 C129 1.419(6) . ?
C91 C102 1.425(6) . ?
C91 Fe9 2.048(4) . ?
C91 H91 0.9800 . ?
C92 P18 1.806(4) . ?
C92 Fe8 2.045(4) . ?
C93 C106 1.390(6) . ?
C93 H93 0.9300 . ?
C97 C110 1.424(6) . ?
C97 Fe9 2.034(4) . ?
C97 H97 0.9800 . ?
C99 Fe10 2.051(4) . ?
C99 H99 0.9800 . ?
C101 C143 1.374(7) . ?
C101 C200 1.375(7) . ?
C101 H101 0.9300 . ?
C102 C109 1.445(6) . ?
C102 P15 1.803(5) . ?
C102 Fe9 2.035(4) . ?
C105 C131 1.362(6) . ?
C105 C197 1.494(7) . ?
C105 Rh2 2.197(4) . ?
C105 H105 0.9800 . ?
C106 H106 0.9300 . ?
C107 C145 1.396(7) . ?
C107 C192 1.511(6) . ?
C107 Rh5 2.093(4) . ?
C107 H107 0.9800 . ?
C108 C147 1.403(7) . ?
C108 C205 1.519(7) . ?
C108 Rh2 2.117(4) . ?
C108 H108 0.9800 . ?
C109 Fe9 2.026(4) . ?
C109 H109 0.9800 . ?
C110 Fe9 2.031(4) . ?
C110 H110 0.9800 . ?
C111 C196 1.371(7) . ?
C111 C218 1.506(7) . ?
C111 Rh4 2.205(4) . ?
C111 H111 0.9800 . ?
C112 H112 0.9300 . ?
C114 Fe10 2.043(4) . ?
C114 H114 0.9800 . ?
C115 C171 1.379(7) . ?
C115 C151 1.390(6) . ?
C115 H115 0.9300 . ?
C121 C171 1.375(7) . ?
C121 H121 0.9300 . ?
C126 Fe8 2.058(4) . ?
C126 H126 0.9800 . ?
C127 C185 1.515(6) . ?
C127 Rh4 2.107(4) . ?
C127 H127 0.9800 . ?
C129 Fe9 2.042(4) . ?
C129 H129 0.9800 . ?
C131 C180 1.509(7) . ?
C131 Rh2 2.217(4) . ?
C131 H131 0.9800 . ?
C134 H134 0.9300 . ?
C140 C146 1.384(7) . ?
C140 C183 1.387(6) . ?
C140 P18 1.817(5) . ?
C143 H143 0.9300 . ?
C145 C174 1.504(7) . ?
C145 Rh5 2.122(5) . ?
C145 H145 0.9800 . ?
C146 C195 1.379(7) . ?
C146 H146 0.9300 . ?
C147 C189 1.507(7) . ?
C147 Rh2 2.104(4) . ?
C147 H147 0.9800 . ?
C148 C192 1.510(8) . ?
C148 C228 1.513(7) . ?
C148 H14A 0.9700 . ?
C148 H14B 0.9700 . ?
C151 H151 0.9300 . ?
C152 C214 1.388(8) . ?
C152 H152 0.9300 . ?
C154 C214 1.336(9) . ?
C154 C165 1.352(8) . ?
C154 H154 0.9300 . ?
C155 O166 1.422(8) . ?
C155 C777 1.433(11) . ?
C155 H15C 0.9700 . ?
C155 H15D 0.9700 . ?
C156 O136 1.414(8) . ?
C156 C238 1.542(10) . ?
C156 H15A 0.9700 . ?
C156 H15B 0.9700 . ?
C161 C165 1.395(7) . ?
C161 H161 0.9300 . ?
C164 C196 1.493(7) . ?
C164 C185 1.529(7) . ?
C164 H16A 0.9700 . ?
C164 H16B 0.9700 . ?
C165 H165 0.9300 . ?
C171 H171 0.9300 . ?
C174 C242 1.526(7) . ?
C174 H17A 0.9700 . ?
C174 H17B 0.9700 . ?
C180 C189 1.505(7) . ?
C180 H18A 0.9700 . ?
C180 H18B 0.9700 . ?
C182 C223 1.421(12) . ?
C182 O166 1.431(9) . ?
C182 H18Q 0.9700 . ?
C182 H18W 0.9700 . ?
C183 C236 1.389(8) . ?
C183 H183 0.9300 . ?
C185 H18C 0.9700 . ?
C185 H18D 0.9700 . ?
C189 H18E 0.9700 . ?
C189 H18F 0.9700 . ?
C192 H19A 0.9700 . ?
C192 H19B 0.9700 . ?
C195 H195 0.9300 . ?
C196 Rh4 2.241(4) . ?
C196 H196 0.9800 . ?
C197 C205 1.500(7) . ?
C197 H19C 0.9700 . ?
C197 H19D 0.9700 . ?
C200 H200 0.9300 . ?
C205 H20A 0.9700 . ?
C205 H20B 0.9700 . ?
C214 H214 0.9300 . ?
C218 C226 1.525(7) . ?
C218 H21A 0.9700 . ?
C218 H21B 0.9700 . ?
C223 C777 1.470(13) . ?
C223 H22C 0.9700 . ?
C223 H22D 0.9700 . ?
C226 H22A 0.9700 . ?
C226 H22B 0.9700 . ?
C228 C233 1.363(9) . ?
C228 Rh5 2.225(5) . ?
C228 H228 0.9800 . ?
C233 C242 1.509(9) . ?
C233 Rh5 2.211(5) . ?
