# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2016

####################################################################### 
# 
# 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_1
_database_code_depnum_ccdc_archive 'CCDC 1445275'
_audit_update_record             
;
2016-02-18 deposited with the CCDC.
2016-02-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014
_chemical_formula_moiety         'C32 H12 B F24, C27 H58 B N P2 Rh'
_chemical_formula_sum            'C59 H70 B2 F24 N P2 Rh'
_chemical_formula_weight         1435.63

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh 0.0927 3.6045 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_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+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   36.8146(6)
_cell_length_b                   14.0680(2)
_cell_length_c                   26.0748(4)
_cell_angle_alpha                90
_cell_angle_beta                 103.843(2)
_cell_angle_gamma                90
_cell_volume                     13112.1(4)
_cell_formula_units_Z            8
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    29248
_cell_measurement_theta_min      3.1387
_cell_measurement_theta_max      76.2299

_exptl_crystal_description       block
_exptl_crystal_colour            purple
_exptl_crystal_density_diffrn    1.454
_exptl_crystal_F_000             5856
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_exptl_absorpt_coefficient_mu    3.515
_exptl_absorpt_correction_T_min  0.64093
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'SuperNova (Cu) X-ray Source'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Atlas'
_diffrn_detector_area_resol_mean 10.5035
_diffrn_reflns_number            78635
_diffrn_reflns_av_unetI/netI     0.0316
_diffrn_reflns_av_R_equivalents  0.0295
_diffrn_reflns_limit_h_min       -44
_diffrn_reflns_limit_h_max       46
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_theta_min         3.376
_diffrn_reflns_theta_max         76.415
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.986
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.986
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.986
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             27168
_reflns_number_gt                23115
_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 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 The H atoms attached to B1 and B2 were located in the difference 
 map and allowed to refine freely. 

 Several of the CF3 groups of the [BArF4]- anions have significant 
 disorder. 4 groups were modelled as
 disordered over 2 sites and 2 modelled over 3 sites. All F atoms
 and C232 were also described by the ISOR command. In spite of
 this modelling some of the F atom ellipsoids remain prolate but
 further attempts to model were not successful.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0628P)²+17.5193P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         27168
_refine_ls_number_parameters     1869
_refine_ls_number_restraints     1194
_refine_ls_R_factor_all          0.0520
_refine_ls_R_factor_gt           0.0423
_refine_ls_wR_factor_ref         0.1206
_refine_ls_wR_factor_gt          0.1115
_refine_ls_goodness_of_fit_ref   0.956
_refine_ls_restrained_S_all      1.087
_refine_ls_shift/su_max          0.002
_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
Rh1 Rh 0.12089(2) 0.73284(2) 0.15867(2) 0.02620(5) Uani 1 1 d . . . . .
B1 B 0.12972(8) 0.5839(2) 0.14755(12) 0.0297(6) Uani 1 1 d . . . . .
H1A H 0.1065(10) 0.618(3) 0.1721(13) 0.042(9) Uiso 1 1 d . . . . .
H1B H 0.1399(9) 0.653(2) 0.1194(13) 0.036(8) Uiso 1 1 d . . . . .
C1 C 0.16350(8) 0.53234(19) 0.18610(12) 0.0351(6) Uani 1 1 d . . . . .
C2 C 0.19836(8) 0.5190(2) 0.17362(14) 0.0444(7) Uani 1 1 d . . . . .
H2 H 0.2016 0.5402 0.1404 0.053 Uiso 1 1 calc R U . . .
C3 C 0.22801(10) 0.4757(3) 0.20844(18) 0.0581(9) Uani 1 1 d . . . . .
H3 H 0.2511 0.4667 0.1988 0.070 Uiso 1 1 calc R U . . .
C4 C 0.22417(11) 0.4457(3) 0.25695(18) 0.0620(10) Uani 1 1 d . . . . .
H4 H 0.2447 0.4168 0.2810 0.074 Uiso 1 1 calc R U . . .
C5 C 0.19060(12) 0.4574(3) 0.27096(14) 0.0567(9) Uani 1 1 d . . . . .
H5 H 0.1880 0.4365 0.3045 0.068 Uiso 1 1 calc R U . . .
C6 C 0.16049(10) 0.5002(2) 0.23563(12) 0.0422(6) Uani 1 1 d . . . . .
H6 H 0.1374 0.5075 0.2455 0.051 Uiso 1 1 calc R U . . .
N1 N 0.10382(7) 0.51314(17) 0.10479(9) 0.0352(5) Uani 1 1 d . . . . .
C7 C 0.12684(11) 0.4665(3) 0.07209(15) 0.0557(9) Uani 1 1 d . . . . .
H7A H 0.1109 0.4250 0.0459 0.083 Uiso 1 1 calc R U . . .
H7B H 0.1466 0.4287 0.0949 0.083 Uiso 1 1 calc R U . . .
H7C H 0.1381 0.5152 0.0540 0.083 Uiso 1 1 calc R U . . .
C8 C 0.07256(9) 0.5648(3) 0.06836(12) 0.0470(7) Uani 1 1 d . . . . .
H8A H 0.0829 0.6117 0.0479 0.070 Uiso 1 1 calc R U . . .
H8B H 0.0573 0.5973 0.0890 0.070 Uiso 1 1 calc R U . . .
H8C H 0.0570 0.5194 0.0442 0.070 Uiso 1 1 calc R U . . .
C9 C 0.08711(10) 0.4382(2) 0.13299(14) 0.0494(8) Uani 1 1 d . . . . .
H9A H 0.0713 0.3960 0.1071 0.074 Uiso 1 1 calc R U . . .
H9B H 0.0719 0.4685 0.1546 0.074 Uiso 1 1 calc R U . . .
H9C H 0.1072 0.4012 0.1558 0.074 Uiso 1 1 calc R U . . .
P1 P 0.09407(2) 0.79141(5) 0.22137(2) 0.02823(13) Uani 1 1 d . . . . .
C10 C 0.09306(9) 0.9191(2) 0.24029(12) 0.0402(6) Uani 1 1 d . . . . .
H10 H 0.0889 0.9556 0.2065 0.048 Uiso 1 1 calc R U . . .
C11 C 0.13112(11) 0.9519(2) 0.27343(13) 0.0504(8) Uani 1 1 d . . . . .
H11A H 0.1319 1.0216 0.2743 0.076 Uiso 1 1 calc R U . . .
H11B H 0.1510 0.9279 0.2577 0.076 Uiso 1 1 calc R U . . .
H11C H 0.1348 0.9274 0.3095 0.076 Uiso 1 1 calc R U . . .
C12 C 0.06183(12) 0.9508(3) 0.26666(15) 0.0562(9) Uani 1 1 d . . . . .
H12A H 0.0638 0.9149 0.2994 0.084 Uiso 1 1 calc R U . . .
H12B H 0.0374 0.9388 0.2426 0.084 Uiso 1 1 calc R U . . .
H12C H 0.0645 1.0189 0.2747 0.084 Uiso 1 1 calc R U . . .
C13 C 0.11454(8) 0.7217(2) 0.28197(11) 0.0350(6) Uani 1 1 d . . . . .
H13 H 0.1076 0.6542 0.2724 0.042 Uiso 1 1 calc R U . . .
C14 C 0.15737(9) 0.7232(2) 0.29717(13) 0.0456(7) Uani 1 1 d . . . . .
H14A H 0.1661 0.7855 0.3119 0.068 Uiso 1 1 calc R U . . .
H14B H 0.1669 0.7112 0.2657 0.068 Uiso 1 1 calc R U . . .
H14C H 0.1666 0.6738 0.3236 0.068 Uiso 1 1 calc R U . . .
C15 C 0.09823(11) 0.7430(3) 0.32946(12) 0.0474(8) Uani 1 1 d . . . . .
H15A H 0.1076 0.6963 0.3574 0.071 Uiso 1 1 calc R U . . .
H15B H 0.0709 0.7395 0.3187 0.071 Uiso 1 1 calc R U . . .
H15C H 0.1058 0.8070 0.3428 0.071 Uiso 1 1 calc R U . . .
C16 C 0.04376(8) 0.7579(2) 0.20698(12) 0.0367(6) Uani 1 1 d . . . . .
H16 H 0.0331 0.7862 0.2354 0.044 Uiso 1 1 calc R U . . .
C17 C 0.03600(8) 0.6514(2) 0.20605(13) 0.0429(7) Uani 1 1 d . . . . .
H17A H 0.0089 0.6406 0.1983 0.064 Uiso 1 1 calc R U . . .
H17B H 0.0478 0.6239 0.2405 0.064 Uiso 1 1 calc R U . . .
H17C H 0.0463 0.6213 0.1787 0.064 Uiso 1 1 calc R U . . .
C18 C 0.02333(9) 0.8032(3) 0.15476(14) 0.0542(9) Uani 1 1 d . . . . .
H18A H 0.0331 0.7769 0.1259 0.081 Uiso 1 1 calc R U . . .
H18B H 0.0273 0.8721 0.1566 0.081 Uiso 1 1 calc R U . . .
H18C H -0.0035 0.7897 0.1483 0.081 Uiso 1 1 calc R U . . .
P2 P 0.14320(2) 0.86044(5) 0.12222(3) 0.03499(15) Uani 1 1 d . . . . .
C19 C 0.19511(9) 0.8613(2) 0.13879(14) 0.0481(7) Uani 1 1 d . . . . .
H19 H 0.2031 0.9130 0.1176 0.058 Uiso 1 1 calc R U . . .
C20 C 0.21182(11) 0.7686(3) 0.1246(2) 0.0668(12) Uani 1 1 d . . . . .
H20A H 0.2392 0.7735 0.1336 0.100 Uiso 1 1 calc R U . . .
H20B H 0.2028 0.7566 0.0867 0.100 Uiso 1 1 calc R U . . .
H20C H 0.2042 0.7161 0.1444 0.100 Uiso 1 1 calc R U . . .
C21 C 0.21080(11) 0.8851(3) 0.19695(16) 0.0622(10) Uani 1 1 d . . . . .
H21A H 0.2035 0.8356 0.2189 0.093 Uiso 1 1 calc R U . . .
H21B H 0.2008 0.9465 0.2049 0.093 Uiso 1 1 calc R U . . .
H21C H 0.2381 0.8886 0.2043 0.093 Uiso 1 1 calc R U . . .
C22 C 0.13053(11) 0.8355(2) 0.04975(12) 0.0479(8) Uani 1 1 d . . . . .
H22 H 0.1422 0.7726 0.0457 0.057 Uiso 1 1 calc R U . . .
C23 C 0.08851(12) 0.8203(3) 0.02827(13) 0.0573(9) Uani 1 1 d . . . . .
H23A H 0.0758 0.8820 0.0232 0.086 Uiso 1 1 calc R U . . .
H23B H 0.0787 0.7823 0.0534 0.086 Uiso 1 1 calc R U . . .
H23C H 0.0841 0.7868 -0.0056 0.086 Uiso 1 1 calc R U . . .
C24 C 0.14612(16) 0.9043(3) 0.01440(15) 0.0752(14) Uani 1 1 d . . . . .
H24A H 0.1426 0.8770 -0.0210 0.113 Uiso 1 1 calc R U . . .
H24B H 0.1728 0.9147 0.0296 0.113 Uiso 1 1 calc R U . . .
H24C H 0.1328 0.9651 0.0121 0.113 Uiso 1 1 calc R U . . .
C25 C 0.13073(10) 0.9861(2) 0.13205(12) 0.0454(7) Uani 1 1 d . . . . .
H25 H 0.1338 0.9934 0.1710 0.054 Uiso 1 1 calc R U . . .
C26 C 0.08931(12) 1.0050(3) 0.10761(14) 0.0559(9) Uani 1 1 d . . . . .
H26A H 0.0814 1.0620 0.1237 0.084 Uiso 1 1 calc R U . . .
H26B H 0.0745 0.9504 0.1140 0.084 Uiso 1 1 calc R U . . .
H26C H 0.0855 1.0149 0.0695 0.084 Uiso 1 1 calc R U . . .
C27 C 0.15536(14) 1.0634(3) 0.11642(16) 0.0636(11) Uani 1 1 d . . . . .
H27A H 0.1533 1.0605 0.0783 0.095 Uiso 1 1 calc R U . . .
H27B H 0.1815 1.0532 0.1353 0.095 Uiso 1 1 calc R U . . .
H27C H 0.1471 1.1260 0.1257 0.095 Uiso 1 1 calc R U . . .
Rh2 Rh 0.37496(2) 0.73340(2) 0.36378(2) 0.02916(5) Uani 1 1 d . . . . .
B2 B 0.42443(9) 0.8175(2) 0.36634(14) 0.0369(7) Uani 1 1 d . . . . .
H2A H 0.4204(10) 0.733(3) 0.3526(15) 0.047(10) Uiso 1 1 d . . . . .
H2B H 0.3992(9) 0.840(2) 0.3907(12) 0.032(8) Uiso 1 1 d . . . . .
C51 C 0.42413(8) 0.8871(2) 0.31878(13) 0.0416(7) Uani 1 1 d . . . . .
C52 C 0.42825(10) 0.8541(3) 0.27015(15) 0.0557(9) Uani 1 1 d . . . . .
H52 H 0.4336 0.7888 0.2665 0.067 Uiso 1 1 calc R U . . .
C53 C 0.42472(13) 0.9141(4) 0.22666(17) 0.0763(13) Uani 1 1 d . . . . .
H53 H 0.4280 0.8901 0.1940 0.092 Uiso 1 1 calc R U . . .
C54 C 0.41639(14) 1.0095(4) 0.2316(2) 0.0799(14) Uani 1 1 d . . . . .
H54 H 0.4134 1.0505 0.2020 0.096 Uiso 1 1 calc R U . . .
C55 C 0.41252(12) 1.0447(3) 0.2789(2) 0.0712(12) Uani 1 1 d . . . . .
H55 H 0.4074 1.1103 0.2822 0.085 Uiso 1 1 calc R U . . .
C56 C 0.41603(10) 0.9844(3) 0.32208(17) 0.0560(9) Uani 1 1 d . . . . .
H56 H 0.4129 1.0095 0.3546 0.067 Uiso 1 1 calc R U . . .
N2 N 0.46298(7) 0.81802(19) 0.41265(11) 0.0419(6) Uani 1 1 d . . . . .
C57 C 0.45957(10) 0.7578(3) 0.45855(14) 0.0509(8) Uani 1 1 d . . . . .
H57A H 0.4836 0.7562 0.4846 0.076 Uiso 1 1 calc R U . . .
H57B H 0.4524 0.6930 0.4463 0.076 Uiso 1 1 calc R U . . .
H57C H 0.4404 0.7846 0.4748 0.076 Uiso 1 1 calc R U . . .
C58 C 0.49375(9) 0.7797(3) 0.39040(15) 0.0524(8) Uani 1 1 d . . . . .
H58A H 0.4959 0.8180 0.3599 0.079 Uiso 1 1 calc R U . . .
H58B H 0.4882 0.7137 0.3793 0.079 Uiso 1 1 calc R U . . .
H58C H 0.5174 0.7822 0.4174 0.079 Uiso 1 1 calc R U . . .
C59 C 0.47305(11) 0.9161(3) 0.43252(17) 0.0625(10) Uani 1 1 d . . . . .
H59A H 0.4957 0.9140 0.4612 0.094 Uiso 1 1 calc R U . . .
H59B H 0.4525 0.9432 0.4457 0.094 Uiso 1 1 calc R U . . .
H59C H 0.4775 0.9557 0.4037 0.094 Uiso 1 1 calc R U . . .
P3 P 0.35937(2) 0.58717(5) 0.32936(3) 0.03627(15) Uani 1 1 d . . . . .
C60 C 0.33645(9) 0.5060(2) 0.36857(12) 0.0425(7) Uani 1 1 d . . . . .
H60 H 0.3101 0.5292 0.3626 0.051 Uiso 1 1 calc R U . . .
C61 C 0.35290(10) 0.5145(3) 0.42826(13) 0.0501(8) Uani 1 1 d . . . . .
H61A H 0.3341 0.4953 0.4471 0.075 Uiso 1 1 calc R U . . .
H61B H 0.3603 0.5805 0.4371 0.075 Uiso 1 1 calc R U . . .
H61C H 0.3749 0.4731 0.4386 0.075 Uiso 1 1 calc R U . . .
C62 C 0.33323(13) 0.4010(3) 0.35161(17) 0.0605(9) Uani 1 1 d . . . . .
H62A H 0.3583 0.3749 0.3543 0.091 Uiso 1 1 calc R U . . .
H62B H 0.3186 0.3962 0.3150 0.091 Uiso 1 1 calc R U . . .
H62C H 0.3208 0.3651 0.3747 0.091 Uiso 1 1 calc R U . . .
C63 C 0.32770(11) 0.5810(3) 0.26139(13) 0.0506(8) Uani 1 1 d . . . . .
H63 H 0.3019 0.5704 0.2665 0.061 Uiso 1 1 calc R U . . .
C64 C 0.33495(12) 0.4990(3) 0.22565(14) 0.0606(10) Uani 1 1 d . . . . .
H64A H 0.3143 0.4955 0.1941 0.091 Uiso 1 1 calc R U . . .
H64B H 0.3368 0.4389 0.2450 0.091 Uiso 1 1 calc R U . . .
H64C H 0.3584 0.5108 0.2151 0.091 Uiso 1 1 calc R U . . .
C65 C 0.32631(15) 0.6764(3) 0.23216(15) 0.0724(13) Uani 1 1 d . . . . .
H65A H 0.3507 0.6888 0.2244 0.109 Uiso 1 1 calc R U . . .
H65B H 0.3204 0.7275 0.2544 0.109 Uiso 1 1 calc R U . . .
H65C H 0.3070 0.6736 0.1990 0.109 Uiso 1 1 calc R U . . .
C66 C 0.40190(10) 0.5220(3) 0.32150(14) 0.0500(8) Uani 1 1 d . . . . .
H66 H 0.3931 0.4603 0.3038 0.060 Uiso 1 1 calc R U . . .
C67 C 0.42815(11) 0.4980(3) 0.37380(17) 0.0634(10) Uani 1 1 d . . . . .
H67A H 0.4504 0.4660 0.3676 0.095 Uiso 1 1 calc R U . . .
H67B H 0.4155 0.4558 0.3938 0.095 Uiso 1 1 calc R U . . .
H67C H 0.4357 0.5565 0.3939 0.095 Uiso 1 1 calc R U . . .
C68 C 0.42267(12) 0.5745(3) 0.28548(17) 0.0645(10) Uani 1 1 d . . . . .
H68A H 0.4354 0.6303 0.3040 0.097 Uiso 1 1 calc R U . . .
H68B H 0.4047 0.5948 0.2532 0.097 Uiso 1 1 calc R U . . .
H68C H 0.4412 0.5318 0.2762 0.097 Uiso 1 1 calc R U . . .
P4 P 0.32071(2) 0.78222(5) 0.38187(3) 0.03377(14) Uani 1 1 d . . . . .
C69 C 0.28220(9) 0.7008(2) 0.38997(15) 0.0469(7) Uani 1 1 d . . . . .
H69 H 0.2947 0.6416 0.4066 0.056 Uiso 1 1 calc R U . . .
C70 C 0.25771(10) 0.6705(3) 0.33633(18) 0.0627(10) Uani 1 1 d . . . . .
H70A H 0.2438 0.6128 0.3407 0.094 Uiso 1 1 calc R U . . .
H70B H 0.2736 0.6578 0.3118 0.094 Uiso 1 1 calc R U . . .
H70C H 0.2400 0.7215 0.3221 0.094 Uiso 1 1 calc R U . . .
C71 C 0.25775(11) 0.7352(3) 0.4262(2) 0.0662(12) Uani 1 1 d . . . . .
H71A H 0.2482 0.7990 0.4153 0.099 Uiso 1 1 calc R U . . .
H71B H 0.2727 0.7373 0.4627 0.099 Uiso 1 1 calc R U . . .
H71C H 0.2367 0.6915 0.4237 0.099 Uiso 1 1 calc R U . . .
C72 C 0.29613(10) 0.8653(3) 0.32913(15) 0.0516(8) Uani 1 1 d . . . . .
H72 H 0.2829 0.8236 0.2994 0.062 Uiso 1 1 calc R U . . .
C73 C 0.26568(11) 0.9264(3) 0.34287(18) 0.0642(10) Uani 1 1 d . . . . .
H73A H 0.2760 0.9612 0.3757 0.096 Uiso 1 1 calc R U . . .
H73B H 0.2451 0.8857 0.3475 0.096 Uiso 1 1 calc R U . . .
H73C H 0.2563 0.9717 0.3142 0.096 Uiso 1 1 calc R U . . .
C74 C 0.32269(12) 0.9245(3) 0.30659(18) 0.0649(10) Uani 1 1 d . . . . .
H74A H 0.3086 0.9604 0.2761 0.097 Uiso 1 1 calc R U . . .
H74B H 0.3407 0.8829 0.2955 0.097 Uiso 1 1 calc R U . . .
H74C H 0.3361 0.9689 0.3336 0.097 Uiso 1 1 calc R U . . .
C75 C 0.33102(9) 0.8481(3) 0.44548(13) 0.0455(7) Uani 1 1 d . . . . .
H75 H 0.3064 0.8652 0.4528 0.055 Uiso 1 1 calc R U . . .
C76 C 0.35302(10) 0.9416(3) 0.44644(17) 0.0590(10) Uani 1 1 d . . . . .
H76A H 0.3553 0.9733 0.4805 0.088 Uiso 1 1 calc R U . . .
H76B H 0.3397 0.9833 0.4180 0.088 Uiso 1 1 calc R U . . .
H76C H 0.3780 0.9277 0.4414 0.088 Uiso 1 1 calc R U . . .
C77 C 0.35063(12) 0.7827(3) 0.48976(15) 0.0634(10) Uani 1 1 d . . . . .
H77A H 0.3752 0.7648 0.4844 0.095 Uiso 1 1 calc R U . . .
H77B H 0.3355 0.7254 0.4898 0.095 Uiso 1 1 calc R U . . .
H77C H 0.3539 0.8155 0.5237 0.095 Uiso 1 1 calc R U . . .
B200 B 0.12057(8) 0.2268(2) 0.40780(10) 0.0267(5) Uani 1 1 d . . . . .
C201 C 0.11308(7) 0.11432(19) 0.41833(9) 0.0263(5) Uani 1 1 d . . . . .
C202 C 0.07715(7) 0.07617(19) 0.41050(9) 0.0274(5) Uani 1 1 d . . . . .
H202 H 0.0562 0.1175 0.4005 0.033 Uiso 1 1 calc R U . . .
C203 C 0.07090(7) -0.0207(2) 0.41683(9) 0.0290(5) Uani 1 1 d . . . . .
C204 C 0.10052(7) -0.0834(2) 0.43147(10) 0.0303(5) Uani 1 1 d . . . . .
H204 H 0.0964 -0.1489 0.4368 0.036 Uiso 1 1 calc R U . . .
C205 C 0.13647(7) -0.0473(2) 0.43803(10) 0.0299(5) Uani 1 1 d . . . . .
C206 C 0.14242(7) 0.0489(2) 0.43145(10) 0.0290(5) Uani 1 1 d . . . . .
H206 H 0.1674 0.0711 0.4360 0.035 Uiso 1 1 calc R U . . .
C207 C 0.03155(8) -0.0564(2) 0.40843(11) 0.0360(6) Uani 1 1 d . . . . .
F1 F 0.00938(5) -0.02488(19) 0.36431(9) 0.0674(7) Uani 1 1 d . U . . .
F2 F 0.02885(6) -0.14996(17) 0.40571(14) 0.0877(9) Uani 1 1 d . U . . .
F3 F 0.01569(6) -0.0303(3) 0.44664(10) 0.0865(9) Uani 1 1 d . U . . .
C208 C 0.16938(8) -0.1117(2) 0.45444(12) 0.0398(6) Uani 1 1 d . . . . .
F4 F 0.19663(6) -0.09074(18) 0.43162(12) 0.0751(7) Uani 1 1 d . U . . .
F5 F 0.16135(6) -0.20228(16) 0.44619(13) 0.0811(8) Uani 1 1 d . U . . .
F6 F 0.18488(8) -0.1045(2) 0.50611(10) 0.0912(10) Uani 1 1 d . U . . .
C209 C 0.08816(7) 0.29596(19) 0.42068(9) 0.0274(5) Uani 1 1 d . . . . .
C210 C 0.07072(7) 0.27548(18) 0.46124(9) 0.0285(5) Uani 1 1 d . . . . .
H210 H 0.0772 0.2185 0.4808 0.034 Uiso 1 1 calc R U . . .
C211 C 0.04418(8) 0.33511(19) 0.47420(10) 0.0310(5) Uani 1 1 d . . . . .
C212 C 0.03440(8) 0.4202(2) 0.44744(10) 0.0345(6) Uani 1 1 d . . . . .
H212 H 0.0162 0.4612 0.4560 0.041 Uiso 1 1 calc R U . . .
C213 C 0.05215(8) 0.44298(19) 0.40781(10) 0.0338(6) Uani 1 1 d . . . . .
C214 C 0.07827(7) 0.38281(19) 0.39475(10) 0.0304(5) Uani 1 1 d . . . . .
H214 H 0.0899 0.4009 0.3674 0.036 Uiso 1 1 calc R U . . .
C215 C 0.02441(10) 0.3023(2) 0.51454(12) 0.0427(7) Uani 1 1 d . . . . .
F7 F 0.04756(8) 0.26431(19) 0.55639(8) 0.0714(7) Uani 1 1 d . U . . .
F8 F -0.00075(8) 0.23456(19) 0.49548(11) 0.0739(7) Uani 1 1 d . U . . .
F9 F 0.00635(8) 0.37070(17) 0.53287(11) 0.0792(8) Uani 1 1 d . U . . .
C216 C 0.04108(11) 0.5334(2) 0.37771(12) 0.0461(7) Uani 1 1 d . . . . .
F10 F 0.00372(8) 0.54767(18) 0.36615(11) 0.0793(7) Uani 1 1 d . U . . .
F11 F 0.05481(8) 0.61020(14) 0.40420(9) 0.0646(6) Uani 1 1 d . U . . .
F12 F 0.05071(10) 0.53540(16) 0.33208(9) 0.0856(9) Uani 1 1 d . U . . .
C217 C 0.12131(7) 0.23089(18) 0.34528(9) 0.0265(5) Uani 1 1 d . . . . .
C218 C 0.08852(7) 0.23872(18) 0.30550(10) 0.0283(5) Uani 1 1 d . . . . .
H218 H 0.0654 0.2463 0.3152 0.034 Uiso 1 1 calc R U . . .
C219 C 0.08850(8) 0.23574(19) 0.25217(10) 0.0306(5) Uani 1 1 d . . . . .
C220 C 0.12161(8) 0.22374(18) 0.23639(10) 0.0320(5) Uani 1 1 d . . . . .
H220 H 0.1217 0.2219 0.2000 0.038 Uiso 1 1 calc R U . . .
C221 C 0.15460(8) 0.21447(19) 0.27528(10) 0.0304(5) Uani 1 1 d . . . . .
C222 C 0.15440(7) 0.21781(19) 0.32829(10) 0.0301(5) Uani 1 1 d . . . . .
H222 H 0.1774 0.2110 0.3540 0.036 Uiso 1 1 calc R U . . .
C223 C 0.05208(9) 0.2483(3) 0.21253(11) 0.0424(7) Uani 1 1 d . . . . .
F13 F 0.02507(6) 0.1943(2) 0.22163(8) 0.0676(7) Uani 1 1 d . U . . .
F14 F 0.03912(8) 0.33763(19) 0.21360(11) 0.0825(8) Uani 1 1 d . U . . .
F15 F 0.05423(7) 0.2356(2) 0.16362(7) 0.0730(7) Uani 1 1 d . U . . .
C224 C 0.19076(9) 0.1960(2) 0.26005(12) 0.0405(6) Uani 1 1 d . . . . .
F16 F 0.19112(6) 0.23391(18) 0.21295(8) 0.0595(6) Uani 1 1 d . U . . .
F17 F 0.19714(7) 0.10293(15) 0.25635(13) 0.0767(8) Uani 1 1 d . U . . .
F18 F 0.22028(5) 0.23123(14) 0.29440(7) 0.0453(4) Uani 1 1 d . U . . .
C225 C 0.15940(7) 0.2674(2) 0.44620(10) 0.0307(5) Uani 1 1 d . . . . .
C226 C 0.17411(7) 0.2328(2) 0.49741(10) 0.0325(6) Uani 1 1 d . . . . .
H226 H 0.1626 0.1794 0.5093 0.039 Uiso 1 1 calc R U . . .
C227 C 0.20504(8) 0.2741(2) 0.53143(11) 0.0400(7) Uani 1 1 d D . . . .
C228 C 0.22255(9) 0.3519(3) 0.51583(12) 0.0514(9) Uani 1 1 d . . . . .
H228 H 0.2440 0.3793 0.5387 0.062 Uiso 1 1 calc R U . . .
C229 C 0.20792(9) 0.3890(3) 0.46573(12) 0.0521(9) Uani 1 1 d D . . . .
C230 C 0.17710(9) 0.3472(2) 0.43186(11) 0.0405(7) Uani 1 1 d . . . . .
H230 H 0.1678 0.3740 0.3978 0.049 Uiso 1 1 calc R U . . .
C231 C 0.21944(8) 0.2330(2) 0.58497(13) 0.0570(9) Uani 1 1 d D . . . .
F19 F 0.19034(17) 0.2054(5) 0.6060(2) 0.0299(16) Uani 0.334 1 d D U P A 1
F20 F 0.23702(18) 0.2990(5) 0.6203(2) 0.0395(19) Uani 0.334 1 d D U P A 1
F21 F 0.2411(3) 0.1592(6) 0.5882(3) 0.085(4) Uani 0.334 1 d D U P A 1
F119 F 0.25505(19) 0.1997(7) 0.5910(3) 0.073(3) Uani 0.333 1 d D U P A 2
F120 F 0.1995(3) 0.1709(7) 0.6014(3) 0.096(4) Uani 0.333 1 d D U P A 2
F121 F 0.2258(2) 0.3053(6) 0.6223(3) 0.056(3) Uani 0.333 1 d D U P A 2
F219 F 0.2512(2) 0.2609(8) 0.6128(3) 0.115(4) Uani 0.333 1 d D U P A 3
F220 F 0.2237(2) 0.1336(4) 0.5797(3) 0.068(2) Uani 0.333 1 d D U P A 3
F221 F 0.1937(2) 0.2323(6) 0.6138(3) 0.064(3) Uani 0.333 1 d D U P A 3
C232 C 0.22543(10) 0.4739(3) 0.44775(13) 0.0762(13) Uani 1 1 d D U . . .
F22 F 0.1994(2) 0.5435(5) 0.4274(4) 0.075(3) Uani 0.334 1 d D U P B 1
F23 F 0.2529(3) 0.5151(7) 0.4815(3) 0.113(4) Uani 0.334 1 d D U P B 1
F24 F 0.2384(2) 0.4508(5) 0.4038(2) 0.0467(18) Uani 0.334 1 d D U P B 1
F122 F 0.2532(2) 0.4633(6) 0.4274(4) 0.085(3) Uani 0.333 1 d D U P B 2
F123 F 0.1983(2) 0.5260(5) 0.4094(3) 0.057(2) Uani 0.333 1 d D U P B 2
F124 F 0.2329(2) 0.5425(4) 0.4864(2) 0.057(2) Uani 0.333 1 d D U P B 2
F222 F 0.26633(13) 0.4597(5) 0.4696(3) 0.069(2) Uani 0.333 1 d D U P B 3
F223 F 0.2253(3) 0.4751(7) 0.3973(2) 0.084(3) Uani 0.333 1 d D U P B 3
F224 F 0.2202(2) 0.5538(4) 0.4689(4) 0.079(3) Uani 0.333 1 d D U P B 3
B300 B 0.37155(8) 0.2267(2) 0.58859(12) 0.0304(6) Uani 1 1 d . . . . .
C301 C 0.33823(7) 0.16015(19) 0.55377(10) 0.0304(5) Uani 1 1 d . . . . .
C302 C 0.31771(7) 0.1881(2) 0.50372(11) 0.0321(5) Uani 1 1 d . . . . .
H302 H 0.3244 0.2452 0.4888 0.039 Uiso 1 1 calc R U . . .
C303 C 0.28784(7) 0.1346(2) 0.47508(11) 0.0334(5) Uani 1 1 d . . . . .
C304 C 0.27700(7) 0.0508(2) 0.49529(11) 0.0339(6) Uani 1 1 d . . . . .
H304 H 0.2567 0.0142 0.4757 0.041 Uiso 1 1 calc R U . . .
C305 C 0.29674(7) 0.0223(2) 0.54499(11) 0.0326(5) Uani 1 1 d . . . . .
C306 C 0.32650(7) 0.0760(2) 0.57361(10) 0.0315(5) Uani 1 1 d . . . . .
H306 H 0.3393 0.0549 0.6078 0.038 Uiso 1 1 calc R U . . .
C307 C 0.26842(8) 0.1670(2) 0.42072(13) 0.0423(7) Uani 1 1 d . . . . .
F51 F 0.26084(8) 0.25953(16) 0.41795(10) 0.0708(7) Uani 1 1 d . U . . .
F52 F 0.28925(6) 0.15287(18) 0.38587(7) 0.0583(5) Uani 1 1 d . U . . .
F53 F 0.23616(5) 0.12120(18) 0.40127(8) 0.0614(6) Uani 1 1 d . U . . .
C308 C 0.28567(8) -0.0666(2) 0.56883(12) 0.0388(6) Uani 1 1 d . . . . .
F54 F 0.26769(6) -0.12849(15) 0.53278(8) 0.0580(5) Uani 1 1 d . U . . .
F55 F 0.31509(6) -0.11403(15) 0.59763(9) 0.0590(5) Uani 1 1 d . U . . .
F56 F 0.26342(7) -0.05007(17) 0.60113(10) 0.0664(6) Uani 1 1 d . U . . .
C309 C 0.40312(7) 0.1630(2) 0.62941(11) 0.0322(5) Uani 1 1 d . . . . .
C310 C 0.42259(8) 0.1964(2) 0.67882(11) 0.0376(6) Uani 1 1 d . . . . .
H310 H 0.4156 0.2556 0.6911 0.045 Uiso 1 1 calc R U . . .
C311 C 0.45193(8) 0.1456(3) 0.71052(12) 0.0425(7) Uani 1 1 d . . . . .
C312 C 0.46341(8) 0.0598(3) 0.69437(13) 0.0449(7) Uani 1 1 d . . . . .
H312 H 0.4837 0.0257 0.7161 0.054 Uiso 1 1 calc R U . . .
C313 C 0.44456(8) 0.0244(2) 0.64554(12) 0.0415(6) Uani 1 1 d D . . . .
C314 C 0.41498(8) 0.0755(2) 0.61405(12) 0.0359(6) Uani 1 1 d . . . . .
H314 H 0.4024 0.0498 0.5809 0.043 Uiso 1 1 calc R U . . .
C315 C 0.47116(10) 0.1869(4) 0.76284(14) 0.0600(10) Uani 1 1 d . . . . .
F57 F 0.49352(7) 0.1260(2) 0.79435(9) 0.0830(8) Uani 1 1 d . U . . .
F58 F 0.49256(10) 0.2607(2) 0.75722(11) 0.0959(10) Uani 1 1 d . U . . .
F59 F 0.44702(8) 0.2183(3) 0.78946(9) 0.1009(12) Uani 1 1 d . U . . .
C316 C 0.45471(9) -0.0699(3) 0.62684(15) 0.0595(10) Uani 1 1 d D . . . .
F60 F 0.4464(4) -0.0798(8) 0.5751(2) 0.096(3) Uani 0.60(3) 1 d D U P C 1
F61 F 0.4382(4) -0.1409(4) 0.6465(7) 0.101(3) Uani 0.60(3) 1 d D U P C 1
F62 F 0.49129(14) -0.0883(6) 0.6435(4) 0.068(2) Uani 0.60(3) 1 d D U P C 1
F160 F 0.4864(4) -0.1049(10) 0.6545(6) 0.103(5) Uani 0.40(3) 1 d D U P C 2
F161 F 0.4580(5) -0.0655(8) 0.5765(3) 0.073(3) Uani 0.40(3) 1 d D U P C 2
F162 F 0.4283(4) -0.1349(7) 0.6257(9) 0.101(4) Uani 0.40(3) 1 d D U P C 2
C317 C 0.34996(7) 0.3029(2) 0.61897(10) 0.0313(5) Uani 1 1 d . . . . .
C318 C 0.33880(8) 0.2767(2) 0.66460(11) 0.0343(6) Uani 1 1 d . . . . .
H318 H 0.3455 0.2157 0.6795 0.041 Uiso 1 1 calc R U . . .
C319 C 0.31813(8) 0.3378(2) 0.68893(12) 0.0380(6) Uani 1 1 d . . . . .
C320 C 0.30842(8) 0.4275(2) 0.66936(13) 0.0416(7) Uani 1 1 d . . . . .
H320 H 0.2949 0.4695 0.6865 0.050 Uiso 1 1 calc R U . . .
C321 C 0.31893(8) 0.4547(2) 0.62376(12) 0.0400(6) Uani 1 1 d D . . . .
C322 C 0.33880(8) 0.3931(2) 0.59896(11) 0.0353(6) Uani 1 1 d . . . . .
H322 H 0.3450 0.4131 0.5673 0.042 Uiso 1 1 calc R U . . .
C323 C 0.30670(10) 0.3044(3) 0.73719(14) 0.0484(8) Uani 1 1 d . . . . .
F63 F 0.28283(9) 0.36349(18) 0.75225(12) 0.0878(9) Uani 1 1 d . U . . .
F64 F 0.33570(8) 0.2928(3) 0.77795(9) 0.0907(10) Uani 1 1 d . U . . .
F65 F 0.28944(6) 0.22063(15) 0.73009(9) 0.0564(5) Uani 1 1 d . U . . .
C324 C 0.30849(10) 0.5524(3) 0.60269(13) 0.0590(9) Uani 1 1 d D . . . .
F66 F 0.2725(2) 0.5570(8) 0.5774(6) 0.085(4) Uani 0.334(19) 1 d D U P D 1
F67 F 0.3113(4) 0.6160(5) 0.6408(3) 0.083(4) Uani 0.334(19) 1 d D U P D 1
F68 F 0.3272(5) 0.5842(8) 0.5704(6) 0.103(4) Uani 0.334(19) 1 d D U P D 1
F166 F 0.3266(4) 0.6189(3) 0.6333(3) 0.148(4) Uani 0.666(19) 1 d D U P D 2
F167 F 0.3152(2) 0.5670(5) 0.5556(2) 0.0732(18) Uani 0.666(19) 1 d D U P D 2
F168 F 0.27253(15) 0.5703(6) 0.5955(4) 0.094(2) Uani 0.666(19) 1 d D U P D 2
C325 C 0.39614(7) 0.2789(2) 0.55205(10) 0.0308(5) Uani 1 1 d . . . . .
C326 C 0.41453(7) 0.3654(2) 0.56679(10) 0.0325(5) Uani 1 1 d . . . . .
H326 H 0.4109 0.3970 0.5974 0.039 Uiso 1 1 calc R U . . .
C327 C 0.43779(7) 0.4065(2) 0.53834(11) 0.0355(6) Uani 1 1 d D . . . .
C328 C 0.44495(8) 0.3613(2) 0.49432(11) 0.0370(6) Uani 1 1 d . . . . .
H328 H 0.4612 0.3890 0.4751 0.044 Uiso 1 1 calc R U . . .
C329 C 0.42773(8) 0.2750(2) 0.47951(11) 0.0350(6) Uani 1 1 d D . . . .
C330 C 0.40345(8) 0.2352(2) 0.50741(11) 0.0323(5) Uani 1 1 d . . . . .
H330 H 0.3915 0.1766 0.4957 0.039 Uiso 1 1 calc R U . . .
C331 C 0.45491(8) 0.5011(3) 0.55508(12) 0.0513(8) Uani 1 1 d D . . . .
F69 F 0.42881(14) 0.5687(3) 0.5489(5) 0.108(3) Uani 0.550(8) 1 d D U P E 1
F70 F 0.4792(2) 0.5318(5) 0.5320(3) 0.102(3) Uani 0.550(8) 1 d D U P E 1
F71 F 0.4702(3) 0.5054(5) 0.60592(18) 0.099(3) Uani 0.550(8) 1 d D U P E 1
F169 F 0.49191(12) 0.4939(5) 0.5667(5) 0.109(3) Uani 0.450(8) 1 d D U P E 2
F170 F 0.4465(3) 0.5383(6) 0.5947(4) 0.101(3) Uani 0.450(8) 1 d D U P E 2
F171 F 0.4479(3) 0.5622(4) 0.5162(3) 0.103(3) Uani 0.450(8) 1 d D U P E 2
C332 C 0.43522(8) 0.2217(2) 0.43324(12) 0.0463(7) Uani 1 1 d D . . . .
F72 F 0.4438(4) 0.1318(4) 0.4447(4) 0.070(3) Uani 0.53(3) 1 d D U P F 1
F73 F 0.4074(2) 0.2238(10) 0.3915(3) 0.075(2) Uani 0.53(3) 1 d D U P F 1
F74 F 0.4649(2) 0.2578(7) 0.4184(4) 0.065(2) Uani 0.53(3) 1 d D U P F 1
F172 F 0.4536(6) 0.2698(7) 0.4049(6) 0.088(3) Uani 0.47(3) 1 d D U P F 2
F173 F 0.4544(4) 0.1422(6) 0.4486(4) 0.061(3) Uani 0.47(3) 1 d D U P F 2
F174 F 0.4036(2) 0.1926(13) 0.4006(5) 0.089(4) Uani 0.47(3) 1 d D U P F 2


_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
Rh1 B1 2.150(3) . ?
Rh1 P1 2.2581(6) . ?
Rh1 P2 2.2748(7) . ?
Rh1 H1A 1.76(4) . ?
Rh1 H1B 1.78(3) . ?
B1 C1 1.577(4) . ?
B1 N1 1.623(4) . ?
B1 H1A 1.28(3) . ?
B1 H1B 1.32(3) . ?
C1 C6 1.398(4) . ?
C1 C2 1.410(4) . ?
C2 C3 1.383(5) . ?
C2 H2 0.9500 . ?
C3 C4 1.372(6) . ?
C3 H3 0.9500 . ?
C4 C5 1.380(6) . ?
C4 H4 0.9500 . ?
C5 C6 1.396(5) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
N1 C7 1.490(4) . ?
N1 C8 1.494(4) . ?
N1 C9 1.499(4) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
P1 C13 1.859(3) . ?
P1 C16 1.860(3) . ?
P1 C10 1.866(3) . ?
C10 C11 1.531(5) . ?
C10 C12 1.540(4) . ?
C10 H10 1.0000 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C13 C15 1.529(4) . ?
C13 C14 1.531(4) . ?
C13 H13 1.0000 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C16 C17 1.524(4) . ?
C16 C18 1.528(4) . ?
C16 H16 1.0000 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
P2 C19 1.856(3) . ?
P2 C25 1.859(3) . ?
P2 C22 1.868(3) . ?
C19 C20 1.525(5) . ?
C19 C21 1.526(5) . ?
C19 H19 1.0000 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 C23 1.529(6) . ?
C22 C24 1.539(5) . ?
C22 H22 1.0000 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C25 C26 1.529(5) . ?
C25 C27 1.533(4) . ?
C25 H25 1.0000 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
Rh2 B2 2.159(3) . ?
Rh2 P3 2.2628(7) . ?
Rh2 P4 2.2655(7) . ?
Rh2 H2A 1.77(4) . ?
Rh2 H2B 1.80(3) . ?
B2 C51 1.578(5) . ?
B2 N2 1.629(4) . ?
B2 H2A 1.24(4) . ?
B2 H2B 1.28(3) . ?
C51 C52 1.392(5) . ?
C51 C56 1.408(5) . ?
C52 C53 1.394(6) . ?
C52 H52 0.9500 . ?
C53 C54 1.389(8) . ?
C53 H53 0.9500 . ?
C54 C55 1.367(7) . ?
C54 H54 0.9500 . ?
C55 C56 1.391(6) . ?
C55 H55 0.9500 . ?
C56 H56 0.9500 . ?
N2 C59 1.490(5) . ?
N2 C58 1.492(4) . ?
N2 C57 1.496(4) . ?
C57 H57A 0.9800 . ?
C57 H57B 0.9800 . ?
C57 H57C 0.9800 . ?
C58 H58A 0.9800 . ?
C58 H58B 0.9800 . ?
C58 H58C 0.9800 . ?
C59 H59A 0.9800 . ?
C59 H59B 0.9800 . ?
C59 H59C 0.9800 . ?
P3 C60 1.864(3) . ?
P3 C66 1.867(3) . ?
P3 C63 1.876(3) . ?
C60 C61 1.534(5) . ?
C60 C62 1.537(5) . ?
C60 H60 1.0000 . ?
C61 H61A 0.9800 . ?
C61 H61B 0.9800 . ?
C61 H61C 0.9800 . ?
C62 H62A 0.9800 . ?
C62 H62B 0.9800 . ?
C62 H62C 0.9800 . ?
C63 C65 1.539(6) . ?
C63 C64 1.545(5) . ?
C63 H63 1.0000 . ?
C64 H64A 0.9800 . ?
C64 H64B 0.9800 . ?
C64 H64C 0.9800 . ?
C65 H65A 0.9800 . ?
C65 H65B 0.9800 . ?
C65 H65C 0.9800 . ?
C66 C67 1.509(5) . ?
C66 C68 1.535(6) . ?
C66 H66 1.0000 . ?
C67 H67A 0.9800 . ?
C67 H67B 0.9800 . ?
C67 H67C 0.9800 . ?
C68 H68A 0.9800 . ?
C68 H68B 0.9800 . ?
C68 H68C 0.9800 . ?
P4 C75 1.858(3) . ?
P4 C72 1.866(3) . ?
P4 C69 1.874(3) . ?
C69 C71 1.530(5) . ?
C69 C70 1.532(5) . ?
C69 H69 1.0000 . ?
C70 H70A 0.9800 . ?
C70 H70B 0.9800 . ?
C70 H70C 0.9800 . ?
C71 H71A 0.9800 . ?
C71 H71B 0.9800 . ?
C71 H71C 0.9800 . ?
C72 C74 1.507(5) . ?
C72 C73 1.522(5) . ?
C72 H72 1.0000 . ?
C73 H73A 0.9800 . ?
C73 H73B 0.9800 . ?
C73 H73C 0.9800 . ?
C74 H74A 0.9800 . ?
C74 H74B 0.9800 . ?
C74 H74C 0.9800 . ?
C75 C77 1.518(5) . ?
C75 C76 1.541(5) . ?
C75 H75 1.0000 . ?
C76 H76A 0.9800 . ?
C76 H76B 0.9800 . ?
C76 H76C 0.9800 . ?
C77 H77A 0.9800 . ?
C77 H77B 0.9800 . ?
C77 H77C 0.9800 . ?
B200 C209 1.636(4) . ?
B200 C217 1.638(3) . ?
B200 C225 1.640(4) . ?
B200 C201 1.640(4) . ?
C201 C202 1.397(3) . ?
C201 C206 1.398(4) . ?
C202 C203 1.398(4) . ?
C202 H202 0.9500 . ?
C203 C204 1.383(4) . ?
C203 C207 1.499(4) . ?
C204 C205 1.389(4) . ?
C204 H204 0.9500 . ?
C205 C206 1.388(4) . ?
C205 C208 1.492(4) . ?
C206 H206 0.9500 . ?
C207 F1 1.318(3) . ?
C207 F2 1.320(4) . ?
C207 F3 1.322(4) . ?
C208 F5 1.314(4) . ?
C208 F4 1.317(4) . ?
C208 F6 1.335(4) . ?
C209 C210 1.393(3) . ?
C209 C214 1.402(4) . ?
C210 C211 1.389(4) . ?
C210 H210 0.9500 . ?
C211 C212 1.389(4) . ?
C211 C215 1.488(4) . ?
C212 C213 1.386(4) . ?
C212 H212 0.9500 . ?
C213 C214 1.383(4) . ?
C213 C216 1.499(4) . ?
C214 H214 0.9500 . ?
C215 F9 1.322(4) . ?
C215 F7 1.326(4) . ?
C215 F8 1.339(4) . ?
C216 F11 1.316(4) . ?
C216 F12 1.321(4) . ?
C216 F10 1.350(5) . ?
C217 C218 1.395(4) . ?
C217 C222 1.405(4) . ?
C218 C219 1.391(4) . ?
C218 H218 0.9500 . ?
C219 C220 1.387(4) . ?
C219 C223 1.495(4) . ?
C220 C221 1.390(4) . ?
C220 H220 0.9500 . ?
C221 C222 1.385(4) . ?
C221 C224 1.500(4) . ?
C222 H222 0.9500 . ?
C223 F15 1.309(4) . ?
C223 F13 1.318(4) . ?
C223 F14 1.346(4) . ?
C224 F18 1.328(4) . ?
C224 F17 1.338(4) . ?
C224 F16 1.342(4) . ?
C225 C230 1.393(4) . ?
C225 C226 1.403(4) . ?
C226 C227 1.392(4) . ?
C226 H226 0.9500 . ?
C227 C228 1.380(5) . ?
C227 C231 1.487(4) . ?
C228 C229 1.390(5) . ?
C228 H228 0.9500 . ?
C229 C230 1.390(4) . ?
C229 C232 1.485(5) . ?
C230 H230 0.9500 . ?
C231 F120 1.279(5) . ?
C231 F219 1.280(5) . ?
C231 F21 1.300(5) . ?
C231 F221 1.343(6) . ?
C231 F20 1.358(5) . ?
C231 F119 1.365(5) . ?
C231 F19 1.371(5) . ?
C231 F121 1.389(6) . ?
C231 F220 1.417(5) . ?
C232 F122 1.269(5) . ?
C232 F224 1.286(6) . ?
C232 F23 1.306(5) . ?
C232 F223 1.314(5) . ?
C232 F124 1.375(5) . ?
C232 F22 1.384(6) . ?
C232 F24 1.382(5) . ?
C232 F123 1.435(5) . ?
C232 F222 1.490(5) . ?
B300 C301 1.635(4) . ?
B300 C325 1.637(4) . ?
B300 C309 1.641(4) . ?
B300 C317 1.646(4) . ?
C301 C302 1.399(4) . ?
C301 C306 1.401(4) . ?
C302 C303 1.392(4) . ?
C302 H302 0.9500 . ?
C303 C304 1.388(4) . ?
C303 C307 1.498(4) . ?
C304 C305 1.385(4) . ?
C304 H304 0.9500 . ?
C305 C306 1.391(4) . ?
C305 C308 1.496(4) . ?
C306 H306 0.9500 . ?
C307 F51 1.330(4) . ?
C307 F52 1.337(4) . ?
C307 F53 1.339(4) . ?
C308 F56 1.329(4) . ?
C308 F54 1.335(3) . ?
C308 F55 1.339(4) . ?
C309 C314 1.396(4) . ?
C309 C310 1.398(4) . ?
C310 C311 1.391(4) . ?
C310 H310 0.9500 . ?
C311 C312 1.378(5) . ?
C311 C315 1.496(5) . ?
C312 C313 1.388(5) . ?
C312 H312 0.9500 . ?
C313 C314 1.396(4) . ?
C313 C316 1.492(5) . ?
C314 H314 0.9500 . ?
C315 F59 1.327(5) . ?
C315 F57 1.328(5) . ?
C315 F58 1.332(5) . ?
C316 F160 1.311(6) . ?
C316 F60 1.317(6) . ?
C316 F162 1.329(6) . ?
C316 F61 1.333(5) . ?
C316 F62 1.338(5) . ?
C316 F161 1.348(6) . ?
C317 C322 1.396(4) . ?
C317 C318 1.398(4) . ?
C318 C319 1.397(4) . ?
C318 H318 0.9500 . ?
C319 C320 1.375(5) . ?
C319 C323 1.495(4) . ?
C320 C321 1.389(4) . ?
C320 H320 0.9500 . ?
C321 C322 1.389(4) . ?
C321 C324 1.496(5) . ?
C322 H322 0.9500 . ?
C323 F64 1.324(5) . ?
C323 F65 1.330(4) . ?
C323 F63 1.336(4) . ?
C324 F68 1.289(6) . ?
C324 F166 1.305(5) . ?
C324 F168 1.316(5) . ?
C324 F67 1.322(6) . ?
C324 F167 1.326(5) . ?
C324 F66 1.333(6) . ?
C325 C330 1.398(4) . ?
C325 C326 1.401(4) . ?
C326 C327 1.386(4) . ?
C326 H326 0.9500 . ?
C327 C328 1.391(4) . ?
C327 C331 1.493(4) . ?
C328 C329 1.382(4) . ?
C328 H328 0.9500 . ?
C329 C330 1.397(4) . ?
C329 C332 1.501(4) . ?
C330 H330 0.9500 . ?
C331 F170 1.260(5) . ?
C331 F70 1.268(4) . ?
C331 F171 1.307(5) . ?
C331 F71 1.312(5) . ?
C331 F169 1.327(5) . ?
C331 F69 1.334(5) . ?
C332 F172 1.304(6) . ?
C332 F73 1.305(5) . ?
C332 F72 1.320(5) . ?
C332 F174 1.331(6) . ?
C332 F173 1.331(5) . ?
C332 F74 1.344(5) . ?