C233 H233 0.9800 . ?
C236 H236 0.9300 . ?
C238 H23C 0.9600 . ?
C238 H23D 0.9600 . ?
C238 H23E 0.9600 . ?
C242 H24A 0.9700 . ?
C242 H24B 0.9700 . ?
C249 O136 1.394(8) . ?
C249 C367 1.504(10) . ?
C249 H24C 0.9700 . ?
C249 H24D 0.9700 . ?
C367 H36A 0.9600 . ?
C367 H36B 0.9600 . ?
C367 H36C 0.9600 . ?
C777 H77A 0.9700 . ?
C777 H77B 0.9700 . ?
Cl19 Rh4 2.3696(11) . ?
Cl20 Rh2 2.3545(12) . ?
Cl22 Rh5 2.3815(12) . ?
P14 Rh4 2.3035(11) . ?
P15 Rh2 2.3066(12) . ?
P18 Rh5 2.3143(12) . ?

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
O91A C992 C993 106.5(10) . . ?
O91A C992 H992 110.4 . . ?
C993 C992 H992 110.4 . . ?
O91A C992 H991 110.4 . . ?
C993 C992 H991 110.4 . . ?
H992 C992 H991 108.6 . . ?
C992 C993 H993 109.5 . . ?
C992 C993 H994 109.5 . . ?
H993 C993 H994 109.5 . . ?
C992 C993 H995 109.5 . . ?
H993 C993 H995 109.5 . . ?
H994 C993 H995 109.5 . . ?
C995 C994 H880 109.5 . . ?
C995 C994 H881 109.5 . . ?
H880 C994 H881 109.5 . . ?
C995 C994 H882 109.5 . . ?
H880 C994 H882 109.5 . . ?
H881 C994 H882 109.5 . . ?
O91A C995 C994 106.6(8) . . ?
O91A C995 H5A 110.4 . . ?
C994 C995 H5A 110.4 . . ?
O91A C995 H5B 110.4 . . ?
C994 C995 H5B 110.4 . . ?
H5A C995 H5B 108.6 . . ?
C995 O91A C992 109.8(9) . . ?
O81B C881 C882 102.6(11) . . ?
O81B C881 H1A 111.3 . . ?
C882 C881 H1A 111.3 . . ?
O81B C881 H1B 111.3 . . ?
C882 C881 H1B 111.3 . . ?
H1A C881 H1B 109.2 . . ?
O81B C884 C883 99.7(11) . . ?
O81B C884 H4A 111.8 . . ?
C883 C884 H4A 111.8 . . ?
O81B C884 H4B 111.8 . . ?
C883 C884 H4B 111.8 . . ?
H4A C884 H4B 109.6 . . ?
C884 C883 C882 107.5(12) . . ?
C884 C883 H3A 110.2 . . ?
C882 C883 H3A 110.2 . . ?
C884 C883 H3B 110.2 . . ?
C882 C883 H3B 110.2 . . ?
H3A C883 H3B 108.5 . . ?
C881 C882 C883 104.8(14) . . ?
C881 C882 H2A 110.8 . . ?
C883 C882 H2A 110.8 . . ?
C881 C882 H2B 110.8 . . ?
C883 C882 H2B 110.8 . . ?
H2A C882 H2B 108.9 . . ?
C881 O81B C884 110.2(9) . . ?
C64 C1 C43 118.2(4) . . ?
C64 C1 P14 120.6(3) . . ?
C43 C1 P14 121.1(3) . . ?
C236 C3 C195 120.3(5) . . ?
C236 C3 H3 119.9 . . ?
C195 C3 H3 119.9 . . ?
C80 C5 C97 107.6(4) . . ?
C80 C5 C11 126.7(4) . . ?
C97 C5 C11 125.6(4) . . ?
C80 C5 Fe9 70.1(2) . . ?
C97 C5 Fe9 69.2(2) . . ?
C11 C5 Fe9 124.3(3) . . ?
C42 C7 C23 108.4(4) . . ?
C42 C7 Fe10 69.7(2) . . ?
C23 C7 Fe10 69.2(2) . . ?
C42 C7 H7 125.8 . . ?
C23 C7 H7 125.8 . . ?
Fe10 C7 H7 125.8 . . ?
C114 C8 C23 108.3(4) . . ?
C114 C8 Fe10 70.3(2) . . ?
C23 C8 Fe10 69.9(2) . . ?
C114 C8 H8 125.9 . . ?
C23 C8 H8 125.9 . . ?
Fe10 C8 H8 125.9 . . ?
C134 C9 C26 120.5(4) . . ?
C134 C9 H9 119.8 . . ?
C26 C9 H9 119.8 . . ?
C22 C10 C77 108.2(4) . . ?
C22 C10 Fe8 70.5(2) . . ?
C77 C10 Fe8 69.3(2) . . ?
C22 C10 H10 125.9 . . ?
C77 C10 H10 125.9 . . ?
Fe8 C10 H10 125.9 . . ?
C12 C11 C17 119.2(4) . . ?
C12 C11 C5 120.7(4) . . ?
C17 C11 C5 120.1(4) . . ?
C29 C12 C11 121.3(4) . . ?
C29 C12 H12 119.4 . . ?
C11 C12 H12 119.4 . . ?
C25 C15 C35 120.3(4) . . ?
C25 C15 H15 119.9 . . ?
C35 C15 H15 119.9 . . ?
C40 C17 C11 120.2(4) . . ?
C40 C17 H17 119.9 . . ?
C11 C17 H17 119.9 . . ?
C10 C22 C126 107.6(4) . . ?
C10 C22 C40 127.2(4) . . ?
C126 C22 C40 125.2(4) . . ?
C10 C22 Fe8 69.1(2) . . ?
C126 C22 Fe8 69.8(2) . . ?
C40 C22 Fe8 126.5(3) . . ?
C7 C23 C8 106.7(3) . . ?
C7 C23 P14 128.8(3) . . ?
C8 C23 P14 124.2(3) . . ?
C7 C23 Fe10 69.9(2) . . ?
C8 C23 Fe10 68.8(2) . . ?
P14 C23 Fe10 131.2(2) . . ?
C15 C25 C26 121.3(4) . . ?
C15 C25 H25 119.3 . . ?
C26 C25 H25 119.3 . . ?
C25 C26 C9 117.8(4) . . ?
C25 C26 P18 120.0(3) . . ?
C9 C26 P18 122.1(3) . . ?
C49 C28 C99 107.8(4) . . ?
C49 C28 Fe10 69.1(2) . . ?
C99 C28 Fe10 69.6(2) . . ?
C49 C28 H28 126.1 . . ?
C99 C28 H28 126.1 . . ?
Fe10 C28 H28 126.1 . . ?
C12 C29 C112 118.7(4) . . ?
C12 C29 C33 120.7(4) . . ?
C112 C29 C33 120.6(4) . . ?
C80 C31 C110 108.3(4) . . ?
C80 C31 Fe9 70.1(2) . . ?
C110 C31 Fe9 69.3(2) . . ?
C80 C31 H31 125.8 . . ?
C110 C31 H31 125.8 . . ?
Fe9 C31 H31 125.8 . . ?
C44 C33 C49 107.3(4) . . ?
C44 C33 C29 126.3(4) . . ?
C49 C33 C29 126.4(4) . . ?
C44 C33 Fe10 69.5(2) . . ?
C49 C33 Fe10 69.5(2) . . ?
C29 C33 Fe10 124.6(3) . . ?
C38 C34 C92 109.0(4) . . ?
C38 C34 Fe8 70.0(2) . . ?
C92 C34 Fe8 69.4(2) . . ?
C38 C34 H34 125.5 . . ?
C92 C34 H34 125.5 . . ?
Fe8 C34 H34 125.5 . . ?
C134 C35 C15 119.5(4) . . ?
C134 C35 H35 120.3 . . ?
C15 C35 H35 120.3 . . ?
C200 C36 C57 119.9(5) . . ?
C200 C36 H36 120.0 . . ?
C57 C36 H36 120.0 . . ?
C34 C38 C59 107.9(4) . . ?
C34 C38 Fe8 69.7(2) . . ?
C59 C38 Fe8 69.5(2) . . ?
C34 C38 H38 126.0 . . ?
C59 C38 H38 126.0 . . ?
Fe8 C38 H38 126.0 . . ?
C112 C40 C17 119.6(4) . . ?
C112 C40 C22 119.8(4) . . ?
C17 C40 C22 120.7(4) . . ?
C114 C42 C7 107.9(4) . . ?
C114 C42 Fe10 69.5(2) . . ?
C7 C42 Fe10 69.8(2) . . ?
C114 C42 H42 126.1 . . ?
C7 C42 H42 126.1 . . ?
Fe10 C42 H42 126.1 . . ?
C106 C43 C1 120.9(4) . . ?
C106 C43 H43 119.5 . . ?
C1 C43 H43 119.5 . . ?
C33 C44 C99 108.6(4) . . ?
C33 C44 Fe10 69.7(2) . . ?
C99 C44 Fe10 70.4(2) . . ?
C33 C44 H44 125.7 . . ?
C99 C44 H44 125.7 . . ?
Fe10 C44 H44 125.7 . . ?
C81 C47 C121 120.7(4) . . ?
C81 C47 H47 119.6 . . ?
C121 C47 H47 119.6 . . ?
C129 C48 C109 108.9(4) . . ?
C129 C48 Fe9 70.0(3) . . ?
C109 C48 Fe9 69.2(3) . . ?
C129 C48 H48 125.6 . . ?
C109 C48 H48 125.6 . . ?
Fe9 C48 H48 125.6 . . ?
C28 C49 C33 108.5(4) . . ?
C28 C49 Fe10 70.4(2) . . ?
C33 C49 Fe10 69.4(2) . . ?
C28 C49 H49 125.7 . . ?
C33 C49 H49 125.7 . . ?
Fe10 C49 H49 125.7 . . ?
C143 C53 C57 121.0(4) . . ?
C143 C53 H53 119.5 . . ?
C57 C53 H53 119.5 . . ?
C53 C57 C36 118.7(4) . . ?
C53 C57 P15 120.8(3) . . ?
C36 C57 P15 120.3(3) . . ?
C38 C59 C87 108.5(4) . . ?
C38 C59 Fe8 70.1(2) . . ?
C87 C59 Fe8 69.2(2) . . ?
C38 C59 H59 125.8 . . ?
C87 C59 H59 125.8 . . ?
Fe8 C59 H59 125.8 . . ?
C85 C64 C1 120.5(4) . . ?
C85 C64 H64 119.8 . . ?
C1 C64 H64 119.8 . . ?
C126 C69 C77 107.9(4) . . ?
C126 C69 Fe8 70.2(2) . . ?
C77 C69 Fe8 69.0(2) . . ?
C126 C69 H69 126.0 . . ?
C77 C69 H69 126.0 . . ?
Fe8 C69 H69 126.0 . . ?
C161 C72 C152 117.8(5) . . ?
C161 C72 P15 120.3(4) . . ?