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
B1 Rh1 P1 124.03(8) . . ?
B1 Rh1 P2 129.13(8) . . ?
P1 Rh1 P2 106.19(3) . . ?
B1 Rh1 H1A 36.5(11) . . ?
P1 Rh1 H1A 89.2(11) . . ?
P2 Rh1 H1A 164.3(11) . . ?
B1 Rh1 H1B 37.8(11) . . ?
P1 Rh1 H1B 161.8(11) . . ?
P2 Rh1 H1B 91.7(11) . . ?
H1A Rh1 H1B 73.1(15) . . ?
C1 B1 N1 113.6(2) . . ?
C1 B1 Rh1 118.95(19) . . ?
N1 B1 Rh1 127.40(19) . . ?
C1 B1 H1A 112.0(16) . . ?
N1 B1 H1A 102.8(16) . . ?
Rh1 B1 H1A 54.9(16) . . ?
C1 B1 H1B 113.9(14) . . ?
N1 B1 H1B 105.4(14) . . ?
Rh1 B1 H1B 55.6(14) . . ?
H1A B1 H1B 108(2) . . ?
C6 C1 C2 116.6(3) . . ?
C6 C1 B1 120.9(3) . . ?
C2 C1 B1 122.5(3) . . ?
C3 C2 C1 121.8(3) . . ?
C3 C2 H2 119.1 . . ?
C1 C2 H2 119.1 . . ?
C4 C3 C2 120.1(4) . . ?
C4 C3 H3 120.0 . . ?
C2 C3 H3 120.0 . . ?
C3 C4 C5 120.2(3) . . ?
C3 C4 H4 119.9 . . ?
C5 C4 H4 119.9 . . ?
C4 C5 C6 119.8(4) . . ?
C4 C5 H5 120.1 . . ?
C6 C5 H5 120.1 . . ?
C5 C6 C1 121.5(3) . . ?
C5 C6 H6 119.2 . . ?
C1 C6 H6 119.2 . . ?
C7 N1 C8 107.9(3) . . ?
C7 N1 C9 109.1(3) . . ?
C8 N1 C9 108.1(2) . . ?
C7 N1 B1 110.0(2) . . ?
C8 N1 B1 112.0(2) . . ?
C9 N1 B1 109.7(2) . . ?
N1 C7 H7A 109.5 . . ?
N1 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
N1 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C8 H8A 109.5 . . ?
N1 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N1 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
N1 C9 H9A 109.5 . . ?
N1 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
N1 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C13 P1 C16 102.67(13) . . ?
C13 P1 C10 108.22(13) . . ?
C16 P1 C10 102.45(14) . . ?
C13 P1 Rh1 105.33(10) . . ?
C16 P1 Rh1 110.37(10) . . ?
C10 P1 Rh1 125.63(9) . . ?
C11 C10 C12 109.9(3) . . ?
C11 C10 P1 111.5(2) . . ?
C12 C10 P1 117.5(2) . . ?
C11 C10 H10 105.7 . . ?
C12 C10 H10 105.7 . . ?
P1 C10 H10 105.7 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C15 C13 C14 111.5(3) . . ?
C15 C13 P1 115.3(2) . . ?
C14 C13 P1 113.3(2) . . ?
C15 C13 H13 105.2 . . ?
C14 C13 H13 105.2 . . ?
P1 C13 H13 105.2 . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C13 C15 H15A 109.5 . . ?
C13 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C13 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C17 C16 C18 110.2(3) . . ?
C17 C16 P1 115.2(2) . . ?
C18 C16 P1 109.1(2) . . ?
C17 C16 H16 107.3 . . ?
C18 C16 H16 107.3 . . ?
P1 C16 H16 107.3 . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C16 C18 H18A 109.5 . . ?
C16 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C16 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C19 P2 C25 103.68(16) . . ?
C19 P2 C22 103.34(16) . . ?
C25 P2 C22 107.95(15) . . ?
C19 P2 Rh1 111.25(11) . . ?
C25 P2 Rh1 124.52(10) . . ?
C22 P2 Rh1 104.27(10) . . ?
C20 C19 C21 110.5(4) . . ?
C20 C19 P2 113.0(2) . . ?
C21 C19 P2 110.9(2) . . ?
C20 C19 H19 107.4 . . ?
C21 C19 H19 107.4 . . ?
P2 C19 H19 107.4 . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C19 C21 H21A 109.5 . . ?
C19 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C19 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C23 C22 C24 111.0(3) . . ?
C23 C22 P2 112.5(2) . . ?
C24 C22 P2 116.7(3) . . ?
C23 C22 H22 105.2 . . ?
C24 C22 H22 105.2 . . ?
P2 C22 H22 105.2 . . ?
C22 C23 H23A 109.5 . . ?
C22 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C22 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C22 C24 H24A 109.5 . . ?
C22 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C22 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C26 C25 C27 111.1(3) . . ?
C26 C25 P2 111.3(2) . . ?
C27 C25 P2 117.2(3) . . ?
C26 C25 H25 105.4 . . ?
C27 C25 H25 105.4 . . ?
P2 C25 H25 105.4 . . ?
C25 C26 H26A 109.5 . . ?
C25 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C25 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C25 C27 H27A 109.5 . . ?
C25 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
C25 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
B2 Rh2 P3 129.97(9) . . ?
B2 Rh2 P4 127.33(9) . . ?
P3 Rh2 P4 101.86(3) . . ?
B2 Rh2 H2A 35.2(12) . . ?
P3 Rh2 H2A 95.2(12) . . ?
P4 Rh2 H2A 162.4(12) . . ?
B2 Rh2 H2B 36.4(10) . . ?
P3 Rh2 H2B 165.3(10) . . ?
P4 Rh2 H2B 92.7(10) . . ?
H2A Rh2 H2B 70.6(15) . . ?
C51 B2 N2 114.9(2) . . ?
C51 B2 Rh2 117.9(2) . . ?
N2 B2 Rh2 127.2(2) . . ?
C51 B2 H2A 113.0(18) . . ?
N2 B2 H2A 103.9(17) . . ?
Rh2 B2 H2A 54.9(17) . . ?
C51 B2 H2B 111.5(14) . . ?
N2 B2 H2B 103.7(14) . . ?
Rh2 B2 H2B 56.4(14) . . ?
H2A B2 H2B 109(2) . . ?
C52 C51 C56 116.8(3) . . ?
C52 C51 B2 121.8(3) . . ?
C56 C51 B2 121.1(3) . . ?
C51 C52 C53 122.0(4) . . ?
C51 C52 H52 119.0 . . ?
C53 C52 H52 119.0 . . ?
C54 C53 C52 119.2(5) . . ?
C54 C53 H53 120.4 . . ?
C52 C53 H53 120.4 . . ?
C55 C54 C53 120.5(4) . . ?
C55 C54 H54 119.8 . . ?
C53 C54 H54 119.8 . . ?
C54 C55 C56 120.0(4) . . ?
C54 C55 H55 120.0 . . ?
C56 C55 H55 120.0 . . ?
C55 C56 C51 121.6(4) . . ?
C55 C56 H56 119.2 . . ?
C51 C56 H56 119.2 . . ?
C59 N2 C58 108.7(3) . . ?
C59 N2 C57 108.0(3) . . ?
C58 N2 C57 108.9(3) . . ?
C59 N2 B2 111.3(3) . . ?
C58 N2 B2 108.6(3) . . ?
C57 N2 B2 111.4(2) . . ?
N2 C57 H57A 109.5 . . ?
N2 C57 H57B 109.5 . . ?
H57A C57 H57B 109.5 . . ?
N2 C57 H57C 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
N2 C58 H58A 109.5 . . ?
N2 C58 H58B 109.5 . . ?
H58A C58 H58B 109.5 . . ?
N2 C58 H58C 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
N2 C59 H59A 109.5 . . ?
N2 C59 H59B 109.5 . . ?
H59A C59 H59B 109.5 . . ?
N2 C59 H59C 109.5 . . ?
H59A C59 H59C 109.5 . . ?
H59B C59 H59C 109.5 . . ?
C60 P3 C66 105.12(16) . . ?
C60 P3 C63 103.25(16) . . ?
C66 P3 C63 102.79(17) . . ?
C60 P3 Rh2 116.41(10) . . ?
C66 P3 Rh2 110.48(12) . . ?
C63 P3 Rh2 117.29(12) . . ?
C61 C60 C62 110.6(3) . . ?
C61 C60 P3 112.8(2) . . ?
C62 C60 P3 116.4(3) . . ?
C61 C60 H60 105.3 . . ?
C62 C60 H60 105.3 . . ?
P3 C60 H60 105.3 . . ?
C60 C61 H61A 109.5 . . ?
C60 C61 H61B 109.5 . . ?
H61A C61 H61B 109.5 . . ?
C60 C61 H61C 109.5 . . ?
H61A C61 H61C 109.5 . . ?
H61B C61 H61C 109.5 . . ?
C60 C62 H62A 109.5 . . ?
C60 C62 H62B 109.5 . . ?
H62A C62 H62B 109.5 . . ?
C60 C62 H62C 109.5 . . ?
H62A C62 H62C 109.5 . . ?
H62B C62 H62C 109.5 . . ?
C65 C63 C64 110.0(3) . . ?
C65 C63 P3 111.5(3) . . ?
C64 C63 P3 116.5(3) . . ?
C65 C63 H63 106.0 . . ?
C64 C63 H63 106.0 . . ?
P3 C63 H63 106.0 . . ?
C63 C64 H64A 109.5 . . ?
C63 C64 H64B 109.5 . . ?
H64A C64 H64B 109.5 . . ?
C63 C64 H64C 109.5 . . ?
H64A C64 H64C 109.5 . . ?
H64B C64 H64C 109.5 . . ?
C63 C65 H65A 109.5 . . ?
C63 C65 H65B 109.5 . . ?
H65A C65 H65B 109.5 . . ?
C63 C65 H65C 109.5 . . ?
H65A C65 H65C 109.5 . . ?
H65B C65 H65C 109.5 . . ?
C67 C66 C68 110.8(3) . . ?
C67 C66 P3 112.5(2) . . ?
C68 C66 P3 112.6(3) . . ?
C67 C66 H66 106.8 . . ?
C68 C66 H66 106.8 . . ?
P3 C66 H66 106.8 . . ?
C66 C67 H67A 109.5 . . ?
C66 C67 H67B 109.5 . . ?
H67A C67 H67B 109.5 . . ?
C66 C67 H67C 109.5 . . ?
H67A C67 H67C 109.5 . . ?
H67B C67 H67C 109.5 . . ?
C66 C68 H68A 109.5 . . ?
C66 C68 H68B 109.5 . . ?
H68A C68 H68B 109.5 . . ?
C66 C68 H68C 109.5 . . ?
H68A C68 H68C 109.5 . . ?
H68B C68 H68C 109.5 . . ?
C75 P4 C72 107.74(17) . . ?
C75 P4 C69 101.70(16) . . ?
C72 P4 C69 102.66(16) . . ?
C75 P4 Rh2 109.58(10) . . ?
C72 P4 Rh2 109.44(12) . . ?
C69 P4 Rh2 124.53(10) . . ?
C71 C69 C70 110.3(3) . . ?
C71 C69 P4 116.7(2) . . ?
C70 C69 P4 111.3(3) . . ?
C71 C69 H69 105.9 . . ?
C70 C69 H69 105.9 . . ?
P4 C69 H69 105.9 . . ?
C69 C70 H70A 109.5 . . ?
C69 C70 H70B 109.5 . . ?
H70A C70 H70B 109.5 . . ?
C69 C70 H70C 109.5 . . ?
H70A C70 H70C 109.5 . . ?
H70B C70 H70C 109.5 . . ?
C69 C71 H71A 109.5 . . ?
C69 C71 H71B 109.5 . . ?
H71A C71 H71B 109.5 . . ?
C69 C71 H71C 109.5 . . ?
H71A C71 H71C 109.5 . . ?
H71B C71 H71C 109.5 . . ?
C74 C72 C73 111.3(3) . . ?
C74 C72 P4 112.8(3) . . ?
C73 C72 P4 115.8(3) . . ?
C74 C72 H72 105.3 . . ?
C73 C72 H72 105.3 . . ?
P4 C72 H72 105.3 . . ?
C72 C73 H73A 109.5 . . ?
C72 C73 H73B 109.5 . . ?
H73A C73 H73B 109.5 . . ?
C72 C73 H73C 109.5 . . ?
H73A C73 H73C 109.5 . . ?
H73B C73 H73C 109.5 . . ?
C72 C74 H74A 109.5 . . ?
C72 C74 H74B 109.5 . . ?
H74A C74 H74B 109.5 . . ?
C72 C74 H74C 109.5 . . ?
H74A C74 H74C 109.5 . . ?
H74B C74 H74C 109.5 . . ?
C77 C75 C76 110.7(3) . . ?
C77 C75 P4 109.5(2) . . ?
C76 C75 P4 115.7(2) . . ?
C77 C75 H75 106.8 . . ?
C76 C75 H75 106.8 . . ?
P4 C75 H75 106.8 . . ?
C75 C76 H76A 109.5 . . ?
C75 C76 H76B 109.5 . . ?
H76A C76 H76B 109.5 . . ?
C75 C76 H76C 109.5 . . ?
H76A C76 H76C 109.5 . . ?
H76B C76 H76C 109.5 . . ?
C75 C77 H77A 109.5 . . ?
C75 C77 H77B 109.5 . . ?
H77A C77 H77B 109.5 . . ?
C75 C77 H77C 109.5 . . ?
H77A C77 H77C 109.5 . . ?
H77B C77 H77C 109.5 . . ?
C209 B200 C217 111.7(2) . . ?
C209 B200 C225 103.8(2) . . ?
C217 B200 C225 112.1(2) . . ?
C209 B200 C201 112.3(2) . . ?
C217 B200 C201 104.1(2) . . ?
C225 B200 C201 113.0(2) . . ?
C202 C201 C206 115.6(2) . . ?
C202 C201 B200 122.5(2) . . ?
C206 C201 B200 121.7(2) . . ?
C201 C202 C203 122.3(2) . . ?
C201 C202 H202 118.9 . . ?
C203 C202 H202 118.9 . . ?
C204 C203 C202 120.8(2) . . ?
C204 C203 C207 119.8(2) . . ?
C202 C203 C207 119.3(2) . . ?
C203 C204 C205 117.8(3) . . ?
C203 C204 H204 121.1 . . ?
C205 C204 H204 121.1 . . ?
C206 C205 C204 121.0(2) . . ?
C206 C205 C208 119.1(2) . . ?
C204 C205 C208 119.8(3) . . ?
C205 C206 C201 122.4(2) . . ?
C205 C206 H206 118.8 . . ?
C201 C206 H206 118.8 . . ?
F1 C207 F2 105.4(3) . . ?
F1 C207 F3 105.7(3) . . ?
F2 C207 F3 106.0(3) . . ?
F1 C207 C203 112.9(2) . . ?
F2 C207 C203 113.6(3) . . ?
F3 C207 C203 112.5(2) . . ?
F5 C208 F4 108.0(3) . . ?
F5 C208 F6 105.3(3) . . ?
F4 C208 F6 104.5(3) . . ?
F5 C208 C205 114.0(3) . . ?
F4 C208 C205 112.8(3) . . ?
F6 C208 C205 111.4(3) . . ?
C210 C209 C214 115.6(2) . . ?
C210 C209 B200 121.6(2) . . ?
C214 C209 B200 122.5(2) . . ?
C211 C210 C209 122.6(2) . . ?
C211 C210 H210 118.7 . . ?
C209 C210 H210 118.7 . . ?
C212 C211 C210 120.7(2) . . ?
C212 C211 C215 120.7(3) . . ?
C210 C211 C215 118.4(2) . . ?
C213 C212 C211 117.5(3) . . ?
C213 C212 H212 121.2 . . ?
C211 C212 H212 121.2 . . ?
C214 C213 C212 121.4(3) . . ?
C214 C213 C216 120.6(3) . . ?
C212 C213 C216 118.0(3) . . ?
C213 C214 C209 122.0(2) . . ?
C213 C214 H214 119.0 . . ?
C209 C214 H214 119.0 . . ?
F9 C215 F7 106.0(3) . . ?
F9 C215 F8 106.8(3) . . ?
F7 C215 F8 105.6(3) . . ?
F9 C215 C211 113.8(3) . . ?
F7 C215 C211 112.3(3) . . ?
F8 C215 C211 111.7(3) . . ?
F11 C216 F12 107.7(3) . . ?
F11 C216 F10 103.8(3) . . ?
F12 C216 F10 105.9(3) . . ?
F11 C216 C213 113.5(3) . . ?
F12 C216 C213 113.0(3) . . ?
F10 C216 C213 112.2(3) . . ?
C218 C217 C222 115.9(2) . . ?
C218 C217 B200 121.7(2) . . ?
C222 C217 B200 122.1(2) . . ?
C219 C218 C217 122.3(2) . . ?
C219 C218 H218 118.9 . . ?
C217 C218 H218 118.9 . . ?
C220 C219 C218 120.7(2) . . ?
C220 C219 C223 121.1(2) . . ?
C218 C219 C223 118.3(3) . . ?
C219 C220 C221 118.1(2) . . ?
C219 C220 H220 120.9 . . ?
C221 C220 H220 120.9 . . ?
C222 C221 C220 120.9(2) . . ?
C222 C221 C224 119.2(3) . . ?
C220 C221 C224 119.9(2) . . ?
C221 C222 C217 122.1(2) . . ?
C221 C222 H222 118.9 . . ?
C217 C222 H222 118.9 . . ?
F15 C223 F13 108.7(3) . . ?
F15 C223 F14 104.6(3) . . ?
F13 C223 F14 104.4(3) . . ?
F15 C223 C219 113.8(3) . . ?
F13 C223 C219 113.4(2) . . ?
F14 C223 C219 111.1(3) . . ?
F18 C224 F17 106.5(3) . . ?
F18 C224 F16 106.4(2) . . ?
F17 C224 F16 106.4(3) . . ?
F18 C224 C221 113.0(2) . . ?
F17 C224 C221 111.8(2) . . ?
F16 C224 C221 112.2(3) . . ?
C230 C225 C226 115.9(2) . . ?
C230 C225 B200 120.8(2) . . ?
C226 C225 B200 122.8(2) . . ?
C227 C226 C225 122.1(3) . . ?
C227 C226 H226 118.9 . . ?
C225 C226 H226 118.9 . . ?
C228 C227 C226 120.8(3) . . ?
C228 C227 C231 119.9(3) . . ?
C226 C227 C231 119.3(3) . . ?
C227 C228 C229 118.1(3) . . ?
C227 C228 H228 120.9 . . ?
C229 C228 H228 120.9 . . ?
C230 C229 C228 120.8(3) . . ?
C230 C229 C232 119.3(3) . . ?
C228 C229 C232 119.9(3) . . ?
C229 C230 C225 122.2(3) . . ?
C229 C230 H230 118.9 . . ?
C225 C230 H230 118.9 . . ?
F219 C231 F221 110.7(5) . . ?
F21 C231 F20 108.4(4) . . ?
F120 C231 F119 109.9(5) . . ?
F21 C231 F19 105.9(5) . . ?
F20 C231 F19 102.4(4) . . ?
F120 C231 F121 106.3(5) . . ?
F119 C231 F121 100.0(4) . . ?
F219 C231 F220 104.5(5) . . ?
F221 C231 F220 99.0(4) . . ?
F120 C231 C227 118.4(4) . . ?
F219 C231 C227 119.0(5) . . ?
F21 C231 C227 116.6(4) . . ?
F221 C231 C227 112.8(4) . . ?
F20 C231 C227 112.1(4) . . ?
F119 C231 C227 111.0(4) . . ?
F19 C231 C227 110.3(3) . . ?
F121 C231 C227 109.6(4) . . ?
F220 C231 C227 108.4(3) . . ?
F224 C232 F223 117.0(5) . . ?
F122 C232 F124 110.4(5) . . ?
F23 C232 F22 107.3(5) . . ?
F23 C232 F24 107.3(5) . . ?
F22 C232 F24 101.1(4) . . ?
F122 C232 F123 105.4(5) . . ?
F124 C232 F123 97.9(4) . . ?
F122 C232 C229 119.4(5) . . ?
F224 C232 C229 116.5(4) . . ?
F23 C232 C229 118.0(5) . . ?
F223 C232 C229 115.3(4) . . ?
F124 C232 C229 111.0(4) . . ?
F22 C232 C229 112.2(4) . . ?
F24 C232 C229 109.6(4) . . ?
F123 C232 C229 110.4(4) . . ?
F224 C232 F222 101.1(4) . . ?
F223 C232 F222 98.3(4) . . ?
C229 C232 F222 104.3(3) . . ?
C301 B300 C325 112.3(2) . . ?
C301 B300 C309 111.6(2) . . ?
C325 B300 C309 102.6(2) . . ?
C301 B300 C317 104.8(2) . . ?
C325 B300 C317 112.7(2) . . ?
C309 B300 C317 113.1(2) . . ?
C302 C301 C306 115.9(2) . . ?
C302 C301 B300 121.6(2) . . ?
C306 C301 B300 122.4(2) . . ?
C303 C302 C301 122.0(3) . . ?
C303 C302 H302 119.0 . . ?
C301 C302 H302 119.0 . . ?
C304 C303 C302 121.1(3) . . ?
C304 C303 C307 120.1(3) . . ?
C302 C303 C307 118.7(3) . . ?
C305 C304 C303 117.8(2) . . ?
C305 C304 H304 121.1 . . ?
C303 C304 H304 121.1 . . ?
C304 C305 C306 121.0(3) . . ?
C304 C305 C308 119.8(2) . . ?
C306 C305 C308 119.2(3) . . ?
C305 C306 C301 122.2(3) . . ?
C305 C306 H306 118.9 . . ?
C301 C306 H306 118.9 . . ?
F51 C307 F52 104.8(3) . . ?
F51 C307 F53 107.1(3) . . ?
F52 C307 F53 105.8(3) . . ?
F51 C307 C303 113.3(3) . . ?
F52 C307 C303 112.1(2) . . ?
F53 C307 C303 113.1(3) . . ?
F56 C308 F54 106.5(2) . . ?
F56 C308 F55 105.7(3) . . ?
F54 C308 F55 105.5(3) . . ?
F56 C308 C305 112.8(3) . . ?
F54 C308 C305 113.0(2) . . ?
F55 C308 C305 112.7(2) . . ?
C314 C309 C310 115.8(3) . . ?
C314 C309 B300 121.1(2) . . ?
C310 C309 B300 122.8(3) . . ?
C311 C310 C309 121.9(3) . . ?
C311 C310 H310 119.0 . . ?
C309 C310 H310 119.0 . . ?
C312 C311 C310 121.4(3) . . ?
C312 C311 C315 120.4(3) . . ?
C310 C311 C315 118.2(3) . . ?
C311 C312 C313 118.1(3) . . ?
C311 C312 H312 120.9 . . ?
C313 C312 H312 120.9 . . ?
C312 C313 C314 120.2(3) . . ?
C312 C313 C316 120.6(3) . . ?
C314 C313 C316 119.2(3) . . ?
C309 C314 C313 122.6(3) . . ?
C309 C314 H314 118.7 . . ?
C313 C314 H314 118.7 . . ?
F59 C315 F57 106.5(3) . . ?
F59 C315 F58 106.6(4) . . ?
F57 C315 F58 106.0(3) . . ?
F59 C315 C311 112.1(3) . . ?
F57 C315 C311 113.7(4) . . ?
F58 C315 C311 111.4(3) . . ?
F160 C316 F162 107.7(5) . . ?
F60 C316 F61 107.4(5) . . ?
F60 C316 F62 106.4(5) . . ?
F61 C316 F62 104.3(4) . . ?
F160 C316 F161 106.2(5) . . ?
F162 C316 F161 104.2(5) . . ?
F160 C316 C313 114.4(5) . . ?
F60 C316 C313 114.4(4) . . ?
F162 C316 C313 112.4(5) . . ?
F61 C316 C313 111.6(4) . . ?
F62 C316 C313 112.2(4) . . ?
F161 C316 C313 111.4(5) . . ?
C322 C317 C318 115.9(3) . . ?
C322 C317 B300 123.0(2) . . ?
C318 C317 B300 120.8(3) . . ?
C319 C318 C317 121.8(3) . . ?
C319 C318 H318 119.1 . . ?
C317 C318 H318 119.1 . . ?
C320 C319 C318 121.1(3) . . ?
C320 C319 C323 120.0(3) . . ?
C318 C319 C323 118.8(3) . . ?
C319 C320 C321 118.0(3) . . ?
C319 C320 H320 121.0 . . ?
C321 C320 H320 121.0 . . ?
C322 C321 C320 120.8(3) . . ?
C322 C321 C324 121.3(3) . . ?
C320 C321 C324 117.9(3) . . ?
C321 C322 C317 122.2(3) . . ?
C321 C322 H322 118.9 . . ?
C317 C322 H322 118.9 . . ?
F64 C323 F65 105.6(3) . . ?
F64 C323 F63 107.5(3) . . ?
F65 C323 F63 105.5(3) . . ?
F64 C323 C319 112.3(3) . . ?
F65 C323 C319 112.5(3) . . ?
F63 C323 C319 112.9(3) . . ?
F166 C324 F168 107.4(5) . . ?
F68 C324 F67 107.3(6) . . ?
F166 C324 F167 105.9(5) . . ?
F168 C324 F167 104.1(4) . . ?
F68 C324 F66 106.5(6) . . ?
F67 C324 F66 103.2(5) . . ?
F68 C324 C321 115.4(5) . . ?
F166 C324 C321 112.7(4) . . ?
F168 C324 C321 112.9(4) . . ?
F67 C324 C321 112.3(5) . . ?
F167 C324 C321 113.2(4) . . ?
F66 C324 C321 111.3(5) . . ?
C330 C325 C326 115.7(2) . . ?
C330 C325 B300 122.1(2) . . ?
C326 C325 B300 121.9(2) . . ?
C327 C326 C325 122.4(3) . . ?
C327 C326 H326 118.8 . . ?
C325 C326 H326 118.8 . . ?
C326 C327 C328 121.0(3) . . ?
C326 C327 C331 119.1(3) . . ?
C328 C327 C331 119.9(3) . . ?
C329 C328 C327 117.8(3) . . ?
C329 C328 H328 121.1 . . ?
C327 C328 H328 121.1 . . ?
C328 C329 C330 121.0(3) . . ?
C328 C329 C332 120.2(3) . . ?
C330 C329 C332 118.8(3) . . ?
C329 C330 C325 122.1(3) . . ?
C329 C330 H330 118.9 . . ?
C325 C330 H330 118.9 . . ?
F170 C331 F171 108.7(5) . . ?
F70 C331 F71 106.5(4) . . ?
F170 C331 F169 106.6(5) . . ?
F171 C331 F169 103.1(5) . . ?
F70 C331 F69 105.7(4) . . ?
F71 C331 F69 102.2(4) . . ?
F170 C331 C327 116.1(3) . . ?
F70 C331 C327 117.5(3) . . ?
F171 C331 C327 111.7(3) . . ?
F71 C331 C327 112.7(4) . . ?
F169 C331 C327 109.7(4) . . ?
F69 C331 C327 111.0(3) . . ?
F73 C332 F72 108.0(5) . . ?
F172 C332 F174 106.8(5) . . ?
F172 C332 F173 107.2(5) . . ?
F174 C332 F173 104.7(5) . . ?
F73 C332 F74 106.3(4) . . ?
F72 C332 F74 105.1(4) . . ?
F172 C332 C329 114.6(5) . . ?
F73 C332 C329 113.6(4) . . ?
F72 C332 C329 112.1(4) . . ?
F174 C332 C329 111.6(4) . . ?
F173 C332 C329 111.4(4) . . ?
F74 C332 C329 111.2(4) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 B1 C1 C6 -94.9(3) . . . . ?
Rh1 B1 C1 C6 81.9(3) . . . . ?
N1 B1 C1 C2 87.2(3) . . . . ?
Rh1 B1 C1 C2 -96.0(3) . . . . ?
C6 C1 C2 C3 0.4(5) . . . . ?
B1 C1 C2 C3 178.4(3) . . . . ?
C1 C2 C3 C4 -1.0(5) . . . . ?
C2 C3 C4 C5 0.9(6) . . . . ?
C3 C4 C5 C6 -0.2(6) . . . . ?
C4 C5 C6 C1 -0.5(5) . . . . ?
C2 C1 C6 C5 0.3(4) . . . . ?
B1 C1 C6 C5 -177.7(3) . . . . ?
C1 B1 N1 C7 -58.9(3) . . . . ?
Rh1 B1 N1 C7 124.5(3) . . . . ?
C1 B1 N1 C8 -178.9(2) . . . . ?
Rh1 B1 N1 C8 4.5(3) . . . . ?
C1 B1 N1 C9 61.1(3) . . . . ?
Rh1 B1 N1 C9 -115.4(3) . . . . ?
C13 P1 C10 C11 50.2(2) . . . . ?
C16 P1 C10 C11 158.2(2) . . . . ?
Rh1 P1 C10 C11 -75.1(2) . . . . ?
C13 P1 C10 C12 -77.9(3) . . . . ?
C16 P1 C10 C12 30.1(3) . . . . ?
Rh1 P1 C10 C12 156.8(2) . . . . ?
C16 P1 C13 C15 -59.7(2) . . . . ?
C10 P1 C13 C15 48.2(3) . . . . ?
Rh1 P1 C13 C15 -175.2(2) . . . . ?
C16 P1 C13 C14 170.1(2) . . . . ?
C10 P1 C13 C14 -82.1(2) . . . . ?
Rh1 P1 C13 C14 54.5(2) . . . . ?
C13 P1 C16 C17 -50.5(2) . . . . ?
C10 P1 C16 C17 -162.7(2) . . . . ?
Rh1 P1 C16 C17 61.4(2) . . . . ?
C13 P1 C16 C18 -175.1(2) . . . . ?
C10 P1 C16 C18 72.7(3) . . . . ?
Rh1 P1 C16 C18 -63.2(2) . . . . ?
C25 P2 C19 C20 -170.2(3) . . . . ?
C22 P2 C19 C20 -57.7(3) . . . . ?
Rh1 P2 C19 C20 53.7(3) . . . . ?
C25 P2 C19 C21 65.0(3) . . . . ?
C22 P2 C19 C21 177.6(3) . . . . ?
Rh1 P2 C19 C21 -71.1(3) . . . . ?
C19 P2 C22 C23 173.5(2) . . . . ?
C25 P2 C22 C23 -77.1(3) . . . . ?
Rh1 P2 C22 C23 57.1(3) . . . . ?
C19 P2 C22 C24 -56.6(4) . . . . ?
C25 P2 C22 C24 52.8(4) . . . . ?
Rh1 P2 C22 C24 -173.0(3) . . . . ?
C19 P2 C25 C26 166.1(2) . . . . ?
C22 P2 C25 C26 57.0(3) . . . . ?
Rh1 P2 C25 C26 -65.5(2) . . . . ?
C19 P2 C25 C27 36.8(3) . . . . ?
C22 P2 C25 C27 -72.4(3) . . . . ?
Rh1 P2 C25 C27 165.1(2) . . . . ?
N2 B2 C51 C52 104.2(4) . . . . ?
Rh2 B2 C51 C52 -75.9(3) . . . . ?
N2 B2 C51 C56 -82.0(4) . . . . ?
Rh2 B2 C51 C56 97.8(3) . . . . ?
C56 C51 C52 C53 0.2(5) . . . . ?
B2 C51 C52 C53 174.2(4) . . . . ?
C51 C52 C53 C54 -0.8(7) . . . . ?
C52 C53 C54 C55 1.5(8) . . . . ?
C53 C54 C55 C56 -1.6(7) . . . . ?
C54 C55 C56 C51 1.0(6) . . . . ?
C52 C51 C56 C55 -0.3(5) . . . . ?
B2 C51 C56 C55 -174.4(3) . . . . ?
C51 B2 N2 C59 53.8(4) . . . . ?
Rh2 B2 N2 C59 -126.1(3) . . . . ?
C51 B2 N2 C58 -65.8(3) . . . . ?
Rh2 B2 N2 C58 114.3(3) . . . . ?
C51 B2 N2 C57 174.3(3) . . . . ?
Rh2 B2 N2 C57 -5.5(4) . . . . ?
C66 P3 C60 C61 84.2(3) . . . . ?
C63 P3 C60 C61 -168.4(2) . . . . ?
Rh2 P3 C60 C61 -38.4(3) . . . . ?
C66 P3 C60 C62 -45.2(3) . . . . ?
C63 P3 C60 C62 62.2(3) . . . . ?
Rh2 P3 C60 C62 -167.8(2) . . . . ?
C60 P3 C63 C65 146.7(3) . . . . ?
C66 P3 C63 C65 -104.2(3) . . . . ?
Rh2 P3 C63 C65 17.2(3) . . . . ?
C60 P3 C63 C64 -85.9(3) . . . . ?
C66 P3 C63 C64 23.3(3) . . . . ?
Rh2 P3 C63 C64 144.7(3) . . . . ?
C60 P3 C66 C67 -59.2(3) . . . . ?
C63 P3 C66 C67 -166.9(3) . . . . ?
Rh2 P3 C66 C67 67.2(3) . . . . ?
C60 P3 C66 C68 174.6(3) . . . . ?
C63 P3 C66 C68 66.9(3) . . . . ?
Rh2 P3 C66 C68 -59.0(3) . . . . ?
C75 P4 C69 C71 27.7(3) . . . . ?
C72 P4 C69 C71 -83.7(3) . . . . ?
Rh2 P4 C69 C71 151.6(3) . . . . ?
C75 P4 C69 C70 155.4(2) . . . . ?
C72 P4 C69 C70 44.0(3) . . . . ?
Rh2 P4 C69 C70 -80.7(3) . . . . ?
C75 P4 C72 C74 86.1(3) . . . . ?
C69 P4 C72 C74 -167.0(3) . . . . ?
Rh2 P4 C72 C74 -32.9(3) . . . . ?
C75 P4 C72 C73 -43.7(3) . . . . ?
C69 P4 C72 C73 63.2(3) . . . . ?
Rh2 P4 C72 C73 -162.8(3) . . . . ?
C72 P4 C75 C77 179.3(3) . . . . ?
C69 P4 C75 C77 71.7(3) . . . . ?
Rh2 P4 C75 C77 -61.8(3) . . . . ?
C72 P4 C75 C76 -54.8(3) . . . . ?
C69 P4 C75 C76 -162.3(3) . . . . ?
Rh2 P4 C75 C76 64.2(3) . . . . ?
C209 B200 C201 C202 32.6(3) . . . . ?
C217 B200 C201 C202 -88.4(3) . . . . ?
C225 B200 C201 C202 149.7(2) . . . . ?
C209 B200 C201 C206 -152.9(2) . . . . ?
C217 B200 C201 C206 86.0(3) . . . . ?
C225 B200 C201 C206 -35.9(3) . . . . ?
C206 C201 C202 C203 1.8(3) . . . . ?
B200 C201 C202 C203 176.5(2) . . . . ?
C201 C202 C203 C204 0.2(4) . . . . ?
C201 C202 C203 C207 179.2(2) . . . . ?
C202 C203 C204 C205 -1.9(4) . . . . ?
C207 C203 C204 C205 179.1(2) . . . . ?
C203 C204 C205 C206 1.6(4) . . . . ?
C203 C204 C205 C208 179.2(2) . . . . ?
C204 C205 C206 C201 0.4(4) . . . . ?
C208 C205 C206 C201 -177.2(2) . . . . ?
C202 C201 C206 C205 -2.1(4) . . . . ?
B200 C201 C206 C205 -176.9(2) . . . . ?
C204 C203 C207 F1 -133.0(3) . . . . ?
C202 C203 C207 F1 48.0(4) . . . . ?
C204 C203 C207 F2 -13.0(4) . . . . ?
C202 C203 C207 F2 168.0(3) . . . . ?
C204 C203 C207 F3 107.5(3) . . . . ?
C202 C203 C207 F3 -71.6(3) . . . . ?
C206 C205 C208 F5 -163.0(3) . . . . ?
C204 C205 C208 F5 19.4(4) . . . . ?
C206 C205 C208 F4 -39.2(4) . . . . ?
C204 C205 C208 F4 143.1(3) . . . . ?
C206 C205 C208 F6 78.0(4) . . . . ?
C204 C205 C208 F6 -99.7(3) . . . . ?
C217 B200 C209 C210 150.7(2) . . . . ?
C225 B200 C209 C210 -88.3(3) . . . . ?
C201 B200 C209 C210 34.1(3) . . . . ?
C217 B200 C209 C214 -34.5(3) . . . . ?
C225 B200 C209 C214 86.5(3) . . . . ?
C201 B200 C209 C214 -151.1(2) . . . . ?
C214 C209 C210 C211 2.3(4) . . . . ?
B200 C209 C210 C211 177.4(2) . . . . ?
C209 C210 C211 C212 -1.4(4) . . . . ?
C209 C210 C211 C215 174.0(3) . . . . ?
C210 C211 C212 C213 -0.2(4) . . . . ?
C215 C211 C212 C213 -175.5(3) . . . . ?
C211 C212 C213 C214 0.9(4) . . . . ?
C211 C212 C213 C216 178.4(3) . . . . ?
C212 C213 C214 C209 0.0(4) . . . . ?
C216 C213 C214 C209 -177.4(3) . . . . ?
C210 C209 C214 C213 -1.6(4) . . . . ?
B200 C209 C214 C213 -176.7(2) . . . . ?
C212 C211 C215 F9 -19.1(4) . . . . ?
C210 C211 C215 F9 165.5(3) . . . . ?
C212 C211 C215 F7 -139.6(3) . . . . ?
C210 C211 C215 F7 45.0(4) . . . . ?
C212 C211 C215 F8 101.9(3) . . . . ?
C210 C211 C215 F8 -73.5(4) . . . . ?
C214 C213 C216 F11 -106.6(3) . . . . ?
C212 C213 C216 F11 75.8(4) . . . . ?
C214 C213 C216 F12 16.4(4) . . . . ?
C212 C213 C216 F12 -161.2(3) . . . . ?
C214 C213 C216 F10 136.1(3) . . . . ?
C212 C213 C216 F10 -41.5(4) . . . . ?
C209 B200 C217 C218 -36.9(3) . . . . ?
C225 B200 C217 C218 -152.9(2) . . . . ?
C201 B200 C217 C218 84.6(3) . . . . ?
C209 B200 C217 C222 149.3(2) . . . . ?
C225 B200 C217 C222 33.2(3) . . . . ?
C201 B200 C217 C222 -89.3(3) . . . . ?
C222 C217 C218 C219 -1.3(4) . . . . ?
B200 C217 C218 C219 -175.5(2) . . . . ?
C217 C218 C219 C220 0.7(4) . . . . ?
C217 C218 C219 C223 -177.8(3) . . . . ?
C218 C219 C220 C221 0.2(4) . . . . ?
C223 C219 C220 C221 178.6(3) . . . . ?
C219 C220 C221 C222 -0.5(4) . . . . ?
C219 C220 C221 C224 176.6(3) . . . . ?
C220 C221 C222 C217 -0.2(4) . . . . ?
C224 C221 C222 C217 -177.3(3) . . . . ?
C218 C217 C222 C221 1.1(4) . . . . ?
B200 C217 C222 C221 175.2(2) . . . . ?
C220 C219 C223 F15 7.7(4) . . . . ?
C218 C219 C223 F15 -173.9(3) . . . . ?
C220 C219 C223 F13 132.6(3) . . . . ?
C218 C219 C223 F13 -48.9(4) . . . . ?
C220 C219 C223 F14 -110.1(3) . . . . ?
C218 C219 C223 F14 68.3(4) . . . . ?
C222 C221 C224 F18 -32.5(4) . . . . ?
C220 C221 C224 F18 150.4(3) . . . . ?
C222 C221 C224 F17 87.7(3) . . . . ?
C220 C221 C224 F17 -89.4(4) . . . . ?
C222 C221 C224 F16 -152.9(3) . . . . ?
C220 C221 C224 F16 30.0(4) . . . . ?
C209 B200 C225 C230 -80.6(3) . . . . ?
C217 B200 C225 C230 40.1(4) . . . . ?
C201 B200 C225 C230 157.4(3) . . . . ?
C209 B200 C225 C226 91.1(3) . . . . ?
C217 B200 C225 C226 -148.1(3) . . . . ?
C201 B200 C225 C226 -30.8(3) . . . . ?
C230 C225 C226 C227 -1.5(4) . . . . ?
B200 C225 C226 C227 -173.6(3) . . . . ?
C225 C226 C227 C228 0.1(5) . . . . ?
C225 C226 C227 C231 -179.3(3) . . . . ?
C226 C227 C228 C229 1.5(5) . . . . ?
C231 C227 C228 C229 -179.1(3) . . . . ?
C227 C228 C229 C230 -1.7(5) . . . . ?
C227 C228 C229 C232 178.8(3) . . . . ?
C228 C229 C230 C225 0.4(5) . . . . ?
C232 C229 C230 C225 179.9(3) . . . . ?
C226 C225 C230 C229 1.2(5) . . . . ?
B200 C225 C230 C229 173.5(3) . . . . ?
C228 C227 C231 F120 169.3(7) . . . . ?
C226 C227 C231 F120 -11.3(7) . . . . ?
C228 C227 C231 F219 -10.6(8) . . . . ?
C226 C227 C231 F219 168.8(7) . . . . ?
C228 C227 C231 F21 -97.9(6) . . . . ?
C226 C227 C231 F21 81.5(6) . . . . ?
C228 C227 C231 F221 121.6(5) . . . . ?
C226 C227 C231 F221 -58.9(6) . . . . ?
C228 C227 C231 F20 27.9(5) . . . . ?
C226 C227 C231 F20 -152.7(4) . . . . ?
C228 C227 C231 F119 -62.3(6) . . . . ?
C226 C227 C231 F119 117.1(5) . . . . ?
C228 C227 C231 F19 141.3(4) . . . . ?
C226 C227 C231 F19 -39.3(5) . . . . ?
C228 C227 C231 F121 47.2(5) . . . . ?
C226 C227 C231 F121 -133.4(5) . . . . ?
C228 C227 C231 F220 -129.7(5) . . . . ?
C226 C227 C231 F220 49.7(5) . . . . ?
C230 C229 C232 F122 -94.6(7) . . . . ?
C228 C229 C232 F122 84.9(7) . . . . ?
C230 C229 C232 F224 108.0(6) . . . . ?
C228 C229 C232 F224 -72.4(6) . . . . ?
C230 C229 C232 F23 176.0(7) . . . . ?
C228 C229 C232 F23 -4.5(8) . . . . ?
C230 C229 C232 F223 -34.8(7) . . . . ?
C228 C229 C232 F223 144.7(6) . . . . ?
C230 C229 C232 F124 135.2(5) . . . . ?
C228 C229 C232 F124 -45.3(6) . . . . ?
C230 C229 C232 F22 50.5(6) . . . . ?
C228 C229 C232 F22 -129.9(5) . . . . ?
C230 C229 C232 F24 -60.9(5) . . . . ?
C228 C229 C232 F24 118.6(5) . . . . ?
C230 C229 C232 F123 27.7(6) . . . . ?
C228 C229 C232 F123 -152.7(5) . . . . ?
C230 C229 C232 F222 -141.5(4) . . . . ?
C228 C229 C232 F222 38.0(5) . . . . ?
C325 B300 C301 C302 -38.5(3) . . . . ?
C309 B300 C301 C302 -153.0(2) . . . . ?
C317 B300 C301 C302 84.2(3) . . . . ?
C325 B300 C301 C306 146.7(2) . . . . ?
C309 B300 C301 C306 32.1(3) . . . . ?
C317 B300 C301 C306 -90.6(3) . . . . ?
C306 C301 C302 C303 -1.0(4) . . . . ?
B300 C301 C302 C303 -176.1(2) . . . . ?
C301 C302 C303 C304 0.2(4) . . . . ?
C301 C302 C303 C307 -177.2(3) . . . . ?
C302 C303 C304 C305 0.3(4) . . . . ?
C307 C303 C304 C305 177.8(3) . . . . ?
C303 C304 C305 C306 -0.1(4) . . . . ?
C303 C304 C305 C308 178.9(2) . . . . ?
C304 C305 C306 C301 -0.7(4) . . . . ?
C308 C305 C306 C301 -179.7(2) . . . . ?
C302 C301 C306 C305 1.2(4) . . . . ?
B300 C301 C306 C305 176.3(2) . . . . ?
C304 C303 C307 F51 136.7(3) . . . . ?
C302 C303 C307 F51 -45.9(4) . . . . ?
C304 C303 C307 F52 -104.9(3) . . . . ?
C302 C303 C307 F52 72.5(4) . . . . ?
C304 C303 C307 F53 14.5(4) . . . . ?
C302 C303 C307 F53 -168.0(3) . . . . ?
C304 C305 C308 F56 -96.1(3) . . . . ?
C306 C305 C308 F56 83.0(3) . . . . ?
C304 C305 C308 F54 24.8(4) . . . . ?
C306 C305 C308 F54 -156.2(3) . . . . ?
C304 C305 C308 F55 144.3(3) . . . . ?
C306 C305 C308 F55 -36.6(4) . . . . ?
C301 B300 C309 C314 40.0(3) . . . . ?
C325 B300 C309 C314 -80.4(3) . . . . ?
C317 B300 C309 C314 157.9(2) . . . . ?
C301 B300 C309 C310 -147.1(2) . . . . ?
C325 B300 C309 C310 92.4(3) . . . . ?
C317 B300 C309 C310 -29.2(4) . . . . ?
C314 C309 C310 C311 0.1(4) . . . . ?
B300 C309 C310 C311 -173.1(3) . . . . ?
C309 C310 C311 C312 0.5(5) . . . . ?
C309 C310 C311 C315 -180.0(3) . . . . ?
C310 C311 C312 C313 -0.7(4) . . . . ?
C315 C311 C312 C313 179.8(3) . . . . ?
C311 C312 C313 C314 0.3(4) . . . . ?
C311 C312 C313 C316 -177.6(3) . . . . ?
C310 C309 C314 C313 -0.5(4) . . . . ?
B300 C309 C314 C313 172.9(3) . . . . ?
C312 C313 C314 C309 0.3(4) . . . . ?
C316 C313 C314 C309 178.2(3) . . . . ?
C312 C311 C315 F59 -133.8(4) . . . . ?
C310 C311 C315 F59 46.7(5) . . . . ?
C312 C311 C315 F57 -12.9(5) . . . . ?
C310 C311 C315 F57 167.6(3) . . . . ?
C312 C311 C315 F58 106.8(4) . . . . ?
C310 C311 C315 F58 -72.8(4) . . . . ?
C312 C313 C316 F160 -12.9(12) . . . . ?
C314 C313 C316 F160 169.2(12) . . . . ?
C312 C313 C316 F60 -154.9(9) . . . . ?
C314 C313 C316 F60 27.2(9) . . . . ?
C312 C313 C316 F162 110.3(11) . . . . ?
C314 C313 C316 F162 -67.6(11) . . . . ?
C312 C313 C316 F61 83.0(9) . . . . ?
C314 C313 C316 F61 -94.9(9) . . . . ?
C312 C313 C316 F62 -33.6(7) . . . . ?
C314 C313 C316 F62 148.5(7) . . . . ?
C312 C313 C316 F161 -133.3(9) . . . . ?
C314 C313 C316 F161 48.8(10) . . . . ?
C301 B300 C317 C322 -94.2(3) . . . . ?
C325 B300 C317 C322 28.3(3) . . . . ?
C309 B300 C317 C322 144.0(3) . . . . ?
C301 B300 C317 C318 80.1(3) . . . . ?
C325 B300 C317 C318 -157.5(2) . . . . ?
C309 B300 C317 C318 -41.7(3) . . . . ?
C322 C317 C318 C319 -0.8(4) . . . . ?
B300 C317 C318 C319 -175.4(2) . . . . ?
C317 C318 C319 C320 -1.1(4) . . . . ?
C317 C318 C319 C323 179.1(3) . . . . ?
C318 C319 C320 C321 1.7(4) . . . . ?
C323 C319 C320 C321 -178.6(3) . . . . ?
C319 C320 C321 C322 -0.3(4) . . . . ?
C319 C320 C321 C324 -179.7(3) . . . . ?
C320 C321 C322 C317 -1.7(4) . . . . ?
C324 C321 C322 C317 177.7(3) . . . . ?
C318 C317 C322 C321 2.2(4) . . . . ?
B300 C317 C322 C321 176.7(3) . . . . ?
C320 C319 C323 F64 -112.7(4) . . . . ?
C318 C319 C323 F64 67.1(4) . . . . ?
C320 C319 C323 F65 128.3(3) . . . . ?
C318 C319 C323 F65 -51.9(4) . . . . ?
C320 C319 C323 F63 9.1(4) . . . . ?
C318 C319 C323 F63 -171.2(3) . . . . ?
C322 C321 C324 F68 -18.2(11) . . . . ?
C320 C321 C324 F68 161.2(10) . . . . ?
C322 C321 C324 F166 -111.0(8) . . . . ?
C320 C321 C324 F166 68.4(9) . . . . ?
C322 C321 C324 F168 127.1(6) . . . . ?
C320 C321 C324 F168 -53.5(6) . . . . ?
C322 C321 C324 F67 -141.6(8) . . . . ?
C320 C321 C324 F67 37.8(8) . . . . ?
C322 C321 C324 F167 9.1(6) . . . . ?
C320 C321 C324 F167 -171.5(5) . . . . ?
C322 C321 C324 F66 103.3(9) . . . . ?
C320 C321 C324 F66 -77.3(9) . . . . ?
C301 B300 C325 C330 -34.3(4) . . . . ?
C309 B300 C325 C330 85.6(3) . . . . ?
C317 B300 C325 C330 -152.5(2) . . . . ?
C301 B300 C325 C326 152.8(2) . . . . ?
C309 B300 C325 C326 -87.3(3) . . . . ?
C317 B300 C325 C326 34.7(3) . . . . ?
C330 C325 C326 C327 1.5(4) . . . . ?
B300 C325 C326 C327 174.8(3) . . . . ?
C325 C326 C327 C328 -2.2(4) . . . . ?
C325 C326 C327 C331 177.0(3) . . . . ?
C326 C327 C328 C329 0.9(4) . . . . ?
C331 C327 C328 C329 -178.4(3) . . . . ?
C327 C328 C329 C330 1.0(4) . . . . ?
C327 C328 C329 C332 -178.3(2) . . . . ?
C328 C329 C330 C325 -1.7(4) . . . . ?
C332 C329 C330 C325 177.6(2) . . . . ?
C326 C325 C330 C329 0.4(4) . . . . ?
B300 C325 C330 C329 -172.9(2) . . . . ?
C326 C327 C331 F170 -0.7(8) . . . . ?
C328 C327 C331 F170 178.6(8) . . . . ?
C326 C327 C331 F70 172.3(6) . . . . ?
C328 C327 C331 F70 -8.4(7) . . . . ?
C326 C327 C331 F171 -126.1(7) . . . . ?
C328 C327 C331 F171 53.2(7) . . . . ?
C326 C327 C331 F71 48.0(6) . . . . ?
C328 C327 C331 F71 -132.7(6) . . . . ?
C326 C327 C331 F169 120.2(7) . . . . ?
C328 C327 C331 F169 -60.5(7) . . . . ?
C326 C327 C331 F69 -65.9(6) . . . . ?
C328 C327 C331 F69 113.4(6) . . . . ?
C328 C329 C332 F172 -10.3(11) . . . . ?
C330 C329 C332 F172 170.3(11) . . . . ?
C328 C329 C332 F73 -106.7(8) . . . . ?
C330 C329 C332 F73 74.0(8) . . . . ?
C328 C329 C332 F72 130.5(8) . . . . ?
C330 C329 C332 F72 -48.8(8) . . . . ?
C328 C329 C332 F174 -131.9(10) . . . . ?
C330 C329 C332 F174 48.8(11) . . . . ?
C328 C329 C332 F173 111.5(9) . . . . ?
C330 C329 C332 F173 -67.8(9) . . . . ?
C328 C329 C332 F74 13.2(7) . . . . ?
C330 C329 C332 F74 -166.1(6) . . . . ?

_refine_diff_density_max         0.891
_refine_diff_density_min         -0.908
_refine_diff_density_rms         0.063

_vrf_PLAT213_1                   
; 
PROBLEM: Fxx has ADP max/min Ratio ..... x.x prolat
RESPONSE: The anion CF3 groups contain a significant degree 
of disorder. Attempts have been made to model the disorder but
some ellipsoids are still prolate.
See _refine_special_details. 
;

_shelxl_version_number           2014-3


_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: 1,2-difluorobenzene/pentane'
_chemical_properties_physical    
'Air-sensitive, Moisture-sensitive, Oxygen-sensitive'
####################################################################### 
# 
# 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_2
_database_code_depnum_ccdc_archive 'CCDC 1445276'
_audit_update_record             
;
2016-02-18 deposited with the CCDC.
2016-02-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014
_chemical_formula_moiety         'C32 H12 B F24, C24 H50 B N P2 Rh'
_chemical_formula_sum            'C56 H62 B2 F24 N P2 Rh'
_chemical_formula_weight         1391.53

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh 0.0927 3.6045 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      orthorhombic
_space_group_IT_number           61
_space_group_name_H-M_alt        'P b c a'
_space_group_name_Hall           '-P 2ac 2ab'

_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+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'x, -y-1/2, z-1/2'
'-x-1/2, y-1/2, z'

_cell_length_a                   25.1599(2)
_cell_length_b                   18.78740(10)
_cell_length_c                   26.2494(2)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     12407.81(15)
_cell_formula_units_Z            8
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    17103
_cell_measurement_theta_min      2.8900
_cell_measurement_theta_max      74.8522

_exptl_crystal_description       cube
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.490
_exptl_crystal_F_000             5648
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_exptl_absorpt_coefficient_mu    3.697
_exptl_absorpt_correction_T_min  0.66978
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'SuperNova (Cu) X-ray Source'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Atlas'
_diffrn_detector_area_resol_mean 10.4102
_diffrn_reflns_number            31463
_diffrn_reflns_av_unetI/netI     0.0240
_diffrn_reflns_av_R_equivalents  0.0214
_diffrn_reflns_limit_h_min       -30
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_theta_min         3.367
_diffrn_reflns_theta_max         75.020
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.969
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.969
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.969
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             12403
_reflns_number_gt                10842
_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 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 The dippp ligand contains significant disorder and is modelled
 over 2 sites where appropriate with occupancy allowed to refine
 freely. P-C and C-C distance of disordered components were 
 described by the DFIX command to be 1.84 and 1.54 Ang respectively.
 Ellipsoids of the C atoms were described by the ISOR command. C19A
 and C19B were fixed at the same position using EADP and EXYZ
 commands.

 Several of the CF3 groups of the [BArF4]- anions have significant 
 disorder. 4 groups were modelled as disordered over 2 sites. All F
 atoms were also described by the ISOR command. In spite of
 this modelling some of the F atom ellipsoids remain prolate but
 further attempts to model were not successful.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0789P)²+35.3720P] 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         12403
_refine_ls_number_parameters     1037
_refine_ls_number_restraints     608
_refine_ls_R_factor_all          0.0478
_refine_ls_R_factor_gt           0.0393
_refine_ls_wR_factor_ref         0.1216
_refine_ls_wR_factor_gt          0.1141
_refine_ls_goodness_of_fit_ref   0.787
_refine_ls_restrained_S_all      0.855
_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
Rh1 Rh 0.33064(2) 0.17866(2) 0.01196(2) 0.02656(7) Uani 1 1 d . . . . .
C1 C 0.38364(11) 0.26538(15) -0.03253(11) 0.0309(6) Uani 1 1 d . . . . .
C2 C 0.41079(11) 0.24067(16) 0.01112(11) 0.0347(6) Uani 1 1 d . . . . .
H2 H 0.4232 0.2742 0.0355 0.042 Uiso 1 1 calc R U . . .
C3 C 0.42000(12) 0.16729(18) 0.01952(13) 0.0392(7) Uani 1 1 d . . . . .
H3 H 0.4368 0.1525 0.0502 0.047 Uiso 1 1 calc R U . . .
C4 C 0.40499(13) 0.11622(17) -0.01622(13) 0.0431(7) Uani 1 1 d . . . . .
H4 H 0.4141 0.0676 -0.0115 0.052 Uiso 1 1 calc R U . . .
C5 C 0.37652(13) 0.13752(17) -0.05883(12) 0.0408(7) Uani 1 1 d . . . . .
H5 H 0.3651 0.1036 -0.0833 0.049 Uiso 1 1 calc R U . . .
C6 C 0.36476(12) 0.21108(16) -0.06531(11) 0.0352(6) Uani 1 1 d . . . . .
H6 H 0.3430 0.2245 -0.0933 0.042 Uiso 1 1 calc R U . . .
B1 B 0.37407(14) 0.34867(19) -0.04369(14) 0.0365(7) Uani 1 1 d . . . . .
H1A H 0.3706 0.3746 -0.0110 0.044 Uiso 1 1 calc R U . . .
H1B H 0.3405 0.3548 -0.0629 0.044 Uiso 1 1 calc R U . . .
N1 N 0.42337(10) 0.38211(14) -0.07648(10) 0.0381(6) Uani 1 1 d . . . . .
C7 C 0.41060(17) 0.45799(18) -0.08704(16) 0.0547(9) Uani 1 1 d . . . . .
H7A H 0.4039 0.4829 -0.0549 0.082 Uiso 1 1 calc R U . . .
H7B H 0.3789 0.4607 -0.1086 0.082 Uiso 1 1 calc R U . . .
H7C H 0.4406 0.4804 -0.1046 0.082 Uiso 1 1 calc R U . . .
C8 C 0.43054(15) 0.34495(19) -0.12581(13) 0.0488(8) Uani 1 1 d . . . . .
H8A H 0.4592 0.3679 -0.1451 0.073 Uiso 1 1 calc R U . . .
H8B H 0.3974 0.3474 -0.1454 0.073 Uiso 1 1 calc R U . . .
H8C H 0.4397 0.2950 -0.1196 0.073 Uiso 1 1 calc R U . . .
C9 C 0.47375(15) 0.3792(2) -0.04748(18) 0.0616(11) Uani 1 1 d . . . . .
H9A H 0.4829 0.3295 -0.0404 0.092 Uiso 1 1 calc R U . . .
H9B H 0.4696 0.4050 -0.0153 0.092 Uiso 1 1 calc R U . . .
H9C H 0.5022 0.4012 -0.0676 0.092 Uiso 1 1 calc R U . . .
P1 P 0.24498(3) 0.19255(6) -0.00814(4) 0.0521(2) Uani 1 1 d D . . . .
C10A C 0.1898(4) 0.1776(7) 0.0339(6) 0.056(3) Uani 0.63(3) 1 d D U P A 1
H10A H 0.1595 0.2076 0.0229 0.067 Uiso 0.63(3) 1 calc R U P A 1
H10B H 0.1786 0.1272 0.0312 0.067 Uiso 0.63(3) 1 calc R U P A 1
C11A C 0.2027(5) 0.1942(6) 0.0886(6) 0.058(3) Uani 0.63(3) 1 d D U P A 1
H11A H 0.1694 0.1941 0.1088 0.070 Uiso 0.63(3) 1 calc R U P A 1
H11B H 0.2182 0.2425 0.0907 0.070 Uiso 0.63(3) 1 calc R U P A 1
C12A C 0.2416(4) 0.1408(5) 0.1118(5) 0.048(2) Uani 0.63(3) 1 d D U P A 1
H12A H 0.2287 0.0924 0.1034 0.058 Uiso 0.63(3) 1 calc R U P A 1
H12B H 0.2398 0.1459 0.1493 0.058 Uiso 0.63(3) 1 calc R U P A 1
C10B C 0.1985(8) 0.1906(12) 0.0501(7) 0.052(4) Uani 0.37(3) 1 d D U P A 2
H10C H 0.1681 0.2221 0.0421 0.062 Uiso 0.37(3) 1 calc R U P A 2
H10D H 0.1841 0.1416 0.0525 0.062 Uiso 0.37(3) 1 calc R U P A 2
C11B C 0.2179(9) 0.2110(10) 0.1036(6) 0.053(4) Uani 0.37(3) 1 d D U P A 2
H11C H 0.2375 0.2567 0.1014 0.064 Uiso 0.37(3) 1 calc R U P A 2
H11D H 0.1867 0.2185 0.1259 0.064 Uiso 0.37(3) 1 calc R U P A 2
C12B C 0.2539(8) 0.1553(10) 0.1278(8) 0.050(4) Uani 0.37(3) 1 d D U P A 2
H12C H 0.2352 0.1090 0.1289 0.060 Uiso 0.37(3) 1 calc R U P A 2
H12D H 0.2624 0.1695 0.1632 0.060 Uiso 0.37(3) 1 calc R U P A 2
P2 P 0.31365(4) 0.14624(4) 0.09246(3) 0.03987(18) Uani 1 1 d D . . . .
C13A C 0.2336(5) 0.2875(9) -0.0275(9) 0.052(4) Uani 0.57(6) 1 d D U P A 1
H13A H 0.2594 0.2967 -0.0557 0.062 Uiso 0.57(6) 1 calc R U P A 1
C14A C 0.1781(7) 0.3017(18) -0.0508(11) 0.089(6) Uani 0.57(6) 1 d D U P A 1
H14A H 0.1508 0.2957 -0.0245 0.134 Uiso 0.57(6) 1 calc R U P A 1
H14B H 0.1715 0.2680 -0.0786 0.134 Uiso 0.57(6) 1 calc R U P A 1
H14C H 0.1767 0.3505 -0.0640 0.134 Uiso 0.57(6) 1 calc R U P A 1
C15A C 0.2463(10) 0.3435(13) 0.0137(10) 0.073(5) Uani 0.57(6) 1 d D U P A 1
H15A H 0.2465 0.3910 -0.0018 0.110 Uiso 0.57(6) 1 calc R U P A 1
H15B H 0.2813 0.3335 0.0285 0.110 Uiso 0.57(6) 1 calc R U P A 1
H15C H 0.2192 0.3416 0.0404 0.110 Uiso 0.57(6) 1 calc R U P A 1
C13B C 0.2329(8) 0.2753(11) -0.0432(12) 0.049(4) Uani 0.43(6) 1 d D U P A 2
H13B H 0.2614 0.2811 -0.0694 0.059 Uiso 0.43(6) 1 calc R U P A 2
C14B C 0.1786(10) 0.2823(16) -0.0697(17) 0.084(7) Uani 0.43(6) 1 d D U P A 2
H14D H 0.1502 0.2753 -0.0446 0.126 Uiso 0.43(6) 1 calc R U P A 2
H14E H 0.1755 0.2462 -0.0965 0.126 Uiso 0.43(6) 1 calc R U P A 2
H14F H 0.1754 0.3298 -0.0848 0.126 Uiso 0.43(6) 1 calc R U P A 2
C15B C 0.2399(8) 0.3333(12) -0.0026(14) 0.053(6) Uani 0.43(6) 1 d D U P A 2
H15D H 0.2400 0.3802 -0.0190 0.080 Uiso 0.43(6) 1 calc R U P A 2
H15E H 0.2737 0.3261 0.0153 0.080 Uiso 0.43(6) 1 calc R U P A 2
H15F H 0.2106 0.3307 0.0219 0.080 Uiso 0.43(6) 1 calc R U P A 2
C16A C 0.2198(3) 0.1321(6) -0.0599(5) 0.081(3) Uani 0.81(4) 1 d D U P A 1
H16A H 0.1805 0.1389 -0.0622 0.097 Uiso 0.81(4) 1 calc R U P A 1
C17A C 0.2432(5) 0.1482(10) -0.1130(4) 0.112(4) Uani 0.81(4) 1 d D U P A 1
H17A H 0.2812 0.1367 -0.1132 0.168 Uiso 0.81(4) 1 calc R U P A 1
H17B H 0.2384 0.1988 -0.1209 0.168 Uiso 0.81(4) 1 calc R U P A 1
H17C H 0.2249 0.1193 -0.1387 0.168 Uiso 0.81(4) 1 calc R U P A 1
C18A C 0.2299(5) 0.0538(6) -0.0465(8) 0.089(3) Uani 0.81(4) 1 d D U P A 1
H18A H 0.2155 0.0233 -0.0734 0.133 Uiso 0.81(4) 1 calc R U P A 1
H18B H 0.2124 0.0425 -0.0141 0.133 Uiso 0.81(4) 1 calc R U P A 1
H18C H 0.2682 0.0456 -0.0432 0.133 Uiso 0.81(4) 1 calc R U P A 1
C16B C 0.2128(19) 0.1224(14) -0.0455(18) 0.080(13) Uani 0.19(4) 1 d D U P A 2
H16B H 0.1737 0.1321 -0.0465 0.096 Uiso 0.19(4) 1 calc R U P A 2
C17B C 0.2353(19) 0.131(2) -0.100(2) 0.078(13) Uani 0.19(4) 1 d D U P A 2
H17D H 0.2741 0.1261 -0.0991 0.117 Uiso 0.19(4) 1 calc R U P A 2
H17E H 0.2258 0.1778 -0.1134 0.117 Uiso 0.19(4) 1 calc R U P A 2
H17F H 0.2204 0.0938 -0.1221 0.117 Uiso 0.19(4) 1 calc R U P A 2
C18B C 0.2214(16) 0.0476(15) -0.0248(19) 0.057(9) Uani 0.19(4) 1 d D U P A 2
H18D H 0.2070 0.0128 -0.0489 0.085 Uiso 0.19(4) 1 calc R U P A 2
H18E H 0.2032 0.0427 0.0080 0.085 Uiso 0.19(4) 1 calc R U P A 2
H18F H 0.2595 0.0391 -0.0202 0.085 Uiso 0.19(4) 1 calc R U P A 2
C19A C 0.33599(15) 0.0553(2) 0.10836(16) 0.0535(9) Uani 0.640(9) 1 d D U P A 1
H19A H 0.3747 0.0511 0.1000 0.064 Uiso 0.640(9) 1 calc R U P A 1
C20A C 0.3057(6) -0.0010(7) 0.0781(5) 0.063(3) Uani 0.640(9) 1 d D U P A 1
H20A H 0.3162 -0.0485 0.0897 0.094 Uiso 0.640(9) 1 calc R U P A 1
H20B H 0.3139 0.0040 0.0418 0.094 Uiso 0.640(9) 1 calc R U P A 1
H20C H 0.2674 0.0053 0.0834 0.094 Uiso 0.640(9) 1 calc R U P A 1
C21A C 0.3282(3) 0.0333(5) 0.1602(3) 0.077(3) Uani 0.640(9) 1 d D U P A 1
H21A H 0.2900 0.0306 0.1675 0.115 Uiso 0.640(9) 1 calc R U P A 1
H21B H 0.3448 0.0678 0.1832 0.115 Uiso 0.640(9) 1 calc R U P A 1
H21C H 0.3443 -0.0136 0.1654 0.115 Uiso 0.640(9) 1 calc R U P A 1
C19B C 0.33599(15) 0.0553(2) 0.10836(16) 0.0535(9) Uani 0.360(9) 1 d D U P A 2
H19B H 0.3186 0.0403 0.1409 0.064 Uiso 0.360(9) 1 calc R U P A 2
C20B C 0.3171(9) 0.0052(12) 0.0652(7) 0.056(5) Uani 0.360(9) 1 d D U P A 2
H20D H 0.3270 0.0255 0.0322 0.084 Uiso 0.360(9) 1 calc R U P A 2
H20E H 0.2784 0.0000 0.0670 0.084 Uiso 0.360(9) 1 calc R U P A 2
H20F H 0.3339 -0.0415 0.0692 0.084 Uiso 0.360(9) 1 calc R U P A 2
C21B C 0.3957(4) 0.0354(6) 0.1110(4) 0.055(3) Uani 0.360(9) 1 d D U P A 2
H21D H 0.3998 -0.0102 0.1288 0.082 Uiso 0.360(9) 1 calc R U P A 2
H21E H 0.4151 0.0725 0.1295 0.082 Uiso 0.360(9) 1 calc R U P A 2
H21F H 0.4100 0.0312 0.0764 0.082 Uiso 0.360(9) 1 calc R U P A 2
C22A C 0.3380(4) 0.2027(5) 0.1430(3) 0.063(3) Uani 0.631(10) 1 d D U P A 1
H22A H 0.3199 0.1911 0.1759 0.075 Uiso 0.631(10) 1 calc R U P A 1
C23A C 0.3382(7) 0.2839(6) 0.1341(7) 0.109(6) Uani 0.631(10) 1 d D U P A 1
H23A H 0.3617 0.3068 0.1590 0.163 Uiso 0.631(10) 1 calc R U P A 1
H23B H 0.3021 0.3025 0.1380 0.163 Uiso 0.631(10) 1 calc R U P A 1
H23C H 0.3510 0.2940 0.0996 0.163 Uiso 0.631(10) 1 calc R U P A 1
C24A C 0.3988(4) 0.1958(5) 0.1488(3) 0.078(3) Uani 0.631(10) 1 d D U P A 1
H24A H 0.4164 0.2238 0.1222 0.117 Uiso 0.631(10) 1 calc R U P A 1
H24B H 0.4091 0.1457 0.1455 0.117 Uiso 0.631(10) 1 calc R U P A 1
H24C H 0.4095 0.2136 0.1824 0.117 Uiso 0.631(10) 1 calc R U P A 1
C22B C 0.3616(6) 0.1995(6) 0.1366(4) 0.042(3) Uani 0.369(10) 1 d D U P A 2
H22B H 0.3966 0.2095 0.1199 0.050 Uiso 0.369(10) 1 calc R U P A 2
C23B C 0.3235(8) 0.2706(9) 0.1396(11) 0.070(5) Uani 0.369(10) 1 d D U P A 2
H23D H 0.2864 0.2560 0.1443 0.105 Uiso 0.369(10) 1 calc R U P A 2
H23E H 0.3267 0.2978 0.1079 0.105 Uiso 0.369(10) 1 calc R U P A 2
H23F H 0.3346 0.3004 0.1684 0.105 Uiso 0.369(10) 1 calc R U P A 2
C24B C 0.3680(5) 0.1751(6) 0.1923(4) 0.061(4) Uani 0.369(10) 1 d D U P A 2
H24D H 0.3335 0.1776 0.2096 0.092 Uiso 0.369(10) 1 calc R U P A 2
H24E H 0.3934 0.2061 0.2098 0.092 Uiso 0.369(10) 1 calc R U P A 2
H24F H 0.3810 0.1259 0.1930 0.092 Uiso 0.369(10) 1 calc R U P A 2
B200 B 0.57316(12) 0.19248(15) 0.24856(11) 0.0250(6) Uani 1 1 d . . . . .
C201 C 0.55812(10) 0.19265(13) 0.18785(10) 0.0246(5) Uani 1 1 d . . . . .
C202 C 0.55468(10) 0.25615(13) 0.16027(10) 0.0258(5) Uani 1 1 d . . . . .
H202 H 0.5560 0.3001 0.1782 0.031 Uiso 1 1 calc R U . . .
C203 C 0.54937(10) 0.25719(13) 0.10745(10) 0.0247(5) Uani 1 1 d . . . . .
C204 C 0.54692(10) 0.19459(14) 0.07970(10) 0.0259(5) Uani 1 1 d . . . . .
H204 H 0.5428 0.1952 0.0437 0.031 Uiso 1 1 calc R U . . .
C205 C 0.55074(11) 0.13100(13) 0.10624(10) 0.0280(5) Uani 1 1 d D . . . .
C206 C 0.55646(11) 0.13012(13) 0.15876(10) 0.0273(5) Uani 1 1 d . . . . .
H206 H 0.5593 0.0856 0.1756 0.033 Uiso 1 1 calc R U . . .
C207 C 0.54782(12) 0.32723(14) 0.08047(11) 0.0312(6) Uani 1 1 d . . . . .
F1 F 0.58222(9) 0.37401(9) 0.10003(7) 0.0476(5) Uani 1 1 d . U . . .
F2 F 0.49999(8) 0.35834(10) 0.08336(8) 0.0484(5) Uani 1 1 d . U . . .
F3 F 0.55936(9) 0.32209(9) 0.03095(7) 0.0437(4) Uani 1 1 d . U . . .
C208 C 0.55113(13) 0.06252(15) 0.07766(10) 0.0440(8) Uani 1 1 d D . . . .
F4 F 0.5728(4) 0.0670(2) 0.03292(17) 0.106(3) Uani 0.606(10) 1 d D U P B 1
F5 F 0.5010(2) 0.0430(3) 0.0668(4) 0.141(4) Uani 0.606(10) 1 d D U P B 1
F6 F 0.5698(3) 0.0098(2) 0.10073(15) 0.067(2) Uani 0.606(10) 1 d D U P B 1
F104 F 0.5324(5) 0.0089(3) 0.1026(3) 0.097(4) Uani 0.394(10) 1 d D U P B 2
F105 F 0.6018(2) 0.0421(5) 0.0686(5) 0.120(6) Uani 0.394(10) 1 d D U P B 2
F106 F 0.5290(5) 0.0631(3) 0.0347(2) 0.071(3) Uani 0.394(10) 1 d D U P B 2
C209 C 0.63698(11) 0.21054(14) 0.24801(9) 0.0259(5) Uani 1 1 d . . . . .
C210 C 0.65685(11) 0.27881(14) 0.25649(10) 0.0289(5) Uani 1 1 d . . . . .
H210 H 0.6331 0.3152 0.2671 0.035 Uiso 1 1 calc R U . . .
C211 C 0.71026(12) 0.29536(17) 0.24991(12) 0.0371(6) Uani 1 1 d . . . . .
C212 C 0.74594(12) 0.24458(18) 0.23330(13) 0.0433(7) Uani 1 1 d . . . . .
H212 H 0.7823 0.2561 0.2282 0.052 Uiso 1 1 calc R U . . .
C213 C 0.72734(12) 0.17676(16) 0.22424(12) 0.0395(7) Uani 1 1 d D . . . .
C214 C 0.67400(12) 0.15973(16) 0.23134(11) 0.0323(6) Uani 1 1 d . . . . .
H214 H 0.6624 0.1125 0.2247 0.039 Uiso 1 1 calc R U . . .
C215 C 0.72807(14) 0.3698(2) 0.26128(18) 0.0558(10) Uani 1 1 d . . . . .
F7 F 0.69669(10) 0.41778(11) 0.23989(12) 0.0722(7) Uani 1 1 d . U . . .
F8 F 0.72734(15) 0.38273(16) 0.31137(13) 0.0982(10) Uani 1 1 d . U . . .
F9 F 0.77697(10) 0.38323(15) 0.24626(17) 0.1069(12) Uani 1 1 d . U . . .
C216 C 0.76428(14) 0.1206(2) 0.20446(14) 0.0613(11) Uani 1 1 d D . . . .
F10 F 0.7544(4) 0.0572(3) 0.2191(5) 0.089(4) Uani 0.520(19) 1 d D U P C 1
F11 F 0.7681(5) 0.1227(6) 0.15472(18) 0.103(4) Uani 0.520(19) 1 d D U P C 1
F12 F 0.81485(19) 0.1341(4) 0.2202(5) 0.088(3) Uani 0.520(19) 1 d D U P C 1
F110 F 0.8102(3) 0.1413(4) 0.1891(7) 0.107(5) Uani 0.480(19) 1 d D U P C 2
F111 F 0.7720(6) 0.0704(5) 0.2391(4) 0.095(4) Uani 0.480(19) 1 d D U P C 2
F112 F 0.7427(4) 0.0843(8) 0.1654(5) 0.123(6) Uani 0.480(19) 1 d D U P C 2
C217 C 0.54019(10) 0.25069(13) 0.28246(9) 0.0230(5) Uani 1 1 d . . . . .
C218 C 0.55926(10) 0.26888(13) 0.33106(9) 0.0247(5) Uani 1 1 d . . . . .
H218 H 0.5915 0.2483 0.3427 0.030 Uiso 1 1 calc R U . . .
C219 C 0.53237(10) 0.31606(13) 0.36258(10) 0.0254(5) Uani 1 1 d D . . . .
C220 C 0.48448(10) 0.34597(14) 0.34799(10) 0.0267(5) Uani 1 1 d . . . . .
H220 H 0.4661 0.3782 0.3696 0.032 Uiso 1 1 calc R U . . .
C221 C 0.46427(10) 0.32731(14) 0.30078(10) 0.0259(5) Uani 1 1 d . . . . .
C222 C 0.49168(10) 0.28081(13) 0.26880(9) 0.0241(5) Uani 1 1 d . . . . .
H222 H 0.4768 0.2693 0.2366 0.029 Uiso 1 1 calc R U . . .
C223 C 0.55516(11) 0.33338(15) 0.41384(11) 0.0381(7) Uani 1 1 d D . . . .
F13 F 0.6037(2) 0.3547(7) 0.4126(3) 0.085(4) Uani 0.447(16) 1 d D U P D 1
F14 F 0.5578(5) 0.2754(3) 0.4428(3) 0.083(3) Uani 0.447(16) 1 d D U P D 1
F15 F 0.5283(3) 0.3772(6) 0.4403(3) 0.080(3) Uani 0.447(16) 1 d D U P D 1
F113 F 0.5349(5) 0.2970(7) 0.4503(2) 0.126(5) Uani 0.553(16) 1 d D U P D 2
F114 F 0.5472(5) 0.4002(4) 0.4263(4) 0.120(4) Uani 0.553(16) 1 d D U P D 2
F115 F 0.60599(17) 0.3263(6) 0.4166(3) 0.079(3) Uani 0.553(16) 1 d D U P D 2
C224 C 0.41118(12) 0.35603(18) 0.28547(11) 0.0370(6) Uani 1 1 d . . . . .
F16 F 0.40467(8) 0.36153(12) 0.23597(7) 0.0527(5) Uani 1 1 d . U . . .
F17 F 0.37213(9) 0.31469(19) 0.30208(13) 0.1000(12) Uani 1 1 d . U . . .
F18 F 0.40103(12) 0.41945(17) 0.30455(12) 0.0986(12) Uani 1 1 d . U . . .
C225 C 0.55914(11) 0.11570(13) 0.27484(9) 0.0265(5) Uani 1 1 d . . . . .
C226 C 0.59060(11) 0.08346(14) 0.31198(10) 0.0294(5) Uani 1 1 d . . . . .
H226 H 0.6233 0.1051 0.3213 0.035 Uiso 1 1 calc R U . . .
C227 C 0.57540(11) 0.02029(15) 0.33581(10) 0.0328(6) Uani 1 1 d D . . . .
C228 C 0.52857(12) -0.01377(14) 0.32283(11) 0.0315(6) Uani 1 1 d . . . . .
H228 H 0.5187 -0.0574 0.3385 0.038 Uiso 1 1 calc R U . . .
C229 C 0.49633(11) 0.01764(14) 0.28612(10) 0.0278(5) Uani 1 1 d . . . . .
C230 C 0.51113(11) 0.08154(13) 0.26348(10) 0.0262(5) Uani 1 1 d . . . . .
H230 H 0.4878 0.1028 0.2394 0.031 Uiso 1 1 calc R U . . .
C231 C 0.61059(13) -0.00971(16) 0.37668(13) 0.0501(9) Uani 1 1 d D . . . .
F19 F 0.5931(3) -0.0671(4) 0.3983(4) 0.070(3) Uani 0.52(2) 1 d D U P E 1
F20 F 0.6215(4) 0.0368(4) 0.4126(3) 0.081(3) Uani 0.52(2) 1 d D U P E 1
F21 F 0.6586(2) -0.0265(6) 0.3574(3) 0.073(3) Uani 0.52(2) 1 d D U P E 1
F119 F 0.6610(2) -0.0022(8) 0.3689(6) 0.106(5) Uani 0.48(2) 1 d D U P E 2
F120 F 0.6018(4) -0.0789(4) 0.3833(5) 0.067(3) Uani 0.48(2) 1 d D U P E 2
F121 F 0.5993(8) 0.0191(8) 0.4215(3) 0.130(5) Uani 0.48(2) 1 d D U P E 2
C232 C 0.44511(12) -0.01588(15) 0.27023(11) 0.0329(6) Uani 1 1 d . . . . .
F22 F 0.43316(10) -0.07376(12) 0.29621(11) 0.0773(8) Uani 1 1 d . U . . .
F23 F 0.40418(8) 0.02778(11) 0.27531(10) 0.0611(6) Uani 1 1 d . U . . .
F24 F 0.44514(10) -0.03454(16) 0.22151(8) 0.0717(7) Uani 1 1 d . U . . .