C152 C72 P15 121.9(4) . . ?
C69 C77 C10 107.8(4) . . ?
C69 C77 Fe8 70.2(2) . . ?
C10 C77 Fe8 69.7(2) . . ?
C69 C77 H77 126.1 . . ?
C10 C77 H77 126.1 . . ?
Fe8 C77 H77 126.1 . . ?
C31 C80 C5 108.2(4) . . ?
C31 C80 Fe9 69.3(2) . . ?
C5 C80 Fe9 69.2(2) . . ?
C31 C80 H80 125.9 . . ?
C5 C80 H80 125.9 . . ?
Fe9 C80 H80 125.9 . . ?
C47 C81 C151 119.6(4) . . ?
C47 C81 P14 119.3(3) . . ?
C151 C81 P14 121.1(3) . . ?
C93 C85 C64 120.9(4) . . ?
C93 C85 H85 119.6 . . ?
C64 C85 H85 119.6 . . ?
C59 C87 C92 107.8(4) . . ?
C59 C87 Fe8 70.2(2) . . ?
C92 C87 Fe8 69.6(2) . . ?
C59 C87 H87 126.1 . . ?
C92 C87 H87 126.1 . . ?
Fe8 C87 H87 126.1 . . ?
C127 C89 C226 123.5(4) . . ?
C127 C89 Rh4 70.2(3) . . ?
C226 C89 Rh4 113.3(3) . . ?
C127 C89 H89 114.1 . . ?
C226 C89 H89 114.1 . . ?
Rh4 C89 H89 114.1 . . ?
C129 C91 C102 108.0(4) . . ?
C129 C91 Fe9 69.5(2) . . ?
C102 C91 Fe9 69.1(2) . . ?
C129 C91 H91 126.0 . . ?
C102 C91 H91 126.0 . . ?
Fe9 C91 H91 126.0 . . ?
C34 C92 C87 106.8(4) . . ?
C34 C92 P18 129.3(3) . . ?
C87 C92 P18 123.8(3) . . ?
C34 C92 Fe8 70.0(2) . . ?
C87 C92 Fe8 69.0(2) . . ?
P18 C92 Fe8 128.2(2) . . ?
C85 C93 C106 119.0(4) . . ?
C85 C93 H93 120.5 . . ?
C106 C93 H93 120.5 . . ?
C110 C97 C5 107.9(4) . . ?
C110 C97 Fe9 69.4(2) . . ?
C5 C97 Fe9 69.7(2) . . ?
C110 C97 H97 126.0 . . ?
C5 C97 H97 126.0 . . ?
Fe9 C97 H97 126.0 . . ?
C44 C99 C28 107.9(4) . . ?
C44 C99 Fe10 69.0(2) . . ?
C28 C99 Fe10 69.8(2) . . ?
C44 C99 H99 126.1 . . ?
C28 C99 H99 126.1 . . ?
Fe10 C99 H99 126.1 . . ?
C143 C101 C200 119.8(5) . . ?
C143 C101 H101 120.1 . . ?
C200 C101 H101 120.1 . . ?
C91 C102 C109 107.4(4) . . ?
C91 C102 P15 128.7(3) . . ?
C109 C102 P15 123.6(3) . . ?
C91 C102 Fe9 70.0(2) . . ?
C109 C102 Fe9 68.8(2) . . ?
P15 C102 Fe9 130.7(2) . . ?
C131 C105 C197 126.2(5) . . ?
C131 C105 Rh2 72.8(3) . . ?
C197 C105 Rh2 107.7(3) . . ?
C131 C105 H105 114.0 . . ?
C197 C105 H105 114.0 . . ?
Rh2 C105 H105 114.0 . . ?
C43 C106 C93 120.5(4) . . ?
C43 C106 H106 119.8 . . ?
C93 C106 H106 119.8 . . ?
C145 C107 C192 124.7(5) . . ?
C145 C107 Rh5 71.8(3) . . ?
C192 C107 Rh5 110.1(3) . . ?
C145 C107 H107 114.1 . . ?
C192 C107 H107 114.1 . . ?
Rh5 C107 H107 114.1 . . ?
C147 C108 C205 123.9(4) . . ?
C147 C108 Rh2 70.1(3) . . ?
C205 C108 Rh2 112.9(3) . . ?
C147 C108 H108 114.1 . . ?
C205 C108 H108 114.1 . . ?
Rh2 C108 H108 114.1 . . ?
C48 C109 C102 107.4(4) . . ?
C48 C109 Fe9 70.1(3) . . ?
C102 C109 Fe9 69.5(2) . . ?
C48 C109 H109 126.3 . . ?
C102 C109 H109 126.3 . . ?
Fe9 C109 H109 126.3 . . ?
C31 C110 C97 107.9(4) . . ?
C31 C110 Fe9 70.0(2) . . ?
C97 C110 Fe9 69.6(2) . . ?
C31 C110 H110 126.0 . . ?
C97 C110 H110 126.0 . . ?
Fe9 C110 H110 126.0 . . ?
C196 C111 C218 125.8(5) . . ?
C196 C111 Rh4 73.5(3) . . ?
C218 C111 Rh4 107.3(3) . . ?
C196 C111 H111 114.1 . . ?
C218 C111 H111 114.1 . . ?
Rh4 C111 H111 114.1 . . ?
C40 C112 C29 121.0(4) . . ?
C40 C112 H112 119.5 . . ?
C29 C112 H112 119.5 . . ?
C8 C114 C42 108.8(4) . . ?
C8 C114 Fe10 69.2(2) . . ?