_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
Rh1 P1 2.2340(9) . ?
Rh1 P2 2.2403(8) . ?
Rh1 C3 2.267(3) . ?
Rh1 C6 2.285(3) . ?
Rh1 C5 2.320(3) . ?
Rh1 C4 2.329(3) . ?
Rh1 C2 2.329(3) . ?
Rh1 C1 2.408(3) . ?
C1 C2 1.412(4) . ?
C1 C6 1.417(4) . ?
C1 B1 1.610(4) . ?
C2 C3 1.415(4) . ?
C2 H2 0.9500 . ?
C3 C4 1.394(5) . ?
C3 H3 0.9500 . ?
C4 C5 1.387(5) . ?
C4 H4 0.9500 . ?
C5 C6 1.424(5) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
B1 N1 1.635(4) . ?
B1 H1A 0.9900 . ?
B1 H1B 0.9900 . ?
N1 C9 1.479(4) . ?
N1 C8 1.482(4) . ?
N1 C7 1.487(4) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
P1 C10A 1.796(9) . ?
P1 C16B 1.832(19) . ?
P1 C13B 1.832(12) . ?
P1 C13A 1.877(12) . ?
P1 C16A 1.880(7) . ?
P1 C10B 1.925(14) . ?
C10A C11A 1.507(11) . ?
C10A H10A 0.9900 . ?
C10A H10B 0.9900 . ?
C11A C12A 1.527(11) . ?
C11A H11A 0.9900 . ?
C11A H11B 0.9900 . ?
C12A P2 1.886(8) . ?
C12A H12A 0.9900 . ?
C12A H12B 0.9900 . ?
C10B C11B 1.536(14) . ?
C10B H10C 0.9900 . ?
C10B H10D 0.9900 . ?
C11B C12B 1.523(15) . ?
C11B H11C 0.9900 . ?
C11B H11D 0.9900 . ?
C12B P2 1.774(12) . ?
C12B H12C 0.9900 . ?
C12B H12D 0.9900 . ?
P2 C22A 1.807(8) . ?
P2 C19A 1.847(4) . ?
P2 C22B 1.950(11) . ?
C13A C15A 1.543(14) . ?
C13A C14A 1.548(13) . ?
C13A H13A 1.0000 . ?
C14A H14A 0.9800 . ?
C14A H14B 0.9800 . ?
C14A H14C 0.9800 . ?
C15A H15A 0.9800 . ?
C15A H15B 0.9800 . ?
C15A H15C 0.9800 . ?
C13B C15B 1.536(15) . ?
C13B C14B 1.539(16) . ?
C13B H13B 1.0000 . ?
C14B H14D 0.9800 . ?
C14B H14E 0.9800 . ?
C14B H14F 0.9800 . ?
C15B H15D 0.9800 . ?
C15B H15E 0.9800 . ?
C15B H15F 0.9800 . ?
C16A C18A 1.534(11) . ?
C16A C17A 1.544(11) . ?
C16A H16A 1.0000 . ?
C17A H17A 0.9800 . ?
C17A H17B 0.9800 . ?
C17A H17C 0.9800 . ?
C18A H18A 0.9800 . ?
C18A H18B 0.9800 . ?
C18A H18C 0.9800 . ?
C16B C18B 1.522(19) . ?
C16B C17B 1.55(2) . ?
C16B H16B 1.0000 . ?
C17B H17D 0.9800 . ?
C17B H17E 0.9800 . ?
C17B H17F 0.9800 . ?
C18B H18D 0.9800 . ?
C18B H18E 0.9800 . ?
C18B H18F 0.9800 . ?
C19A C21A 1.436(7) . ?
C19A C20A 1.526(10) . ?
C19A H19A 1.0000 . ?
C20A H20A 0.9800 . ?
C20A H20B 0.9800 . ?
C20A H20C 0.9800 . ?
C21A H21A 0.9800 . ?
C21A H21B 0.9800 . ?
C21A H21C 0.9800 . ?
C20B H20D 0.9800 . ?
C20B H20E 0.9800 . ?
C20B H20F 0.9800 . ?
C21B H21D 0.9800 . ?
C21B H21E 0.9800 . ?
C21B H21F 0.9800 . ?
C22A C23A 1.543(12) . ?
C22A C24A 1.541(11) . ?
C22A H22A 1.0000 . ?
C23A H23A 0.9800 . ?
C23A H23B 0.9800 . ?
C23A H23C 0.9800 . ?
C24A H24A 0.9800 . ?
C24A H24B 0.9800 . ?
C24A H24C 0.9800 . ?
C22B C24B 1.541(12) . ?
C22B C23B 1.647(17) . ?
C22B H22B 1.0000 . ?
C23B H23D 0.9800 . ?
C23B H23E 0.9800 . ?
C23B H23F 0.9800 . ?
C24B H24D 0.9800 . ?
C24B H24E 0.9800 . ?
C24B H24F 0.9800 . ?
B200 C217 1.636(4) . ?
B200 C225 1.637(4) . ?
B200 C201 1.638(4) . ?
B200 C209 1.641(4) . ?
C201 C202 1.398(4) . ?
C201 C206 1.402(3) . ?
C202 C203 1.393(4) . ?
C202 H202 0.9500 . ?
C203 C204 1.385(4) . ?
C203 C207 1.495(3) . ?
C204 C205 1.386(4) . ?
C204 H204 0.9500 . ?
C205 C206 1.386(4) . ?
C205 C208 1.489(4) . ?
C206 H206 0.9500 . ?
C207 F3 1.335(3) . ?
C207 F1 1.336(3) . ?
C207 F2 1.340(3) . ?
C208 F6 1.253(4) . ?
C208 F106 1.258(5) . ?
C208 F104 1.290(5) . ?
C208 F4 1.298(4) . ?
C208 F5 1.345(5) . ?
C208 F105 1.351(5) . ?
C209 C210 1.394(4) . ?
C209 C214 1.404(4) . ?
C210 C211 1.390(4) . ?
C210 H210 0.9500 . ?
C211 C212 1.381(4) . ?
C211 C215 1.499(5) . ?
C212 C213 1.378(5) . ?
C212 H212 0.9500 . ?
C213 C214 1.392(4) . ?
C213 C216 1.499(4) . ?
C214 H214 0.9500 . ?
C215 F9 1.316(4) . ?
C215 F7 1.323(5) . ?
C215 F8 1.337(5) . ?
C216 F10 1.274(5) . ?
C216 F110 1.285(5) . ?
C216 F11 1.310(5) . ?
C216 F111 1.324(6) . ?
C216 F112 1.345(5) . ?
C216 F12 1.362(5) . ?
C217 C222 1.392(4) . ?
C217 C218 1.405(3) . ?
C218 C219 1.388(3) . ?
C218 H218 0.9500 . ?
C219 C220 1.384(4) . ?
C219 C223 1.498(4) . ?
C220 C221 1.385(4) . ?
C220 H220 0.9500 . ?
C221 C222 1.394(4) . ?
C221 C224 1.496(4) . ?
C222 H222 0.9500 . ?
C223 F15 1.271(5) . ?
C223 F113 1.282(5) . ?
C223 F13 1.286(5) . ?
C223 F115 1.288(5) . ?
C223 F114 1.312(5) . ?
C223 F14 1.331(5) . ?
C224 F16 1.314(3) . ?
C224 F18 1.317(4) . ?
C224 F17 1.326(4) . ?
C225 C226 1.394(4) . ?
C225 C230 1.400(4) . ?
C226 C227 1.395(4) . ?
C226 H226 0.9500 . ?
C227 C228 1.383(4) . ?
C227 C231 1.501(4) . ?
C228 C229 1.391(4) . ?
C228 H228 0.9500 . ?
C229 C230 1.390(4) . ?
C229 C232 1.494(4) . ?
C230 H230 0.9500 . ?
C231 F119 1.292(6) . ?
C231 F19 1.296(5) . ?
C231 F20 1.315(5) . ?
C231 F121 1.325(6) . ?
C231 F120 1.330(5) . ?
C231 F21 1.347(5) . ?
C232 F22 1.318(3) . ?
C232 F23 1.323(4) . ?
C232 F24 1.326(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
P1 Rh1 P2 94.04(4) . . ?
P1 Rh1 C3 171.24(9) . . ?
P2 Rh1 C3 94.65(9) . . ?
P1 Rh1 C6 96.99(8) . . ?
P2 Rh1 C6 168.92(8) . . ?
C3 Rh1 C6 74.35(12) . . ?
P1 Rh1 C5 109.25(9) . . ?
P2 Rh1 C5 139.44(9) . . ?
C3 Rh1 C5 62.95(12) . . ?
C6 Rh1 C5 36.00(11) . . ?
P1 Rh1 C4 139.36(10) . . ?
P2 Rh1 C4 108.41(9) . . ?
C3 Rh1 C4 35.28(12) . . ?
C6 Rh1 C4 63.29(11) . . ?
C5 Rh1 C4 34.72(12) . . ?
P1 Rh1 C2 140.77(8) . . ?
P2 Rh1 C2 108.07(8) . . ?
C3 Rh1 C2 35.84(11) . . ?
C6 Rh1 C2 62.16(11) . . ?
C5 Rh1 C2 74.23(11) . . ?
C4 Rh1 C2 63.47(12) . . ?
P1 Rh1 C1 109.92(7) . . ?
P2 Rh1 C1 138.35(7) . . ?
C3 Rh1 C1 63.70(10) . . ?
C6 Rh1 C1 35.01(10) . . ?
C5 Rh1 C1 63.98(10) . . ?
C4 Rh1 C1 75.04(10) . . ?
C2 Rh1 C1 34.65(10) . . ?
C2 C1 C6 114.7(3) . . ?
C2 C1 B1 122.6(3) . . ?
C6 C1 B1 122.6(3) . . ?
C2 C1 Rh1 69.63(15) . . ?
C6 C1 Rh1 67.77(15) . . ?
B1 C1 Rh1 131.53(19) . . ?
C1 C2 C3 121.7(3) . . ?
C1 C2 Rh1 75.72(16) . . ?
C3 C2 Rh1 69.70(16) . . ?
C1 C2 H2 119.1 . . ?
C3 C2 H2 119.1 . . ?
Rh1 C2 H2 127.6 . . ?
C4 C3 C2 121.4(3) . . ?
C4 C3 Rh1 74.78(18) . . ?
C2 C3 Rh1 74.47(17) . . ?
C4 C3 H3 119.3 . . ?
C2 C3 H3 119.3 . . ?
Rh1 C3 H3 122.8 . . ?
C5 C4 C3 118.9(3) . . ?
C5 C4 Rh1 72.30(17) . . ?
C3 C4 Rh1 69.95(17) . . ?
C5 C4 H4 120.5 . . ?
C3 C4 H4 120.5 . . ?
Rh1 C4 H4 129.6 . . ?
C4 C5 C6 118.9(3) . . ?
C4 C5 Rh1 72.98(17) . . ?
C6 C5 Rh1 70.67(16) . . ?
C4 C5 H5 120.5 . . ?
C6 C5 H5 120.5 . . ?
Rh1 C5 H5 127.9 . . ?
C1 C6 C5 123.8(3) . . ?
C1 C6 Rh1 77.22(16) . . ?
C5 C6 Rh1 73.33(16) . . ?
C1 C6 H6 118.1 . . ?
C5 C6 H6 118.1 . . ?
Rh1 C6 H6 122.7 . . ?
C1 B1 N1 110.8(2) . . ?
C1 B1 H1A 109.5 . . ?
N1 B1 H1A 109.5 . . ?
C1 B1 H1B 109.5 . . ?
N1 B1 H1B 109.5 . . ?
H1A B1 H1B 108.1 . . ?
C9 N1 C8 109.1(3) . . ?
C9 N1 C7 108.4(3) . . ?
C8 N1 C7 108.4(3) . . ?
C9 N1 B1 111.4(3) . . ?
C8 N1 B1 111.8(3) . . ?
C7 N1 B1 107.6(2) . . ?
N1 C7 H7A 109.5 . . ?
N1 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
N1 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C8 H8A 109.5 . . ?
N1 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N1 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
N1 C9 H9A 109.5 . . ?
N1 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
N1 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C16B P1 C13B 105.6(15) . . ?
C10A P1 C13A 101.4(6) . . ?
C10A P1 C16A 95.1(7) . . ?
C13A P1 C16A 109.0(9) . . ?
C16B P1 C10B 98(2) . . ?
C13B P1 C10B 108.3(12) . . ?
C10A P1 Rh1 125.7(5) . . ?
C16B P1 Rh1 117.9(14) . . ?
C13B P1 Rh1 112.2(6) . . ?
C13A P1 Rh1 108.8(5) . . ?
C16A P1 Rh1 115.1(3) . . ?
C10B P1 Rh1 113.4(7) . . ?
C11A C10A P1 112.7(7) . . ?
C11A C10A H10A 109.0 . . ?
P1 C10A H10A 109.0 . . ?
C11A C10A H10B 109.0 . . ?
P1 C10A H10B 109.0 . . ?
H10A C10A H10B 107.8 . . ?
C10A C11A C12A 112.4(8) . . ?
C10A C11A H11A 109.1 . . ?
C12A C11A H11A 109.1 . . ?
C10A C11A H11B 109.1 . . ?
C12A C11A H11B 109.1 . . ?
H11A C11A H11B 107.8 . . ?
C11A C12A P2 118.3(5) . . ?
C11A C12A H12A 107.7 . . ?
P2 C12A H12A 107.7 . . ?
C11A C12A H12B 107.7 . . ?
P2 C12A H12B 107.7 . . ?
H12A C12A H12B 107.1 . . ?
C11B C10B P1 121.8(10) . . ?
C11B C10B H10C 106.9 . . ?
P1 C10B H10C 106.9 . . ?
C11B C10B H10D 106.9 . . ?
P1 C10B H10D 106.9 . . ?
H10C C10B H10D 106.7 . . ?
C12B C11B C10B 113.5(13) . . ?
C12B C11B H11C 108.9 . . ?
C10B C11B H11C 108.9 . . ?
C12B C11B H11D 108.9 . . ?
C10B C11B H11D 108.9 . . ?
H11C C11B H11D 107.7 . . ?
C11B C12B P2 110.6(10) . . ?
C11B C12B H12C 109.5 . . ?
P2 C12B H12C 109.5 . . ?
C11B C12B H12D 109.5 . . ?
P2 C12B H12D 109.5 . . ?
H12C C12B H12D 108.1 . . ?
C22A P2 C19A 105.9(4) . . ?
C22A P2 C12A 99.2(5) . . ?
C19A P2 C12A 100.5(3) . . ?
C12B P2 C22B 99.5(10) . . ?
C12B P2 Rh1 128.9(6) . . ?
C22A P2 Rh1 117.9(3) . . ?
C19A P2 Rh1 113.99(14) . . ?
C12A P2 Rh1 116.9(4) . . ?
C22B P2 Rh1 107.6(4) . . ?
C15A C13A C14A 110.2(13) . . ?
C15A C13A P1 115.3(13) . . ?
C14A C13A P1 114.1(11) . . ?
C15A C13A H13A 105.4 . . ?
C14A C13A H13A 105.4 . . ?
P1 C13A H13A 105.4 . . ?
C13A C14A H14A 109.5 . . ?
C13A C14A H14B 109.5 . . ?
H14A C14A H14B 109.5 . . ?
C13A C14A H14C 109.5 . . ?
H14A C14A H14C 109.5 . . ?
H14B C14A H14C 109.5 . . ?
C13A C15A H15A 109.5 . . ?
C13A C15A H15B 109.5 . . ?
H15A C15A H15B 109.5 . . ?
C13A C15A H15C 109.5 . . ?
H15A C15A H15C 109.5 . . ?
H15B C15A H15C 109.5 . . ?
C15B C13B C14B 110.8(16) . . ?
C15B C13B P1 103.5(13) . . ?
C14B C13B P1 116.5(14) . . ?
C15B C13B H13B 108.6 . . ?
C14B C13B H13B 108.6 . . ?
P1 C13B H13B 108.6 . . ?
C13B C14B H14D 109.5 . . ?
C13B C14B H14E 109.5 . . ?
H14D C14B H14E 109.5 . . ?
C13B C14B H14F 109.5 . . ?
H14D C14B H14F 109.5 . . ?
H14E C14B H14F 109.5 . . ?
C13B C15B H15D 109.5 . . ?
C13B C15B H15E 109.5 . . ?
H15D C15B H15E 109.5 . . ?
C13B C15B H15F 109.5 . . ?
H15D C15B H15F 109.5 . . ?
H15E C15B H15F 109.5 . . ?
C18A C16A C17A 109.4(9) . . ?
C18A C16A P1 110.9(6) . . ?
C17A C16A P1 114.0(6) . . ?
C18A C16A H16A 107.4 . . ?
C17A C16A H16A 107.4 . . ?
P1 C16A H16A 107.4 . . ?
C16A C17A H17A 109.5 . . ?
C16A C17A H17B 109.5 . . ?
H17A C17A H17B 109.5 . . ?
C16A C17A H17C 109.5 . . ?
H17A C17A H17C 109.5 . . ?
H17B C17A H17C 109.5 . . ?
C16A C18A H18A 109.5 . . ?
C16A C18A H18B 109.5 . . ?
H18A C18A H18B 109.5 . . ?
C16A C18A H18C 109.5 . . ?
H18A C18A H18C 109.5 . . ?
H18B C18A H18C 109.5 . . ?
C18B C16B C17B 112(3) . . ?
C18B C16B P1 114(2) . . ?
C17B C16B P1 105(3) . . ?
C18B C16B H16B 108.5 . . ?
C17B C16B H16B 108.5 . . ?
P1 C16B H16B 108.5 . . ?
C16B C17B H17D 109.5 . . ?
C16B C17B H17E 109.5 . . ?
H17D C17B H17E 109.5 . . ?
C16B C17B H17F 109.5 . . ?
H17D C17B H17F 109.5 . . ?
H17E C17B H17F 109.5 . . ?
C16B C18B H18D 109.5 . . ?
C16B C18B H18E 109.5 . . ?
H18D C18B H18E 109.5 . . ?
C16B C18B H18F 109.5 . . ?
H18D C18B H18F 109.5 . . ?
H18E C18B H18F 109.5 . . ?
C21A C19A C20A 103.0(6) . . ?
C21A C19A P2 116.0(5) . . ?
C20A C19A P2 111.8(7) . . ?
C21A C19A H19A 108.6 . . ?
C20A C19A H19A 108.6 . . ?
P2 C19A H19A 108.6 . . ?
C19A C20A H20A 109.5 . . ?
C19A C20A H20B 109.5 . . ?
H20A C20A H20B 109.5 . . ?
C19A C20A H20C 109.5 . . ?
H20A C20A H20C 109.5 . . ?
H20B C20A H20C 109.5 . . ?
C19A C21A H21A 109.5 . . ?
C19A C21A H21B 109.5 . . ?
H21A C21A H21B 109.5 . . ?
C19A C21A H21C 109.5 . . ?
H21A C21A H21C 109.5 . . ?
H21B C21A H21C 109.5 . . ?
H20D C20B H20E 109.5 . . ?
H20D C20B H20F 109.5 . . ?
H20E C20B H20F 109.5 . . ?
H21D C21B H21E 109.5 . . ?
H21D C21B H21F 109.5 . . ?
H21E C21B H21F 109.5 . . ?
C23A C22A C24A 95.4(10) . . ?
C23A C22A P2 118.0(9) . . ?
C24A C22A P2 111.1(6) . . ?
C23A C22A H22A 110.5 . . ?
C24A C22A H22A 110.5 . . ?
P2 C22A H22A 110.5 . . ?
C22A C23A H23A 109.5 . . ?
C22A C23A H23B 109.5 . . ?
H23A C23A H23B 109.5 . . ?
C22A C23A H23C 109.5 . . ?
H23A C23A H23C 109.5 . . ?
H23B C23A H23C 109.5 . . ?
C22A C24A H24A 109.5 . . ?
C22A C24A H24B 109.5 . . ?
H24A C24A H24B 109.5 . . ?
C22A C24A H24C 109.5 . . ?
H24A C24A H24C 109.5 . . ?
H24B C24A H24C 109.5 . . ?
C24B C22B C23B 104.9(13) . . ?
C24B C22B P2 118.3(9) . . ?
C23B C22B P2 94.8(10) . . ?
C24B C22B H22B 112.4 . . ?
C23B C22B H22B 112.4 . . ?
P2 C22B H22B 112.4 . . ?
C22B C23B H23D 109.5 . . ?
C22B C23B H23E 109.5 . . ?
H23D C23B H23E 109.5 . . ?
C22B C23B H23F 109.5 . . ?
H23D C23B H23F 109.5 . . ?
H23E C23B H23F 109.5 . . ?
C22B C24B H24D 109.5 . . ?
C22B C24B H24E 109.5 . . ?
H24D C24B H24E 109.5 . . ?
C22B C24B H24F 109.5 . . ?
H24D C24B H24F 109.5 . . ?
H24E C24B H24F 109.5 . . ?
C217 B200 C225 104.5(2) . . ?
C217 B200 C201 114.3(2) . . ?
C225 B200 C201 111.2(2) . . ?
C217 B200 C209 111.3(2) . . ?
C225 B200 C209 113.4(2) . . ?
C201 B200 C209 102.5(2) . . ?
C202 C201 C206 115.6(2) . . ?
C202 C201 B200 121.3(2) . . ?
C206 C201 B200 122.4(2) . . ?
C203 C202 C201 122.2(2) . . ?
C203 C202 H202 118.9 . . ?
C201 C202 H202 118.9 . . ?
C204 C203 C202 121.1(2) . . ?
C204 C203 C207 119.8(2) . . ?
C202 C203 C207 119.1(2) . . ?
C203 C204 C205 117.7(2) . . ?
C203 C204 H204 121.2 . . ?
C205 C204 H204 121.2 . . ?
C204 C205 C206 121.2(2) . . ?
C204 C205 C208 119.5(2) . . ?
C206 C205 C208 119.3(2) . . ?
C205 C206 C201 122.3(2) . . ?
C205 C206 H206 118.8 . . ?
C201 C206 H206 118.8 . . ?
F3 C207 F1 106.3(2) . . ?
F3 C207 F2 106.4(2) . . ?
F1 C207 F2 105.9(2) . . ?
F3 C207 C203 113.1(2) . . ?
F1 C207 C203 112.3(2) . . ?
F2 C207 C203 112.4(2) . . ?
F106 C208 F104 107.4(5) . . ?
F6 C208 F4 109.3(4) . . ?
F6 C208 F5 103.8(4) . . ?
F4 C208 F5 102.7(4) . . ?
F106 C208 F105 105.2(5) . . ?
F104 C208 F105 102.2(5) . . ?
F6 C208 C205 116.2(3) . . ?
F106 C208 C205 116.2(3) . . ?
F104 C208 C205 114.6(4) . . ?
F4 C208 C205 113.7(3) . . ?
F5 C208 C205 109.7(3) . . ?
F105 C208 C205 109.9(3) . . ?
C210 C209 C214 115.9(3) . . ?
C210 C209 B200 122.7(2) . . ?
C214 C209 B200 120.8(2) . . ?
C211 C210 C209 122.2(3) . . ?
C211 C210 H210 118.9 . . ?
C209 C210 H210 118.9 . . ?
C212 C211 C210 120.9(3) . . ?
C212 C211 C215 120.9(3) . . ?
C210 C211 C215 118.2(3) . . ?
C213 C212 C211 118.2(3) . . ?
C213 C212 H212 120.9 . . ?
C211 C212 H212 120.9 . . ?
C212 C213 C214 121.1(3) . . ?
C212 C213 C216 120.0(3) . . ?
C214 C213 C216 118.8(3) . . ?
C213 C214 C209 121.7(3) . . ?
C213 C214 H214 119.2 . . ?
C209 C214 H214 119.2 . . ?
F9 C215 F7 107.5(3) . . ?
F9 C215 F8 105.8(4) . . ?
F7 C215 F8 106.6(4) . . ?
F9 C215 C211 113.5(3) . . ?
F7 C215 C211 111.9(3) . . ?
F8 C215 C211 111.2(3) . . ?
F10 C216 F11 110.0(5) . . ?
F110 C216 F111 107.4(5) . . ?
F110 C216 F112 106.2(5) . . ?
F111 C216 F112 102.8(5) . . ?
F10 C216 F12 105.4(5) . . ?
F11 C216 F12 103.3(4) . . ?
F10 C216 C213 115.6(4) . . ?
F110 C216 C213 116.9(4) . . ?
F11 C216 C213 111.7(4) . . ?
F111 C216 C213 110.8(4) . . ?
F112 C216 C213 111.7(4) . . ?
F12 C216 C213 110.0(4) . . ?
C222 C217 C218 115.7(2) . . ?
C222 C217 B200 125.2(2) . . ?
C218 C217 B200 118.9(2) . . ?
C219 C218 C217 122.0(2) . . ?
C219 C218 H218 119.0 . . ?
C217 C218 H218 119.0 . . ?
C220 C219 C218 121.3(2) . . ?
C220 C219 C223 119.6(2) . . ?
C218 C219 C223 119.2(2) . . ?
C219 C220 C221 117.7(2) . . ?
C219 C220 H220 121.2 . . ?
C221 C220 H220 121.2 . . ?
C220 C221 C222 121.1(2) . . ?
C220 C221 C224 118.5(2) . . ?
C222 C221 C224 120.4(2) . . ?
C217 C222 C221 122.2(2) . . ?
C217 C222 H222 118.9 . . ?
C221 C222 H222 118.9 . . ?
F15 C223 F13 108.5(5) . . ?
F113 C223 F115 107.3(5) . . ?
F113 C223 F114 105.3(5) . . ?
F115 C223 F114 103.6(4) . . ?
F15 C223 F14 104.2(5) . . ?
F13 C223 F14 102.8(5) . . ?
F15 C223 C219 115.3(4) . . ?
F113 C223 C219 113.7(4) . . ?
F13 C223 C219 114.2(4) . . ?
F115 C223 C219 114.1(3) . . ?
F114 C223 C219 111.9(4) . . ?
F14 C223 C219 110.8(4) . . ?
F16 C224 F18 106.3(3) . . ?
F16 C224 F17 106.2(3) . . ?
F18 C224 F17 105.1(3) . . ?
F16 C224 C221 113.9(2) . . ?
F18 C224 C221 113.4(3) . . ?
F17 C224 C221 111.2(3) . . ?
C226 C225 C230 116.1(2) . . ?
C226 C225 B200 123.7(2) . . ?
C230 C225 B200 120.0(2) . . ?
C225 C226 C227 121.8(3) . . ?
C225 C226 H226 119.1 . . ?
C227 C226 H226 119.1 . . ?
C228 C227 C226 121.1(3) . . ?
C228 C227 C231 120.3(2) . . ?
C226 C227 C231 118.6(3) . . ?
C227 C228 C229 118.1(2) . . ?
C227 C228 H228 121.0 . . ?
C229 C228 H228 121.0 . . ?
C230 C229 C228 120.4(3) . . ?
C230 C229 C232 118.4(2) . . ?
C228 C229 C232 121.2(2) . . ?
C229 C230 C225 122.4(2) . . ?
C229 C230 H230 118.8 . . ?
C225 C230 H230 118.8 . . ?
F19 C231 F20 108.0(5) . . ?
F119 C231 F121 107.8(5) . . ?
F119 C231 F120 106.8(5) . . ?
F121 C231 F120 104.3(5) . . ?
F19 C231 F21 105.9(5) . . ?
F20 C231 F21 103.7(4) . . ?
F119 C231 C227 115.2(5) . . ?
F19 C231 C227 115.2(4) . . ?
F20 C231 C227 112.7(4) . . ?
F121 C231 C227 110.8(4) . . ?
F120 C231 C227 111.3(4) . . ?
F21 C231 C227 110.4(4) . . ?
F22 C232 F23 106.4(3) . . ?
F22 C232 F24 106.3(3) . . ?
F23 C232 F24 105.2(3) . . ?
F22 C232 C229 113.6(2) . . ?
F23 C232 C229 112.5(2) . . ?
F24 C232 C229 112.3(2) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C6 C1 C2 C3 2.7(4) . . . . ?
B1 C1 C2 C3 -178.3(3) . . . . ?
Rh1 C1 C2 C3 54.7(3) . . . . ?
C6 C1 C2 Rh1 -52.0(2) . . . . ?
B1 C1 C2 Rh1 127.0(2) . . . . ?
C1 C2 C3 C4 3.2(5) . . . . ?
Rh1 C2 C3 C4 60.7(3) . . . . ?
C1 C2 C3 Rh1 -57.5(3) . . . . ?
C2 C3 C4 C5 -5.4(5) . . . . ?
Rh1 C3 C4 C5 55.1(3) . . . . ?
C2 C3 C4 Rh1 -60.6(3) . . . . ?
C3 C4 C5 C6 1.6(4) . . . . ?
Rh1 C4 C5 C6 55.6(2) . . . . ?
C3 C4 C5 Rh1 -54.0(3) . . . . ?
C2 C1 C6 C5 -6.6(4) . . . . ?
B1 C1 C6 C5 174.3(3) . . . . ?
Rh1 C1 C6 C5 -59.6(3) . . . . ?
C2 C1 C6 Rh1 53.0(2) . . . . ?
B1 C1 C6 Rh1 -126.1(2) . . . . ?
C4 C5 C6 C1 4.7(4) . . . . ?
Rh1 C5 C6 C1 61.4(3) . . . . ?
C4 C5 C6 Rh1 -56.7(3) . . . . ?
C2 C1 B1 N1 89.6(3) . . . . ?
C6 C1 B1 N1 -91.4(3) . . . . ?
Rh1 C1 B1 N1 -179.53(19) . . . . ?
C1 B1 N1 C9 -63.6(4) . . . . ?
C1 B1 N1 C8 58.8(3) . . . . ?
C1 B1 N1 C7 177.7(3) . . . . ?
C16B P1 C10A C11A 151.5(13) . . . . ?
C13B P1 C10A C11A -104.4(12) . . . . ?
C13A P1 C10A C11A -91.2(11) . . . . ?
C16A P1 C10A C11A 158.2(8) . . . . ?
C10B P1 C10A C11A -11(3) . . . . ?
Rh1 P1 C10A C11A 32.2(10) . . . . ?
P1 C10A C11A C12A -69.7(9) . . . . ?
C10A C11A C12A P2 74.4(9) . . . . ?
P1 C10B C11B C12B -73.0(17) . . . . ?
C10B C11B C12B P2 64.3(15) . . . . ?
C11B C12B P2 C22A 99.9(11) . . . . ?
C11B C12B P2 C19A -155.7(9) . . . . ?
C11B C12B P2 C12A -72(2) . . . . ?
C11B C12B P2 C22B 102.8(11) . . . . ?
C11B C12B P2 Rh1 -19.1(16) . . . . ?
C11A C12A P2 C12B 101(2) . . . . ?
C11A C12A P2 C22A 93.2(7) . . . . ?
C11A C12A P2 C19A -158.6(6) . . . . ?
C11A C12A P2 C22B 95.6(8) . . . . ?
C11A C12A P2 Rh1 -34.7(8) . . . . ?
C10A P1 C13A C15A 73.8(13) . . . . ?
C16B P1 C13A C15A 162(2) . . . . ?
C13B P1 C13A C15A -166(5) . . . . ?
C16A P1 C13A C15A 173.3(11) . . . . ?
C10B P1 C13A C15A 57.8(14) . . . . ?
Rh1 P1 C13A C15A -60.4(13) . . . . ?
C10A P1 C13A C14A -55.3(12) . . . . ?
C16B P1 C13A C14A 33(2) . . . . ?
C13B P1 C13A C14A 64(4) . . . . ?
C16A P1 C13A C14A 44.2(11) . . . . ?
C10B P1 C13A C14A -71.3(12) . . . . ?
Rh1 P1 C13A C14A 170.6(9) . . . . ?
C10A P1 C13B C15B 71.1(13) . . . . ?
C16B P1 C13B C15B 158(2) . . . . ?
C13A P1 C13B C15B 7(3) . . . . ?
C16A P1 C13B C15B 168.3(12) . . . . ?
C10B P1 C13B C15B 54.1(14) . . . . ?
Rh1 P1 C13B C15B -71.8(15) . . . . ?
C10A P1 C13B C14B -50.8(16) . . . . ?
C16B P1 C13B C14B 37(2) . . . . ?
C13A P1 C13B C14B -115(5) . . . . ?
C16A P1 C13B C14B 46.3(14) . . . . ?
C10B P1 C13B C14B -67.8(16) . . . . ?
Rh1 P1 C13B C14B 166.3(13) . . . . ?
C10A P1 C16A C18A -77.9(8) . . . . ?
C16B P1 C16A C18A -49(6) . . . . ?
C13B P1 C16A C18A 173.2(10) . . . . ?
C13A P1 C16A C18A 178.2(8) . . . . ?
C10B P1 C16A C18A -74.8(10) . . . . ?
Rh1 P1 C16A C18A 55.6(7) . . . . ?
C10A P1 C16A C17A 158.1(8) . . . . ?
C16B P1 C16A C17A -173(7) . . . . ?
C13B P1 C16A C17A 49.2(11) . . . . ?
C13A P1 C16A C17A 54.2(9) . . . . ?
C10B P1 C16A C17A 161.1(10) . . . . ?
Rh1 P1 C16A C17A -68.4(8) . . . . ?
C10A P1 C16B C18B -77(3) . . . . ?
C13B P1 C16B C18B 176(3) . . . . ?
C13A P1 C16B C18B -176(2) . . . . ?
C16A P1 C16B C18B 132(8) . . . . ?
C10B P1 C16B C18B -72(3) . . . . ?
Rh1 P1 C16B C18B 50(3) . . . . ?
C10A P1 C16B C17B 160(3) . . . . ?
C13B P1 C16B C17B 53(3) . . . . ?
C13A P1 C16B C17B 61(3) . . . . ?
C16A P1 C16B C17B 9(5) . . . . ?
C10B P1 C16B C17B 165(3) . . . . ?
Rh1 P1 C16B C17B -73(3) . . . . ?
C12B P2 C19A C21A -38.5(10) . . . . ?
C22A P2 C19A C21A 46.0(5) . . . . ?
C12A P2 C19A C21A -56.9(6) . . . . ?
C22B P2 C19A C21A 63.4(6) . . . . ?
Rh1 P2 C19A C21A 177.3(4) . . . . ?
C12B P2 C19A C20A 79.1(11) . . . . ?
C22A P2 C19A C20A 163.6(6) . . . . ?
C12A P2 C19A C20A 60.8(7) . . . . ?
C22B P2 C19A C20A -178.9(7) . . . . ?
Rh1 P2 C19A C20A -65.1(6) . . . . ?
C12B P2 C22A C23A -93.9(11) . . . . ?
C19A P2 C22A C23A 164.8(10) . . . . ?
C12A P2 C22A C23A -91.4(11) . . . . ?
C22B P2 C22A C23A 95(2) . . . . ?
Rh1 P2 C22A C23A 35.8(11) . . . . ?
C12B P2 C22A C24A 157.5(8) . . . . ?
C19A P2 C22A C24A 56.1(7) . . . . ?
C12A P2 C22A C24A 159.9(6) . . . . ?
C22B P2 C22A C24A -13.2(14) . . . . ?
Rh1 P2 C22A C24A -72.9(7) . . . . ?
C217 B200 C201 C202 46.7(3) . . . . ?
C225 B200 C201 C202 164.8(2) . . . . ?
C209 B200 C201 C202 -73.8(3) . . . . ?
C217 B200 C201 C206 -143.8(2) . . . . ?
C225 B200 C201 C206 -25.8(3) . . . . ?
C209 B200 C201 C206 95.7(3) . . . . ?
C206 C201 C202 C203 0.7(4) . . . . ?
B200 C201 C202 C203 170.8(2) . . . . ?
C201 C202 C203 C204 0.4(4) . . . . ?
C201 C202 C203 C207 -177.9(3) . . . . ?
C202 C203 C204 C205 -0.9(4) . . . . ?
C207 C203 C204 C205 177.4(3) . . . . ?
C203 C204 C205 C206 0.4(4) . . . . ?
C203 C204 C205 C208 -176.8(3) . . . . ?
C204 C205 C206 C201 0.7(4) . . . . ?
C208 C205 C206 C201 177.9(3) . . . . ?
C202 C201 C206 C205 -1.2(4) . . . . ?
B200 C201 C206 C205 -171.2(3) . . . . ?
C204 C203 C207 F3 -18.1(4) . . . . ?
C202 C203 C207 F3 160.2(3) . . . . ?
C204 C203 C207 F1 -138.5(3) . . . . ?
C202 C203 C207 F1 39.9(3) . . . . ?
C204 C203 C207 F2 102.3(3) . . . . ?
C202 C203 C207 F2 -79.4(3) . . . . ?
C204 C205 C208 F6 159.8(5) . . . . ?
C206 C205 C208 F6 -17.5(5) . . . . ?
C204 C205 C208 F106 -25.5(7) . . . . ?
C206 C205 C208 F106 157.2(7) . . . . ?
C204 C205 C208 F104 -151.8(7) . . . . ?
C206 C205 C208 F104 31.0(8) . . . . ?
C204 C205 C208 F4 31.5(6) . . . . ?
C206 C205 C208 F4 -145.8(6) . . . . ?
C204 C205 C208 F5 -82.9(6) . . . . ?
C206 C205 C208 F5 99.9(6) . . . . ?
C204 C205 C208 F105 93.8(7) . . . . ?
C206 C205 C208 F105 -83.5(8) . . . . ?
C217 B200 C209 C210 -24.2(3) . . . . ?
C225 B200 C209 C210 -141.7(2) . . . . ?
C201 B200 C209 C210 98.3(3) . . . . ?
C217 B200 C209 C214 165.5(2) . . . . ?
C225 B200 C209 C214 48.0(3) . . . . ?
C201 B200 C209 C214 -72.0(3) . . . . ?
C214 C209 C210 C211 -1.3(4) . . . . ?
B200 C209 C210 C211 -172.1(3) . . . . ?
C209 C210 C211 C212 1.6(5) . . . . ?
C209 C210 C211 C215 -178.4(3) . . . . ?
C210 C211 C212 C213 -1.1(5) . . . . ?
C215 C211 C212 C213 179.0(3) . . . . ?
C211 C212 C213 C214 0.3(5) . . . . ?
C211 C212 C213 C216 177.9(3) . . . . ?
C212 C213 C214 C209 -0.1(5) . . . . ?
C216 C213 C214 C209 -177.7(3) . . . . ?
C210 C209 C214 C213 0.6(4) . . . . ?
B200 C209 C214 C213 171.5(3) . . . . ?
C212 C211 C215 F9 10.2(6) . . . . ?
C210 C211 C215 F9 -169.7(4) . . . . ?
C212 C211 C215 F7 132.0(3) . . . . ?
C210 C211 C215 F7 -47.9(5) . . . . ?
C212 C211 C215 F8 -108.9(4) . . . . ?
C210 C211 C215 F8 71.1(4) . . . . ?
C212 C213 C216 F10 147.8(8) . . . . ?
C214 C213 C216 F10 -34.5(8) . . . . ?
C212 C213 C216 F110 -10.8(10) . . . . ?
C214 C213 C216 F110 166.9(10) . . . . ?
C212 C213 C216 F11 -85.4(8) . . . . ?
C214 C213 C216 F11 92.3(8) . . . . ?
C212 C213 C216 F111 112.7(9) . . . . ?
C214 C213 C216 F111 -69.6(9) . . . . ?
C212 C213 C216 F112 -133.4(10) . . . . ?
C214 C213 C216 F112 44.3(10) . . . . ?
C212 C213 C216 F12 28.7(7) . . . . ?
C214 C213 C216 F12 -153.7(6) . . . . ?
C225 B200 C217 C222 -99.7(3) . . . . ?
C201 B200 C217 C222 22.1(4) . . . . ?
C209 B200 C217 C222 137.6(2) . . . . ?
C225 B200 C217 C218 75.3(3) . . . . ?
C201 B200 C217 C218 -163.0(2) . . . . ?
C209 B200 C217 C218 -47.5(3) . . . . ?
C222 C217 C218 C219 -2.4(4) . . . . ?
B200 C217 C218 C219 -177.8(2) . . . . ?
C217 C218 C219 C220 1.8(4) . . . . ?
C217 C218 C219 C223 -179.7(2) . . . . ?
C218 C219 C220 C221 -0.1(4) . . . . ?
C223 C219 C220 C221 -178.6(2) . . . . ?
C219 C220 C221 C222 -0.9(4) . . . . ?
C219 C220 C221 C224 176.8(2) . . . . ?
C218 C217 C222 C221 1.4(4) . . . . ?
B200 C217 C222 C221 176.5(2) . . . . ?
C220 C221 C222 C217 0.3(4) . . . . ?
C224 C221 C222 C217 -177.4(2) . . . . ?
C220 C219 C223 F15 -1.8(7) . . . . ?
C218 C219 C223 F15 179.7(7) . . . . ?
C220 C219 C223 F113 81.2(9) . . . . ?
C218 C219 C223 F113 -97.4(9) . . . . ?
C220 C219 C223 F13 -128.4(7) . . . . ?
C218 C219 C223 F13 53.1(8) . . . . ?
C220 C219 C223 F115 -155.3(6) . . . . ?
C218 C219 C223 F115 26.2(7) . . . . ?
C220 C219 C223 F114 -38.0(8) . . . . ?
C218 C219 C223 F114 143.5(8) . . . . ?
C220 C219 C223 F14 116.2(7) . . . . ?
C218 C219 C223 F14 -62.3(7) . . . . ?
C220 C221 C224 F16 153.3(3) . . . . ?
C222 C221 C224 F16 -29.0(4) . . . . ?
C220 C221 C224 F18 31.5(4) . . . . ?
C222 C221 C224 F18 -150.7(3) . . . . ?
C220 C221 C224 F17 -86.7(4) . . . . ?
C222 C221 C224 F17 91.0(3) . . . . ?
C217 B200 C225 C226 -94.2(3) . . . . ?
C201 B200 C225 C226 142.0(3) . . . . ?
C209 B200 C225 C226 27.1(3) . . . . ?
C217 B200 C225 C230 80.4(3) . . . . ?
C201 B200 C225 C230 -43.4(3) . . . . ?
C209 B200 C225 C230 -158.3(2) . . . . ?
C230 C225 C226 C227 0.9(4) . . . . ?
B200 C225 C226 C227 175.7(2) . . . . ?
C225 C226 C227 C228 1.1(4) . . . . ?
C225 C226 C227 C231 -177.9(3) . . . . ?
C226 C227 C228 C229 -1.5(4) . . . . ?
C231 C227 C228 C229 177.5(3) . . . . ?
C227 C228 C229 C230 -0.1(4) . . . . ?
C227 C228 C229 C232 -179.8(3) . . . . ?
C228 C229 C230 C225 2.3(4) . . . . ?
C232 C229 C230 C225 -178.0(2) . . . . ?
C226 C225 C230 C229 -2.6(4) . . . . ?
B200 C225 C230 C229 -177.6(2) . . . . ?
C228 C227 C231 F119 144.1(10) . . . . ?
C226 C227 C231 F119 -36.9(10) . . . . ?
C228 C227 C231 F19 -1.3(8) . . . . ?
C226 C227 C231 F19 177.8(7) . . . . ?
C228 C227 C231 F20 -125.9(6) . . . . ?
C226 C227 C231 F20 53.1(6) . . . . ?
C228 C227 C231 F121 -93.3(11) . . . . ?
C226 C227 C231 F121 85.7(11) . . . . ?
C228 C227 C231 F120 22.3(9) . . . . ?
C226 C227 C231 F120 -158.7(8) . . . . ?
C228 C227 C231 F21 118.6(6) . . . . ?
C226 C227 C231 F21 -62.3(6) . . . . ?
C230 C229 C232 F22 -175.9(3) . . . . ?
C228 C229 C232 F22 3.8(4) . . . . ?
C230 C229 C232 F23 -55.1(3) . . . . ?
C228 C229 C232 F23 124.6(3) . . . . ?
C230 C229 C232 F24 63.3(3) . . . . ?
C228 C229 C232 F24 -117.0(3) . . . . ?

_refine_diff_density_max         0.583
_refine_diff_density_min         -0.680
_refine_diff_density_rms         0.061

_vrf_PLAT213_2                   
; 
PROBLEM: Fxx has ADP max/min Ratio ..... x.x prolat
RESPONSE: The anion CF3 groups contain a significant degree 
of disorder. Attempts have been made to model the disorder but
some ellipsoids are still prolate.
See _refine_special_details. 
;

_shelxl_version_number           2014-3


_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: 1,2-difluorobenzene/pentane'
_chemical_properties_physical    
'Air-sensitive, Moisture-sensitive, Oxygen-sensitive'
####################################################################### 
# 
# 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_3
_database_code_depnum_ccdc_archive 'CCDC 1445277'
_audit_update_record             
;
2016-02-18 deposited with the CCDC.
2016-02-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014
_chemical_formula_moiety         'C32 H12 B F24, C33 H70 B N P2 Rh'
_chemical_formula_sum            'C65 H82 B2 F24 N P2 Rh'
_chemical_formula_weight         1519.78

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh 0.0927 3.6045 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      orthorhombic
_space_group_IT_number           33
_space_group_name_H-M_alt        'P n a 21'
_space_group_name_Hall           'P 2c -2n'

_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+1/2'
'x+1/2, -y+1/2, z'
'-x+1/2, y+1/2, z+1/2'

_cell_length_a                   51.6071(4)
_cell_length_b                   19.7098(2)
_cell_length_c                   14.21100(10)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     14454.9(2)
_cell_formula_units_Z            8
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    65636
_cell_measurement_theta_min      3.1071
_cell_measurement_theta_max      76.2910

_exptl_crystal_description       block
_exptl_crystal_colour            purple
_exptl_crystal_density_diffrn    1.397
_exptl_crystal_F_000             6240
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_exptl_absorpt_coefficient_mu    3.219
_exptl_absorpt_correction_T_min  0.61543
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'SuperNova (Cu) X-ray Source'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Atlas'
_diffrn_detector_area_resol_mean 10.5035
_diffrn_reflns_number            166541
_diffrn_reflns_av_unetI/netI     0.0354
_diffrn_reflns_av_R_equivalents  0.0559
_diffrn_reflns_limit_h_min       -61
_diffrn_reflns_limit_h_max       64
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_theta_min         3.410
_diffrn_reflns_theta_max         76.478
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             29727
_reflns_number_gt                27935
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.920
_reflns_Friedel_fraction_max     0.996
_reflns_Friedel_fraction_full    1.000

_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 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 The structure was refined as a 2-component inversion twin with the
 Flack parameter found to be close to zero, -0.006(7).

 The H atoms of the BH2 group could not be reliably located in the
 difference map and have been placed in calculated positions.

 The iso-butyl groups of the phosphine ligand show significant 
 disorder and have been modelled over 2 sites with occupancies 
 allowed to freely refine. C-C and P-C distnaces have been fixed
 to 1.54 and 1.84 Ang respectively using the DFIX command where
 appropriate. Ellipsoids of disordered C atoms were decribed by
 SIMU and ISOR commands where appropriate. Where disorded atoms
 shared the same site they were fixed with EXYZ and EADP commands.