C42 C114 Fe10 70.2(2) . . ?
C8 C114 H114 125.6 . . ?
C42 C114 H114 125.6 . . ?
Fe10 C114 H114 125.6 . . ?
C171 C115 C151 120.4(5) . . ?
C171 C115 H115 119.8 . . ?
C151 C115 H115 119.8 . . ?
C171 C121 C47 119.5(5) . . ?
C171 C121 H121 120.2 . . ?
C47 C121 H121 120.2 . . ?
C69 C126 C22 108.6(4) . . ?
C69 C126 Fe8 69.6(2) . . ?
C22 C126 Fe8 69.8(2) . . ?
C69 C126 H126 125.7 . . ?
C22 C126 H126 125.7 . . ?
Fe8 C126 H126 125.7 . . ?
C89 C127 C185 126.9(5) . . ?
C89 C127 Rh4 71.0(3) . . ?
C185 C127 Rh4 110.8(3) . . ?
C89 C127 H127 113.4 . . ?
C185 C127 H127 113.4 . . ?
Rh4 C127 H127 113.4 . . ?
C48 C129 C91 108.3(4) . . ?
C48 C129 Fe9 69.6(3) . . ?
C91 C129 Fe9 69.9(2) . . ?
C48 C129 H129 125.8 . . ?
C91 C129 H129 125.8 . . ?
Fe9 C129 H129 125.8 . . ?
C105 C131 C180 123.2(5) . . ?
C105 C131 Rh2 71.2(3) . . ?
C180 C131 Rh2 111.2(3) . . ?
C105 C131 H131 114.5 . . ?
C180 C131 H131 114.5 . . ?
Rh2 C131 H131 114.5 . . ?
C35 C134 C9 120.5(4) . . ?
C35 C134 H134 119.7 . . ?
C9 C134 H134 119.7 . . ?
C146 C140 C183 118.7(4) . . ?
C146 C140 P18 121.7(4) . . ?
C183 C140 P18 119.6(4) . . ?
C101 C143 C53 120.0(5) . . ?
C101 C143 H143 120.0 . . ?
C53 C143 H143 120.0 . . ?
C107 C145 C174 124.4(5) . . ?
C107 C145 Rh5 69.5(3) . . ?
C174 C145 Rh5 114.7(3) . . ?
C107 C145 H145 113.6 . . ?
C174 C145 H145 113.6 . . ?
Rh5 C145 H145 113.6 . . ?
C195 C146 C140 120.8(5) . . ?
C195 C146 H146 119.6 . . ?
C140 C146 H146 119.6 . . ?
C108 C147 C189 126.2(5) . . ?
C108 C147 Rh2 71.1(3) . . ?
C189 C147 Rh2 110.9(3) . . ?
C108 C147 H147 113.6 . . ?
C189 C147 H147 113.6 . . ?
Rh2 C147 H147 113.6 . . ?
C192 C148 C228 112.7(5) . . ?
C192 C148 H14A 109.0 . . ?
C228 C148 H14A 109.0 . . ?
C192 C148 H14B 109.0 . . ?
C228 C148 H14B 109.0 . . ?
H14A C148 H14B 107.8 . . ?
C81 C151 C115 119.5(5) . . ?
C81 C151 H151 120.3 . . ?
C115 C151 H151 120.3 . . ?
C72 C152 C214 120.8(6) . . ?
C72 C152 H152 119.6 . . ?
C214 C152 H152 119.6 . . ?
C214 C154 C165 120.3(6) . . ?
C214 C154 H154 119.9 . . ?
C165 C154 H154 119.9 . . ?
O166 C155 C777 109.2(6) . . ?
O166 C155 H15C 109.8 . . ?
C777 C155 H15C 109.8 . . ?
O166 C155 H15D 109.8 . . ?
C777 C155 H15D 109.8 . . ?
H15C C155 H15D 108.3 . . ?
O136 C156 C238 109.7(6) . . ?
O136 C156 H15A 109.7 . . ?
C238 C156 H15A 109.7 . . ?
O136 C156 H15B 109.7 . . ?
C238 C156 H15B 109.7 . . ?
H15A C156 H15B 108.2 . . ?
C72 C161 C165 121.0(5) . . ?
C72 C161 H161 119.5 . . ?
C165 C161 H161 119.5 . . ?
C196 C164 C185 113.0(4) . . ?
C196 C164 H16A 109.0 . . ?
C185 C164 H16A 109.0 . . ?
C196 C164 H16B 109.0 . . ?
C185 C164 H16B 109.0 . . ?
H16A C164 H16B 107.8 . . ?
C154 C165 C161 119.7(6) . . ?
C154 C165 H165 120.2 . . ?
C161 C165 H165 120.2 . . ?
C121 C171 C115 120.2(4) . . ?
C121 C171 H171 119.9 . . ?
C115 C171 H171 119.9 . . ?
C145 C174 C242 113.4(5) . . ?
C145 C174 H17A 108.9 . . ?
C242 C174 H17A 108.9 . . ?
C145 C174 H17B 108.9 . . ?
C242 C174 H17B 108.9 . . ?
H17A C174 H17B 107.7 . . ?
C189 C180 C131 112.8(4) . . ?
C189 C180 H18A 109.0 . . ?
C131 C180 H18A 109.0 . . ?
C189 C180 H18B 109.0 . . ?
C131 C180 H18B 109.0 . . ?
H18A C180 H18B 107.8 . . ?
C223 C182 O166 108.8(7) . . ?
C223 C182 H18Q 109.9 . . ?
O166 C182 H18Q 109.9 . . ?