 Several of the CF3 groups of the [BArF4]- anions have significant 
 disorder. Groups were modelled as
 disordered over 2 or 3 sites. Disordered F atoms
 described by the SIMU and ISOR commands. In spite of
 this modelling some of the F atom ellipsoids remain prolate but
 further attempts to model were not successful. 
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0907P)²+24.5007P] 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_abs_structure_details 
;
 Refined as an inversion twin.
;
_refine_ls_abs_structure_Flack   -0.006(7)
_chemical_absolute_configuration ?
_refine_ls_number_reflns         29727
_refine_ls_number_parameters     2360
_refine_ls_number_restraints     2598
_refine_ls_R_factor_all          0.0548
_refine_ls_R_factor_gt           0.0517
_refine_ls_wR_factor_ref         0.1318
_refine_ls_wR_factor_gt          0.1291
_refine_ls_goodness_of_fit_ref   0.867
_refine_ls_restrained_S_all      0.896
_refine_ls_shift/su_max          0.003
_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
Rh1 Rh 0.57890(2) 0.74455(2) 1.00862(4) 0.02791(9) Uani 1 1 d . . . . .
B1 B 0.57833(13) 0.7702(4) 1.1559(4) 0.0345(14) Uani 1 1 d . . . . .
H1A H 0.5834 0.7242 1.1346 0.041 Uiso 1 1 calc R U . . .
H1B H 0.5709 0.7943 1.1011 0.041 Uiso 1 1 calc R U . . .
C1 C 0.60371(13) 0.8094(4) 1.1895(5) 0.0420(14) Uani 1 1 d . . . . .
C2 C 0.62469(14) 0.7764(5) 1.2333(5) 0.0530(18) Uani 1 1 d . . . . .
H2 H 0.6232 0.7298 1.2495 0.064 Uiso 1 1 calc R U . . .
C3 C 0.64763(17) 0.8111(6) 1.2533(7) 0.073(3) Uani 1 1 d . . . . .
H3 H 0.6617 0.7883 1.2827 0.088 Uiso 1 1 calc R U . . .
C4 C 0.6496(2) 0.8794(7) 1.2297(8) 0.088(3) Uani 1 1 d . . . . .
H4 H 0.6653 0.9031 1.2423 0.105 Uiso 1 1 calc R U . . .
C5 C 0.6296(2) 0.9125(6) 1.1889(8) 0.083(3) Uani 1 1 d . . . . .
H5 H 0.6312 0.9592 1.1736 0.100 Uiso 1 1 calc R U . . .
C6 C 0.60658(18) 0.8782(4) 1.1694(6) 0.0577(19) Uani 1 1 d . . . . .
H6 H 0.5926 0.9023 1.1417 0.069 Uiso 1 1 calc R U . . .
N1 N 0.55621(12) 0.7628(4) 1.2346(4) 0.0476(14) Uani 1 1 d . . . . .
C7 C 0.53369(14) 0.7240(6) 1.1981(6) 0.061(2) Uani 1 1 d . . . . .
H7A H 0.5197 0.7245 1.2448 0.091 Uiso 1 1 calc R U . . .
H7B H 0.5389 0.6770 1.1858 0.091 Uiso 1 1 calc R U . . .
H7C H 0.5276 0.7449 1.1396 0.091 Uiso 1 1 calc R U . . .
C8 C 0.5475(2) 0.8322(6) 1.2637(7) 0.077(3) Uani 1 1 d . . . . .
H8A H 0.5338 0.8282 1.3111 0.116 Uiso 1 1 calc R U . . .
H8B H 0.5408 0.8565 1.2087 0.116 Uiso 1 1 calc R U . . .
H8C H 0.5621 0.8572 1.2903 0.116 Uiso 1 1 calc R U . . .
C9 C 0.56662(18) 0.7262(6) 1.3186(6) 0.075(3) Uani 1 1 d . . . . .
H9A H 0.5725 0.6809 1.2998 0.112 Uiso 1 1 calc R U . . .
H9B H 0.5530 0.7220 1.3662 0.112 Uiso 1 1 calc R U . . .
H9C H 0.5812 0.7517 1.3449 0.112 Uiso 1 1 calc R U . . .
P1 P 0.57405(3) 0.81598(7) 0.88862(10) 0.0292(3) Uani 1 1 d . . . . .
C10 C 0.55507(15) 0.7924(3) 0.7838(5) 0.0435(15) Uani 1 1 d . . . . .
H10A H 0.5484 0.8346 0.7547 0.052 Uiso 1 1 calc R U . . .
H10B H 0.5670 0.7711 0.7378 0.052 Uiso 1 1 calc R U . . .
C11 C 0.53219(17) 0.7443(4) 0.7993(6) 0.053(2) Uani 1 1 d D . . . .
H11 H 0.5371 0.7056 0.8412 0.064 Uiso 1 1 calc R U . A 1
C12A C 0.5094(6) 0.783(2) 0.839(4) 0.071(8) Uani 0.42(6) 1 d D U P B 1
H12A H 0.5075 0.8258 0.8045 0.107 Uiso 0.42(6) 1 calc R U P B 1
H12B H 0.5124 0.7921 0.9055 0.107 Uiso 0.42(6) 1 calc R U P B 1
H12C H 0.4937 0.7557 0.8312 0.107 Uiso 0.42(6) 1 calc R U P B 1
C13A C 0.5279(9) 0.720(2) 0.697(2) 0.071(8) Uani 0.42(6) 1 d D U P B 1
H13A H 0.5230 0.7592 0.6578 0.107 Uiso 0.42(6) 1 calc R U P B 1
H13B H 0.5141 0.6863 0.6955 0.107 Uiso 0.42(6) 1 calc R U P B 1
H13C H 0.5440 0.7004 0.6727 0.107 Uiso 0.42(6) 1 calc R U P B 1
C12B C 0.5117(4) 0.7698(11) 0.873(2) 0.053(5) Uani 0.58(6) 1 d D U P B 2
H12D H 0.5051 0.8142 0.8535 0.079 Uiso 0.58(6) 1 calc R U P B 2
H12E H 0.5199 0.7737 0.9349 0.079 Uiso 0.58(6) 1 calc R U P B 2
H12F H 0.4974 0.7373 0.8764 0.079 Uiso 0.58(6) 1 calc R U P B 2
C13B C 0.5172(8) 0.7245(18) 0.7116(19) 0.078(7) Uani 0.58(6) 1 d D U P B 2
H13D H 0.5294 0.7113 0.6620 0.118 Uiso 0.58(6) 1 calc R U P B 2
H13E H 0.5068 0.7631 0.6902 0.118 Uiso 0.58(6) 1 calc R U P B 2
H13F H 0.5057 0.6862 0.7261 0.118 Uiso 0.58(6) 1 calc R U P B 2
C14 C 0.55756(11) 0.8916(3) 0.9363(4) 0.0325(11) Uani 1 1 d . . . . .
H14A H 0.5413 0.8760 0.9666 0.039 Uiso 1 1 calc R U . . .
H14B H 0.5687 0.9101 0.9869 0.039 Uiso 1 1 calc R U . . .
C15 C 0.55035(14) 0.9516(3) 0.8704(5) 0.0415(14) Uani 1 1 d . . . . .
H15 H 0.5509 0.9356 0.8037 0.050 Uiso 1 1 calc R U . . .
C16 C 0.56963(17) 1.0102(4) 0.8825(8) 0.062(2) Uani 1 1 d . . . . .
H16A H 0.5685 1.0279 0.9469 0.093 Uiso 1 1 calc R U . . .
H16B H 0.5655 1.0465 0.8378 0.093 Uiso 1 1 calc R U . . .
H16C H 0.5873 0.9938 0.8706 0.093 Uiso 1 1 calc R U . . .
C17 C 0.52330(16) 0.9766(4) 0.8925(8) 0.067(2) Uani 1 1 d . . . . .
H17A H 0.5191 1.0150 0.8516 0.100 Uiso 1 1 calc R U . . .
H17B H 0.5225 0.9910 0.9584 0.100 Uiso 1 1 calc R U . . .
H17C H 0.5108 0.9398 0.8818 0.100 Uiso 1 1 calc R U . . .
C18 C 0.60339(14) 0.8511(3) 0.8338(5) 0.0424(15) Uani 1 1 d . . . . .
H18A H 0.6118 0.8144 0.7973 0.051 Uiso 1 1 calc R U . . .
H18B H 0.5980 0.8865 0.7885 0.051 Uiso 1 1 calc R U . . .
C19 C 0.62379(13) 0.8821(4) 0.9005(6) 0.0517(18) Uani 1 1 d . . . . .
H19 H 0.6146 0.9089 0.9499 0.062 Uiso 1 1 calc R U . . .
C20 C 0.64137(19) 0.9302(5) 0.8453(10) 0.081(3) Uani 1 1 d . . . . .
H20A H 0.6309 0.9667 0.8179 0.121 Uiso 1 1 calc R U . . .
H20B H 0.6501 0.9050 0.7949 0.121 Uiso 1 1 calc R U . . .
H20C H 0.6544 0.9496 0.8877 0.121 Uiso 1 1 calc R U . . .
C21 C 0.63967(15) 0.8268(5) 0.9489(7) 0.061(2) Uani 1 1 d . . . . .
H21A H 0.6494 0.8011 0.9016 0.092 Uiso 1 1 calc R U . . .
H21B H 0.6280 0.7961 0.9829 0.092 Uiso 1 1 calc R U . . .
H21C H 0.6518 0.8477 0.9934 0.092 Uiso 1 1 calc R U . . .
P2 P 0.59450(3) 0.65495(7) 0.92938(11) 0.0307(3) Uani 1 1 d D . . . .
C22A C 0.57655(15) 0.5758(4) 0.9500(6) 0.0377(16) Uani 0.771(6) 1 d D U P C 1
H22A H 0.5872 0.5376 0.9265 0.045 Uiso 0.771(6) 1 calc R U P C 1
H22B H 0.5746 0.5697 1.0188 0.045 Uiso 0.771(6) 1 calc R U P C 1
C23A C 0.54950(15) 0.5705(4) 0.9049(6) 0.0392(17) Uani 0.771(6) 1 d D U P C 1
H23A H 0.5499 0.5955 0.8436 0.047 Uiso 0.771(6) 1 calc R U P C 1
C24A C 0.52864(18) 0.6024(5) 0.9668(7) 0.049(2) Uani 0.771(6) 1 d D U P C 1
H24A H 0.5268 0.5759 1.0248 0.073 Uiso 0.771(6) 1 calc R U P C 1
H24B H 0.5121 0.6028 0.9328 0.073 Uiso 0.771(6) 1 calc R U P C 1
H24C H 0.5336 0.6491 0.9825 0.073 Uiso 0.771(6) 1 calc R U P C 1
C25A C 0.5431(2) 0.4962(5) 0.8847(8) 0.055(2) Uani 0.771(6) 1 d D U P C 1
H25A H 0.5256 0.4929 0.8581 0.082 Uiso 0.771(6) 1 calc R U P C 1
H25B H 0.5439 0.4701 0.9434 0.082 Uiso 0.771(6) 1 calc R U P C 1
H25C H 0.5557 0.4778 0.8398 0.082 Uiso 0.771(6) 1 calc R U P C 1
C22B C 0.5690(5) 0.5934(13) 0.903(2) 0.039(4) Uani 0.229(6) 1 d D U P C 2
H22C H 0.5633 0.6015 0.8379 0.046 Uiso 0.229(6) 1 calc R U P C 2
H22D H 0.5771 0.5478 0.9049 0.046 Uiso 0.229(6) 1 calc R U P C 2
C23B C 0.5446(5) 0.5901(15) 0.9643(19) 0.044(4) Uani 0.229(6) 1 d D U P C 2
H23B H 0.5380 0.6375 0.9726 0.053 Uiso 0.229(6) 1 calc R U P C 2
C24B C 0.5502(7) 0.5608(16) 1.063(2) 0.051(6) Uani 0.229(6) 1 d D U P C 2
H24D H 0.5544 0.5125 1.0579 0.076 Uiso 0.229(6) 1 calc R U P C 2
H24E H 0.5348 0.5663 1.1032 0.076 Uiso 0.229(6) 1 calc R U P C 2
H24F H 0.5648 0.5850 1.0915 0.076 Uiso 0.229(6) 1 calc R U P C 2
C25B C 0.5240(7) 0.5505(19) 0.910(3) 0.063(6) Uani 0.229(6) 1 d D U P C 2
H25D H 0.5276 0.5018 0.9157 0.094 Uiso 0.229(6) 1 calc R U P C 2
H25E H 0.5244 0.5638 0.8440 0.094 Uiso 0.229(6) 1 calc R U P C 2
H25F H 0.5069 0.5603 0.9368 0.094 Uiso 0.229(6) 1 calc R U P C 2
C26A C 0.62759(17) 0.6345(5) 0.9638(7) 0.049(2) Uani 0.771(6) 1 d D U P C 1
H26A H 0.6307 0.5865 0.9468 0.059 Uiso 0.771(6) 1 calc R U P C 1
H26B H 0.6393 0.6623 0.9244 0.059 Uiso 0.771(6) 1 calc R U P C 1
C27A C 0.63598(16) 0.6437(4) 1.0662(6) 0.0561(17) Uani 0.771(6) 1 d D U P C 1
H27A H 0.6300 0.6898 1.0862 0.067 Uiso 0.771(6) 1 calc R U P C 1
C28A C 0.6225(3) 0.5919(6) 1.1314(9) 0.073(3) Uani 0.771(6) 1 d D U P C 1
H28A H 0.6301 0.5948 1.1946 0.109 Uiso 0.771(6) 1 calc R U P C 1
H28B H 0.6251 0.5460 1.1064 0.109 Uiso 0.771(6) 1 calc R U P C 1
H28C H 0.6040 0.6019 1.1346 0.109 Uiso 0.771(6) 1 calc R U P C 1
C29A C 0.6647(2) 0.6427(9) 1.0760(13) 0.087(4) Uani 0.771(6) 1 d D U P C 1
H29A H 0.6722 0.6809 1.0411 0.130 Uiso 0.771(6) 1 calc R U P C 1
H29B H 0.6715 0.6000 1.0506 0.130 Uiso 0.771(6) 1 calc R U P C 1
H29C H 0.6694 0.6464 1.1426 0.130 Uiso 0.771(6) 1 calc R U P C 1
C26B C 0.6154(5) 0.6072(12) 1.013(2) 0.047(4) Uani 0.229(6) 1 d D U P C 2
H26C H 0.6038 0.5854 1.0598 0.056 Uiso 0.229(6) 1 calc R U P C 2
H26D H 0.6239 0.5703 0.9773 0.056 Uiso 0.229(6) 1 calc R U P C 2
C27B C 0.63598(16) 0.6437(4) 1.0662(6) 0.0561(17) Uani 0.229(6) 1 d D U P C 2
H27B H 0.6294 0.6900 1.0824 0.067 Uiso 0.229(6) 1 calc R U P C 2
C28B C 0.6466(7) 0.611(2) 1.157(2) 0.062(6) Uani 0.229(6) 1 d D U P C 2
H28D H 0.6522 0.5641 1.1433 0.094 Uiso 0.229(6) 1 calc R U P C 2
H28E H 0.6329 0.6095 1.2050 0.094 Uiso 0.229(6) 1 calc R U P C 2
H28F H 0.6613 0.6369 1.1805 0.094 Uiso 0.229(6) 1 calc R U P C 2
C29B C 0.6619(5) 0.6521(18) 1.008(3) 0.056(5) Uani 0.229(6) 1 d D U P C 2
H29D H 0.6578 0.6706 0.9454 0.084 Uiso 0.229(6) 1 calc R U P C 2
H29E H 0.6702 0.6078 1.0005 0.084 Uiso 0.229(6) 1 calc R U P C 2
H29F H 0.6736 0.6831 1.0408 0.084 Uiso 0.229(6) 1 calc R U P C 2
C30A C 0.59793(19) 0.6533(4) 0.7986(6) 0.0404(17) Uani 0.771(6) 1 d D U P C 1
H30A H 0.5806 0.6608 0.7707 0.049 Uiso 0.771(6) 1 calc R U P C 1
H30B H 0.6090 0.6920 0.7798 0.049 Uiso 0.771(6) 1 calc R U P C 1
C31A C 0.6095(2) 0.5881(5) 0.7553(7) 0.050(2) Uani 0.771(6) 1 d D U P C 1
H31A H 0.6104 0.5526 0.8055 0.060 Uiso 0.771(6) 1 calc R U P C 1
C32A C 0.5911(3) 0.5624(6) 0.6768(8) 0.066(3) Uani 0.771(6) 1 d D U P C 1
H32A H 0.5978 0.5197 0.6511 0.098 Uiso 0.771(6) 1 calc R U P C 1
H32B H 0.5902 0.5964 0.6265 0.098 Uiso 0.771(6) 1 calc R U P C 1
H32C H 0.5738 0.5549 0.7030 0.098 Uiso 0.771(6) 1 calc R U P C 1
C33A C 0.6364(2) 0.5982(7) 0.7147(8) 0.065(3) Uani 0.771(6) 1 d D U P C 1
H33A H 0.6483 0.6125 0.7648 0.097 Uiso 0.771(6) 1 calc R U P C 1
H33B H 0.6359 0.6331 0.6657 0.097 Uiso 0.771(6) 1 calc R U P C 1
H33C H 0.6426 0.5554 0.6874 0.097 Uiso 0.771(6) 1 calc R U P C 1
C30B C 0.6135(7) 0.6680(14) 0.8255(19) 0.045(4) Uani 0.229(6) 1 d D U P C 2
H30C H 0.6021 0.6872 0.7762 0.054 Uiso 0.229(6) 1 calc R U P C 2
H30D H 0.6269 0.7025 0.8398 0.054 Uiso 0.229(6) 1 calc R U P C 2
C31B C 0.6271(6) 0.6048(14) 0.785(2) 0.051(4) Uani 0.229(6) 1 d D U P C 2
H31B H 0.6324 0.5727 0.8357 0.061 Uiso 0.229(6) 1 calc R U P C 2
C32B C 0.6084(8) 0.570(2) 0.714(3) 0.066(7) Uani 0.229(6) 1 d D U P C 2
H32D H 0.6170 0.5312 0.6857 0.098 Uiso 0.229(6) 1 calc R U P C 2
H32E H 0.6036 0.6029 0.6653 0.098 Uiso 0.229(6) 1 calc R U P C 2
H32F H 0.5929 0.5553 0.7478 0.098 Uiso 0.229(6) 1 calc R U P C 2
C33B C 0.6510(8) 0.634(2) 0.734(3) 0.070(8) Uani 0.229(6) 1 d D U P C 2
H33D H 0.6454 0.6638 0.6826 0.105 Uiso 0.229(6) 1 calc R U P C 2
H33E H 0.6616 0.5973 0.7091 0.105 Uiso 0.229(6) 1 calc R U P C 2
H33F H 0.6613 0.6608 0.7792 0.105 Uiso 0.229(6) 1 calc R U P C 2
Rh2 Rh 0.66262(2) 0.17919(2) 0.50142(3) 0.02768(9) Uani 1 1 d . . . . .
B2 B 0.62962(12) 0.2408(3) 0.5426(5) 0.0346(14) Uani 1 1 d . . . . .
H2A H 0.6454 0.2555 0.5085 0.042 Uiso 1 1 calc R U . . .
H2B H 0.6324 0.1934 0.5633 0.042 Uiso 1 1 calc R U . . .
C51 C 0.60566(12) 0.2427(3) 0.4717(5) 0.0428(14) Uani 1 1 d . . . . .
C52 C 0.58466(13) 0.1983(4) 0.4780(6) 0.0513(17) Uani 1 1 d . . . . .
H52 H 0.5839 0.1668 0.5286 0.062 Uiso 1 1 calc R U . . .
C53 C 0.56465(15) 0.1989(6) 0.4116(7) 0.070(3) Uani 1 1 d . . . . .
H53 H 0.5507 0.1678 0.4166 0.084 Uiso 1 1 calc R U . . .
C54 C 0.56544(19) 0.2455(7) 0.3382(8) 0.087(4) Uani 1 1 d . . . . .
H54 H 0.5520 0.2463 0.2927 0.105 Uiso 1 1 calc R U . . .
C55 C 0.5855(2) 0.2900(8) 0.3316(9) 0.092(4) Uani 1 1 d . . . . .
H55 H 0.5859 0.3223 0.2821 0.111 Uiso 1 1 calc R U . . .
C56 C 0.60540(16) 0.2881(5) 0.3969(7) 0.066(2) Uani 1 1 d . . . . .
H56 H 0.6194 0.3191 0.3903 0.079 Uiso 1 1 calc R U . . .
N2 N 0.62603(10) 0.2881(3) 0.6346(4) 0.0386(11) Uani 1 1 d . . . . .
C57 C 0.64949(12) 0.2854(4) 0.6954(6) 0.0470(16) Uani 1 1 d . . . . .
H57A H 0.6468 0.3137 0.7513 0.071 Uiso 1 1 calc R U . . .
H57B H 0.6645 0.3024 0.6602 0.071 Uiso 1 1 calc R U . . .
H57C H 0.6527 0.2385 0.7148 0.071 Uiso 1 1 calc R U . . .
C58 C 0.60352(12) 0.2630(4) 0.6908(5) 0.0467(16) Uani 1 1 d . . . . .
H58A H 0.5878 0.2653 0.6525 0.070 Uiso 1 1 calc R U . . .
H58B H 0.6014 0.2913 0.7470 0.070 Uiso 1 1 calc R U . . .
H58C H 0.6066 0.2159 0.7098 0.070 Uiso 1 1 calc R U . . .
C59 C 0.62134(17) 0.3601(4) 0.6073(7) 0.0573(19) Uani 1 1 d . . . . .
H59A H 0.6359 0.3765 0.5694 0.086 Uiso 1 1 calc R U . . .
H59B H 0.6197 0.3880 0.6641 0.086 Uiso 1 1 calc R U . . .
H59C H 0.6053 0.3631 0.5704 0.086 Uiso 1 1 calc R U . . .
P3 P 0.67458(3) 0.07249(7) 0.53233(10) 0.0299(3) Uani 1 1 d . . . . .
C60 C 0.68824(13) 0.0167(3) 0.4402(4) 0.0382(13) Uani 1 1 d . . . . .
H60A H 0.6737 0.0031 0.3987 0.046 Uiso 1 1 calc R U . . .
H60B H 0.7001 0.0447 0.4018 0.046 Uiso 1 1 calc R U . . .
C61 C 0.70299(14) -0.0486(3) 0.4668(5) 0.0448(15) Uani 1 1 d . . . . .
H61 H 0.7119 -0.0414 0.5285 0.054 Uiso 1 1 calc R U . . .
C62 C 0.7232(2) -0.0630(5) 0.3917(10) 0.088(3) Uani 1 1 d . . . . .
H62A H 0.7148 -0.0651 0.3300 0.132 Uiso 1 1 calc R U . . .
H62B H 0.7317 -0.1064 0.4051 0.132 Uiso 1 1 calc R U . . .
H62C H 0.7362 -0.0267 0.3916 0.132 Uiso 1 1 calc R U . . .
C63 C 0.6854(2) -0.1094(4) 0.4745(9) 0.081(3) Uani 1 1 d . . . . .
H63A H 0.6958 -0.1499 0.4873 0.121 Uiso 1 1 calc R U . . .
H63B H 0.6760 -0.1154 0.4152 0.121 Uiso 1 1 calc R U . . .
H63C H 0.6731 -0.1024 0.5258 0.121 Uiso 1 1 calc R U . . .
C64 C 0.69880(11) 0.0657(3) 0.6271(4) 0.0376(13) Uani 1 1 d . . . . .
H64A H 0.6995 0.0179 0.6481 0.045 Uiso 1 1 calc R U . . .
H64B H 0.7160 0.0772 0.6007 0.045 Uiso 1 1 calc R U . . .
C65 C 0.69406(12) 0.1107(4) 0.7136(5) 0.0478(16) Uani 1 1 d . . . . .
H65 H 0.6749 0.1154 0.7224 0.057 Uiso 1 1 calc R U . . .
C66 C 0.70541(15) 0.1813(4) 0.7002(7) 0.061(2) Uani 1 1 d . . . . .
H66A H 0.6980 0.2020 0.6435 0.091 Uiso 1 1 calc R U . . .
H66B H 0.7243 0.1780 0.6935 0.091 Uiso 1 1 calc R U . . .
H66C H 0.7012 0.2094 0.7550 0.091 Uiso 1 1 calc R U . . .
C67 C 0.70522(17) 0.0770(6) 0.8016(6) 0.073(3) Uani 1 1 d . . . . .
H67A H 0.7034 0.1078 0.8553 0.110 Uiso 1 1 calc R U . . .
H67B H 0.7236 0.0668 0.7914 0.110 Uiso 1 1 calc R U . . .
H67C H 0.6958 0.0348 0.8144 0.110 Uiso 1 1 calc R U . . .
C68A C 0.64756(12) 0.0261(4) 0.5856(6) 0.0479(16) Uani 0.34(4) 1 d D . P D 1
H68A H 0.6525 -0.0224 0.5869 0.058 Uiso 0.34(4) 1 calc R U P D 1
H68B H 0.6463 0.0411 0.6519 0.058 Uiso 0.34(4) 1 calc R U P D 1
C69A C 0.6201(5) 0.030(4) 0.544(3) 0.068(5) Uani 0.34(4) 1 d D U P D 1
H69A H 0.6193 0.0761 0.5143 0.081 Uiso 0.34(4) 1 calc R U P D 1
C70A C 0.5979(7) 0.030(3) 0.614(3) 0.081(7) Uani 0.34(4) 1 d D U P D 1
H70A H 0.5992 -0.0099 0.6545 0.122 Uiso 0.34(4) 1 calc R U P D 1
H70B H 0.5813 0.0285 0.5796 0.122 Uiso 0.34(4) 1 calc R U P D 1
H70C H 0.5986 0.0712 0.6520 0.122 Uiso 0.34(4) 1 calc R U P D 1
C71A C 0.6182(9) -0.019(2) 0.460(4) 0.075(7) Uani 0.34(4) 1 d D U P D 1
H71A H 0.6040 -0.0043 0.4185 0.112 Uiso 0.34(4) 1 calc R U P D 1
H71B H 0.6147 -0.0647 0.4830 0.112 Uiso 0.34(4) 1 calc R U P D 1
H71C H 0.6345 -0.0184 0.4249 0.112 Uiso 0.34(4) 1 calc R U P D 1
C68B C 0.64756(12) 0.0261(4) 0.5856(6) 0.0479(16) Uani 0.66(4) 1 d D . P D 2
H68C H 0.6524 -0.0225 0.5890 0.058 Uiso 0.66(4) 1 calc R U P D 2
H68D H 0.6454 0.0425 0.6510 0.058 Uiso 0.66(4) 1 calc R U P D 2
C69B C 0.6207(3) 0.0312(17) 0.5350(15) 0.065(3) Uani 0.66(4) 1 d D U P D 2
H69B H 0.6159 0.0804 0.5318 0.078 Uiso 0.66(4) 1 calc R U P D 2
C70B C 0.6010(3) -0.0040(14) 0.5996(17) 0.087(5) Uani 0.66(4) 1 d D U P D 2
H70D H 0.6023 0.0148 0.6632 0.130 Uiso 0.66(4) 1 calc R U P D 2
H70E H 0.6046 -0.0528 0.6015 0.130 Uiso 0.66(4) 1 calc R U P D 2
H70F H 0.5834 0.0034 0.5753 0.130 Uiso 0.66(4) 1 calc R U P D 2
C71B C 0.6201(5) 0.0034(15) 0.4351(18) 0.089(6) Uani 0.66(4) 1 d D U P D 2
H71D H 0.6273 -0.0426 0.4345 0.133 Uiso 0.66(4) 1 calc R U P D 2
H71E H 0.6305 0.0327 0.3939 0.133 Uiso 0.66(4) 1 calc R U P D 2
H71F H 0.6022 0.0023 0.4124 0.133 Uiso 0.66(4) 1 calc R U P D 2
P4 P 0.69208(3) 0.19568(7) 0.38905(10) 0.0282(3) Uani 1 1 d . . . . .
C72 C 0.72609(11) 0.1720(3) 0.4138(4) 0.0344(12) Uani 1 1 d . . . . .
H72A H 0.7318 0.1992 0.4687 0.041 Uiso 1 1 calc R U . . .
H72B H 0.7260 0.1239 0.4342 0.041 Uiso 1 1 calc R U . . .
C73 C 0.74721(12) 0.1790(3) 0.3379(4) 0.0376(13) Uani 1 1 d . . . . .
H73 H 0.7451 0.2241 0.3067 0.045 Uiso 1 1 calc R U . . .
C74 C 0.74594(17) 0.1246(5) 0.2628(7) 0.069(3) Uani 1 1 d . . . . .
H74A H 0.7463 0.0797 0.2925 0.104 Uiso 1 1 calc R U . . .
H74B H 0.7608 0.1292 0.2204 0.104 Uiso 1 1 calc R U . . .
H74C H 0.7298 0.1296 0.2268 0.104 Uiso 1 1 calc R U . . .
C75 C 0.77365(13) 0.1776(5) 0.3852(6) 0.0550(19) Uani 1 1 d . . . . .
H75A H 0.7872 0.1804 0.3371 0.082 Uiso 1 1 calc R U . . .
H75B H 0.7756 0.1352 0.4206 0.082 Uiso 1 1 calc R U . . .
H75C H 0.7752 0.2162 0.4282 0.082 Uiso 1 1 calc R U . . .
C76A C 0.69447(13) 0.2858(3) 0.3560(4) 0.0380(13) Uani 0.547(15) 1 d D . P E 1
H76A H 0.7087 0.2900 0.3096 0.046 Uiso 0.547(15) 1 calc R U P E 1
H76B H 0.6782 0.2981 0.3231 0.046 Uiso 0.547(15) 1 calc R U P E 1
C77A C 0.6991(3) 0.3381(6) 0.4317(10) 0.038(3) Uani 0.547(15) 1 d D . P E 1
H77A H 0.6956 0.3169 0.4944 0.046 Uiso 0.547(15) 1 calc R U P E 1
C78A C 0.7281(3) 0.3576(8) 0.4259(13) 0.062(4) Uani 0.547(15) 1 d D . P E 1
H78A H 0.7317 0.3789 0.3649 0.092 Uiso 0.547(15) 1 calc R U P E 1
H78B H 0.7388 0.3167 0.4327 0.092 Uiso 0.547(15) 1 calc R U P E 1
H78C H 0.7323 0.3896 0.4765 0.092 Uiso 0.547(15) 1 calc R U P E 1
C79A C 0.6827(3) 0.4009(7) 0.4225(13) 0.064(4) Uani 0.547(15) 1 d D . P E 1
H79A H 0.6643 0.3883 0.4240 0.095 Uiso 0.547(15) 1 calc R U P E 1
H79B H 0.6866 0.4235 0.3627 0.095 Uiso 0.547(15) 1 calc R U P E 1
H79C H 0.6865 0.4318 0.4748 0.095 Uiso 0.547(15) 1 calc R U P E 1
C76B C 0.69447(13) 0.2858(3) 0.3560(4) 0.0380(13) Uani 0.453(15) 1 d D . P E 2
H76C H 0.7012 0.2887 0.2909 0.046 Uiso 0.453(15) 1 calc R U P E 2
H76D H 0.6768 0.3056 0.3561 0.046 Uiso 0.453(15) 1 calc R U P E 2
C77B C 0.7124(4) 0.3302(7) 0.4220(10) 0.042(4) Uani 0.453(15) 1 d D . P E 2
H77B H 0.7300 0.3093 0.4204 0.051 Uiso 0.453(15) 1 calc R U P E 2
C78B C 0.7047(4) 0.3350(8) 0.5225(10) 0.051(4) Uani 0.453(15) 1 d D . P E 2
H78D H 0.6874 0.3549 0.5271 0.076 Uiso 0.453(15) 1 calc R U P E 2
H78E H 0.7171 0.3636 0.5562 0.076 Uiso 0.453(15) 1 calc R U P E 2
H78F H 0.7046 0.2895 0.5504 0.076 Uiso 0.453(15) 1 calc R U P E 2
C79B C 0.7148(4) 0.4017(7) 0.3786(14) 0.058(5) Uani 0.453(15) 1 d D . P E 2
H79D H 0.7261 0.4297 0.4182 0.088 Uiso 0.453(15) 1 calc R U P E 2
H79E H 0.6976 0.4227 0.3748 0.088 Uiso 0.453(15) 1 calc R U P E 2
H79F H 0.7223 0.3982 0.3154 0.088 Uiso 0.453(15) 1 calc R U P E 2
C80 C 0.68265(13) 0.1571(3) 0.2765(4) 0.0374(12) Uani 1 1 d . . . . .
H80A H 0.6927 0.1789 0.2255 0.045 Uiso 1 1 calc R U . F 1
H80B H 0.6875 0.1085 0.2777 0.045 Uiso 1 1 calc R U . F 1
C81A C 0.65381(17) 0.1627(6) 0.2524(6) 0.072(3) Uani 0.706(16) 1 d D . P G 1
H81A H 0.6439 0.1616 0.3128 0.086 Uiso 0.706(16) 1 calc R U P G 1
C82A C 0.6471(3) 0.0953(9) 0.1955(14) 0.098(5) Uani 0.706(16) 1 d D U P G 1
H82A H 0.6558 0.0965 0.1342 0.148 Uiso 0.706(16) 1 calc R U P G 1
H82B H 0.6283 0.0924 0.1862 0.148 Uiso 0.706(16) 1 calc R U P G 1
H82C H 0.6531 0.0557 0.2311 0.148 Uiso 0.706(16) 1 calc R U P G 1
C83A C 0.6455(3) 0.2217(9) 0.2003(16) 0.099(6) Uani 0.706(16) 1 d D U P G 1
H83A H 0.6553 0.2249 0.1416 0.149 Uiso 0.706(16) 1 calc R U P G 1
H83B H 0.6484 0.2626 0.2381 0.149 Uiso 0.706(16) 1 calc R U P G 1
H83C H 0.6270 0.2177 0.1859 0.149 Uiso 0.706(16) 1 calc R U P G 1
C81B C 0.65381(17) 0.1627(6) 0.2524(6) 0.072(3) Uani 0.294(16) 1 d D . P G 2
H81B H 0.6493 0.2083 0.2788 0.086 Uiso 0.294(16) 1 calc R U P G 2
C82B C 0.6348(6) 0.1191(17) 0.298(2) 0.069(8) Uani 0.294(16) 1 d D U P G 2
H82D H 0.6312 0.0798 0.2577 0.104 Uiso 0.294(16) 1 calc R U P G 2
H82E H 0.6187 0.1446 0.3081 0.104 Uiso 0.294(16) 1 calc R U P G 2
H82F H 0.6415 0.1036 0.3586 0.104 Uiso 0.294(16) 1 calc R U P G 2
C83B C 0.6514(9) 0.175(3) 0.146(2) 0.103(9) Uani 0.294(16) 1 d D U P G 2
H83D H 0.6330 0.1755 0.1281 0.155 Uiso 0.294(16) 1 calc R U P G 2
H83E H 0.6603 0.1388 0.1116 0.155 Uiso 0.294(16) 1 calc R U P G 2
H83F H 0.6592 0.2188 0.1298 0.155 Uiso 0.294(16) 1 calc R U P G 2
B200 B 0.70656(11) 0.6457(3) 0.4729(4) 0.0265(11) Uani 1 1 d . . . . .
C201 C 0.67462(10) 0.6475(3) 0.4722(4) 0.0297(11) Uani 1 1 d . . . . .
C202 C 0.66075(11) 0.5901(3) 0.4432(4) 0.0332(12) Uani 1 1 d . . . . .
H202 H 0.6700 0.5500 0.4276 0.040 Uiso 1 1 calc R U . . .
C203 C 0.63389(11) 0.5896(3) 0.4365(4) 0.0385(13) Uani 1 1 d D . . . .
C204 C 0.61935(11) 0.6459(4) 0.4630(5) 0.0416(14) Uani 1 1 d . . . . .
H204 H 0.6010 0.6448 0.4619 0.050 Uiso 1 1 calc R U . . .
C205 C 0.63248(10) 0.7033(3) 0.4909(4) 0.0370(13) Uani 1 1 d D . . . .
C206 C 0.65951(10) 0.7048(3) 0.4934(5) 0.0331(11) Uani 1 1 d . . . . .
H206 H 0.6680 0.7459 0.5100 0.040 Uiso 1 1 calc R U . . .
C207 C 0.62005(11) 0.5262(4) 0.4064(5) 0.0524(17) Uani 1 1 d D . . . .
F1 F 0.63278(12) 0.4935(4) 0.3396(6) 0.073(2) Uani 0.847(14) 1 d D U P H 1
F2 F 0.59689(12) 0.5401(4) 0.3700(7) 0.087(3) Uani 0.847(14) 1 d D U P H 1
F3 F 0.6163(2) 0.4840(3) 0.4757(5) 0.090(3) Uani 0.847(14) 1 d D U P H 1
F101 F 0.6024(6) 0.5073(14) 0.4696(19) 0.087(9) Uani 0.153(14) 1 d D U P H 2
F102 F 0.6356(4) 0.4732(7) 0.398(3) 0.074(8) Uani 0.153(14) 1 d D U P H 2
F103 F 0.6077(7) 0.5319(12) 0.3263(17) 0.087(9) Uani 0.153(14) 1 d D U P H 2
C208 C 0.61760(10) 0.7644(3) 0.5239(4) 0.0461(16) Uani 1 1 d D . . . .
F4 F 0.59235(15) 0.7534(9) 0.5230(19) 0.077(5) Uani 0.44(4) 1 d D U P I 1
F5 F 0.6215(5) 0.8179(6) 0.4715(15) 0.080(6) Uani 0.44(4) 1 d D U P I 1
F6 F 0.6234(4) 0.7813(11) 0.6104(10) 0.078(5) Uani 0.44(4) 1 d D U P I 1
F104 F 0.6300(3) 0.7996(9) 0.5882(14) 0.086(5) Uani 0.56(4) 1 d D U P I 2
F105 F 0.5952(3) 0.7485(6) 0.5619(19) 0.092(5) Uani 0.56(4) 1 d D U P I 2
F106 F 0.6124(4) 0.8071(6) 0.4555(8) 0.072(4) Uani 0.56(4) 1 d D U P I 2
C209 C 0.71761(10) 0.5785(3) 0.5285(4) 0.0268(10) Uani 1 1 d . . . . .
C210 C 0.70376(10) 0.5435(3) 0.5971(4) 0.0290(10) Uani 1 1 d . . . . .
H210 H 0.6861 0.5551 0.6071 0.035 Uiso 1 1 calc R U . . .
C211 C 0.71466(11) 0.4923(3) 0.6517(4) 0.0337(12) Uani 1 1 d D . . . .
C212 C 0.74046(12) 0.4742(3) 0.6406(4) 0.0339(12) Uani 1 1 d . . . . .
H212 H 0.7481 0.4397 0.6782 0.041 Uiso 1 1 calc R U . . .
C213 C 0.75477(11) 0.5084(3) 0.5726(4) 0.0315(11) Uani 1 1 d D . . . .
C214 C 0.74376(10) 0.5589(3) 0.5184(4) 0.0304(11) Uani 1 1 d . . . . .
H214 H 0.7542 0.5811 0.4727 0.037 Uiso 1 1 calc R U . . .
C215 C 0.69870(12) 0.4587(3) 0.7255(5) 0.0515(17) Uani 1 1 d D . . . .
F7 F 0.6756(2) 0.4386(11) 0.6935(8) 0.058(3) Uani 0.62(5) 1 d D U P J 1
F8 F 0.7099(3) 0.4067(10) 0.7665(16) 0.089(5) Uani 0.62(5) 1 d D U P J 1
F9 F 0.6928(4) 0.5026(7) 0.7960(10) 0.073(4) Uani 0.62(5) 1 d D U P J 1
F107 F 0.7013(7) 0.4854(17) 0.8101(8) 0.092(7) Uani 0.38(5) 1 d D U P J 2
F108 F 0.67354(17) 0.4578(15) 0.7052(17) 0.054(5) Uani 0.38(5) 1 d D U P J 2
F109 F 0.7052(5) 0.3926(8) 0.735(2) 0.075(6) Uani 0.38(5) 1 d D U P J 2
C216 C 0.78289(13) 0.4908(3) 0.5604(4) 0.0476(16) Uani 1 1 d D . . . .
F10 F 0.79732(18) 0.5467(5) 0.5481(15) 0.061(4) Uani 0.56(4) 1 d D U P K 1
F11 F 0.7929(2) 0.4568(11) 0.6303(12) 0.081(5) Uani 0.56(4) 1 d D U P K 1
F12 F 0.7865(2) 0.4547(11) 0.4815(12) 0.084(5) Uani 0.56(4) 1 d D U P K 1
F110 F 0.7861(3) 0.4311(9) 0.520(2) 0.089(6) Uani 0.44(4) 1 d D U P K 2
F111 F 0.7964(2) 0.5363(10) 0.5150(18) 0.066(5) Uani 0.44(4) 1 d D U P K 2
F112 F 0.7943(2) 0.4843(14) 0.6459(8) 0.067(5) Uani 0.44(4) 1 d D U P K 2
C217 C 0.71443(9) 0.6455(3) 0.3611(4) 0.0258(10) Uani 1 1 d . . . . .
C218 C 0.71735(10) 0.5863(3) 0.3082(4) 0.0302(11) Uani 1 1 d . . . . .
H218 H 0.7165 0.5437 0.3394 0.036 Uiso 1 1 calc R U . . .
C219 C 0.72151(11) 0.5875(3) 0.2119(4) 0.0333(12) Uani 1 1 d . . . . .
C220 C 0.72341(11) 0.6481(3) 0.1634(4) 0.0347(12) Uani 1 1 d . . . . .
H220 H 0.7266 0.6488 0.0975 0.042 Uiso 1 1 calc R U . . .
C221 C 0.72054(10) 0.7082(3) 0.2140(4) 0.0304(11) Uani 1 1 d D . . . .
C222 C 0.71588(10) 0.7064(3) 0.3105(4) 0.0280(10) Uani 1 1 d . . . . .
H222 H 0.7136 0.7480 0.3432 0.034 Uiso 1 1 calc R U . . .
C223 C 0.72350(14) 0.5220(4) 0.1585(5) 0.0460(15) Uani 1 1 d . . . . .
F13 F 0.70203(11) 0.4863(3) 0.1632(5) 0.0840(19) Uani 1 1 d . . . . .
F14 F 0.74231(10) 0.4825(2) 0.1922(4) 0.0707(14) Uani 1 1 d . . . . .
F15 F 0.72951(16) 0.5301(3) 0.0688(4) 0.090(2) Uani 1 1 d . . . . .
C224 C 0.72265(11) 0.7741(3) 0.1641(4) 0.0458(15) Uani 1 1 d D . . . .
F16 F 0.7418(2) 0.7753(6) 0.1006(8) 0.038(3) Uani 0.334 1 d D U P L 1
F17 F 0.7010(2) 0.7871(7) 0.1120(10) 0.049(4) Uani 0.334 1 d D U P L 1
F18 F 0.7255(4) 0.8277(5) 0.2185(9) 0.054(5) Uani 0.334 1 d D U P L 1
F116 F 0.7021(3) 0.8126(7) 0.1698(15) 0.079(4) Uani 0.333 1 d D U P L 2
F117 F 0.7420(3) 0.8123(6) 0.2066(11) 0.070(4) Uani 0.333 1 d D U P L 2
F118 F 0.7304(4) 0.7699(7) 0.0762(7) 0.070(4) Uani 0.333 1 d D U P L 2
F216 F 0.7069(3) 0.7765(7) 0.0871(9) 0.058(5) Uani 0.333 1 d D U P L 3
F217 F 0.7151(3) 0.8274(4) 0.2150(9) 0.046(4) Uani 0.333 1 d D U P L 3
F218 F 0.7461(2) 0.7877(7) 0.1314(13) 0.065(5) Uani 0.333 1 d D U P L 3
C225 C 0.72003(10) 0.7091(3) 0.5291(4) 0.0267(10) Uani 1 1 d . . . . .
C226 C 0.70935(11) 0.7390(3) 0.6092(4) 0.0320(11) Uani 1 1 d . . . . .
H226 H 0.6933 0.7225 0.6322 0.038 Uiso 1 1 calc R U . . .
C227 C 0.72144(12) 0.7922(3) 0.6569(4) 0.0359(12) Uani 1 1 d . . . . .
C228 C 0.74565(13) 0.8151(3) 0.6287(5) 0.0393(13) Uani 1 1 d . . . . .
H228 H 0.7540 0.8511 0.6611 0.047 Uiso 1 1 calc R U . . .
C229 C 0.75723(11) 0.7844(3) 0.5525(4) 0.0346(12) Uani 1 1 d D . . . .
C230 C 0.74460(9) 0.7332(2) 0.5026(5) 0.0296(9) Uani 1 1 d . . . . .
H230 H 0.7529 0.7141 0.4491 0.036 Uiso 1 1 calc R U . . .
C231 C 0.70805(17) 0.8282(4) 0.7357(6) 0.0511(17) Uani 1 1 d . . . . .
F19 F 0.68796(12) 0.7945(3) 0.7699(4) 0.0778(17) Uani 1 1 d . . . . .
F20 F 0.72309(14) 0.8408(4) 0.8088(4) 0.093(2) Uani 1 1 d . . . . .
F21 F 0.69887(15) 0.8886(3) 0.7085(5) 0.097(2) Uani 1 1 d . . . . .
C232 C 0.78365(12) 0.8066(3) 0.5228(4) 0.0499(18) Uani 1 1 d D . . . .
F22 F 0.7973(2) 0.8322(9) 0.5960(9) 0.053(4) Uani 0.334 1 d D U P M 1
F23 F 0.7833(3) 0.8548(10) 0.4577(13) 0.074(5) Uani 0.334 1 d D U P M 1
F24 F 0.7981(2) 0.7557(7) 0.4901(15) 0.061(4) Uani 0.334 1 d D U P M 1
F122 F 0.7928(3) 0.7769(9) 0.4468(11) 0.061(4) Uani 0.333 1 d D U P M 2
F123 F 0.8012(2) 0.7995(12) 0.5913(10) 0.069(5) Uani 0.333 1 d D U P M 2
F124 F 0.7839(2) 0.8745(5) 0.5034(15) 0.059(3) Uani 0.333 1 d D U P M 2
F222 F 0.8015(2) 0.7589(8) 0.5438(17) 0.074(4) Uani 0.333 1 d D U P M 3
F223 F 0.7915(3) 0.8642(8) 0.5586(16) 0.083(5) Uani 0.333 1 d D U P M 3
F224 F 0.7852(3) 0.8126(12) 0.4282(7) 0.065(4) Uani 0.333 1 d D U P M 3
B300 B 0.45601(11) 0.7452(3) 0.4547(4) 0.0242(11) Uani 1 1 d . . . . .
C301 C 0.46717(9) 0.8106(2) 0.5122(4) 0.0262(9) Uani 1 1 d . . . . .
C302 C 0.49314(9) 0.8303(2) 0.4989(5) 0.0301(10) Uani 1 1 d . . . . .
H302 H 0.5033 0.8072 0.4532 0.036 Uiso 1 1 calc R U . . .
C303 C 0.50443(11) 0.8823(3) 0.5506(4) 0.0323(11) Uani 1 1 d . . . . .
C304 C 0.49042(12) 0.9181(3) 0.6168(5) 0.0373(12) Uani 1 1 d . . . . .
H304 H 0.4981 0.9540 0.6514 0.045 Uiso 1 1 calc R U . . .
C305 C 0.46479(11) 0.9000(3) 0.6313(4) 0.0353(12) Uani 1 1 d D . . . .
C306 C 0.45356(11) 0.8469(3) 0.5802(4) 0.0308(11) Uani 1 1 d . . . . .
H306 H 0.4360 0.8353 0.5923 0.037 Uiso 1 1 calc R U . . .
C307 C 0.53215(12) 0.9017(4) 0.5325(5) 0.0423(14) Uani 1 1 d . . . . .
F51 F 0.54697(8) 0.8481(3) 0.5120(6) 0.0850(18) Uani 1 1 d . . . . .
F52 F 0.53488(10) 0.9431(4) 0.4620(5) 0.100(2) Uani 1 1 d . . . . .
F53 F 0.54336(9) 0.9293(3) 0.6080(4) 0.0764(16) Uani 1 1 d . . . . .
C308 C 0.44931(12) 0.9407(3) 0.7000(5) 0.0520(17) Uani 1 1 d D . . . .
F54 F 0.4289(4) 0.9076(10) 0.7319(19) 0.076(6) Uani 0.38(4) 1 d D U P N 1
F55 F 0.4624(3) 0.9606(16) 0.7736(14) 0.086(6) Uani 0.38(4) 1 d D U P N 1
F56 F 0.4399(7) 0.9967(10) 0.6610(14) 0.096(7) Uani 0.38(4) 1 d D U P N 1
F154 F 0.4508(4) 1.0064(4) 0.6826(13) 0.093(5) Uani 0.62(4) 1 d D U P N 2
F155 F 0.42488(16) 0.9245(9) 0.7035(13) 0.086(4) Uani 0.62(4) 1 d D U P N 2
F156 F 0.4583(3) 0.9338(11) 0.7872(6) 0.087(4) Uani 0.62(4) 1 d D U P N 2
C309 C 0.47001(9) 0.6792(2) 0.5035(5) 0.0272(9) Uani 1 1 d . . . . .
C310 C 0.49386(10) 0.6548(3) 0.4708(4) 0.0298(11) Uani 1 1 d . . . . .
H310 H 0.5014 0.6750 0.4165 0.036 Uiso 1 1 calc R U . . .
C311 C 0.50699(10) 0.6019(3) 0.5151(5) 0.0336(12) Uani 1 1 d . . . . .
C312 C 0.49668(13) 0.5702(3) 0.5927(5) 0.0419(14) Uani 1 1 d . . . . .
H312 H 0.5055 0.5337 0.6225 0.050 Uiso 1 1 calc R U . . .
C313 C 0.47297(13) 0.5932(3) 0.6262(5) 0.0461(15) Uani 1 1 d D . . . .
C314 C 0.46030(12) 0.6476(3) 0.5840(4) 0.0361(12) Uani 1 1 d . . . . .
H314 H 0.4446 0.6637 0.6109 0.043 Uiso 1 1 calc R U . . .
C315 C 0.53282(12) 0.5801(3) 0.4770(6) 0.0452(17) Uani 1 1 d . . . . .
F57 F 0.53993(10) 0.5200(3) 0.5039(7) 0.102(2) Uani 1 1 d . . . . .
F58 F 0.53367(10) 0.5808(3) 0.3826(4) 0.0758(15) Uani 1 1 d . . . . .
F59 F 0.55151(7) 0.6244(3) 0.4996(5) 0.0687(12) Uani 1 1 d . . . . .
C316 C 0.46161(14) 0.5597(4) 0.7081(6) 0.079(3) Uani 1 1 d D . . . .
F60 F 0.4673(4) 0.4928(5) 0.7142(12) 0.092(7) Uani 0.334 1 d D U P O 1
F61 F 0.4679(3) 0.5875(8) 0.7910(7) 0.086(5) Uani 0.334 1 d D U P O 1
F62 F 0.43504(18) 0.5612(8) 0.7070(11) 0.069(5) Uani 0.334 1 d D U P O 1
F160 F 0.4377(2) 0.5799(10) 0.7319(13) 0.088(6) Uani 0.333 1 d D U P O 2
F161 F 0.4587(4) 0.4904(4) 0.6931(11) 0.070(5) Uani 0.333 1 d D U P O 2
F162 F 0.4759(4) 0.5622(11) 0.7866(8) 0.105(6) Uani 0.333 1 d D U P O 2
F260 F 0.4373(2) 0.5388(10) 0.6984(13) 0.098(6) Uani 0.333 1 d D U P O 3
F261 F 0.4760(3) 0.5080(8) 0.7431(11) 0.089(6) Uani 0.333 1 d D U P O 3
F262 F 0.4609(4) 0.6036(8) 0.7844(7) 0.094(6) Uani 0.333 1 d D U P O 3
C317 C 0.42429(10) 0.7410(3) 0.4558(4) 0.0280(10) Uani 1 1 d . . . . .
C318 C 0.40935(10) 0.7990(3) 0.4400(4) 0.0298(11) Uani 1 1 d . . . . .
H318 H 0.4179 0.8414 0.4335 0.036 Uiso 1 1 calc R U . . .
C319 C 0.38242(11) 0.7973(3) 0.4335(5) 0.0349(12) Uani 1 1 d . . . . .
C320 C 0.36903(12) 0.7368(3) 0.4422(5) 0.0405(14) Uani 1 1 d . . . . .
H320 H 0.3506 0.7355 0.4395 0.049 Uiso 1 1 calc R U . . .
C321 C 0.38339(11) 0.6781(3) 0.4551(5) 0.0407(14) Uani 1 1 d D . . . .
C322 C 0.41045(11) 0.6803(3) 0.4609(5) 0.0357(12) Uani 1 1 d . . . . .
H322 H 0.4197 0.6391 0.4686 0.043 Uiso 1 1 calc R U . . .
C323 C 0.36805(12) 0.8616(3) 0.4143(6) 0.0444(15) Uani 1 1 d . . . . .
F63 F 0.37615(8) 0.9131(2) 0.4669(3) 0.0541(11) Uani 1 1 d . . . . .
F64 F 0.34276(8) 0.8559(3) 0.4264(5) 0.0782(17) Uani 1 1 d . . . . .
F65 F 0.37149(11) 0.8820(3) 0.3241(4) 0.0673(13) Uani 1 1 d . . . . .
C324 C 0.37028(11) 0.6109(4) 0.4590(5) 0.068(3) Uani 1 1 d D . . . .
F66 F 0.34459(16) 0.6144(7) 0.4602(14) 0.069(5) Uani 0.334 1 d D U P P 1
F67 F 0.3778(3) 0.5722(6) 0.5307(10) 0.074(6) Uani 0.334 1 d D U P P 1
F68 F 0.3761(3) 0.5738(6) 0.3804(9) 0.061(4) Uani 0.334 1 d D U P P 1
F166 F 0.3820(3) 0.5618(6) 0.4121(15) 0.088(6) Uani 0.333 1 d D U P P 2
F167 F 0.34579(19) 0.6137(7) 0.4257(14) 0.066(5) Uani 0.333 1 d D U P P 2
F168 F 0.3678(4) 0.5891(9) 0.5488(9) 0.098(6) Uani 0.333 1 d D U P P 2
F266 F 0.3840(3) 0.5639(5) 0.5063(13) 0.067(5) Uani 0.333 1 d D U P P 3
F267 F 0.3471(2) 0.6130(7) 0.5011(15) 0.085(5) Uani 0.333 1 d D U P P 3
F268 F 0.3665(4) 0.5839(8) 0.3732(9) 0.093(6) Uani 0.333 1 d D U P P 3
C325 C 0.46279(10) 0.7492(2) 0.3415(4) 0.0259(10) Uani 1 1 d . . . . .
C326 C 0.46141(10) 0.6906(3) 0.2854(4) 0.0285(11) Uani 1 1 d . . . . .
H326 H 0.4582 0.6481 0.3149 0.034 Uiso 1 1 calc R U . . .
C327 C 0.46455(10) 0.6925(3) 0.1884(4) 0.0306(11) Uani 1 1 d . . . . .
C328 C 0.46927(11) 0.7531(3) 0.1419(4) 0.0330(11) Uani 1 1 d . . . . .
H328 H 0.4713 0.7545 0.0755 0.040 Uiso 1 1 calc R U . . .
C329 C 0.47093(10) 0.8114(3) 0.1957(4) 0.0328(11) Uani 1 1 d D . . . .
C330 C 0.46764(10) 0.8098(3) 0.2925(4) 0.0287(10) Uani 1 1 d . . . . .
H330 H 0.4687 0.8510 0.3268 0.034 Uiso 1 1 calc R U . . .
C331 C 0.46315(13) 0.6278(3) 0.1335(5) 0.0407(13) Uani 1 1 d . . . . .
F69 F 0.46253(19) 0.6364(3) 0.0423(4) 0.109(3) Uani 1 1 d . . . . .
F70 F 0.48301(11) 0.5880(3) 0.1514(5) 0.089(2) Uani 1 1 d . . . . .
F71 F 0.44228(11) 0.5921(3) 0.1536(5) 0.087(2) Uani 1 1 d . . . . .
C332 C 0.47614(11) 0.8778(3) 0.1478(4) 0.0460(15) Uani 1 1 d D . . . .
F72 F 0.4545(2) 0.9145(6) 0.1381(11) 0.057(4) Uani 0.334 1 d D U P Q 1
F73 F 0.4928(2) 0.9164(5) 0.1962(8) 0.036(3) Uani 0.334 1 d D U P Q 1
F74 F 0.4861(3) 0.8708(7) 0.0619(6) 0.057(5) Uani 0.334 1 d D U P Q 1
F172 F 0.4954(3) 0.8714(7) 0.0831(10) 0.069(5) Uani 0.333 1 d D U P Q 2
F173 F 0.4561(3) 0.9021(7) 0.1005(13) 0.073(5) Uani 0.333 1 d D U P Q 2
F174 F 0.4843(4) 0.9260(6) 0.2061(10) 0.062(5) Uani 0.333 1 d D U P Q 2
F272 F 0.4739(4) 0.8757(7) 0.0548(6) 0.070(5) Uani 0.333 1 d D U P Q 3
F273 F 0.4588(3) 0.9257(6) 0.1756(12) 0.073(5) Uani 0.333 1 d D U P Q 3
F274 F 0.4991(2) 0.9040(7) 0.1687(13) 0.075(5) Uani 0.333 1 d D U P Q 3