C223 C182 H18W 109.9 . . ?
O166 C182 H18W 109.9 . . ?
H18Q C182 H18W 108.3 . . ?
C140 C183 C236 119.7(6) . . ?
C140 C183 H183 120.1 . . ?
C236 C183 H183 120.1 . . ?
C127 C185 C164 112.8(4) . . ?
C127 C185 H18C 109.0 . . ?
C164 C185 H18C 109.0 . . ?
C127 C185 H18D 109.0 . . ?
C164 C185 H18D 109.0 . . ?
H18C C185 H18D 107.8 . . ?
C180 C189 C147 114.0(4) . . ?
C180 C189 H18E 108.8 . . ?
C147 C189 H18E 108.8 . . ?
C180 C189 H18F 108.8 . . ?
C147 C189 H18F 108.8 . . ?
H18E C189 H18F 107.7 . . ?
C148 C192 C107 114.5(5) . . ?
C148 C192 H19A 108.6 . . ?
C107 C192 H19A 108.6 . . ?
C148 C192 H19B 108.6 . . ?
C107 C192 H19B 108.6 . . ?
H19A C192 H19B 107.6 . . ?
C3 C195 C146 119.9(6) . . ?
C3 C195 H195 120.0 . . ?
C146 C195 H195 120.0 . . ?
C111 C196 C164 124.9(5) . . ?
C111 C196 Rh4 70.6(3) . . ?
C164 C196 Rh4 111.0(3) . . ?
C111 C196 H196 114.1 . . ?
C164 C196 H196 114.1 . . ?
Rh4 C196 H196 114.1 . . ?
C105 C197 C205 115.0(4) . . ?
C105 C197 H19C 108.5 . . ?
C205 C197 H19C 108.5 . . ?
C105 C197 H19D 108.5 . . ?
C205 C197 H19D 108.5 . . ?
H19C C197 H19D 107.5 . . ?
C101 C200 C36 120.5(5) . . ?
C101 C200 H200 119.8 . . ?
C36 C200 H200 119.8 . . ?
C197 C205 C108 113.7(4) . . ?
C197 C205 H20A 108.8 . . ?
C108 C205 H20A 108.8 . . ?
C197 C205 H20B 108.8 . . ?
C108 C205 H20B 108.8 . . ?
H20A C205 H20B 107.7 . . ?
C154 C214 C152 120.4(6) . . ?
C154 C214 H214 119.8 . . ?
C152 C214 H214 119.8 . . ?
C111 C218 C226 113.5(4) . . ?
C111 C218 H21A 108.9 . . ?
C226 C218 H21A 108.9 . . ?
C111 C218 H21B 108.9 . . ?
C226 C218 H21B 108.9 . . ?
H21A C218 H21B 107.7 . . ?
C182 C223 C777 107.5(7) . . ?
C182 C223 H22C 110.2 . . ?
C777 C223 H22C 110.2 . . ?
C182 C223 H22D 110.2 . . ?
C777 C223 H22D 110.2 . . ?
H22C C223 H22D 108.5 . . ?
C89 C226 C218 113.2(4) . . ?
C89 C226 H22A 108.9 . . ?
C218 C226 H22A 108.9 . . ?
C89 C226 H22B 108.9 . . ?
C218 C226 H22B 108.9 . . ?
H22A C226 H22B 107.7 . . ?
C233 C228 C148 122.7(6) . . ?
C233 C228 Rh5 71.5(3) . . ?
C148 C228 Rh5 110.3(3) . . ?
C233 C228 H228 114.8 . . ?
C148 C228 H228 114.8 . . ?
Rh5 C228 H228 114.8 . . ?
C228 C233 C242 126.8(6) . . ?
C228 C233 Rh5 72.7(3) . . ?
C242 C233 Rh5 109.0(3) . . ?
C228 C233 H233 113.5 . . ?
C242 C233 H233 113.5 . . ?
Rh5 C233 H233 113.5 . . ?
C3 C236 C183 120.6(5) . . ?
C3 C236 H236 119.7 . . ?
C183 C236 H236 119.7 . . ?
C156 C238 H23C 109.5 . . ?
C156 C238 H23D 109.5 . . ?
H23C C238 H23D 109.5 . . ?
C156 C238 H23E 109.5 . . ?
H23C C238 H23E 109.5 . . ?
H23D C238 H23E 109.5 . . ?
C233 C242 C174 112.9(5) . . ?
C233 C242 H24A 109.0 . . ?
C174 C242 H24A 109.0 . . ?
C233 C242 H24B 109.0 . . ?
C174 C242 H24B 109.0 . . ?
H24A C242 H24B 107.8 . . ?
O136 C249 C367 109.8(6) . . ?
O136 C249 H24C 109.7 . . ?
C367 C249 H24C 109.7 . . ?
O136 C249 H24D 109.7 . . ?
C367 C249 H24D 109.7 . . ?
H24C C249 H24D 108.2 . . ?
C249 C367 H36A 109.5 . . ?
C249 C367 H36B 109.5 . . ?
H36A C367 H36B 109.5 . . ?
C249 C367 H36C 109.5 . . ?
H36A C367 H36C 109.5 . . ?
H36B C367 H36C 109.5 . . ?
C155 C777 C223 104.5(9) . . ?
C155 C777 H77A 110.8 . . ?
C223 C777 H77A 110.8 . . ?
C155 C777 H77B 110.8 . . ?
C223 C777 H77B 110.8 . . ?
H77A C777 H77B 108.9 . . ?
C77 Fe8 C87 104.96(18) . . ?