_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
Rh1 P1 2.2254(14) . ?
Rh1 P2 2.2436(14) . ?
B1 C1 1.595(10) . ?
B1 N1 1.605(8) . ?
B1 H1A 0.9900 . ?
B1 H1B 0.9900 . ?
C1 C6 1.394(11) . ?
C1 C2 1.408(10) . ?
C2 C3 1.396(12) . ?
C2 H2 0.9500 . ?
C3 C4 1.391(17) . ?
C3 H3 0.9500 . ?
C4 C5 1.352(17) . ?
C4 H4 0.9500 . ?
C5 C6 1.394(14) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
N1 C7 1.484(10) . ?
N1 C9 1.494(10) . ?
N1 C8 1.499(12) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
P1 C18 1.838(7) . ?
P1 C10 1.843(7) . ?
P1 C14 1.846(6) . ?
C10 C11 1.530(11) . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C11 C12A 1.50(2) . ?
C11 C13B 1.518(19) . ?
C11 C13A 1.54(2) . ?
C11 C12B 1.569(18) . ?
C11 H11 1.0000 . ?
C12A H12A 0.9800 . ?
C12A H12B 0.9800 . ?
C12A H12C 0.9800 . ?
C13A H13A 0.9800 . ?
C13A H13B 0.9800 . ?
C13A H13C 0.9800 . ?
C12B H12D 0.9800 . ?
C12B H12E 0.9800 . ?
C12B H12F 0.9800 . ?
C13B H13D 0.9800 . ?
C13B H13E 0.9800 . ?
C13B H13F 0.9800 . ?
C14 C15 1.553(8) . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C15 C17 1.513(10) . ?
C15 C16 1.535(10) . ?
C15 H15 1.0000 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
C18 C19 1.543(11) . ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
C19 C21 1.527(12) . ?
C19 C20 1.529(10) . ?
C19 H19 1.0000 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
P2 C30B 1.79(2) . ?
P2 C26A 1.822(9) . ?
P2 C22B 1.83(2) . ?
P2 C22A 1.838(8) . ?
P2 C26B 1.86(2) . ?
P2 C30A 1.867(8) . ?
C22A C23A 1.540(11) . ?
C22A H22A 0.9900 . ?
C22A H22B 0.9900 . ?
C23A C24A 1.526(12) . ?
C23A C25A 1.529(11) . ?
C23A H23A 1.0000 . ?
C24A H24A 0.9800 . ?
C24A H24B 0.9800 . ?
C24A H24C 0.9800 . ?
C25A H25A 0.9800 . ?
C25A H25B 0.9800 . ?
C25A H25C 0.9800 . ?
C22B C23B 1.53(2) . ?
C22B H22C 0.9900 . ?
C22B H22D 0.9900 . ?
C23B C25B 1.52(3) . ?
C23B C24B 1.55(2) . ?
C23B H23B 1.0000 . ?
C24B H24D 0.9800 . ?
C24B H24E 0.9800 . ?
C24B H24F 0.9800 . ?
C25B H25D 0.9800 . ?
C25B H25E 0.9800 . ?
C25B H25F 0.9800 . ?
C26A C27A 1.529(12) . ?
C26A H26A 0.9900 . ?
C26A H26B 0.9900 . ?
C27A C29A 1.491(13) . ?
C27A C28A 1.544(14) . ?
C27A H27A 1.0000 . ?
C28A H28A 0.9800 . ?
C28A H28B 0.9800 . ?
C28A H28C 0.9800 . ?
C29A H29A 0.9800 . ?
C29A H29B 0.9800 . ?
C29A H29C 0.9800 . ?
C26B H26C 0.9900 . ?
C26B H26D 0.9900 . ?
C28B H28D 0.9800 . ?
C28B H28E 0.9800 . ?
C28B H28F 0.9800 . ?
C29B H29D 0.9800 . ?
C29B H29E 0.9800 . ?
C29B H29F 0.9800 . ?
C30A C31A 1.545(11) . ?
C30A H30A 0.9900 . ?
C30A H30B 0.9900 . ?
C31A C33A 1.521(14) . ?
C31A C32A 1.548(15) . ?
C31A H31A 1.0000 . ?
C32A H32A 0.9800 . ?
C32A H32B 0.9800 . ?
C32A H32C 0.9800 . ?
C33A H33A 0.9800 . ?
C33A H33B 0.9800 . ?
C33A H33C 0.9800 . ?
C30B C31B 1.54(2) . ?
C30B H30C 0.9900 . ?
C30B H30D 0.9900 . ?
C31B C33B 1.54(3) . ?
C31B C32B 1.54(3) . ?
C31B H31B 1.0000 . ?
C32B H32D 0.9800 . ?
C32B H32E 0.9800 . ?
C32B H32F 0.9800 . ?
C33B H33D 0.9800 . ?
C33B H33E 0.9800 . ?
C33B H33F 0.9800 . ?
Rh2 P4 2.2289(14) . ?
Rh2 P3 2.2353(14) . ?
B2 C51 1.595(10) . ?
B2 N2 1.617(9) . ?
B2 H2A 0.9900 . ?
B2 H2B 0.9900 . ?
C51 C56 1.390(11) . ?
C51 C52 1.397(10) . ?
C52 C53 1.399(11) . ?
C52 H52 0.9500 . ?
C53 C54 1.390(17) . ?
C53 H53 0.9500 . ?
C54 C55 1.361(18) . ?
C54 H54 0.9500 . ?
C55 C56 1.383(14) . ?
C55 H55 0.9500 . ?
C56 H56 0.9500 . ?
N2 C57 1.488(9) . ?
N2 C59 1.490(9) . ?
N2 C58 1.494(8) . ?
C57 H57A 0.9800 . ?
C57 H57B 0.9800 . ?
C57 H57C 0.9800 . ?
C58 H58A 0.9800 . ?
C58 H58B 0.9800 . ?
C58 H58C 0.9800 . ?
C59 H59A 0.9800 . ?
C59 H59B 0.9800 . ?
C59 H59C 0.9800 . ?
P3 C68A 1.831(7) . ?
P3 C64 1.842(6) . ?
P3 C60 1.849(6) . ?
C60 C61 1.541(8) . ?
C60 H60A 0.9900 . ?
C60 H60B 0.9900 . ?
C61 C63 1.506(12) . ?
C61 C62 1.519(13) . ?
C61 H61 1.0000 . ?
C62 H62A 0.9800 . ?
C62 H62B 0.9800 . ?
C62 H62C 0.9800 . ?
C63 H63A 0.9800 . ?
C63 H63B 0.9800 . ?
C63 H63C 0.9800 . ?
C64 C65 1.535(9) . ?
C64 H64A 0.9900 . ?
C64 H64B 0.9900 . ?
C65 C66 1.522(12) . ?
C65 C67 1.528(11) . ?
C65 H65 1.0000 . ?
C66 H66A 0.9800 . ?
C66 H66B 0.9800 . ?
C66 H66C 0.9800 . ?
C67 H67A 0.9800 . ?
C67 H67B 0.9800 . ?
C67 H67C 0.9800 . ?
C68A C69A 1.54(3) . ?
C68A H68A 0.9900 . ?
C68A H68B 0.9900 . ?
C69A C70A 1.52(3) . ?
C69A C71A 1.53(3) . ?
C69A H69A 1.0000 . ?
C70A H70A 0.9800 . ?
C70A H70B 0.9800 . ?
C70A H70C 0.9800 . ?
C71A H71A 0.9800 . ?
C71A H71B 0.9800 . ?
C71A H71C 0.9800 . ?
C69B C71B 1.52(2) . ?
C69B C70B 1.54(2) . ?
C69B H69B 1.0000 . ?
C70B H70D 0.9800 . ?
C70B H70E 0.9800 . ?
C70B H70F 0.9800 . ?
C71B H71D 0.9800 . ?
C71B H71E 0.9800 . ?
C71B H71F 0.9800 . ?
P4 C80 1.837(6) . ?
P4 C76A 1.841(6) . ?
P4 C72 1.850(6) . ?
C72 C73 1.540(8) . ?
C72 H72A 0.9900 . ?
C72 H72B 0.9900 . ?
C73 C74 1.515(10) . ?
C73 C75 1.521(10) . ?
C73 H73 1.0000 . ?
C74 H74A 0.9800 . ?
C74 H74B 0.9800 . ?
C74 H74C 0.9800 . ?
C75 H75A 0.9800 . ?
C75 H75B 0.9800 . ?
C75 H75C 0.9800 . ?
C76A C77A 1.510(13) . ?
C76A H76A 0.9900 . ?
C76A H76B 0.9900 . ?
C77A C79A 1.504(16) . ?
C77A C78A 1.551(17) . ?
C77A H77A 1.0000 . ?
C78A H78A 0.9800 . ?
C78A H78B 0.9800 . ?
C78A H78C 0.9800 . ?
C79A H79A 0.9800 . ?
C79A H79B 0.9800 . ?
C79A H79C 0.9800 . ?
C77B C78B 1.484(18) . ?
C77B C79B 1.545(17) . ?
C77B H77B 1.0000 . ?
C78B H78D 0.9800 . ?
C78B H78E 0.9800 . ?
C78B H78F 0.9800 . ?
C79B H79D 0.9800 . ?
C79B H79E 0.9800 . ?
C79B H79F 0.9800 . ?
C80 C81A 1.530(10) . ?
C80 H80A 0.9900 . ?
C80 H80B 0.9900 . ?
C81A C83A 1.445(17) . ?
C81A C82A 1.593(16) . ?
C81A H81A 1.0000 . ?
C82A H82A 0.9800 . ?
C82A H82B 0.9800 . ?
C82A H82C 0.9800 . ?
C83A H83A 0.9800 . ?
C83A H83B 0.9800 . ?
C83A H83C 0.9800 . ?
C82B H82D 0.9800 . ?
C82B H82E 0.9800 . ?
C82B H82F 0.9800 . ?
C83B H83D 0.9800 . ?
C83B H83E 0.9800 . ?
C83B H83F 0.9800 . ?
B200 C225 1.638(8) . ?
B200 C217 1.641(8) . ?
B200 C209 1.644(8) . ?
B200 C201 1.648(8) . ?
C201 C202 1.401(8) . ?
C201 C206 1.405(8) . ?
C202 C203 1.389(8) . ?
C202 H202 0.9500 . ?
C203 C204 1.391(10) . ?
C203 C207 1.501(9) . ?
C204 C205 1.378(9) . ?
C204 H204 0.9500 . ?
C205 C206 1.396(7) . ?
C205 C208 1.503(9) . ?
C206 H206 0.9500 . ?
C207 F3 1.304(8) . ?
C207 F103 1.310(10) . ?
C207 F1 1.322(8) . ?
C207 F102 1.324(10) . ?
C207 F2 1.331(7) . ?
C207 F101 1.332(10) . ?
C208 F5 1.305(9) . ?
C208 F6 1.308(9) . ?
C208 F106 1.313(8) . ?
C208 F105 1.314(8) . ?
C208 F104 1.314(9) . ?
C208 F4 1.321(9) . ?
C209 C210 1.392(7) . ?
C209 C214 1.411(7) . ?
C210 C211 1.392(8) . ?
C210 H210 0.9500 . ?
C211 C212 1.387(8) . ?
C211 C215 1.490(9) . ?
C212 C213 1.391(8) . ?
C212 H212 0.9500 . ?
C213 C214 1.380(7) . ?
C213 C216 1.503(8) . ?
C214 H214 0.9500 . ?
C215 F8 1.313(8) . ?
C215 F107 1.320(9) . ?
C215 F108 1.331(9) . ?
C215 F7 1.334(8) . ?
C215 F109 1.352(9) . ?
C215 F9 1.359(8) . ?
C216 F11 1.305(8) . ?
C216 F111 1.308(9) . ?
C216 F110 1.322(9) . ?
C216 F12 1.340(8) . ?
C216 F10 1.342(8) . ?
C216 F112 1.356(9) . ?
C217 C218 1.396(7) . ?
C217 C222 1.401(7) . ?
C218 C219 1.386(9) . ?
C218 H218 0.9500 . ?
C219 C220 1.382(9) . ?
C219 C223 1.501(8) . ?
C220 C221 1.394(8) . ?
C220 H220 0.9500 . ?
C221 C222 1.392(8) . ?
C221 C224 1.484(8) . ?
C222 H222 0.9500 . ?
C223 F13 1.314(9) . ?
C223 F15 1.322(10) . ?
C223 F14 1.332(9) . ?
C224 F116 1.307(9) . ?
C224 F118 1.315(9) . ?
C224 F18 1.318(8) . ?
C224 F218 1.323(9) . ?
C224 F217 1.335(8) . ?
C224 F16 1.338(8) . ?
C224 F216 1.364(9) . ?
C224 F17 1.366(8) . ?
C224 F117 1.389(9) . ?
C225 C226 1.395(8) . ?
C225 C230 1.405(7) . ?
C226 C227 1.396(9) . ?
C226 H226 0.9500 . ?
C227 C228 1.388(9) . ?
C227 C231 1.494(9) . ?
C228 C229 1.377(9) . ?
C228 H228 0.9500 . ?
C229 C230 1.395(7) . ?
C229 C232 1.493(9) . ?
C230 H230 0.9500 . ?
C231 F20 1.321(10) . ?
C231 F19 1.324(10) . ?
C231 F21 1.339(9) . ?
C232 F223 1.309(9) . ?
C232 F122 1.314(9) . ?
C232 F23 1.326(9) . ?
C232 F24 1.334(9) . ?
C232 F123 1.337(9) . ?
C232 F222 1.350(9) . ?
C232 F224 1.351(9) . ?
C232 F22 1.354(8) . ?
C232 F124 1.367(8) . ?
B300 C301 1.632(7) . ?
B300 C317 1.639(8) . ?
B300 C309 1.641(7) . ?
B300 C325 1.649(8) . ?
C301 C306 1.392(8) . ?
C301 C302 1.408(7) . ?
C302 C303 1.389(8) . ?
C302 H302 0.9500 . ?
C303 C304 1.380(9) . ?
C303 C307 1.503(8) . ?
C304 C305 1.385(9) . ?
C304 H304 0.9500 . ?
C305 C306 1.399(8) . ?
C305 C308 1.495(9) . ?
C306 H306 0.9500 . ?
C307 F52 1.300(9) . ?
C307 F51 1.336(8) . ?
C307 F53 1.336(8) . ?
C308 F155 1.301(8) . ?
C308 F55 1.305(9) . ?
C308 F54 1.320(9) . ?
C308 F154 1.320(8) . ?
C308 F56 1.328(9) . ?
C308 F156 1.330(9) . ?
C309 C314 1.395(9) . ?
C309 C310 1.401(7) . ?
C310 C311 1.395(7) . ?
C310 H310 0.9500 . ?
C311 C312 1.374(10) . ?
C311 C315 1.501(8) . ?
C312 C313 1.389(9) . ?
C312 H312 0.9500 . ?
C313 C314 1.392(8) . ?
C313 C316 1.461(11) . ?
C314 H314 0.9500 . ?
C315 F57 1.299(8) . ?
C315 F59 1.339(8) . ?
C315 F58 1.342(9) . ?
C316 F260 1.325(10) . ?
C316 F160 1.339(10) . ?
C316 F162 1.339(10) . ?
C316 F61 1.339(10) . ?
C316 F60 1.353(10) . ?
C316 F261 1.353(9) . ?
C316 F62 1.372(10) . ?
C316 F262 1.389(10) . ?
C316 F161 1.390(9) . ?
C317 C322 1.396(8) . ?
C317 C318 1.396(7) . ?
C318 C319 1.394(8) . ?
C318 H318 0.9500 . ?
C319 C320 1.384(9) . ?
C319 C323 1.494(8) . ?
C320 C321 1.386(9) . ?
C320 H320 0.9500 . ?
C321 C322 1.399(8) . ?
C321 C324 1.488(9) . ?
C322 H322 0.9500 . ?
C323 F64 1.321(8) . ?
C323 F63 1.328(8) . ?
C323 F65 1.355(10) . ?
C324 F166 1.320(9) . ?
C324 F66 1.328(9) . ?
C324 F67 1.331(9) . ?
C324 F267 1.336(9) . ?
C324 F268 1.344(10) . ?
C324 F266 1.346(9) . ?
C324 F167 1.350(9) . ?
C324 F168 1.352(10) . ?
C324 F68 1.369(9) . ?
C325 C330 1.405(7) . ?
C325 C326 1.406(7) . ?
C326 C327 1.389(8) . ?
C326 H326 0.9500 . ?
C327 C328 1.386(8) . ?
C327 C331 1.496(8) . ?
C328 C329 1.383(8) . ?
C328 H328 0.9500 . ?
C329 C330 1.386(8) . ?
C329 C332 1.499(9) . ?
C330 H330 0.9500 . ?
C331 F69 1.307(9) . ?
C331 F70 1.316(8) . ?
C331 F71 1.318(9) . ?
C332 F173 1.325(9) . ?
C332 F274 1.326(9) . ?
C332 F272 1.327(9) . ?
C332 F174 1.330(9) . ?
C332 F74 1.332(9) . ?
C332 F72 1.337(9) . ?
C332 F73 1.338(8) . ?
C332 F172 1.361(9) . ?
C332 F273 1.361(9) . ?