C77 Fe8 C10 40.98(16) . . ?
C87 Fe8 C10 123.52(18) . . ?
C77 Fe8 C92 119.01(18) . . ?
C87 Fe8 C92 41.43(15) . . ?
C10 Fe8 C92 106.64(17) . . ?
C77 Fe8 C59 123.26(18) . . ?
C87 Fe8 C59 40.62(17) . . ?
C10 Fe8 C59 160.46(18) . . ?
C92 Fe8 C59 68.81(16) . . ?
C77 Fe8 C69 40.73(18) . . ?
C87 Fe8 C69 118.82(17) . . ?
C10 Fe8 C69 68.47(18) . . ?
C92 Fe8 C69 154.36(18) . . ?
C59 Fe8 C69 106.96(17) . . ?
C77 Fe8 C34 155.69(18) . . ?
C87 Fe8 C34 68.53(16) . . ?
C10 Fe8 C34 121.83(16) . . ?
C92 Fe8 C34 40.67(16) . . ?
C59 Fe8 C34 67.88(16) . . ?
C69 Fe8 C34 163.08(18) . . ?
C77 Fe8 C38 161.03(17) . . ?
C87 Fe8 C38 68.41(17) . . ?
C10 Fe8 C38 157.39(16) . . ?
C92 Fe8 C38 68.55(17) . . ?
C59 Fe8 C38 40.39(17) . . ?
C69 Fe8 C38 125.52(18) . . ?
C34 Fe8 C38 40.27(15) . . ?
C77 Fe8 C126 68.10(18) . . ?
C87 Fe8 C126 154.81(16) . . ?
C10 Fe8 C126 68.01(18) . . ?
C92 Fe8 C126 163.29(16) . . ?
C59 Fe8 C126 121.57(17) . . ?
C69 Fe8 C126 40.22(17) . . ?
C34 Fe8 C126 127.51(17) . . ?
C38 Fe8 C126 109.91(18) . . ?
C77 Fe8 C22 68.46(17) . . ?
C87 Fe8 C22 161.58(17) . . ?
C10 Fe8 C22 40.46(17) . . ?
C92 Fe8 C22 125.38(16) . . ?
C59 Fe8 C22 157.28(18) . . ?
C69 Fe8 C22 68.16(16) . . ?
C34 Fe8 C22 109.97(16) . . ?
C38 Fe8 C22 123.16(17) . . ?
C126 Fe8 C22 40.45(16) . . ?
C109 Fe9 C110 105.55(18) . . ?
C109 Fe9 C97 119.59(17) . . ?
C110 Fe9 C97 41.02(16) . . ?
C109 Fe9 C102 41.67(17) . . ?
C110 Fe9 C102 121.81(17) . . ?
C97 Fe9 C102 157.07(17) . . ?
C109 Fe9 C48 40.72(18) . . ?
C110 Fe9 C48 121.80(19) . . ?
C97 Fe9 C48 105.40(18) . . ?
C102 Fe9 C48 68.88(18) . . ?
C109 Fe9 C5 155.97(17) . . ?
C110 Fe9 C5 69.02(16) . . ?
C97 Fe9 C5 41.07(15) . . ?
C102 Fe9 C5 160.91(17) . . ?
C48 Fe9 C5 120.91(18) . . ?
C109 Fe9 C31 123.38(18) . . ?
C110 Fe9 C31 40.74(17) . . ?
C97 Fe9 C31 68.67(17) . . ?
C102 Fe9 C31 108.34(17) . . ?
C48 Fe9 C31 159.08(19) . . ?
C5 Fe9 C31 68.62(16) . . ?
C109 Fe9 C129 68.74(19) . . ?
C110 Fe9 C129 158.28(19) . . ?
C97 Fe9 C129 122.16(18) . . ?
C102 Fe9 C129 68.71(18) . . ?
C48 Fe9 C129 40.44(19) . . ?
C5 Fe9 C129 107.20(17) . . ?
C31 Fe9 C129 159.59(19) . . ?
C109 Fe9 C91 69.20(18) . . ?
C110 Fe9 C91 158.92(18) . . ?
C97 Fe9 C91 159.48(17) . . ?
C102 Fe9 C91 40.86(17) . . ?
C48 Fe9 C91 68.30(19) . . ?
C5 Fe9 C91 124.06(17) . . ?
C31 Fe9 C91 124.03(18) . . ?
C129 Fe9 C91 40.59(18) . . ?
C109 Fe9 C80 160.94(18) . . ?
C110 Fe9 C80 68.50(17) . . ?
C97 Fe9 C80 68.58(16) . . ?
C102 Fe9 C80 124.86(17) . . ?
C48 Fe9 C80 157.86(18) . . ?
C5 Fe9 C80 40.70(16) . . ?
C31 Fe9 C80 40.51(16) . . ?
C129 Fe9 C80 123.44(18) . . ?
C91 Fe9 C80 109.47(17) . . ?
C8 Fe10 C44 156.42(17) . . ?
C8 Fe10 C33 119.72(16) . . ?
C44 Fe10 C33 40.82(16) . . ?
C8 Fe10 C49 105.34(17) . . ?
C44 Fe10 C49 68.59(17) . . ?
C33 Fe10 C49 41.10(16) . . ?
C8 Fe10 C23 41.29(15) . . ?
C44 Fe10 C23 160.08(17) . . ?
C33 Fe10 C23 158.97(16) . . ?
C49 Fe10 C23 125.05(17) . . ?
C8 Fe10 C114 40.52(16) . . ?
C44 Fe10 C114 120.50(17) . . ?