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
P1 Rh1 P2 98.84(5) . . ?
C1 B1 N1 114.8(5) . . ?
C1 B1 H1A 108.6 . . ?
N1 B1 H1A 108.6 . . ?
C1 B1 H1B 108.6 . . ?
N1 B1 H1B 108.6 . . ?
H1A B1 H1B 107.5 . . ?
C6 C1 C2 117.3(7) . . ?
C6 C1 B1 119.9(7) . . ?
C2 C1 B1 122.7(7) . . ?
C3 C2 C1 121.1(9) . . ?
C3 C2 H2 119.5 . . ?
C1 C2 H2 119.5 . . ?
C4 C3 C2 119.1(10) . . ?
C4 C3 H3 120.4 . . ?
C2 C3 H3 120.4 . . ?
C5 C4 C3 120.9(9) . . ?
C5 C4 H4 119.6 . . ?
C3 C4 H4 119.6 . . ?
C4 C5 C6 120.2(10) . . ?
C4 C5 H5 119.9 . . ?
C6 C5 H5 119.9 . . ?
C1 C6 C5 121.3(9) . . ?
C1 C6 H6 119.3 . . ?
C5 C6 H6 119.3 . . ?
C7 N1 C9 108.2(7) . . ?
C7 N1 C8 109.3(7) . . ?
C9 N1 C8 109.2(8) . . ?
C7 N1 B1 111.1(6) . . ?
C9 N1 B1 110.2(6) . . ?
C8 N1 B1 108.9(6) . . ?
N1 C7 H7A 109.5 . . ?
N1 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
N1 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C8 H8A 109.5 . . ?
N1 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N1 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
N1 C9 H9A 109.5 . . ?
N1 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
N1 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C18 P1 C10 101.0(3) . . ?
C18 P1 C14 103.4(3) . . ?
C10 P1 C14 104.8(3) . . ?
C18 P1 Rh1 118.1(2) . . ?
C10 P1 Rh1 121.3(2) . . ?
C14 P1 Rh1 106.35(19) . . ?
C11 C10 P1 116.7(5) . . ?
C11 C10 H10A 108.1 . . ?
P1 C10 H10A 108.1 . . ?
C11 C10 H10B 108.1 . . ?
P1 C10 H10B 108.1 . . ?
H10A C10 H10B 107.3 . . ?
C12A C11 C10 110.1(18) . . ?
C13B C11 C10 115.7(14) . . ?
C12A C11 C13A 113.1(18) . . ?
C10 C11 C13A 99(2) . . ?
C13B C11 C12B 106.6(15) . . ?
C10 C11 C12B 114.7(9) . . ?
C12A C11 H11 111.3 . . ?
C10 C11 H11 111.3 . . ?
C13A C11 H11 111.3 . . ?
C11 C12A H12A 109.5 . . ?
C11 C12A H12B 109.5 . . ?
H12A C12A H12B 109.5 . . ?
C11 C12A H12C 109.5 . . ?
H12A C12A H12C 109.5 . . ?
H12B C12A H12C 109.5 . . ?
C11 C13A H13A 109.5 . . ?
C11 C13A H13B 109.5 . . ?
H13A C13A H13B 109.5 . . ?
C11 C13A H13C 109.5 . . ?
H13A C13A H13C 109.5 . . ?
H13B C13A H13C 109.5 . . ?
C11 C12B H12D 109.5 . . ?
C11 C12B H12E 109.5 . . ?
H12D C12B H12E 109.5 . . ?
C11 C12B H12F 109.5 . . ?
H12D C12B H12F 109.5 . . ?
H12E C12B H12F 109.5 . . ?
C11 C13B H13D 109.5 . . ?
C11 C13B H13E 109.5 . . ?
H13D C13B H13E 109.5 . . ?
C11 C13B H13F 109.5 . . ?
H13D C13B H13F 109.5 . . ?
H13E C13B H13F 109.5 . . ?
C15 C14 P1 120.2(4) . . ?
C15 C14 H14A 107.3 . . ?
P1 C14 H14A 107.3 . . ?
C15 C14 H14B 107.3 . . ?
P1 C14 H14B 107.3 . . ?
H14A C14 H14B 106.9 . . ?
C17 C15 C16 109.3(6) . . ?
C17 C15 C14 110.1(6) . . ?
C16 C15 C14 110.5(6) . . ?
C17 C15 H15 109.0 . . ?
C16 C15 H15 109.0 . . ?
C14 C15 H15 109.0 . . ?
C15 C16 H16A 109.5 . . ?
C15 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C15 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C15 C17 H17A 109.5 . . ?
C15 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C15 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C19 C18 P1 116.8(5) . . ?
C19 C18 H18A 108.1 . . ?
P1 C18 H18A 108.1 . . ?
C19 C18 H18B 108.1 . . ?
P1 C18 H18B 108.1 . . ?
H18A C18 H18B 107.3 . . ?
C21 C19 C20 110.8(7) . . ?
C21 C19 C18 111.1(6) . . ?
C20 C19 C18 109.6(8) . . ?
C21 C19 H19 108.4 . . ?
C20 C19 H19 108.4 . . ?
C18 C19 H19 108.4 . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C19 C21 H21A 109.5 . . ?
C19 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C19 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C30B P2 C22B 108.9(15) . . ?
C26A P2 C22A 104.0(4) . . ?
C30B P2 C26B 106.4(15) . . ?
C22B P2 C26B 102.1(13) . . ?
C26A P2 C30A 100.0(4) . . ?
C22A P2 C30A 101.1(4) . . ?
C30B P2 Rh1 119.8(9) . . ?
C26A P2 Rh1 112.1(3) . . ?
C22B P2 Rh1 111.4(8) . . ?
C22A P2 Rh1 114.0(3) . . ?
C26B P2 Rh1 106.6(9) . . ?
C30A P2 Rh1 123.2(3) . . ?
C23A C22A P2 116.6(6) . . ?
C23A C22A H22A 108.1 . . ?
P2 C22A H22A 108.1 . . ?
C23A C22A H22B 108.1 . . ?
P2 C22A H22B 108.1 . . ?
H22A C22A H22B 107.3 . . ?
C24A C23A C25A 110.5(7) . . ?
C24A C23A C22A 111.8(7) . . ?
C25A C23A C22A 109.8(7) . . ?
C24A C23A H23A 108.2 . . ?
C25A C23A H23A 108.2 . . ?
C22A C23A H23A 108.2 . . ?
C23A C24A H24A 109.5 . . ?
C23A C24A H24B 109.5 . . ?
H24A C24A H24B 109.5 . . ?
C23A C24A H24C 109.5 . . ?
H24A C24A H24C 109.5 . . ?
H24B C24A H24C 109.5 . . ?
C23A C25A H25A 109.5 . . ?
C23A C25A H25B 109.5 . . ?
H25A C25A H25B 109.5 . . ?
C23A C25A H25C 109.5 . . ?
H25A C25A H25C 109.5 . . ?
H25B C25A H25C 109.5 . . ?
C23B C22B P2 120.5(18) . . ?
C23B C22B H22C 107.2 . . ?
P2 C22B H22C 107.2 . . ?
C23B C22B H22D 107.2 . . ?
P2 C22B H22D 107.2 . . ?
H22C C22B H22D 106.8 . . ?
C25B C23B C22B 108(2) . . ?
C25B C23B C24B 113(3) . . ?
C22B C23B C24B 112(3) . . ?
C25B C23B H23B 107.7 . . ?
C22B C23B H23B 107.7 . . ?
C24B C23B H23B 107.7 . . ?
C23B C24B H24D 109.5 . . ?
C23B C24B H24E 109.5 . . ?
H24D C24B H24E 109.5 . . ?
C23B C24B H24F 109.5 . . ?
H24D C24B H24F 109.5 . . ?
H24E C24B H24F 109.5 . . ?
C23B C25B H25D 109.5 . . ?
C23B C25B H25E 109.5 . . ?
H25D C25B H25E 109.5 . . ?
C23B C25B H25F 109.5 . . ?
H25D C25B H25F 109.5 . . ?
H25E C25B H25F 109.5 . . ?
C27A C26A P2 119.6(7) . . ?
C27A C26A H26A 107.4 . . ?
P2 C26A H26A 107.4 . . ?
C27A C26A H26B 107.4 . . ?
P2 C26A H26B 107.4 . . ?
H26A C26A H26B 106.9 . . ?
C29A C27A C26A 111.7(10) . . ?
C29A C27A C28A 112.4(10) . . ?
C26A C27A C28A 111.4(8) . . ?
C29A C27A H27A 107.0 . . ?
C26A C27A H27A 107.0 . . ?
C28A C27A H27A 107.0 . . ?
C27A C28A H28A 109.5 . . ?
C27A C28A H28B 109.5 . . ?
H28A C28A H28B 109.5 . . ?
C27A C28A H28C 109.5 . . ?
H28A C28A H28C 109.5 . . ?
H28B C28A H28C 109.5 . . ?
C27A C29A H29A 109.5 . . ?
C27A C29A H29B 109.5 . . ?
H29A C29A H29B 109.5 . . ?
C27A C29A H29C 109.5 . . ?
H29A C29A H29C 109.5 . . ?
H29B C29A H29C 109.5 . . ?
P2 C26B H26C 107.4 . . ?
P2 C26B H26D 107.4 . . ?
H26C C26B H26D 107.0 . . ?
H28D C28B H28E 109.5 . . ?
H28D C28B H28F 109.5 . . ?
H28E C28B H28F 109.5 . . ?
H29D C29B H29E 109.5 . . ?
H29D C29B H29F 109.5 . . ?
H29E C29B H29F 109.5 . . ?
C31A C30A P2 116.6(6) . . ?
C31A C30A H30A 108.1 . . ?
P2 C30A H30A 108.1 . . ?
C31A C30A H30B 108.1 . . ?
P2 C30A H30B 108.1 . . ?
H30A C30A H30B 107.3 . . ?
C33A C31A C30A 113.3(9) . . ?
C33A C31A C32A 109.2(9) . . ?
C30A C31A C32A 108.9(8) . . ?
C33A C31A H31A 108.4 . . ?
C30A C31A H31A 108.4 . . ?
C32A C31A H31A 108.4 . . ?
C31A C32A H32A 109.5 . . ?
C31A C32A H32B 109.5 . . ?
H32A C32A H32B 109.5 . . ?
C31A C32A H32C 109.5 . . ?
H32A C32A H32C 109.5 . . ?
H32B C32A H32C 109.5 . . ?
C31A C33A H33A 109.5 . . ?
C31A C33A H33B 109.5 . . ?
H33A C33A H33B 109.5 . . ?
C31A C33A H33C 109.5 . . ?
H33A C33A H33C 109.5 . . ?
H33B C33A H33C 109.5 . . ?
C31B C30B P2 116.3(18) . . ?
C31B C30B H30C 108.2 . . ?
P2 C30B H30C 108.2 . . ?
C31B C30B H30D 108.2 . . ?
P2 C30B H30D 108.2 . . ?
H30C C30B H30D 107.4 . . ?
C33B C31B C32B 111(3) . . ?
C33B C31B C30B 104(2) . . ?
C32B C31B C30B 108(3) . . ?
C33B C31B H31B 111.1 . . ?
C32B C31B H31B 111.1 . . ?
C30B C31B H31B 111.1 . . ?
C31B C32B H32D 109.5 . . ?
C31B C32B H32E 109.5 . . ?
H32D C32B H32E 109.5 . . ?
C31B C32B H32F 109.5 . . ?
H32D C32B H32F 109.5 . . ?
H32E C32B H32F 109.5 . . ?
C31B C33B H33D 109.5 . . ?
C31B C33B H33E 109.5 . . ?
H33D C33B H33E 109.5 . . ?
C31B C33B H33F 109.5 . . ?
H33D C33B H33F 109.5 . . ?
H33E C33B H33F 109.5 . . ?
P4 Rh2 P3 95.14(5) . . ?
C51 B2 N2 114.1(5) . . ?
C51 B2 H2A 108.7 . . ?
N2 B2 H2A 108.7 . . ?
C51 B2 H2B 108.7 . . ?
N2 B2 H2B 108.7 . . ?
H2A B2 H2B 107.6 . . ?
C56 C51 C52 116.4(7) . . ?
C56 C51 B2 120.4(7) . . ?
C52 C51 B2 123.1(6) . . ?
C51 C52 C53 121.6(8) . . ?
C51 C52 H52 119.2 . . ?
C53 C52 H52 119.2 . . ?
C54 C53 C52 119.4(9) . . ?
C54 C53 H53 120.3 . . ?
C52 C53 H53 120.3 . . ?
C55 C54 C53 120.0(9) . . ?
C55 C54 H54 120.0 . . ?
C53 C54 H54 120.0 . . ?
C54 C55 C56 120.1(11) . . ?
C54 C55 H55 119.9 . . ?
C56 C55 H55 119.9 . . ?
C55 C56 C51 122.5(10) . . ?
C55 C56 H56 118.8 . . ?
C51 C56 H56 118.8 . . ?
C57 N2 C59 108.5(6) . . ?
C57 N2 C58 108.1(6) . . ?
C59 N2 C58 109.2(5) . . ?
C57 N2 B2 110.8(5) . . ?
C59 N2 B2 110.9(5) . . ?
C58 N2 B2 109.3(5) . . ?
N2 C57 H57A 109.5 . . ?
N2 C57 H57B 109.5 . . ?
H57A C57 H57B 109.5 . . ?
N2 C57 H57C 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
N2 C58 H58A 109.5 . . ?
N2 C58 H58B 109.5 . . ?
H58A C58 H58B 109.5 . . ?
N2 C58 H58C 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
N2 C59 H59A 109.5 . . ?
N2 C59 H59B 109.5 . . ?
H59A C59 H59B 109.5 . . ?
N2 C59 H59C 109.5 . . ?
H59A C59 H59C 109.5 . . ?
H59B C59 H59C 109.5 . . ?
C68A P3 C64 100.3(3) . . ?
C68A P3 C60 106.6(3) . . ?
C64 P3 C60 102.5(3) . . ?
C68A P3 Rh2 109.9(2) . . ?
C64 P3 Rh2 113.5(2) . . ?
C60 P3 Rh2 121.7(2) . . ?
C61 C60 P3 120.7(5) . . ?
C61 C60 H60A 107.1 . . ?
P3 C60 H60A 107.1 . . ?
C61 C60 H60B 107.1 . . ?
P3 C60 H60B 107.1 . . ?
H60A C60 H60B 106.8 . . ?
C63 C61 C62 108.3(8) . . ?
C63 C61 C60 112.6(6) . . ?
C62 C61 C60 108.8(7) . . ?
C63 C61 H61 109.0 . . ?
C62 C61 H61 109.0 . . ?
C60 C61 H61 109.0 . . ?
C61 C62 H62A 109.5 . . ?
C61 C62 H62B 109.5 . . ?
H62A C62 H62B 109.5 . . ?
C61 C62 H62C 109.5 . . ?
H62A C62 H62C 109.5 . . ?
H62B C62 H62C 109.5 . . ?
C61 C63 H63A 109.5 . . ?
C61 C63 H63B 109.5 . . ?
H63A C63 H63B 109.5 . . ?
C61 C63 H63C 109.5 . . ?
H63A C63 H63C 109.5 . . ?
H63B C63 H63C 109.5 . . ?
C65 C64 P3 115.9(4) . . ?
C65 C64 H64A 108.3 . . ?
P3 C64 H64A 108.3 . . ?
C65 C64 H64B 108.3 . . ?
P3 C64 H64B 108.3 . . ?
H64A C64 H64B 107.4 . . ?
C66 C65 C67 110.8(7) . . ?
C66 C65 C64 111.5(6) . . ?
C67 C65 C64 110.1(7) . . ?
C66 C65 H65 108.1 . . ?
C67 C65 H65 108.1 . . ?
C64 C65 H65 108.1 . . ?
C65 C66 H66A 109.5 . . ?
C65 C66 H66B 109.5 . . ?
H66A C66 H66B 109.5 . . ?
C65 C66 H66C 109.5 . . ?
H66A C66 H66C 109.5 . . ?
H66B C66 H66C 109.5 . . ?
C65 C67 H67A 109.5 . . ?
C65 C67 H67B 109.5 . . ?
H67A C67 H67B 109.5 . . ?
C65 C67 H67C 109.5 . . ?
H67A C67 H67C 109.5 . . ?
H67B C67 H67C 109.5 . . ?
C69A C68A P3 121(2) . . ?
C69A C68A H68A 107.1 . . ?
P3 C68A H68A 107.1 . . ?
C69A C68A H68B 107.1 . . ?
P3 C68A H68B 107.1 . . ?
H68A C68A H68B 106.8 . . ?
C70A C69A C71A 117(4) . . ?
C70A C69A C68A 116(3) . . ?
C71A C69A C68A 109(3) . . ?
C70A C69A H69A 104.1 . . ?
C71A C69A H69A 104.1 . . ?
C68A C69A H69A 104.1 . . ?
C69A C70A H70A 109.5 . . ?
C69A C70A H70B 109.5 . . ?
H70A C70A H70B 109.5 . . ?
C69A C70A H70C 109.5 . . ?
H70A C70A H70C 109.5 . . ?
H70B C70A H70C 109.5 . . ?
C69A C71A H71A 109.5 . . ?
C69A C71A H71B 109.5 . . ?
H71A C71A H71B 109.5 . . ?
C69A C71A H71C 109.5 . . ?
H71A C71A H71C 109.5 . . ?
H71B C71A H71C 109.5 . . ?
C71B C69B C70B 112(2) . . ?
C71B C69B H69B 107.6 . . ?
C70B C69B H69B 107.6 . . ?
C69B C70B H70D 109.5 . . ?
C69B C70B H70E 109.5 . . ?
H70D C70B H70E 109.5 . . ?
C69B C70B H70F 109.5 . . ?
H70D C70B H70F 109.5 . . ?
H70E C70B H70F 109.5 . . ?
C69B C71B H71D 109.5 . . ?
C69B C71B H71E 109.5 . . ?
H71D C71B H71E 109.5 . . ?
C69B C71B H71F 109.5 . . ?
H71D C71B H71F 109.5 . . ?
H71E C71B H71F 109.5 . . ?
C80 P4 C76A 101.2(3) . . ?
C80 P4 C72 108.2(3) . . ?
C76A P4 C72 103.2(3) . . ?
C80 P4 Rh2 112.5(2) . . ?
C76A P4 Rh2 111.7(2) . . ?
C72 P4 Rh2 118.29(19) . . ?
C73 C72 P4 121.0(4) . . ?
C73 C72 H72A 107.1 . . ?
P4 C72 H72A 107.1 . . ?
C73 C72 H72B 107.1 . . ?
P4 C72 H72B 107.1 . . ?
H72A C72 H72B 106.8 . . ?
C74 C73 C75 109.7(6) . . ?
C74 C73 C72 113.5(6) . . ?
C75 C73 C72 108.9(5) . . ?
C74 C73 H73 108.2 . . ?
C75 C73 H73 108.2 . . ?
C72 C73 H73 108.2 . . ?
C73 C74 H74A 109.5 . . ?
C73 C74 H74B 109.5 . . ?
H74A C74 H74B 109.5 . . ?
C73 C74 H74C 109.5 . . ?
H74A C74 H74C 109.5 . . ?
H74B C74 H74C 109.5 . . ?
C73 C75 H75A 109.5 . . ?
C73 C75 H75B 109.5 . . ?
H75A C75 H75B 109.5 . . ?
C73 C75 H75C 109.5 . . ?
H75A C75 H75C 109.5 . . ?
H75B C75 H75C 109.5 . . ?
C77A C76A P4 119.2(7) . . ?
C77A C76A H76A 107.5 . . ?
P4 C76A H76A 107.5 . . ?
C77A C76A H76B 107.5 . . ?
P4 C76A H76B 107.5 . . ?
H76A C76A H76B 107.0 . . ?
C79A C77A C76A 114.3(12) . . ?
C79A C77A C78A 109.6(12) . . ?
C76A C77A C78A 106.4(10) . . ?
C79A C77A H77A 108.8 . . ?
C76A C77A H77A 108.8 . . ?
C78A C77A H77A 108.8 . . ?
C77A C78A H78A 109.5 . . ?
C77A C78A H78B 109.5 . . ?
H78A C78A H78B 109.5 . . ?
C77A C78A H78C 109.5 . . ?
H78A C78A H78C 109.5 . . ?
H78B C78A H78C 109.5 . . ?
C77A C79A H79A 109.5 . . ?
C77A C79A H79B 109.5 . . ?
H79A C79A H79B 109.5 . . ?
C77A C79A H79C 109.5 . . ?
H79A C79A H79C 109.5 . . ?
H79B C79A H79C 109.5 . . ?
C78B C77B C79B 110.3(14) . . ?
C78B C77B H77B 106.9 . . ?
C79B C77B H77B 106.9 . . ?
C77B C78B H78D 109.5 . . ?
C77B C78B H78E 109.5 . . ?
H78D C78B H78E 109.5 . . ?
C77B C78B H78F 109.5 . . ?
H78D C78B H78F 109.5 . . ?
H78E C78B H78F 109.5 . . ?
C77B C79B H79D 109.5 . . ?
C77B C79B H79E 109.5 . . ?
H79D C79B H79E 109.5 . . ?
C77B C79B H79F 109.5 . . ?
H79D C79B H79F 109.5 . . ?
H79E C79B H79F 109.5 . . ?
C81A C80 P4 115.0(5) . . ?
C81A C80 H80A 108.5 . . ?
P4 C80 H80A 108.5 . . ?
C81A C80 H80B 108.5 . . ?
P4 C80 H80B 108.5 . . ?
H80A C80 H80B 107.5 . . ?
C83A C81A C80 117.5(10) . . ?
C83A C81A C82A 110.2(12) . . ?
C80 C81A C82A 105.4(9) . . ?
C83A C81A H81A 107.8 . . ?
C80 C81A H81A 107.8 . . ?
C82A C81A H81A 107.8 . . ?
C81A C82A H82A 109.5 . . ?
C81A C82A H82B 109.5 . . ?
H82A C82A H82B 109.5 . . ?
C81A C82A H82C 109.5 . . ?
H82A C82A H82C 109.5 . . ?
H82B C82A H82C 109.5 . . ?
C81A C83A H83A 109.5 . . ?
C81A C83A H83B 109.5 . . ?
H83A C83A H83B 109.5 . . ?
C81A C83A H83C 109.5 . . ?
H83A C83A H83C 109.5 . . ?
H83B C83A H83C 109.5 . . ?
H82D C82B H82E 109.5 . . ?
H82D C82B H82F 109.5 . . ?
H82E C82B H82F 109.5 . . ?
H83D C83B H83E 109.5 . . ?
H83D C83B H83F 109.5 . . ?
H83E C83B H83F 109.5 . . ?
C225 B200 C217 111.6(4) . . ?
C225 B200 C209 103.5(4) . . ?
C217 B200 C209 112.2(4) . . ?
C225 B200 C201 114.3(4) . . ?
C217 B200 C201 104.0(4) . . ?
C209 B200 C201 111.5(4) . . ?
C202 C201 C206 115.4(5) . . ?
C202 C201 B200 119.7(5) . . ?
C206 C201 B200 124.8(5) . . ?
C203 C202 C201 122.4(6) . . ?
C203 C202 H202 118.8 . . ?
C201 C202 H202 118.8 . . ?
C202 C203 C204 120.9(6) . . ?
C202 C203 C207 120.0(6) . . ?
C204 C203 C207 119.0(5) . . ?
C205 C204 C203 117.9(5) . . ?
C205 C204 H204 121.0 . . ?
C203 C204 H204 121.0 . . ?
C204 C205 C206 121.0(6) . . ?
C204 C205 C208 119.8(5) . . ?
C206 C205 C208 119.1(5) . . ?
C205 C206 C201 122.2(5) . . ?
C205 C206 H206 118.9 . . ?
C201 C206 H206 118.9 . . ?
F3 C207 F1 107.8(6) . . ?
F103 C207 F102 106.6(9) . . ?
F3 C207 F2 106.9(6) . . ?
F1 C207 F2 105.5(6) . . ?
F103 C207 F101 106.0(9) . . ?
F102 C207 F101 104.8(9) . . ?
F3 C207 C203 112.8(6) . . ?
F103 C207 C203 114.1(9) . . ?
F1 C207 C203 112.0(5) . . ?
F102 C207 C203 113.2(8) . . ?
F2 C207 C203 111.5(6) . . ?
F101 C207 C203 111.5(9) . . ?
F5 C208 F6 107.3(8) . . ?
F106 C208 F105 106.1(7) . . ?
F106 C208 F104 106.0(8) . . ?
F105 C208 F104 105.7(7) . . ?
F5 C208 F4 106.1(8) . . ?
F6 C208 F4 106.0(8) . . ?
F5 C208 C205 113.0(7) . . ?
F6 C208 C205 112.3(7) . . ?
F106 C208 C205 112.7(7) . . ?
F105 C208 C205 112.7(7) . . ?
F104 C208 C205 112.9(6) . . ?
F4 C208 C205 111.7(7) . . ?
C210 C209 C214 115.2(5) . . ?
C210 C209 B200 123.9(5) . . ?
C214 C209 B200 120.3(5) . . ?
C211 C210 C209 122.8(5) . . ?
C211 C210 H210 118.6 . . ?
C209 C210 H210 118.6 . . ?
C212 C211 C210 120.8(5) . . ?
C212 C211 C215 119.7(5) . . ?
C210 C211 C215 119.5(5) . . ?
C211 C212 C213 117.6(5) . . ?
C211 C212 H212 121.2 . . ?
C213 C212 H212 121.2 . . ?
C214 C213 C212 121.2(5) . . ?
C214 C213 C216 120.0(5) . . ?
C212 C213 C216 118.8(5) . . ?
C213 C214 C209 122.3(5) . . ?
C213 C214 H214 118.8 . . ?
C209 C214 H214 118.8 . . ?
F107 C215 F108 107.7(8) . . ?
F8 C215 F7 108.2(7) . . ?
F107 C215 F109 105.8(8) . . ?
F108 C215 F109 104.6(8) . . ?
F8 C215 F9 105.6(7) . . ?
F7 C215 F9 103.9(7) . . ?
F8 C215 C211 114.6(7) . . ?
F107 C215 C211 114.0(8) . . ?
F108 C215 C211 113.1(8) . . ?
F7 C215 C211 112.7(6) . . ?
F109 C215 C211 111.0(8) . . ?
F9 C215 C211 111.0(6) . . ?
F111 C216 F110 109.1(8) . . ?
F11 C216 F12 108.0(7) . . ?
F11 C216 F10 107.5(7) . . ?
F12 C216 F10 104.4(7) . . ?
F111 C216 F112 105.9(8) . . ?
F110 C216 F112 104.8(7) . . ?
F11 C216 C213 114.4(7) . . ?
F111 C216 C213 114.5(7) . . ?
F110 C216 C213 112.2(7) . . ?
F12 C216 C213 110.7(6) . . ?
F10 C216 C213 111.2(6) . . ?
F112 C216 C213 109.7(7) . . ?
C218 C217 C222 115.7(5) . . ?
C218 C217 B200 123.4(5) . . ?
C222 C217 B200 120.6(5) . . ?
C219 C218 C217 122.3(5) . . ?
C219 C218 H218 118.9 . . ?
C217 C218 H218 118.9 . . ?
C220 C219 C218 121.2(5) . . ?
C220 C219 C223 119.1(6) . . ?
C218 C219 C223 119.7(6) . . ?
C219 C220 C221 118.0(6) . . ?
C219 C220 H220 121.0 . . ?
C221 C220 H220 121.0 . . ?
C222 C221 C220 120.3(5) . . ?
C222 C221 C224 120.4(5) . . ?
C220 C221 C224 119.3(5) . . ?
C221 C222 C217 122.5(5) . . ?
C221 C222 H222 118.8 . . ?
C217 C222 H222 118.8 . . ?
F13 C223 F15 108.1(7) . . ?
F13 C223 F14 106.5(7) . . ?
F15 C223 F14 104.2(6) . . ?
F13 C223 C219 112.2(6) . . ?
F15 C223 C219 113.5(6) . . ?
F14 C223 C219 111.8(6) . . ?
F116 C224 F118 110.0(8) . . ?
F218 C224 F217 107.4(8) . . ?
F18 C224 F16 107.4(7) . . ?
F218 C224 F216 104.8(7) . . ?
F217 C224 F216 103.5(7) . . ?
F18 C224 F17 105.0(7) . . ?
F16 C224 F17 103.6(7) . . ?
F116 C224 F117 104.1(8) . . ?
F118 C224 F117 103.2(7) . . ?
F116 C224 C221 114.7(7) . . ?
F118 C224 C221 115.0(7) . . ?
F18 C224 C221 115.5(7) . . ?
F218 C224 C221 114.4(7) . . ?
F217 C224 C221 114.1(6) . . ?
F16 C224 C221 113.1(6) . . ?
F216 C224 C221 111.7(7) . . ?
F17 C224 C221 111.3(7) . . ?
F117 C224 C221 108.6(6) . . ?
C226 C225 C230 115.6(5) . . ?
C226 C225 B200 123.5(5) . . ?
C230 C225 B200 120.7(5) . . ?
C225 C226 C227 122.5(5) . . ?
C225 C226 H226 118.8 . . ?
C227 C226 H226 118.8 . . ?
C228 C227 C226 120.5(6) . . ?
C228 C227 C231 118.5(6) . . ?
C226 C227 C231 120.9(6) . . ?
C229 C228 C227 118.3(6) . . ?
C229 C228 H228 120.8 . . ?
C227 C228 H228 120.8 . . ?
C228 C229 C230 121.0(6) . . ?
C228 C229 C232 119.4(5) . . ?
C230 C229 C232 119.7(5) . . ?
C229 C230 C225 122.0(6) . . ?
C229 C230 H230 119.0 . . ?
C225 C230 H230 119.0 . . ?
F20 C231 F19 105.4(7) . . ?
F20 C231 F21 105.5(7) . . ?
F19 C231 F21 106.0(7) . . ?
F20 C231 C227 114.0(7) . . ?
F19 C231 C227 113.5(6) . . ?
F21 C231 C227 111.7(6) . . ?
F23 C232 F24 107.6(8) . . ?
F122 C232 F123 108.0(8) . . ?
F223 C232 F222 107.7(8) . . ?
F223 C232 F224 107.0(8) . . ?
F222 C232 F224 103.9(8) . . ?
F23 C232 F22 105.9(8) . . ?
F24 C232 F22 105.0(7) . . ?
F122 C232 F124 105.5(8) . . ?
F123 C232 F124 104.0(7) . . ?
F223 C232 C229 115.4(7) . . ?
F122 C232 C229 115.4(7) . . ?
F23 C232 C229 113.3(7) . . ?
F24 C232 C229 112.9(7) . . ?
F123 C232 C229 112.4(7) . . ?
F222 C232 C229 110.9(7) . . ?
F224 C232 C229 111.2(6) . . ?
F22 C232 C229 111.5(7) . . ?
F124 C232 C229 110.7(6) . . ?
C301 B300 C317 112.8(4) . . ?
C301 B300 C309 105.0(4) . . ?
C317 B300 C309 113.3(4) . . ?
C301 B300 C325 112.1(4) . . ?
C317 B300 C325 102.9(4) . . ?
C309 B300 C325 110.9(4) . . ?
C306 C301 C302 115.6(5) . . ?
C306 C301 B300 125.1(5) . . ?
C302 C301 B300 119.1(5) . . ?
C303 C302 C301 122.1(6) . . ?
C303 C302 H302 118.9 . . ?
C301 C302 H302 118.9 . . ?
C304 C303 C302 121.1(5) . . ?
C304 C303 C307 119.1(5) . . ?
C302 C303 C307 119.7(5) . . ?
C303 C304 C305 118.1(5) . . ?
C303 C304 H304 120.9 . . ?
C305 C304 H304 120.9 . . ?
C304 C305 C306 120.7(6) . . ?
C304 C305 C308 118.0(5) . . ?
C306 C305 C308 121.3(5) . . ?
C301 C306 C305 122.4(5) . . ?
C301 C306 H306 118.8 . . ?
C305 C306 H306 118.8 . . ?
F52 C307 F51 105.5(7) . . ?
F52 C307 F53 108.4(6) . . ?
F51 C307 F53 104.4(6) . . ?
F52 C307 C303 113.2(6) . . ?
F51 C307 C303 112.4(5) . . ?
F53 C307 C303 112.2(6) . . ?
F55 C308 F54 106.7(8) . . ?
F155 C308 F154 107.6(7) . . ?
F55 C308 F56 106.0(8) . . ?
F54 C308 F56 105.1(8) . . ?
F155 C308 F156 106.2(7) . . ?
F154 C308 F156 104.7(7) . . ?
F155 C308 C305 114.3(6) . . ?
F55 C308 C305 114.0(8) . . ?
F54 C308 C305 112.7(8) . . ?
F154 C308 C305 111.9(6) . . ?
F56 C308 C305 111.7(8) . . ?
F156 C308 C305 111.5(7) . . ?
C314 C309 C310 115.8(5) . . ?
C314 C309 B300 122.8(5) . . ?
C310 C309 B300 121.2(5) . . ?
C311 C310 C309 122.2(6) . . ?
C311 C310 H310 118.9 . . ?
C309 C310 H310 118.9 . . ?
C312 C311 C310 121.0(5) . . ?
C312 C311 C315 120.2(5) . . ?
C310 C311 C315 118.8(6) . . ?
C311 C312 C313 117.8(5) . . ?
C311 C312 H312 121.1 . . ?
C313 C312 H312 121.1 . . ?
C312 C313 C314 121.2(6) . . ?
C312 C313 C316 118.6(5) . . ?
C314 C313 C316 120.2(6) . . ?
C313 C314 C309 121.9(6) . . ?
C313 C314 H314 119.1 . . ?
C309 C314 H314 119.1 . . ?
F57 C315 F59 108.7(6) . . ?
F57 C315 F58 107.0(7) . . ?
F59 C315 F58 102.1(6) . . ?
F57 C315 C311 113.9(6) . . ?
F59 C315 C311 111.6(6) . . ?
F58 C315 C311 112.7(6) . . ?
F160 C316 F162 106.6(9) . . ?
F61 C316 F60 106.9(8) . . ?
F260 C316 F261 108.8(9) . . ?
F61 C316 F62 104.0(8) . . ?
F60 C316 F62 103.8(8) . . ?
F260 C316 F262 104.5(8) . . ?
F261 C316 F262 101.3(8) . . ?
F160 C316 F161 103.4(9) . . ?
F162 C316 F161 102.9(8) . . ?
F260 C316 C313 115.9(9) . . ?
F160 C316 C313 115.9(8) . . ?
F162 C316 C313 115.2(8) . . ?
F61 C316 C313 114.8(8) . . ?
F60 C316 C313 113.9(8) . . ?
F261 C316 C313 114.4(8) . . ?
F62 C316 C313 112.5(7) . . ?
F262 C316 C313 110.5(8) . . ?
F161 C316 C313 111.4(7) . . ?
C322 C317 C318 115.3(5) . . ?
C322 C317 B300 123.7(5) . . ?
C318 C317 B300 120.6(5) . . ?
C319 C318 C317 122.8(5) . . ?
C319 C318 H318 118.6 . . ?
C317 C318 H318 118.6 . . ?
C320 C319 C318 120.9(5) . . ?
C320 C319 C323 120.0(5) . . ?
C318 C319 C323 119.1(5) . . ?
C319 C320 C321 117.7(5) . . ?
C319 C320 H320 121.2 . . ?
C321 C320 H320 121.2 . . ?
C320 C321 C322 121.0(6) . . ?
C320 C321 C324 120.3(5) . . ?
C322 C321 C324 118.7(5) . . ?
C317 C322 C321 122.4(5) . . ?
C317 C322 H322 118.8 . . ?
C321 C322 H322 118.8 . . ?
F64 C323 F63 107.6(6) . . ?
F64 C323 F65 106.1(6) . . ?
F63 C323 F65 105.3(6) . . ?
F64 C323 C319 113.2(6) . . ?
F63 C323 C319 112.9(5) . . ?
F65 C323 C319 111.1(6) . . ?
F66 C324 F67 108.2(8) . . ?
F267 C324 F268 106.7(8) . . ?
F267 C324 F266 105.6(8) . . ?
F268 C324 F266 104.9(8) . . ?
F166 C324 F167 106.3(8) . . ?
F166 C324 F168 106.6(8) . . ?
F167 C324 F168 104.9(8) . . ?
F66 C324 F68 104.9(8) . . ?
F67 C324 F68 104.7(8) . . ?
F166 C324 C321 115.2(8) . . ?
F66 C324 C321 114.1(8) . . ?
F67 C324 C321 113.9(8) . . ?
F267 C324 C321 113.3(8) . . ?
F268 C324 C321 112.6(8) . . ?
F266 C324 C321 113.0(7) . . ?
F167 C324 C321 112.1(7) . . ?
F168 C324 C321 111.1(7) . . ?
F68 C324 C321 110.2(7) . . ?
C330 C325 C326 115.2(5) . . ?
C330 C325 B300 124.2(5) . . ?
C326 C325 B300 120.2(5) . . ?
C327 C326 C325 122.3(5) . . ?
C327 C326 H326 118.8 . . ?
C325 C326 H326 118.8 . . ?
C328 C327 C326 121.2(5) . . ?
C328 C327 C331 119.6(6) . . ?
C326 C327 C331 119.2(5) . . ?
C329 C328 C327 117.6(6) . . ?
C329 C328 H328 121.2 . . ?
C327 C328 H328 121.2 . . ?
C328 C329 C330 121.5(5) . . ?
C328 C329 C332 119.0(5) . . ?
C330 C329 C332 119.5(5) . . ?
C329 C330 C325 122.2(5) . . ?
C329 C330 H330 118.9 . . ?
C325 C330 H330 118.9 . . ?
F69 C331 F70 106.7(7) . . ?
F69 C331 F71 105.3(7) . . ?
F70 C331 F71 106.0(7) . . ?
F69 C331 C327 114.1(6) . . ?
F70 C331 C327 111.7(5) . . ?
F71 C331 C327 112.5(5) . . ?
F274 C332 F272 108.3(8) . . ?
F173 C332 F174 107.8(8) . . ?
F74 C332 F72 106.5(7) . . ?
F74 C332 F73 106.3(7) . . ?
F72 C332 F73 106.3(7) . . ?
F173 C332 F172 105.2(8) . . ?
F174 C332 F172 104.7(8) . . ?
F274 C332 F273 104.6(8) . . ?
F272 C332 F273 104.6(8) . . ?
F173 C332 C329 114.0(7) . . ?
F274 C332 C329 113.5(7) . . ?
F272 C332 C329 114.2(7) . . ?
F174 C332 C329 113.4(7) . . ?
F74 C332 C329 113.3(7) . . ?
F72 C332 C329 111.7(7) . . ?
F73 C332 C329 112.2(6) . . ?
F172 C332 C329 111.0(7) . . ?
F273 C332 C329 110.8(7) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 B1 C1 C6 -97.2(8) . . . . ?
N1 B1 C1 C2 87.8(8) . . . . ?
C6 C1 C2 C3 -1.6(11) . . . . ?
B1 C1 C2 C3 173.5(7) . . . . ?
C1 C2 C3 C4 0.2(14) . . . . ?
C2 C3 C4 C5 0.8(17) . . . . ?
C3 C4 C5 C6 -0.4(18) . . . . ?
C2 C1 C6 C5 2.0(12) . . . . ?
B1 C1 C6 C5 -173.3(8) . . . . ?
C4 C5 C6 C1 -1.1(16) . . . . ?
C1 B1 N1 C7 -178.4(7) . . . . ?
C1 B1 N1 C9 -58.5(9) . . . . ?
C1 B1 N1 C8 61.2(8) . . . . ?
C18 P1 C10 C11 164.4(5) . . . . ?
C14 P1 C10 C11 -88.4(6) . . . . ?
Rh1 P1 C10 C11 31.7(6) . . . . ?
P1 C10 C11 C12A 79(2) . . . . ?
P1 C10 C11 C13B -178.8(19) . . . . ?
P1 C10 C11 C13A -162.5(17) . . . . ?
P1 C10 C11 C12B 56.3(14) . . . . ?
C18 P1 C14 C15 56.7(6) . . . . ?
C10 P1 C14 C15 -48.6(6) . . . . ?
Rh1 P1 C14 C15 -178.3(4) . . . . ?
P1 C14 C15 C17 136.8(6) . . . . ?
P1 C14 C15 C16 -102.4(6) . . . . ?
C10 P1 C18 C19 175.6(5) . . . . ?
C14 P1 C18 C19 67.3(5) . . . . ?
Rh1 P1 C18 C19 -49.8(5) . . . . ?
P1 C18 C19 C21 77.5(7) . . . . ?
P1 C18 C19 C20 -159.7(5) . . . . ?
C30B P2 C22A C23A -84.4(15) . . . . ?
C26A P2 C22A C23A -165.1(7) . . . . ?
C22B P2 C22A C23A -17.7(19) . . . . ?
C26B P2 C22A C23A 174.7(13) . . . . ?
C30A P2 C22A C23A -61.7(7) . . . . ?
Rh1 P2 C22A C23A 72.5(7) . . . . ?
P2 C22A C23A C24A -85.3(8) . . . . ?
P2 C22A C23A C25A 151.7(7) . . . . ?
C30B P2 C22B C23B -159(2) . . . . ?
C26A P2 C22B C23B 117(2) . . . . ?
C22A P2 C22B C23B 77(3) . . . . ?
C26B P2 C22B C23B 89(3) . . . . ?
C30A P2 C22B C23B -147(3) . . . . ?
Rh1 P2 C22B C23B -24(3) . . . . ?
P2 C22B C23B C25B 163(2) . . . . ?
P2 C22B C23B C24B -71(3) . . . . ?
C30B P2 C26A C27A 152.0(13) . . . . ?
C22B P2 C26A C27A -105.3(13) . . . . ?
C22A P2 C26A C27A -88.1(8) . . . . ?
C26B P2 C26A C27A -51.7(16) . . . . ?
C30A P2 C26A C27A 167.7(8) . . . . ?
Rh1 P2 C26A C27A 35.5(9) . . . . ?
P2 C26A C27A C29A -164.7(9) . . . . ?
P2 C26A C27A C28A 68.7(11) . . . . ?
C30B P2 C30A C31A 86.1(19) . . . . ?
C26A P2 C30A C31A 54.1(8) . . . . ?
C22B P2 C30A C31A -70.8(12) . . . . ?
C22A P2 C30A C31A -52.4(8) . . . . ?
C26B P2 C30A C31A 28.3(13) . . . . ?
Rh1 P2 C30A C31A 179.0(6) . . . . ?
P2 C30A C31A C33A -110.4(9) . . . . ?
P2 C30A C31A C32A 127.9(8) . . . . ?
C26A P2 C30B C31B 63(3) . . . . ?
C22B P2 C30B C31B -60(3) . . . . ?
C22A P2 C30B C31B -34(3) . . . . ?
C26B P2 C30B C31B 50(3) . . . . ?
C30A P2 C30B C31B -84(3) . . . . ?
Rh1 P2 C30B C31B 170(2) . . . . ?
P2 C30B C31B C33B -152(3) . . . . ?
P2 C30B C31B C32B 89(3) . . . . ?
N2 B2 C51 C56 92.9(8) . . . . ?
N2 B2 C51 C52 -89.9(8) . . . . ?
C56 C51 C52 C53 0.9(11) . . . . ?
B2 C51 C52 C53 -176.4(7) . . . . ?
C51 C52 C53 C54 -0.9(13) . . . . ?
C52 C53 C54 C55 -0.2(17) . . . . ?
C53 C54 C55 C56 1.1(19) . . . . ?
C54 C55 C56 C51 -1.1(19) . . . . ?
C52 C51 C56 C55 0.1(14) . . . . ?
B2 C51 C56 C55 177.5(9) . . . . ?
C51 B2 N2 C57 -178.0(5) . . . . ?
C51 B2 N2 C59 -57.5(7) . . . . ?
C51 B2 N2 C58 62.9(7) . . . . ?
C68A P3 C60 C61 -69.6(6) . . . . ?
C64 P3 C60 C61 35.3(6) . . . . ?
Rh2 P3 C60 C61 163.4(4) . . . . ?
P3 C60 C61 C63 89.8(8) . . . . ?
P3 C60 C61 C62 -150.1(7) . . . . ?
C68A P3 C64 C65 -74.2(6) . . . . ?
C60 P3 C64 C65 176.1(5) . . . . ?
Rh2 P3 C64 C65 43.0(6) . . . . ?
P3 C64 C65 C66 -86.1(6) . . . . ?
P3 C64 C65 C67 150.4(6) . . . . ?
C64 P3 C68A C69A 166(2) . . . . ?
C60 P3 C68A C69A -87(2) . . . . ?
Rh2 P3 C68A C69A 47(2) . . . . ?
P3 C68A C69A C70A -144(4) . . . . ?
P3 C68A C69A C71A 81(5) . . . . ?
C80 P4 C72 C73 47.8(6) . . . . ?
C76A P4 C72 C73 -58.9(5) . . . . ?
Rh2 P4 C72 C73 177.2(4) . . . . ?
P4 C72 C73 C74 -75.1(8) . . . . ?
P4 C72 C73 C75 162.4(5) . . . . ?
C80 P4 C76A C77A 173.3(8) . . . . ?
C72 P4 C76A C77A -74.8(8) . . . . ?
Rh2 P4 C76A C77A 53.3(8) . . . . ?
P4 C76A C77A C79A -136.5(11) . . . . ?
P4 C76A C77A C78A 102.4(10) . . . . ?
C76A P4 C80 C81A -80.7(6) . . . . ?
C72 P4 C80 C81A 171.2(6) . . . . ?
Rh2 P4 C80 C81A 38.6(6) . . . . ?
P4 C80 C81A C83A 89.8(13) . . . . ?
P4 C80 C81A C82A -147.0(9) . . . . ?
C225 B200 C201 C202 -167.5(5) . . . . ?
C217 B200 C201 C202 70.6(6) . . . . ?
C209 B200 C201 C202 -50.4(7) . . . . ?
C225 B200 C201 C206 16.7(8) . . . . ?
C217 B200 C201 C206 -105.2(6) . . . . ?
C209 B200 C201 C206 133.7(6) . . . . ?
C206 C201 C202 C203 -0.4(9) . . . . ?
B200 C201 C202 C203 -176.6(5) . . . . ?
C201 C202 C203 C204 -3.2(9) . . . . ?
C201 C202 C203 C207 -179.1(5) . . . . ?
C202 C203 C204 C205 3.7(9) . . . . ?
C207 C203 C204 C205 179.6(6) . . . . ?
C203 C204 C205 C206 -0.6(9) . . . . ?
C203 C204 C205 C208 -177.5(5) . . . . ?
C204 C205 C206 C201 -3.1(10) . . . . ?
C208 C205 C206 C201 173.8(5) . . . . ?
C202 C201 C206 C205 3.5(9) . . . . ?
B200 C201 C206 C205 179.5(6) . . . . ?
C202 C203 C207 F3 83.4(8) . . . . ?
C204 C203 C207 F3 -92.6(8) . . . . ?
C202 C203 C207 F103 -116(2) . . . . ?
C204 C203 C207 F103 68(2) . . . . ?
C202 C203 C207 F1 -38.4(8) . . . . ?
C204 C203 C207 F1 145.7(7) . . . . ?
C202 C203 C207 F102 6(2) . . . . ?
C204 C203 C207 F102 -169(2) . . . . ?
C202 C203 C207 F2 -156.3(7) . . . . ?
C204 C203 C207 F2 27.7(9) . . . . ?
C202 C203 C207 F101 124(2) . . . . ?
C204 C203 C207 F101 -52(2) . . . . ?
C204 C205 C208 F5 -118.4(17) . . . . ?
C206 C205 C208 F5 64.6(17) . . . . ?
C204 C205 C208 F6 120.1(15) . . . . ?
C206 C205 C208 F6 -56.9(16) . . . . ?
C204 C205 C208 F106 -91.5(13) . . . . ?
C206 C205 C208 F106 91.5(13) . . . . ?
C204 C205 C208 F105 28.6(15) . . . . ?
C206 C205 C208 F105 -148.4(14) . . . . ?
C204 C205 C208 F104 148.3(15) . . . . ?
C206 C205 C208 F104 -28.6(15) . . . . ?
C204 C205 C208 F4 1.2(15) . . . . ?
C206 C205 C208 F4 -175.8(14) . . . . ?
C225 B200 C209 C210 98.9(6) . . . . ?
C217 B200 C209 C210 -140.7(5) . . . . ?
C201 B200 C209 C210 -24.5(7) . . . . ?
C225 B200 C209 C214 -71.6(6) . . . . ?
C217 B200 C209 C214 48.9(6) . . . . ?
C201 B200 C209 C214 165.1(5) . . . . ?
C214 C209 C210 C211 -0.6(8) . . . . ?
B200 C209 C210 C211 -171.5(5) . . . . ?
C209 C210 C211 C212 0.9(9) . . . . ?
C209 C210 C211 C215 178.3(5) . . . . ?
C210 C211 C212 C213 -0.8(8) . . . . ?
C215 C211 C212 C213 -178.2(5) . . . . ?
C211 C212 C213 C214 0.4(8) . . . . ?
C211 C212 C213 C216 178.8(5) . . . . ?
C212 C213 C214 C209 -0.1(9) . . . . ?
C216 C213 C214 C209 -178.5(5) . . . . ?
C210 C209 C214 C213 0.2(8) . . . . ?
B200 C209 C214 C213 171.4(5) . . . . ?
C212 C211 C215 F8 -9.0(15) . . . . ?
C210 C211 C215 F8 173.5(15) . . . . ?
C212 C211 C215 F107 83(2) . . . . ?
C210 C211 C215 F107 -94(2) . . . . ?
C212 C211 C215 F108 -153.4(18) . . . . ?
C210 C211 C215 F108 29.2(19) . . . . ?
C212 C211 C215 F7 -133.4(12) . . . . ?
C210 C211 C215 F7 49.2(14) . . . . ?
C212 C211 C215 F109 -36.2(19) . . . . ?
C210 C211 C215 F109 146.3(19) . . . . ?
C212 C211 C215 F9 110.6(12) . . . . ?
C210 C211 C215 F9 -66.9(13) . . . . ?
C214 C213 C216 F11 162.2(14) . . . . ?
C212 C213 C216 F11 -16.2(15) . . . . ?
C214 C213 C216 F111 16.2(16) . . . . ?
C212 C213 C216 F111 -162.2(15) . . . . ?
C214 C213 C216 F110 -108.9(16) . . . . ?
C212 C213 C216 F110 72.7(16) . . . . ?
C214 C213 C216 F12 -75.4(13) . . . . ?
C212 C213 C216 F12 106.2(13) . . . . ?
C214 C213 C216 F10 40.2(13) . . . . ?
C212 C213 C216 F10 -138.2(11) . . . . ?
C214 C213 C216 F112 135.1(14) . . . . ?
C212 C213 C216 F112 -43.3(14) . . . . ?
C225 B200 C217 C218 147.0(5) . . . . ?
C209 B200 C217 C218 31.4(7) . . . . ?
C201 B200 C217 C218 -89.3(6) . . . . ?
C225 B200 C217 C222 -39.9(6) . . . . ?
C209 B200 C217 C222 -155.6(5) . . . . ?
C201 B200 C217 C222 83.8(6) . . . . ?
C222 C217 C218 C219 0.2(7) . . . . ?
B200 C217 C218 C219 173.5(5) . . . . ?
C217 C218 C219 C220 1.1(8) . . . . ?
C217 C218 C219 C223 -177.7(5) . . . . ?
C218 C219 C220 C221 -1.2(8) . . . . ?
C223 C219 C220 C221 177.7(6) . . . . ?
C219 C220 C221 C222 -0.1(8) . . . . ?
C219 C220 C221 C224 179.6(5) . . . . ?
C220 C221 C222 C217 1.4(8) . . . . ?
C224 C221 C222 C217 -178.2(5) . . . . ?
C218 C217 C222 C221 -1.4(7) . . . . ?
B200 C217 C222 C221 -175.0(5) . . . . ?
C220 C219 C223 F13 -116.7(7) . . . . ?
C218 C219 C223 F13 62.2(8) . . . . ?
C220 C219 C223 F15 6.2(9) . . . . ?
C218 C219 C223 F15 -174.9(6) . . . . ?
C220 C219 C223 F14 123.8(7) . . . . ?
C218 C219 C223 F14 -57.4(8) . . . . ?
C222 C221 C224 F116 -59.5(12) . . . . ?
C220 C221 C224 F116 120.9(12) . . . . ?
C222 C221 C224 F118 171.4(11) . . . . ?
C220 C221 C224 F118 -8.3(12) . . . . ?
C222 C221 C224 F18 14.1(11) . . . . ?
C220 C221 C224 F18 -165.5(10) . . . . ?
C222 C221 C224 F218 112.5(11) . . . . ?
C220 C221 C224 F218 -67.2(11) . . . . ?
C222 C221 C224 F217 -11.8(10) . . . . ?
C220 C221 C224 F217 168.6(9) . . . . ?
C222 C221 C224 F16 138.4(8) . . . . ?
C220 C221 C224 F16 -41.2(9) . . . . ?
C222 C221 C224 F216 -128.7(10) . . . . ?
C220 C221 C224 F216 51.7(10) . . . . ?
C222 C221 C224 F17 -105.4(9) . . . . ?
C220 C221 C224 F17 74.9(9) . . . . ?
C222 C221 C224 F117 56.5(11) . . . . ?
C220 C221 C224 F117 -123.2(10) . . . . ?
C217 B200 C225 C226 152.3(5) . . . . ?
C209 B200 C225 C226 -86.9(6) . . . . ?
C201 B200 C225 C226 34.6(7) . . . . ?
C217 B200 C225 C230 -33.0(7) . . . . ?
C209 B200 C225 C230 87.8(6) . . . . ?
C201 B200 C225 C230 -150.6(5) . . . . ?
C230 C225 C226 C227 3.8(8) . . . . ?
B200 C225 C226 C227 178.8(5) . . . . ?
C225 C226 C227 C228 -3.6(9) . . . . ?
C225 C226 C227 C231 172.9(6) . . . . ?
C226 C227 C228 C229 0.4(9) . . . . ?
C231 C227 C228 C229 -176.2(6) . . . . ?
C227 C228 C229 C230 2.4(9) . . . . ?
C227 C228 C229 C232 -177.9(5) . . . . ?
C228 C229 C230 C225 -2.1(9) . . . . ?
C232 C229 C230 C225 178.2(5) . . . . ?
C226 C225 C230 C229 -1.0(8) . . . . ?
B200 C225 C230 C229 -176.1(5) . . . . ?
C228 C227 C231 F20 -46.0(10) . . . . ?
C226 C227 C231 F20 137.4(7) . . . . ?
C228 C227 C231 F19 -166.7(7) . . . . ?
C226 C227 C231 F19 16.7(10) . . . . ?
C228 C227 C231 F21 73.5(9) . . . . ?
C226 C227 C231 F21 -103.1(8) . . . . ?
C228 C229 C232 F223 -14.7(15) . . . . ?
C230 C229 C232 F223 165.0(14) . . . . ?
C228 C229 C232 F122 -176.9(13) . . . . ?
C230 C229 C232 F122 2.8(13) . . . . ?
C228 C229 C232 F23 -92.4(13) . . . . ?
C230 C229 C232 F23 87.3(13) . . . . ?
C228 C229 C232 F24 144.9(12) . . . . ?
C230 C229 C232 F24 -35.4(12) . . . . ?
C228 C229 C232 F123 58.6(13) . . . . ?
C230 C229 C232 F123 -121.7(12) . . . . ?
C228 C229 C232 F222 108.1(13) . . . . ?
C230 C229 C232 F222 -72.2(13) . . . . ?
C228 C229 C232 F224 -136.7(12) . . . . ?
C230 C229 C232 F224 42.9(13) . . . . ?
C228 C229 C232 F22 27.0(11) . . . . ?
C230 C229 C232 F22 -153.3(10) . . . . ?
C228 C229 C232 F124 -57.2(12) . . . . ?
C230 C229 C232 F124 122.4(11) . . . . ?
C317 B300 C301 C306 20.2(7) . . . . ?
C309 B300 C301 C306 -103.7(6) . . . . ?
C325 B300 C301 C306 135.8(5) . . . . ?
C317 B300 C301 C302 -164.8(5) . . . . ?
C309 B300 C301 C302 71.3(6) . . . . ?
C325 B300 C301 C302 -49.2(6) . . . . ?
C306 C301 C302 C303 0.2(8) . . . . ?
B300 C301 C302 C303 -175.2(5) . . . . ?
C301 C302 C303 C304 -1.0(9) . . . . ?
C301 C302 C303 C307 -179.2(6) . . . . ?
C302 C303 C304 C305 0.8(9) . . . . ?
C307 C303 C304 C305 179.0(6) . . . . ?
C303 C304 C305 C306 0.1(9) . . . . ?
C303 C304 C305 C308 -177.4(5) . . . . ?
C302 C301 C306 C305 0.7(8) . . . . ?
B300 C301 C306 C305 175.8(5) . . . . ?
C304 C305 C306 C301 -0.9(9) . . . . ?
C308 C305 C306 C301 176.5(5) . . . . ?
C304 C303 C307 F52 -94.9(8) . . . . ?
C302 C303 C307 F52 83.3(8) . . . . ?
C304 C303 C307 F51 145.6(7) . . . . ?
C302 C303 C307 F51 -36.2(9) . . . . ?
C304 C303 C307 F53 28.2(9) . . . . ?
C302 C303 C307 F53 -153.6(6) . . . . ?
C304 C305 C308 F155 174.1(13) . . . . ?
C306 C305 C308 F155 -3.3(15) . . . . ?
C304 C305 C308 F55 -37.0(19) . . . . ?
C306 C305 C308 F55 145.5(18) . . . . ?
C304 C305 C308 F54 -158.9(17) . . . . ?
C306 C305 C308 F54 23.6(18) . . . . ?
C304 C305 C308 F154 51.5(13) . . . . ?
C306 C305 C308 F154 -126.0(13) . . . . ?
C304 C305 C308 F56 83.1(19) . . . . ?
C306 C305 C308 F56 -94.4(19) . . . . ?
C304 C305 C308 F156 -65.4(13) . . . . ?
C306 C305 C308 F156 117.1(13) . . . . ?
C301 B300 C309 C314 84.9(6) . . . . ?
C317 B300 C309 C314 -38.6(7) . . . . ?
C325 B300 C309 C314 -153.8(5) . . . . ?
C301 B300 C309 C310 -89.5(6) . . . . ?
C317 B300 C309 C310 146.9(5) . . . . ?
C325 B300 C309 C310 31.8(7) . . . . ?
C314 C309 C310 C311 0.7(8) . . . . ?
B300 C309 C310 C311 175.5(5) . . . . ?
C309 C310 C311 C312 1.2(9) . . . . ?
C309 C310 C311 C315 -178.3(5) . . . . ?
C310 C311 C312 C313 -0.8(10) . . . . ?
C315 C311 C312 C313 178.7(6) . . . . ?
C311 C312 C313 C314 -1.5(10) . . . . ?
C311 C312 C313 C316 179.4(6) . . . . ?
C312 C313 C314 C309 3.6(11) . . . . ?
C316 C313 C314 C309 -177.4(6) . . . . ?
C310 C309 C314 C313 -3.0(9) . . . . ?
B300 C309 C314 C313 -177.7(6) . . . . ?
C312 C311 C315 F57 19.3(10) . . . . ?
C310 C311 C315 F57 -161.1(7) . . . . ?
C312 C311 C315 F59 -104.2(7) . . . . ?
C310 C311 C315 F59 75.3(8) . . . . ?
C312 C311 C315 F58 141.5(7) . . . . ?
C310 C311 C315 F58 -38.9(8) . . . . ?
C312 C313 C316 F260 -128.1(12) . . . . ?
C314 C313 C316 F260 52.9(13) . . . . ?
C312 C313 C316 F160 -174.2(12) . . . . ?
C314 C313 C316 F160 6.7(13) . . . . ?
C312 C313 C316 F162 60.4(13) . . . . ?
C314 C313 C316 F162 -118.7(13) . . . . ?
C312 C313 C316 F61 91.6(10) . . . . ?
C314 C313 C316 F61 -87.4(10) . . . . ?
C312 C313 C316 F60 -32.0(12) . . . . ?
C314 C313 C316 F60 148.9(11) . . . . ?
C312 C313 C316 F261 -0.2(12) . . . . ?
C314 C313 C316 F261 -179.2(11) . . . . ?
C312 C313 C316 F62 -149.8(9) . . . . ?
C314 C313 C316 F62 31.2(11) . . . . ?
C312 C313 C316 F262 113.3(10) . . . . ?
C314 C313 C316 F262 -65.7(11) . . . . ?
C312 C313 C316 F161 -56.4(12) . . . . ?
C314 C313 C316 F161 124.6(11) . . . . ?
C301 B300 C317 C322 -143.6(6) . . . . ?
C309 B300 C317 C322 -24.4(8) . . . . ?
C325 B300 C317 C322 95.4(6) . . . . ?
C301 B300 C317 C318 44.2(7) . . . . ?
C309 B300 C317 C318 163.4(5) . . . . ?
C325 B300 C317 C318 -76.8(6) . . . . ?
C322 C317 C318 C319 2.5(9) . . . . ?
B300 C317 C318 C319 175.3(5) . . . . ?
C317 C318 C319 C320 -0.2(10) . . . . ?
C317 C318 C319 C323 -178.6(6) . . . . ?
C318 C319 C320 C321 -1.7(10) . . . . ?
C323 C319 C320 C321 176.7(7) . . . . ?
C319 C320 C321 C322 1.3(10) . . . . ?
C319 C320 C321 C324 -176.2(6) . . . . ?
C318 C317 C322 C321 -2.9(9) . . . . ?
B300 C317 C322 C321 -175.4(6) . . . . ?
C320 C321 C322 C317 1.1(11) . . . . ?
C324 C321 C322 C317 178.6(6) . . . . ?
C320 C319 C323 F64 13.0(10) . . . . ?
C318 C319 C323 F64 -168.6(6) . . . . ?
C320 C319 C323 F63 135.7(7) . . . . ?
C318 C319 C323 F63 -45.9(9) . . . . ?
C320 C319 C323 F65 -106.3(7) . . . . ?
C318 C319 C323 F65 72.1(8) . . . . ?
C320 C321 C324 F166 137.4(12) . . . . ?
C322 C321 C324 F166 -40.2(13) . . . . ?
C320 C321 C324 F66 -7.4(12) . . . . ?
C322 C321 C324 F66 175.1(10) . . . . ?
C320 C321 C324 F67 -132.3(10) . . . . ?
C322 C321 C324 F67 50.2(11) . . . . ?
C320 C321 C324 F267 -35.6(13) . . . . ?
C322 C321 C324 F267 146.8(12) . . . . ?
C320 C321 C324 F268 85.6(12) . . . . ?
C322 C321 C324 F268 -91.9(12) . . . . ?
C320 C321 C324 F266 -155.7(11) . . . . ?
C322 C321 C324 F266 26.8(12) . . . . ?
C320 C321 C324 F167 15.7(12) . . . . ?
C322 C321 C324 F167 -161.9(11) . . . . ?
C320 C321 C324 F168 -101.3(12) . . . . ?
C322 C321 C324 F168 81.2(12) . . . . ?
C320 C321 C324 F68 110.4(9) . . . . ?
C322 C321 C324 F68 -67.2(9) . . . . ?
C301 B300 C325 C330 -24.4(7) . . . . ?
C317 B300 C325 C330 97.1(6) . . . . ?
C309 B300 C325 C330 -141.4(5) . . . . ?
C301 B300 C325 C326 162.2(4) . . . . ?
C317 B300 C325 C326 -76.3(5) . . . . ?
C309 B300 C325 C326 45.2(6) . . . . ?
C330 C325 C326 C327 -0.2(8) . . . . ?
B300 C325 C326 C327 173.8(5) . . . . ?
C325 C326 C327 C328 0.1(8) . . . . ?
C325 C326 C327 C331 179.2(5) . . . . ?
C326 C327 C328 C329 0.5(8) . . . . ?
C331 C327 C328 C329 -178.7(5) . . . . ?
C327 C328 C329 C330 -0.9(8) . . . . ?
C327 C328 C329 C332 179.7(5) . . . . ?
C328 C329 C330 C325 0.8(9) . . . . ?
C332 C329 C330 C325 -179.8(5) . . . . ?
C326 C325 C330 C329 -0.3(8) . . . . ?
B300 C325 C330 C329 -174.0(5) . . . . ?
C328 C327 C331 F69 -10.4(9) . . . . ?
C326 C327 C331 F69 170.5(7) . . . . ?
C328 C327 C331 F70 110.8(7) . . . . ?
C326 C327 C331 F70 -68.4(8) . . . . ?
C328 C327 C331 F71 -130.2(7) . . . . ?
C326 C327 C331 F71 50.6(8) . . . . ?
C328 C329 C332 F173 73.6(11) . . . . ?
C330 C329 C332 F173 -105.7(11) . . . . ?
C328 C329 C332 F274 -112.8(11) . . . . ?
C330 C329 C332 F274 67.8(11) . . . . ?
C328 C329 C332 F272 12.0(11) . . . . ?
C330 C329 C332 F272 -167.4(11) . . . . ?
C328 C329 C332 F174 -162.5(10) . . . . ?
C330 C329 C332 F174 18.1(11) . . . . ?
C328 C329 C332 F74 -18.8(10) . . . . ?
C330 C329 C332 F74 161.8(9) . . . . ?
C328 C329 C332 F72 101.5(9) . . . . ?
C330 C329 C332 F72 -77.9(9) . . . . ?
C328 C329 C332 F73 -139.3(8) . . . . ?
C330 C329 C332 F73 41.3(9) . . . . ?
C328 C329 C332 F172 -44.9(11) . . . . ?
C330 C329 C332 F172 135.7(10) . . . . ?
C328 C329 C332 F273 129.9(10) . . . . ?
C330 C329 C332 F273 -49.5(11) . . . . ?

_refine_diff_density_max         0.579
_refine_diff_density_min         -1.076
_refine_diff_density_rms         0.060

_vrf_PLAT213_3                   
; 
PROBLEM: Fxx has ADP max/min Ratio ..... x.x prolat
RESPONSE: The anion CF3 groups contain a significant degree 
of disorder. Attempts have been made to model the disorder but
some ellipsoids are still prolate.
See _refine_special_details. 
;

_vrf_PLAT090_3                   
; 
PROBLEM: Poor Data / Parameter Ratio (Zmax > 18) ... 6.67 Note
RESPONSE: The structure has a significant degree of disorder in
both phosphine ligands and CF3 groups of the anions. Disorder
has been modelled and restraints applied where neccessary.
See _refine_special_details. 
;

_shelxl_version_number           2014-3


_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: 1,2-difluorobenzene/pentane'
_chemical_properties_physical    
'Air-sensitive, Moisture-sensitive, Oxygen-sensitive'
####################################################################### 
# 
# 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_4
_database_code_depnum_ccdc_archive 'CCDC 1445278'
_audit_update_record             
;
2016-02-18 deposited with the CCDC.
2016-02-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014
_chemical_formula_moiety         'C32 H12 B F24, C38 H46 B N P2 Rh'
_chemical_formula_sum            'C70 H58 B2 F24 N P2 Rh'
_chemical_formula_weight         1555.64

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'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'

_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                   13.050(3)
_cell_length_b                   13.326(3)
_cell_length_c                   20.491(4)
_cell_angle_alpha                104.04(3)
_cell_angle_beta                 94.17(3)
_cell_angle_gamma                95.59(3)
_cell_volume                     3423.4(13)
_cell_formula_units_Z            2
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    15028
_cell_measurement_theta_min      5.097
_cell_measurement_theta_max      27.485

_exptl_crystal_description       block
_exptl_crystal_colour            red
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.509
_exptl_crystal_F_000             1572
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.55
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.22
_exptl_absorpt_coefficient_mu    0.404
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.8953
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_process_details   'Denzo/Scalepack (Otwinowski & Minor 1997)'