C33 Fe10 C114 102.12(17) . . ?
C49 Fe10 C114 117.64(18) . . ?
C23 Fe10 C114 68.71(16) . . ?
C8 Fe10 C99 160.17(17) . . ?
C44 Fe10 C99 40.66(17) . . ?
C33 Fe10 C99 68.63(16) . . ?
C49 Fe10 C99 68.28(18) . . ?
C23 Fe10 C99 126.01(17) . . ?
C114 Fe10 C99 159.26(17) . . ?
C8 Fe10 C42 68.42(16) . . ?
C44 Fe10 C42 105.91(17) . . ?
C33 Fe10 C42 117.07(17) . . ?
C49 Fe10 C42 152.53(17) . . ?
C23 Fe10 C42 68.85(16) . . ?
C114 Fe10 C42 40.33(16) . . ?
C99 Fe10 C42 125.99(17) . . ?
C8 Fe10 C7 68.68(16) . . ?
C44 Fe10 C7 122.78(17) . . ?
C33 Fe10 C7 154.67(17) . . ?
C49 Fe10 C7 164.19(17) . . ?
C23 Fe10 C7 40.98(15) . . ?
C114 Fe10 C7 67.99(17) . . ?
C99 Fe10 C7 112.13(17) . . ?
C42 Fe10 C7 40.52(16) . . ?
C8 Fe10 C28 122.53(18) . . ?
C44 Fe10 C28 68.48(18) . . ?
C33 Fe10 C28 68.74(17) . . ?
C49 Fe10 C28 40.45(17) . . ?
C23 Fe10 C28 111.25(17) . . ?
C114 Fe10 C28 154.99(18) . . ?
C99 Fe10 C28 40.64(17) . . ?
C42 Fe10 C28 164.60(18) . . ?
C7 Fe10 C28 129.49(17) . . ?
C23 P14 C81 102.76(19) . . ?
C23 P14 C1 103.52(18) . . ?
C81 P14 C1 102.43(18) . . ?
C23 P14 Rh4 116.41(13) . . ?
C81 P14 Rh4 113.18(13) . . ?
C1 P14 Rh4 116.65(13) . . ?
C102 P15 C57 103.4(2) . . ?
C102 P15 C72 101.4(2) . . ?
C57 P15 C72 103.3(2) . . ?
C102 P15 Rh2 118.95(14) . . ?
C57 P15 Rh2 115.76(15) . . ?
C72 P15 Rh2 111.97(15) . . ?
C92 P18 C140 102.9(2) . . ?
C92 P18 C26 102.26(19) . . ?
C140 P18 C26 102.73(19) . . ?
C92 P18 Rh5 117.75(14) . . ?
C140 P18 Rh5 112.77(16) . . ?
C26 P18 Rh5 116.45(14) . . ?
C147 Rh2 C108 38.83(18) . . ?
C147 Rh2 C105 96.28(19) . . ?
C108 Rh2 C105 81.65(18) . . ?
C147 Rh2 C131 80.93(18) . . ?
C108 Rh2 C131 89.67(18) . . ?
C105 Rh2 C131 35.94(17) . . ?
C147 Rh2 P15 92.77(13) . . ?
C108 Rh2 P15 97.21(13) . . ?
C105 Rh2 P15 163.65(13) . . ?
C131 Rh2 P15 160.12(13) . . ?
C147 Rh2 Cl20 156.64(14) . . ?
C108 Rh2 Cl20 163.42(14) . . ?
C105 Rh2 Cl20 88.09(14) . . ?
C131 Rh2 Cl20 89.60(13) . . ?
P15 Rh2 Cl20 88.97(4) . . ?
C127 Rh4 C89 38.81(18) . . ?
C127 Rh4 C111 96.73(19) . . ?
C89 Rh4 C111 81.71(17) . . ?
C127 Rh4 C196 80.68(17) . . ?
C89 Rh4 C196 88.92(17) . . ?
C111 Rh4 C196 35.91(18) . . ?
C127 Rh4 P14 92.50(12) . . ?
C89 Rh4 P14 93.43(12) . . ?
C111 Rh4 P14 158.13(14) . . ?
C196 Rh4 P14 165.93(14) . . ?
C127 Rh4 Cl19 154.25(14) . . ?
C89 Rh4 Cl19 165.78(14) . . ?
C111 Rh4 Cl19 88.87(13) . . ?
C196 Rh4 Cl19 89.66(13) . . ?
P14 Rh4 Cl19 91.38(4) . . ?
C107 Rh5 C145 38.68(19) . . ?
C107 Rh5 C233 96.3(2) . . ?
C145 Rh5 C233 80.53(19) . . ?
C107 Rh5 C228 81.73(19) . . ?
C145 Rh5 C228 89.09(19) . . ?
C233 Rh5 C228 35.8(2) . . ?
C107 Rh5 P18 91.84(14) . . ?
C145 Rh5 P18 94.85(13) . . ?
C233 Rh5 P18 159.95(19) . . ?
C228 Rh5 P18 164.26(19) . . ?
C107 Rh5 Cl22 152.01(14) . . ?
C145 Rh5 Cl22 167.58(14) . . ?
C233 Rh5 Cl22 90.03(15) . . ?
C228 Rh5 Cl22 87.89(14) . . ?
P18 Rh5 Cl22 91.28(4) . . ?
C249 O136 C156 112.8(6) . . ?
C155 O166 C182 106.0(6) . . ?

_refine_diff_density_max         1.314
_refine_diff_density_min         -0.828
_refine_diff_density_rms         0.107