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  'horizonally mounted graphite crystal'
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_device       '95mm CCD camera on κ-goniostat'
_diffrn_measurement_method       CCD
_diffrn_detector_area_resol_mean 9
_diffrn_reflns_number            28059
_diffrn_reflns_av_unetI/netI     0.0387
_diffrn_reflns_av_R_equivalents  0.0233
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         5.122
_diffrn_reflns_theta_max         27.504
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measured_fraction_theta_full 0.991
_diffrn_reflns_Laue_measured_fraction_max 0.992
_diffrn_reflns_Laue_measured_fraction_full 0.991
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_point_group_measured_fraction_full 0.991
_reflns_number_total             15589
_reflns_number_gt                13130
_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       'Collect (Nonius BV, 1997-2000)'
_computing_cell_refinement       'Denzo/Scalepack (Otwinowski & Minor 1997)'
_computing_data_reduction        'Denzo/Scalepack (Otwinowski & Minor 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Several of the CF3 groups of the [BArF4]- anion have significant 
 disorder. 3 groups were modelled as disordered over 2 sites and 
 1 over 3 sites. All F atoms were also described by the ISOR and 
 SIMU commands. In spite of this modelling some of the F atom 
 ellipsoids remain prolate but further attempts to model were not
 successful.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0623P)²+5.2958P] 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         15589
_refine_ls_number_parameters     1042
_refine_ls_number_restraints     648
_refine_ls_R_factor_all          0.0511
_refine_ls_R_factor_gt           0.0393
_refine_ls_wR_factor_ref         0.1061
_refine_ls_wR_factor_gt          0.0968
_refine_ls_goodness_of_fit_ref   0.838
_refine_ls_restrained_S_all      0.909
_refine_ls_shift/su_max          0.008
_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
Rh1 Rh 0.88834(2) -0.06063(2) 0.74808(2) 0.01949(6) Uani 1 1 d . . . . .
B1 B 0.7718(2) 0.1298(2) 0.67396(14) 0.0290(5) Uani 1 1 d . . . . .
H1A H 0.8305 0.1417 0.6476 0.035 Uiso 1 1 calc R U . . .
H1B H 0.7834 0.1821 0.7181 0.035 Uiso 1 1 calc R U . . .
C1 C 0.76721(16) 0.01450(17) 0.68597(11) 0.0231(4) Uani 1 1 d . . . . .
C2 C 0.72173(16) -0.01346(19) 0.74053(12) 0.0271(5) Uani 1 1 d . . . . .
H2 H 0.7022 0.0430 0.7778 0.032 Uiso 1 1 calc R U . . .
C3 C 0.71589(17) -0.1160(2) 0.74896(13) 0.0318(5) Uani 1 1 d . . . . .
H3 H 0.6907 -0.1302 0.7912 0.038 Uiso 1 1 calc R U . . .
C4 C 0.75186(19) -0.19659(19) 0.70157(14) 0.0354(6) Uani 1 1 d . . . . .
H4 H 0.7542 -0.2669 0.7105 0.042 Uiso 1 1 calc R U . . .
C5 C 0.80310(19) -0.17069(19) 0.64960(13) 0.0321(5) Uani 1 1 d . . . . .
H5 H 0.8408 -0.2233 0.6203 0.038 Uiso 1 1 calc R U . . .
C6 C 0.81215(17) -0.06665(18) 0.64341(11) 0.0270(5) Uani 1 1 d . . . . .
H6 H 0.8570 -0.0483 0.6095 0.032 Uiso 1 1 calc R U . . .
N1 N 0.66376(16) 0.14414(16) 0.63314(11) 0.0318(4) Uani 1 1 d . . . . .
C7 C 0.5752(2) 0.1355(3) 0.67374(17) 0.0478(7) Uani 1 1 d . . . . .
H7A H 0.5122 0.1476 0.6493 0.072 Uiso 1 1 calc R U . . .
H7B H 0.5889 0.1875 0.7173 0.072 Uiso 1 1 calc R U . . .
H7C H 0.5661 0.0656 0.6815 0.072 Uiso 1 1 calc R U . . .
C8 C 0.6425(2) 0.0668(2) 0.56687(14) 0.0441(6) Uani 1 1 d . . . . .
H8A H 0.5784 0.0785 0.5434 0.066 Uiso 1 1 calc R U . . .
H8B H 0.6352 -0.0036 0.5739 0.066 Uiso 1 1 calc R U . . .
H8C H 0.7000 0.0744 0.5395 0.066 Uiso 1 1 calc R U . . .
C9 C 0.6741(3) 0.2503(2) 0.62087(19) 0.0525(8) Uani 1 1 d . . . . .
H9A H 0.7320 0.2575 0.5937 0.079 Uiso 1 1 calc R U . . .
H9B H 0.6872 0.3027 0.6642 0.079 Uiso 1 1 calc R U . . .
H9C H 0.6100 0.2605 0.5966 0.079 Uiso 1 1 calc R U . . .
P1 P 0.93558(4) -0.01719(4) 0.85965(3) 0.02393(12) Uani 1 1 d . . . . .
C10 C 1.04415(19) -0.06739(19) 0.89836(11) 0.0299(5) Uani 1 1 d . . . . .
H10A H 1.1089 -0.0310 0.8886 0.036 Uiso 1 1 calc R U . . .
H10B H 1.0417 -0.0470 0.9480 0.036 Uiso 1 1 calc R U . . .
C11 C 1.0523(2) -0.1852(2) 0.87776(13) 0.0359(5) Uani 1 1 d . . . . .
H11A H 1.1139 -0.1985 0.9041 0.043 Uiso 1 1 calc R U . . .
H11B H 0.9910 -0.2215 0.8916 0.043 Uiso 1 1 calc R U . . .
C12 C 1.0600(2) -0.2347(2) 0.80325(14) 0.0406(6) Uani 1 1 d . . . . .
H12A H 1.0599 -0.3106 0.7975 0.049 Uiso 1 1 calc R U . . .
H12B H 0.9966 -0.2245 0.7772 0.049 Uiso 1 1 calc R U . . .
C13 C 1.1516(2) -0.1965(2) 0.77181(15) 0.0427(6) Uani 1 1 d . . . . .
H13A H 1.1512 -0.2435 0.7262 0.051 Uiso 1 1 calc R U . . .
H13B H 1.2148 -0.2047 0.7989 0.051 Uiso 1 1 calc R U . . .
C14 C 1.16179(18) -0.0843(2) 0.76428(13) 0.0335(5) Uani 1 1 d . . . . .
H14A H 1.2218 -0.0759 0.7384 0.040 Uiso 1 1 calc R U . . .
H14B H 1.1798 -0.0377 0.8101 0.040 Uiso 1 1 calc R U . . .
C15 C 0.83107(19) -0.0555(2) 0.90733(12) 0.0319(5) Uani 1 1 d . . . . .
C16 C 0.7907(2) 0.0165(2) 0.95758(12) 0.0388(6) Uani 1 1 d . . . . .
H16 H 0.8147 0.0886 0.9666 0.047 Uiso 1 1 calc R U . . .
C17 C 0.7155(2) -0.0181(3) 0.99423(15) 0.0532(8) Uani 1 1 d . . . . .
H17 H 0.6883 0.0310 1.0284 0.064 Uiso 1 1 calc R U . . .
C18 C 0.6798(2) -0.1215(3) 0.98209(16) 0.0578(9) Uani 1 1 d . . . . .
H18 H 0.6290 -0.1438 1.0082 0.069 Uiso 1 1 calc R U . . .
C19 C 0.7178(2) -0.1939(3) 0.93158(17) 0.0534(8) Uani 1 1 d . . . . .
H19 H 0.6926 -0.2657 0.9226 0.064 Uiso 1 1 calc R U . . .
C20 C 0.7932(2) -0.1603(2) 0.89411(14) 0.0419(6) Uani 1 1 d . . . . .
H20 H 0.8188 -0.2095 0.8593 0.050 Uiso 1 1 calc R U . . .
C21 C 0.9640(2) 0.12300(18) 0.89619(11) 0.0314(5) Uani 1 1 d . . . . .
C22 C 0.8948(3) 0.1870(2) 0.87824(14) 0.0458(7) Uani 1 1 d . . . . .
H22 H 0.8347 0.1569 0.8483 0.055 Uiso 1 1 calc R U . . .
C23 C 0.9125(3) 0.2943(2) 0.90362(16) 0.0593(9) Uani 1 1 d . . . . .
H23 H 0.8642 0.3372 0.8915 0.071 Uiso 1 1 calc R U . . .
C24 C 1.0001(3) 0.3386(2) 0.94631(17) 0.0609(9) Uani 1 1 d . . . . .
H24 H 1.0129 0.4121 0.9630 0.073 Uiso 1 1 calc R U . . .
C25 C 1.0689(3) 0.2765(2) 0.96472(18) 0.0580(8) Uani 1 1 d . . . . .
H25 H 1.1292 0.3075 0.9942 0.070 Uiso 1 1 calc R U . . .
C26 C 1.0514(2) 0.1691(2) 0.94071(14) 0.0418(6) Uani 1 1 d . . . . .
H26 H 1.0988 0.1268 0.9546 0.050 Uiso 1 1 calc R U . . .
P2 P 1.05273(4) -0.03506(4) 0.72422(3) 0.02168(11) Uani 1 1 d . . . . .
C27 C 1.06313(17) -0.09185(18) 0.63442(11) 0.0251(4) Uani 1 1 d . . . . .
C28 C 1.0475(2) -0.19955(19) 0.60949(13) 0.0344(5) Uani 1 1 d . . . . .
H28 H 1.0318 -0.2423 0.6393 0.041 Uiso 1 1 calc R U . . .
C29 C 1.0545(2) -0.2456(2) 0.54179(14) 0.0399(6) Uani 1 1 d . . . . .
H29 H 1.0445 -0.3193 0.5256 0.048 Uiso 1 1 calc R U . . .
C30 C 1.0759(2) -0.1839(2) 0.49780(13) 0.0374(6) Uani 1 1 d . . . . .
H30 H 1.0806 -0.2151 0.4514 0.045 Uiso 1 1 calc R U . . .
C31 C 1.0903(2) -0.0776(2) 0.52164(13) 0.0366(6) Uani 1 1 d . . . . .
H31 H 1.1043 -0.0354 0.4913 0.044 Uiso 1 1 calc R U . . .
C32 C 1.08462(19) -0.03051(19) 0.58970(12) 0.0304(5) Uani 1 1 d . . . . .
H32 H 1.0954 0.0432 0.6056 0.037 Uiso 1 1 calc R U . . .
C33 C 1.10498(18) 0.10142(18) 0.73734(12) 0.0282(5) Uani 1 1 d . . . . .
C34 C 1.0384(2) 0.17708(19) 0.74779(13) 0.0355(5) Uani 1 1 d . . . . .
H34 H 0.9663 0.1575 0.7472 0.043 Uiso 1 1 calc R U . . .
C35 C 1.0764(3) 0.2818(2) 0.75922(16) 0.0468(7) Uani 1 1 d . . . . .
H35 H 1.0302 0.3334 0.7670 0.056 Uiso 1 1 calc R U . . .
C36 C 1.1799(3) 0.3109(2) 0.75929(15) 0.0490(7) Uani 1 1 d . . . . .
H36 H 1.2055 0.3825 0.7675 0.059 Uiso 1 1 calc R U . . .
C37 C 1.2463(3) 0.2366(3) 0.74751(18) 0.0556(8) Uani 1 1 d . . . . .
H37 H 1.3180 0.2567 0.7469 0.067 Uiso 1 1 calc R U . . .
C38 C 1.2095(2) 0.1323(2) 0.73649(17) 0.0480(7) Uani 1 1 d . . . . .
H38 H 1.2563 0.0813 0.7283 0.058 Uiso 1 1 calc R U . . .
B200 B 0.55446(18) 0.43895(18) 0.27027(12) 0.0218(5) Uani 1 1 d . . . . .
C201 C 0.56282(16) 0.31585(16) 0.26748(11) 0.0225(4) Uani 1 1 d . . . . .
C202 C 0.58581(16) 0.28522(17) 0.32677(11) 0.0240(4) Uani 1 1 d . . . . .
H202 H 0.6002 0.3372 0.3682 0.029 Uiso 1 1 calc R U . . .
C203 C 0.58841(16) 0.18102(17) 0.32751(11) 0.0243(4) Uani 1 1 d . . . . .
C204 C 0.56960(16) 0.10310(17) 0.26826(12) 0.0249(4) Uani 1 1 d . . . . .
H204 H 0.5720 0.0322 0.2685 0.030 Uiso 1 1 calc R U . . .
C205 C 0.54690(16) 0.13160(17) 0.20807(11) 0.0239(4) Uani 1 1 d . . . . .
C206 C 0.54211(16) 0.23522(17) 0.20799(11) 0.0229(4) Uani 1 1 d . . . . .
H206 H 0.5243 0.2521 0.1665 0.027 Uiso 1 1 calc R U . . .
C207 C 0.6110(2) 0.15325(19) 0.39333(13) 0.0324(5) Uani 1 1 d . . . . .
F1 F 0.6833(2) 0.21743(17) 0.43383(11) 0.0859(8) Uani 1 1 d . U . . .
F2 F 0.52955(18) 0.1501(3) 0.42628(12) 0.0975(10) Uani 1 1 d . U . . .
F3 F 0.6422(2) 0.06009(16) 0.38556(10) 0.0797(7) Uani 1 1 d . U . . .
C208 C 0.52855(18) 0.04695(18) 0.14403(12) 0.0305(5) Uani 1 1 d . . . . .
F4 F 0.60075(14) -0.01845(13) 0.13959(8) 0.0483(4) Uani 1 1 d . U . . .
F5 F 0.53006(13) 0.08269(12) 0.08862(7) 0.0435(4) Uani 1 1 d . U . . .
F6 F 0.43738(14) -0.01111(14) 0.13839(9) 0.0565(5) Uani 1 1 d . U . . .
C209 C 0.64387(16) 0.51439(16) 0.32587(11) 0.0225(4) Uani 1 1 d . . . . .
C210 C 0.74456(17) 0.48679(17) 0.33181(11) 0.0246(4) Uani 1 1 d . . . . .
H210 H 0.7579 0.4201 0.3070 0.030 Uiso 1 1 calc R U . . .
C211 C 0.82500(16) 0.55311(17) 0.37241(11) 0.0246(4) Uani 1 1 d . . . . .
C212 C 0.80907(17) 0.65137(17) 0.40994(12) 0.0268(5) Uani 1 1 d . . . . .
H212 H 0.8642 0.6971 0.4379 0.032 Uiso 1 1 calc R U . . .
C213 C 0.71064(17) 0.68021(17) 0.40531(11) 0.0261(4) Uani 1 1 d D . . . .
C214 C 0.62973(17) 0.61316(17) 0.36389(11) 0.0256(4) Uani 1 1 d . . . . .
H214 H 0.5630 0.6356 0.3616 0.031 Uiso 1 1 calc R U . . .
C215 C 0.93092(18) 0.52036(19) 0.37728(14) 0.0335(5) Uani 1 1 d . . . . .
F7 F 0.95491(16) 0.4977(2) 0.43644(12) 0.0747(6) Uani 1 1 d . U . . .
F8 F 0.94460(13) 0.43803(15) 0.32951(11) 0.0689(6) Uani 1 1 d . U . . .
F9 F 1.00522(12) 0.59554(13) 0.37630(11) 0.0593(5) Uani 1 1 d . U . . .
C216 C 0.69039(18) 0.78508(19) 0.44526(13) 0.0382(6) Uani 1 1 d D . . . .
F10 F 0.7635(5) 0.8355(5) 0.4900(4) 0.0544(19) Uani 0.518(14) 1 d D U P A 1
F11 F 0.6793(6) 0.8495(4) 0.4020(3) 0.0510(15) Uani 0.518(14) 1 d D U P A 1
F12 F 0.6005(4) 0.7851(4) 0.4700(5) 0.065(2) Uani 0.518(14) 1 d D U P A 1
F110 F 0.6344(9) 0.8356(5) 0.4150(4) 0.092(3) Uani 0.482(14) 1 d D U P A 2
F111 F 0.6438(8) 0.7747(4) 0.5018(4) 0.078(3) Uani 0.482(14) 1 d D U P A 2
F112 F 0.7774(4) 0.8453(5) 0.4733(4) 0.0488(19) Uani 0.482(14) 1 d D U P A 2
C217 C 0.43700(17) 0.45789(16) 0.29043(11) 0.0239(4) Uani 1 1 d . . . . .
C218 C 0.41232(18) 0.47057(17) 0.35704(12) 0.0263(4) Uani 1 1 d . . . . .
H218 H 0.4656 0.4711 0.3913 0.032 Uiso 1 1 calc R U . . .
C219 C 0.31239(18) 0.48238(17) 0.37477(12) 0.0301(5) Uani 1 1 d D . . . .
C220 C 0.23247(19) 0.48369(18) 0.32655(14) 0.0330(5) Uani 1 1 d . . . . .
H220 H 0.1645 0.4932 0.3387 0.040 Uiso 1 1 calc R U . . .
C221 C 0.25482(17) 0.47078(17) 0.26022(13) 0.0290(5) Uani 1 1 d . . . . .
C222 C 0.35453(17) 0.45601(16) 0.24266(12) 0.0256(4) Uani 1 1 d . . . . .
H222 H 0.3668 0.4442 0.1964 0.031 Uiso 1 1 calc R U . . .
C223 C 0.2884(2) 0.4938(2) 0.44631(15) 0.0450(7) Uani 1 1 d D . . . .
F13 F 0.3700(5) 0.5520(7) 0.4903(3) 0.064(2) Uani 0.334 1 d D U P B 1
F14 F 0.2094(5) 0.5473(7) 0.4624(4) 0.072(3) Uani 0.334 1 d D U P B 1
F15 F 0.2752(9) 0.4048(5) 0.4636(4) 0.085(3) Uani 0.334 1 d D U P B 1
F113 F 0.2215(5) 0.4135(4) 0.4520(4) 0.043(2) Uani 0.333 1 d D U P B 2
F114 F 0.3688(5) 0.5049(7) 0.4909(3) 0.052(2) Uani 0.333 1 d D U P B 2
F115 F 0.2376(5) 0.5787(4) 0.4671(3) 0.0310(15) Uani 0.333 1 d D U P B 2
F213 F 0.3542(6) 0.4513(8) 0.4817(3) 0.071(2) Uani 0.333 1 d D U P B 3
F214 F 0.2796(8) 0.5888(5) 0.4794(4) 0.081(3) Uani 0.333 1 d D U P B 3
F215 F 0.1943(5) 0.4374(6) 0.4469(4) 0.058(2) Uani 0.333 1 d D U P B 3
C224 C 0.1735(2) 0.4782(2) 0.20690(16) 0.0407(6) Uani 1 1 d . . . . .
F16 F 0.0814(2) 0.4898(5) 0.22752(19) 0.0818(16) Uani 0.684(7) 1 d . U P C 1
F17 F 0.1988(4) 0.5602(4) 0.1827(3) 0.100(2) Uani 0.684(7) 1 d . U P C 1
F18 F 0.1608(4) 0.3982(3) 0.1542(2) 0.0775(16) Uani 0.684(7) 1 d . U P C 1
F116 F 0.2021(6) 0.4686(13) 0.1476(4) 0.086(3) Uani 0.316(7) 1 d . U P C 2
F117 F 0.0946(7) 0.4049(8) 0.2026(6) 0.086(3) Uani 0.316(7) 1 d . U P C 2
F118 F 0.1335(8) 0.5626(7) 0.2211(5) 0.076(3) Uani 0.316(7) 1 d . U P C 2
C225 C 0.57867(17) 0.47021(17) 0.19958(11) 0.0250(4) Uani 1 1 d . . . . .
C226 C 0.53745(19) 0.55394(18) 0.18145(13) 0.0313(5) Uani 1 1 d . . . . .
H226 H 0.4898 0.5893 0.2088 0.038 Uiso 1 1 calc R U . . .
C227 C 0.5637(2) 0.5871(2) 0.12495(14) 0.0397(6) Uani 1 1 d D . . . .
C228 C 0.6350(2) 0.5396(2) 0.08439(14) 0.0428(6) Uani 1 1 d . . . . .
H228 H 0.6526 0.5617 0.0455 0.051 Uiso 1 1 calc R U . . .
C229 C 0.6795(2) 0.4590(2) 0.10266(13) 0.0363(6) Uani 1 1 d . . . . .
C230 C 0.65121(18) 0.42470(18) 0.15835(12) 0.0288(5) Uani 1 1 d . . . . .
H230 H 0.6823 0.3682 0.1689 0.035 Uiso 1 1 calc R U . . .
C231 C 0.5126(3) 0.6749(3) 0.10752(17) 0.0629(10) Uani 1 1 d D . . . .
F19 F 0.4999(5) 0.7471(3) 0.1616(2) 0.0778(17) Uani 0.598(9) 1 d D U P D 1
F20 F 0.4227(6) 0.6435(5) 0.0742(5) 0.135(3) Uani 0.598(9) 1 d D U P D 1
F21 F 0.5690(7) 0.7254(6) 0.0730(5) 0.134(3) Uani 0.598(9) 1 d D U P D 1
F119 F 0.5149(8) 0.6760(8) 0.0440(3) 0.089(3) Uani 0.402(9) 1 d D U P D 2
F120 F 0.5496(10) 0.7654(4) 0.1437(6) 0.137(4) Uani 0.402(9) 1 d D U P D 2
F121 F 0.4119(4) 0.6682(8) 0.1150(6) 0.099(3) Uani 0.402(9) 1 d D U P D 2
C232 C 0.7605(3) 0.4073(3) 0.06281(16) 0.0508(7) Uani 1 1 d . . . . .
F22 F 0.85127(16) 0.4187(2) 0.10039(12) 0.0784(7) Uani 1 1 d . U . . .
F23 F 0.73487(18) 0.30526(16) 0.03891(11) 0.0734(6) Uani 1 1 d . U . . .
F24 F 0.77957(19) 0.44566(19) 0.00990(11) 0.0783(7) Uani 1 1 d . U . . .


_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
Rh1 P1 2.2416(8) . ?
Rh1 P2 2.2469(7) . ?
Rh1 C6 2.277(2) . ?
Rh1 C3 2.302(2) . ?
Rh1 C5 2.319(3) . ?
Rh1 C2 2.326(2) . ?
Rh1 C4 2.377(3) . ?
Rh1 C1 2.399(2) . ?
B1 C1 1.611(3) . ?
B1 N1 1.638(3) . ?
B1 H1A 0.9900 . ?
B1 H1B 0.9900 . ?
C1 C2 1.413(3) . ?
C1 C6 1.419(3) . ?
C2 C3 1.414(3) . ?
C2 H2 1.0000 . ?
C3 C4 1.405(4) . ?
C3 H3 1.0000 . ?
C4 C5 1.392(4) . ?
C4 H4 1.0000 . ?
C5 C6 1.417(3) . ?
C5 H5 1.0000 . ?
C6 H6 1.0000 . ?
N1 C8 1.481(4) . ?
N1 C7 1.484(4) . ?
N1 C9 1.491(3) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
P1 C21 1.826(3) . ?
P1 C10 1.834(2) . ?
P1 C15 1.837(2) . ?
C10 C11 1.540(3) . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C11 C12 1.524(4) . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C12 C13 1.501(4) . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
C13 C14 1.534(4) . ?
C13 H13A 0.9900 . ?
C13 H13B 0.9900 . ?
C14 P2 1.845(2) . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C15 C20 1.389(4) . ?
C15 C16 1.398(4) . ?
C16 C17 1.389(4) . ?
C16 H16 0.9500 . ?
C17 C18 1.367(5) . ?
C17 H17 0.9500 . ?
C18 C19 1.390(5) . ?
C18 H18 0.9500 . ?
C19 C20 1.396(4) . ?
C19 H19 0.9500 . ?
C20 H20 0.9500 . ?
C21 C22 1.390(4) . ?
C21 C26 1.396(4) . ?
C22 C23 1.388(4) . ?
C22 H22 0.9500 . ?
C23 C24 1.376(5) . ?
C23 H23 0.9500 . ?
C24 C25 1.370(5) . ?
C24 H24 0.9500 . ?
C25 C26 1.387(4) . ?
C25 H25 0.9500 . ?
C26 H26 0.9500 . ?
P2 C33 1.827(2) . ?
P2 C27 1.832(2) . ?
C27 C28 1.391(3) . ?
C27 C32 1.394(3) . ?
C28 C29 1.387(4) . ?
C28 H28 0.9500 . ?
C29 C30 1.385(4) . ?
C29 H29 0.9500 . ?
C30 C31 1.371(4) . ?
C30 H30 0.9500 . ?
C31 C32 1.394(3) . ?
C31 H31 0.9500 . ?
C32 H32 0.9500 . ?
C33 C34 1.382(4) . ?
C33 C38 1.389(4) . ?
C34 C35 1.392(4) . ?
C34 H34 0.9500 . ?
C35 C36 1.368(5) . ?
C35 H35 0.9500 . ?
C36 C37 1.368(5) . ?
C36 H36 0.9500 . ?
C37 C38 1.384(4) . ?
C37 H37 0.9500 . ?
C38 H38 0.9500 . ?
B200 C209 1.641(3) . ?
B200 C201 1.642(3) . ?
B200 C217 1.643(3) . ?
B200 C225 1.645(3) . ?
C201 C202 1.394(3) . ?
C201 C206 1.405(3) . ?
C202 C203 1.396(3) . ?
C202 H202 0.9500 . ?
C203 C204 1.381(3) . ?
C203 C207 1.500(3) . ?
C204 C205 1.396(3) . ?
C204 H204 0.9500 . ?
C205 C206 1.389(3) . ?
C205 C208 1.495(3) . ?
C206 H206 0.9500 . ?
C207 F1 1.302(3) . ?
C207 F2 1.303(3) . ?
C207 F3 1.320(3) . ?
C208 F5 1.334(3) . ?
C208 F6 1.336(3) . ?
C208 F4 1.338(3) . ?
C209 C214 1.394(3) . ?
C209 C210 1.403(3) . ?
C210 C211 1.382(3) . ?
C210 H210 0.9500 . ?
C211 C212 1.392(3) . ?
C211 C215 1.493(3) . ?
C212 C213 1.379(3) . ?
C212 H212 0.9500 . ?
C213 C214 1.397(3) . ?
C213 C216 1.497(3) . ?
C214 H214 0.9500 . ?
C215 F8 1.318(3) . ?
C215 F9 1.330(3) . ?
C215 F7 1.342(3) . ?
C216 F110 1.266(4) . ?
C216 F10 1.285(4) . ?
C216 F12 1.311(4) . ?
C216 F112 1.330(4) . ?
C216 F111 1.376(5) . ?
C216 F11 1.385(4) . ?
C217 C222 1.395(3) . ?
C217 C218 1.399(3) . ?
C218 C219 1.392(3) . ?
C218 H218 0.9500 . ?
C219 C220 1.388(4) . ?
C219 C223 1.496(4) . ?
C220 C221 1.384(4) . ?
C220 H220 0.9500 . ?
C221 C222 1.395(3) . ?
C221 C224 1.495(4) . ?
C222 H222 0.9500 . ?
C223 F214 1.304(5) . ?
C223 F15 1.317(5) . ?
C223 F114 1.313(5) . ?
C223 F14 1.326(5) . ?
C223 F215 1.379(5) . ?
C223 F115 1.361(4) . ?
C223 F213 1.337(5) . ?
C223 F113 1.347(5) . ?
C223 F13 1.381(5) . ?
C224 F118 1.265(7) . ?
C224 F116 1.278(8) . ?
C224 F18 1.307(4) . ?
C224 F16 1.314(4) . ?
C224 F17 1.329(4) . ?
C224 F117 1.330(7) . ?
C225 C230 1.399(3) . ?
C225 C226 1.401(3) . ?
C226 C227 1.389(3) . ?
C226 H226 0.9500 . ?
C227 C228 1.389(4) . ?
C227 C231 1.503(4) . ?
C228 C229 1.385(4) . ?
C228 H228 0.9500 . ?
C229 C230 1.389(3) . ?
C229 C232 1.501(4) . ?
C230 H230 0.9500 . ?
C231 F120 1.280(5) . ?
C231 F21 1.306(5) . ?
C231 F20 1.292(5) . ?
C231 F119 1.309(5) . ?
C231 F19 1.312(4) . ?
C231 F121 1.330(5) . ?
C232 F23 1.329(4) . ?
C232 F24 1.335(3) . ?
C232 F22 1.340(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
P1 Rh1 P2 92.21(4) . . ?
P1 Rh1 C6 163.50(6) . . ?
P2 Rh1 C6 96.68(6) . . ?
P1 Rh1 C3 99.17(7) . . ?
P2 Rh1 C3 166.60(7) . . ?
C6 Rh1 C3 74.11(9) . . ?
P1 Rh1 C5 152.81(7) . . ?
P2 Rh1 C5 104.31(7) . . ?
C6 Rh1 C5 35.89(9) . . ?
C3 Rh1 C5 62.52(10) . . ?
P1 Rh1 C2 103.35(7) . . ?
P2 Rh1 C2 147.33(6) . . ?
C6 Rh1 C2 62.32(8) . . ?
C3 Rh1 C2 35.57(8) . . ?
C5 Rh1 C2 74.00(9) . . ?
P1 Rh1 C4 119.69(7) . . ?
P2 Rh1 C4 132.17(7) . . ?
C6 Rh1 C4 62.93(9) . . ?
C3 Rh1 C4 34.91(10) . . ?
C5 Rh1 C4 34.45(9) . . ?
C2 Rh1 C4 62.97(9) . . ?
P1 Rh1 C1 128.29(6) . . ?
P2 Rh1 C1 114.30(6) . . ?
C6 Rh1 C1 35.21(8) . . ?
C3 Rh1 C1 63.51(8) . . ?
C5 Rh1 C1 63.95(8) . . ?
C2 Rh1 C1 34.75(7) . . ?
C4 Rh1 C1 74.68(8) . . ?
C1 B1 N1 110.53(19) . . ?
C1 B1 H1A 109.5 . . ?
N1 B1 H1A 109.5 . . ?
C1 B1 H1B 109.5 . . ?
N1 B1 H1B 109.5 . . ?
H1A B1 H1B 108.1 . . ?
C2 C1 C6 114.5(2) . . ?
C2 C1 B1 123.2(2) . . ?
C6 C1 B1 122.2(2) . . ?
C2 C1 Rh1 69.81(12) . . ?
C6 C1 Rh1 67.70(12) . . ?
B1 C1 Rh1 130.29(15) . . ?
C3 C2 C1 122.2(2) . . ?
C3 C2 Rh1 71.27(13) . . ?
C1 C2 Rh1 75.44(13) . . ?
C3 C2 H2 118.6 . . ?
C1 C2 H2 118.6 . . ?
Rh1 C2 H2 118.6 . . ?
C4 C3 C2 121.2(2) . . ?
C4 C3 Rh1 75.47(14) . . ?
C2 C3 Rh1 73.16(13) . . ?
C4 C3 H3 119.3 . . ?
C2 C3 H3 119.3 . . ?
Rh1 C3 H3 119.3 . . ?
C5 C4 C3 118.0(2) . . ?
C5 C4 Rh1 70.51(14) . . ?
C3 C4 Rh1 69.62(13) . . ?
C5 C4 H4 120.3 . . ?
C3 C4 H4 120.3 . . ?
Rh1 C4 H4 120.3 . . ?
C4 C5 C6 119.9(2) . . ?
C4 C5 Rh1 75.03(15) . . ?
C6 C5 Rh1 70.43(13) . . ?
C4 C5 H5 119.9 . . ?
C6 C5 H5 119.9 . . ?
Rh1 C5 H5 119.9 . . ?
C5 C6 C1 123.6(2) . . ?
C5 C6 Rh1 73.68(14) . . ?
C1 C6 Rh1 77.08(13) . . ?
C5 C6 H6 118.1 . . ?
C1 C6 H6 118.1 . . ?
Rh1 C6 H6 118.1 . . ?
C8 N1 C7 109.6(2) . . ?
C8 N1 C9 108.2(2) . . ?
C7 N1 C9 108.2(2) . . ?
C8 N1 B1 111.6(2) . . ?
C7 N1 B1 110.98(19) . . ?
C9 N1 B1 108.2(2) . . ?
N1 C7 H7A 109.5 . . ?
N1 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
N1 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C8 H8A 109.5 . . ?
N1 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N1 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
N1 C9 H9A 109.5 . . ?
N1 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
N1 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C21 P1 C10 102.06(12) . . ?
C21 P1 C15 103.18(12) . . ?
C10 P1 C15 100.24(11) . . ?
C21 P1 Rh1 113.81(8) . . ?
C10 P1 Rh1 123.16(8) . . ?
C15 P1 Rh1 111.86(9) . . ?
C11 C10 P1 118.81(18) . . ?
C11 C10 H10A 107.6 . . ?
P1 C10 H10A 107.6 . . ?
C11 C10 H10B 107.6 . . ?
P1 C10 H10B 107.6 . . ?
H10A C10 H10B 107.0 . . ?
C12 C11 C10 117.4(2) . . ?
C12 C11 H11A 108.0 . . ?
C10 C11 H11A 108.0 . . ?
C12 C11 H11B 108.0 . . ?
C10 C11 H11B 108.0 . . ?
H11A C11 H11B 107.2 . . ?
C13 C12 C11 117.7(2) . . ?
C13 C12 H12A 107.9 . . ?
C11 C12 H12A 107.9 . . ?
C13 C12 H12B 107.9 . . ?
C11 C12 H12B 107.9 . . ?
H12A C12 H12B 107.2 . . ?
C12 C13 C14 118.8(2) . . ?
C12 C13 H13A 107.6 . . ?
C14 C13 H13A 107.6 . . ?
C12 C13 H13B 107.6 . . ?
C14 C13 H13B 107.6 . . ?
H13A C13 H13B 107.0 . . ?
C13 C14 P2 120.39(19) . . ?
C13 C14 H14A 107.2 . . ?
P2 C14 H14A 107.2 . . ?
C13 C14 H14B 107.2 . . ?
P2 C14 H14B 107.2 . . ?
H14A C14 H14B 106.9 . . ?
C20 C15 C16 119.1(2) . . ?
C20 C15 P1 118.5(2) . . ?
C16 C15 P1 122.3(2) . . ?
C17 C16 C15 119.6(3) . . ?
C17 C16 H16 120.2 . . ?
C15 C16 H16 120.2 . . ?
C18 C17 C16 121.2(3) . . ?
C18 C17 H17 119.4 . . ?
C16 C17 H17 119.4 . . ?
C17 C18 C19 120.0(3) . . ?
C17 C18 H18 120.0 . . ?
C19 C18 H18 120.0 . . ?
C18 C19 C20 119.5(3) . . ?
C18 C19 H19 120.3 . . ?
C20 C19 H19 120.3 . . ?
C15 C20 C19 120.6(3) . . ?
C15 C20 H20 119.7 . . ?
C19 C20 H20 119.7 . . ?
C22 C21 C26 118.5(2) . . ?
C22 C21 P1 117.9(2) . . ?
C26 C21 P1 123.6(2) . . ?
C23 C22 C21 120.8(3) . . ?
C23 C22 H22 119.6 . . ?
C21 C22 H22 119.6 . . ?
C24 C23 C22 120.0(3) . . ?
C24 C23 H23 120.0 . . ?
C22 C23 H23 120.0 . . ?
C25 C24 C23 120.0(3) . . ?
C25 C24 H24 120.0 . . ?
C23 C24 H24 120.0 . . ?
C24 C25 C26 120.7(3) . . ?
C24 C25 H25 119.6 . . ?
C26 C25 H25 119.6 . . ?
C25 C26 C21 120.0(3) . . ?
C25 C26 H26 120.0 . . ?
C21 C26 H26 120.0 . . ?
C33 P2 C27 103.86(11) . . ?
C33 P2 C14 100.25(12) . . ?
C27 P2 C14 101.37(11) . . ?
C33 P2 Rh1 114.83(8) . . ?
C27 P2 Rh1 110.49(8) . . ?
C14 P2 Rh1 123.61(8) . . ?
C28 C27 C32 118.6(2) . . ?
C28 C27 P2 119.26(17) . . ?
C32 C27 P2 122.14(18) . . ?
C29 C28 C27 121.1(2) . . ?
C29 C28 H28 119.5 . . ?
C27 C28 H28 119.5 . . ?
C30 C29 C28 119.9(2) . . ?
C30 C29 H29 120.1 . . ?
C28 C29 H29 120.1 . . ?
C31 C30 C29 119.6(2) . . ?
C31 C30 H30 120.2 . . ?
C29 C30 H30 120.2 . . ?
C30 C31 C32 121.0(2) . . ?
C30 C31 H31 119.5 . . ?
C32 C31 H31 119.5 . . ?
C27 C32 C31 119.9(2) . . ?
C27 C32 H32 120.1 . . ?
C31 C32 H32 120.1 . . ?
C34 C33 C38 118.4(2) . . ?
C34 C33 P2 119.21(18) . . ?
C38 C33 P2 122.4(2) . . ?
C33 C34 C35 120.4(3) . . ?
C33 C34 H34 119.8 . . ?
C35 C34 H34 119.8 . . ?
C36 C35 C34 120.4(3) . . ?
C36 C35 H35 119.8 . . ?
C34 C35 H35 119.8 . . ?
C35 C36 C37 119.8(3) . . ?
C35 C36 H36 120.1 . . ?
C37 C36 H36 120.1 . . ?
C36 C37 C38 120.4(3) . . ?
C36 C37 H37 119.8 . . ?
C38 C37 H37 119.8 . . ?
C37 C38 C33 120.7(3) . . ?
C37 C38 H38 119.7 . . ?
C33 C38 H38 119.7 . . ?
C209 B200 C201 110.60(17) . . ?
C209 B200 C217 112.26(18) . . ?
C201 B200 C217 104.91(17) . . ?
C209 B200 C225 102.98(17) . . ?
C201 B200 C225 113.52(18) . . ?
C217 B200 C225 112.78(18) . . ?
C202 C201 C206 115.92(19) . . ?
C202 C201 B200 120.28(19) . . ?
C206 C201 B200 123.69(19) . . ?
C201 C202 C203 122.5(2) . . ?
C201 C202 H202 118.8 . . ?
C203 C202 H202 118.8 . . ?
C204 C203 C202 120.7(2) . . ?
C204 C203 C207 119.6(2) . . ?
C202 C203 C207 119.7(2) . . ?
C203 C204 C205 118.1(2) . . ?
C203 C204 H204 121.0 . . ?
C205 C204 H204 121.0 . . ?
C206 C205 C204 120.9(2) . . ?
C206 C205 C208 121.4(2) . . ?
C204 C205 C208 117.7(2) . . ?
C205 C206 C201 122.0(2) . . ?
C205 C206 H206 119.0 . . ?
C201 C206 H206 119.0 . . ?
F1 C207 F2 107.1(3) . . ?
F1 C207 F3 105.6(2) . . ?
F2 C207 F3 105.0(2) . . ?
F1 C207 C203 113.4(2) . . ?
F2 C207 C203 112.2(2) . . ?
F3 C207 C203 112.9(2) . . ?
F5 C208 F6 106.4(2) . . ?
F5 C208 F4 105.84(19) . . ?
F6 C208 F4 106.5(2) . . ?
F5 C208 C205 113.15(19) . . ?
F6 C208 C205 112.58(19) . . ?
F4 C208 C205 111.9(2) . . ?
C214 C209 C210 115.7(2) . . ?
C214 C209 B200 123.39(19) . . ?
C210 C209 B200 120.49(19) . . ?
C211 C210 C209 122.4(2) . . ?
C211 C210 H210 118.8 . . ?
C209 C210 H210 118.8 . . ?
C210 C211 C212 120.9(2) . . ?
C210 C211 C215 120.6(2) . . ?
C212 C211 C215 118.6(2) . . ?
C213 C212 C211 117.9(2) . . ?
C213 C212 H212 121.1 . . ?
C211 C212 H212 121.1 . . ?
C212 C213 C214 121.0(2) . . ?
C212 C213 C216 119.4(2) . . ?
C214 C213 C216 119.6(2) . . ?
C209 C214 C213 122.1(2) . . ?
C209 C214 H214 119.0 . . ?
C213 C214 H214 119.0 . . ?
F8 C215 F9 107.2(2) . . ?
F8 C215 F7 106.5(2) . . ?
F9 C215 F7 103.2(2) . . ?
F8 C215 C211 114.1(2) . . ?
F9 C215 C211 113.0(2) . . ?
F7 C215 C211 112.0(2) . . ?
F10 C216 F12 111.4(4) . . ?
F110 C216 F112 109.2(4) . . ?
F110 C216 F111 107.1(4) . . ?
F112 C216 F111 101.0(4) . . ?
F10 C216 F11 103.7(4) . . ?
F12 C216 F11 101.4(3) . . ?
F110 C216 C213 116.7(3) . . ?
F10 C216 C213 115.9(3) . . ?
F12 C216 C213 113.8(3) . . ?
F112 C216 C213 112.0(3) . . ?
F111 C216 C213 109.5(3) . . ?
F11 C216 C213 109.0(3) . . ?
C222 C217 C218 115.6(2) . . ?
C222 C217 B200 123.0(2) . . ?
C218 C217 B200 121.30(19) . . ?
C219 C218 C217 122.3(2) . . ?
C219 C218 H218 118.9 . . ?
C217 C218 H218 118.9 . . ?
C220 C219 C218 120.9(2) . . ?
C220 C219 C223 118.3(2) . . ?
C218 C219 C223 120.8(2) . . ?
C221 C220 C219 117.9(2) . . ?
C221 C220 H220 121.0 . . ?
C219 C220 H220 121.0 . . ?
C220 C221 C222 120.7(2) . . ?
C220 C221 C224 120.3(2) . . ?
C222 C221 C224 118.9(2) . . ?
C221 C222 C217 122.5(2) . . ?
C221 C222 H222 118.8 . . ?
C217 C222 H222 118.8 . . ?
F15 C223 F14 109.9(5) . . ?
F214 C223 F215 105.4(4) . . ?
F114 C223 F115 106.2(4) . . ?
F214 C223 F213 110.2(5) . . ?
F215 C223 F213 103.4(4) . . ?
F114 C223 F113 108.6(4) . . ?
F115 C223 F113 104.0(4) . . ?
F15 C223 F13 105.0(4) . . ?
F14 C223 F13 103.3(4) . . ?
F214 C223 C219 114.7(4) . . ?
F15 C223 C219 113.8(4) . . ?
F114 C223 C219 115.5(4) . . ?
F14 C223 C219 113.8(4) . . ?
F215 C223 C219 109.2(4) . . ?
F115 C223 C219 110.4(3) . . ?
F213 C223 C219 112.9(4) . . ?
F113 C223 C219 111.3(4) . . ?
F13 C223 C219 110.1(4) . . ?
F118 C224 F116 106.3(7) . . ?
F18 C224 F16 106.4(4) . . ?
F18 C224 F17 105.1(4) . . ?
F16 C224 F17 105.3(4) . . ?
F118 C224 F117 104.2(7) . . ?
F116 C224 F117 107.4(8) . . ?
F118 C224 C221 113.0(4) . . ?
F116 C224 C221 115.9(4) . . ?
F18 C224 C221 113.8(2) . . ?
F16 C224 C221 114.9(3) . . ?
F17 C224 C221 110.6(2) . . ?
F117 C224 C221 109.3(4) . . ?
C230 C225 C226 115.4(2) . . ?
C230 C225 B200 122.65(19) . . ?
C226 C225 B200 121.5(2) . . ?
C227 C226 C225 122.4(2) . . ?
C227 C226 H226 118.8 . . ?
C225 C226 H226 118.8 . . ?
C228 C227 C226 120.9(2) . . ?
C228 C227 C231 120.1(2) . . ?
C226 C227 C231 119.0(2) . . ?
C229 C228 C227 117.7(2) . . ?
C229 C228 H228 121.2 . . ?
C227 C228 H228 121.2 . . ?
C228 C229 C230 121.0(2) . . ?
C228 C229 C232 120.4(2) . . ?
C230 C229 C232 118.5(2) . . ?
C229 C230 C225 122.5(2) . . ?
C229 C230 H230 118.8 . . ?
C225 C230 H230 118.8 . . ?
F21 C231 F20 108.6(4) . . ?
F120 C231 F119 107.9(5) . . ?
F21 C231 F19 103.5(4) . . ?
F20 C231 F19 107.3(4) . . ?
F120 C231 F121 104.7(5) . . ?
F119 C231 F121 103.0(4) . . ?
F120 C231 C227 114.3(4) . . ?
F21 C231 C227 112.6(4) . . ?
F20 C231 C227 112.4(3) . . ?
F119 C231 C227 113.0(4) . . ?
F19 C231 C227 112.1(3) . . ?
F121 C231 C227 113.1(4) . . ?
F23 C232 F24 106.8(3) . . ?
F23 C232 F22 105.8(3) . . ?
F24 C232 F22 106.3(3) . . ?
F23 C232 C229 112.6(3) . . ?
F24 C232 C229 112.9(3) . . ?
F22 C232 C229 112.0(3) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 B1 C1 C2 -84.1(3) . . . . ?
N1 B1 C1 C6 98.2(2) . . . . ?
N1 B1 C1 Rh1 -174.92(14) . . . . ?
C6 C1 C2 C3 -4.0(3) . . . . ?
B1 C1 C2 C3 178.1(2) . . . . ?
Rh1 C1 C2 C3 -56.2(2) . . . . ?
C6 C1 C2 Rh1 52.26(17) . . . . ?
B1 C1 C2 Rh1 -125.6(2) . . . . ?
C1 C2 C3 C4 -2.5(3) . . . . ?
Rh1 C2 C3 C4 -60.7(2) . . . . ?
C1 C2 C3 Rh1 58.2(2) . . . . ?
C2 C3 C4 C5 6.5(3) . . . . ?
Rh1 C3 C4 C5 -53.1(2) . . . . ?
C2 C3 C4 Rh1 59.5(2) . . . . ?
C3 C4 C5 C6 -3.8(3) . . . . ?
Rh1 C4 C5 C6 -56.4(2) . . . . ?
C3 C4 C5 Rh1 52.6(2) . . . . ?
C4 C5 C6 C1 -3.0(3) . . . . ?
Rh1 C5 C6 C1 -61.7(2) . . . . ?
C4 C5 C6 Rh1 58.6(2) . . . . ?
C2 C1 C6 C5 6.8(3) . . . . ?
B1 C1 C6 C5 -175.3(2) . . . . ?
Rh1 C1 C6 C5 60.1(2) . . . . ?
C2 C1 C6 Rh1 -53.33(17) . . . . ?
B1 C1 C6 Rh1 124.6(2) . . . . ?
C1 B1 N1 C8 -58.7(3) . . . . ?
C1 B1 N1 C7 63.9(3) . . . . ?
C1 B1 N1 C9 -177.6(2) . . . . ?
C21 P1 C10 C11 -177.13(19) . . . . ?
C15 P1 C10 C11 76.9(2) . . . . ?
Rh1 P1 C10 C11 -47.9(2) . . . . ?
P1 C10 C11 C12 59.1(3) . . . . ?
C10 C11 C12 C13 61.5(3) . . . . ?
C11 C12 C13 C14 -66.5(3) . . . . ?
C12 C13 C14 P2 -51.2(3) . . . . ?
C21 P1 C15 C20 -177.2(2) . . . . ?
C10 P1 C15 C20 -72.1(2) . . . . ?
Rh1 P1 C15 C20 60.1(2) . . . . ?
C21 P1 C15 C16 0.9(2) . . . . ?
C10 P1 C15 C16 106.0(2) . . . . ?
Rh1 P1 C15 C16 -121.85(19) . . . . ?
C20 C15 C16 C17 1.4(4) . . . . ?
P1 C15 C16 C17 -176.7(2) . . . . ?
C15 C16 C17 C18 -0.1(4) . . . . ?
C16 C17 C18 C19 -1.0(5) . . . . ?
C17 C18 C19 C20 0.7(5) . . . . ?
C16 C15 C20 C19 -1.6(4) . . . . ?
P1 C15 C20 C19 176.5(2) . . . . ?
C18 C19 C20 C15 0.6(4) . . . . ?
C10 P1 C21 C22 -179.0(2) . . . . ?
C15 P1 C21 C22 -75.3(2) . . . . ?
Rh1 P1 C21 C22 46.1(2) . . . . ?
C10 P1 C21 C26 1.3(2) . . . . ?
C15 P1 C21 C26 105.0(2) . . . . ?
Rh1 P1 C21 C26 -133.6(2) . . . . ?
C26 C21 C22 C23 0.5(4) . . . . ?
P1 C21 C22 C23 -179.3(2) . . . . ?
C21 C22 C23 C24 0.9(5) . . . . ?
C22 C23 C24 C25 -1.2(5) . . . . ?
C23 C24 C25 C26 0.1(6) . . . . ?
C24 C25 C26 C21 1.3(5) . . . . ?
C22 C21 C26 C25 -1.6(4) . . . . ?
P1 C21 C26 C25 178.1(2) . . . . ?
C13 C14 P2 C33 174.6(2) . . . . ?
C13 C14 P2 C27 -78.8(2) . . . . ?
C13 C14 P2 Rh1 45.4(2) . . . . ?
C33 P2 C27 C28 168.4(2) . . . . ?
C14 P2 C27 C28 64.8(2) . . . . ?
Rh1 P2 C27 C28 -67.9(2) . . . . ?
C33 P2 C27 C32 -12.6(2) . . . . ?
C14 P2 C27 C32 -116.3(2) . . . . ?
Rh1 P2 C27 C32 111.00(19) . . . . ?
C32 C27 C28 C29 0.9(4) . . . . ?
P2 C27 C28 C29 179.8(2) . . . . ?
C27 C28 C29 C30 -0.9(4) . . . . ?
C28 C29 C30 C31 0.1(4) . . . . ?
C29 C30 C31 C32 0.6(4) . . . . ?
C28 C27 C32 C31 -0.2(4) . . . . ?
P2 C27 C32 C31 -179.08(19) . . . . ?
C30 C31 C32 C27 -0.6(4) . . . . ?
C27 P2 C33 C34 108.6(2) . . . . ?
C14 P2 C33 C34 -146.8(2) . . . . ?
Rh1 P2 C33 C34 -12.1(2) . . . . ?
C27 P2 C33 C38 -70.7(3) . . . . ?
C14 P2 C33 C38 33.9(3) . . . . ?
Rh1 P2 C33 C38 168.6(2) . . . . ?
C38 C33 C34 C35 -1.9(4) . . . . ?
P2 C33 C34 C35 178.8(2) . . . . ?
C33 C34 C35 C36 0.9(4) . . . . ?
C34 C35 C36 C37 0.5(5) . . . . ?
C35 C36 C37 C38 -0.9(5) . . . . ?
C36 C37 C38 C33 -0.1(5) . . . . ?
C34 C33 C38 C37 1.6(4) . . . . ?
P2 C33 C38 C37 -179.2(2) . . . . ?
C209 B200 C201 C202 39.1(3) . . . . ?
C217 B200 C201 C202 -82.2(2) . . . . ?
C225 B200 C201 C202 154.27(19) . . . . ?
C209 B200 C201 C206 -144.7(2) . . . . ?
C217 B200 C201 C206 94.0(2) . . . . ?
C225 B200 C201 C206 -29.5(3) . . . . ?
C206 C201 C202 C203 0.1(3) . . . . ?
B200 C201 C202 C203 176.55(19) . . . . ?
C201 C202 C203 C204 1.1(3) . . . . ?
C201 C202 C203 C207 -178.4(2) . . . . ?
C202 C203 C204 C205 -0.7(3) . . . . ?
C207 C203 C204 C205 178.8(2) . . . . ?
C203 C204 C205 C206 -0.8(3) . . . . ?
C203 C204 C205 C208 178.91(19) . . . . ?
C204 C205 C206 C201 2.0(3) . . . . ?
C208 C205 C206 C201 -177.7(2) . . . . ?
C202 C201 C206 C205 -1.6(3) . . . . ?
B200 C201 C206 C205 -177.94(19) . . . . ?
C204 C203 C207 F1 140.0(3) . . . . ?
C202 C203 C207 F1 -40.4(3) . . . . ?
C204 C203 C207 F2 -98.4(3) . . . . ?
C202 C203 C207 F2 81.1(3) . . . . ?
C204 C203 C207 F3 20.0(3) . . . . ?
C202 C203 C207 F3 -160.4(2) . . . . ?
C206 C205 C208 F5 13.6(3) . . . . ?
C204 C205 C208 F5 -166.16(19) . . . . ?
C206 C205 C208 F6 -107.1(3) . . . . ?
C204 C205 C208 F6 73.2(3) . . . . ?
C206 C205 C208 F4 133.0(2) . . . . ?
C204 C205 C208 F4 -46.7(3) . . . . ?
C201 B200 C209 C214 -147.1(2) . . . . ?
C217 B200 C209 C214 -30.3(3) . . . . ?
C225 B200 C209 C214 91.3(2) . . . . ?
C201 B200 C209 C210 40.5(3) . . . . ?
C217 B200 C209 C210 157.33(19) . . . . ?
C225 B200 C209 C210 -81.1(2) . . . . ?
C214 C209 C210 C211 -0.3(3) . . . . ?
B200 C209 C210 C211 172.6(2) . . . . ?
C209 C210 C211 C212 0.3(3) . . . . ?
C209 C210 C211 C215 179.9(2) . . . . ?
C210 C211 C212 C213 0.0(3) . . . . ?
C215 C211 C212 C213 -179.5(2) . . . . ?
C211 C212 C213 C214 -0.4(3) . . . . ?
C211 C212 C213 C216 179.6(2) . . . . ?
C210 C209 C214 C213 -0.1(3) . . . . ?
B200 C209 C214 C213 -172.8(2) . . . . ?
C212 C213 C214 C209 0.5(3) . . . . ?
C216 C213 C214 C209 -179.6(2) . . . . ?
C210 C211 C215 F8 15.1(3) . . . . ?
C212 C211 C215 F8 -165.4(2) . . . . ?
C210 C211 C215 F9 137.9(2) . . . . ?
C212 C211 C215 F9 -42.5(3) . . . . ?
C210 C211 C215 F7 -106.1(3) . . . . ?
C212 C211 C215 F7 73.5(3) . . . . ?
C212 C213 C216 F110 136.9(8) . . . . ?
C214 C213 C216 F110 -43.0(8) . . . . ?
C212 C213 C216 F10 -10.8(6) . . . . ?
C214 C213 C216 F10 169.3(5) . . . . ?
C212 C213 C216 F12 -142.0(5) . . . . ?
C214 C213 C216 F12 38.1(6) . . . . ?
C212 C213 C216 F112 10.0(6) . . . . ?
C214 C213 C216 F112 -170.0(5) . . . . ?
C212 C213 C216 F111 -101.3(6) . . . . ?
C214 C213 C216 F111 78.8(6) . . . . ?
C212 C213 C216 F11 105.7(4) . . . . ?
C214 C213 C216 F11 -74.2(4) . . . . ?
C209 B200 C217 C222 141.9(2) . . . . ?
C201 B200 C217 C222 -98.0(2) . . . . ?
C225 B200 C217 C222 26.1(3) . . . . ?
C209 B200 C217 C218 -42.2(3) . . . . ?
C201 B200 C217 C218 77.9(2) . . . . ?
C225 B200 C217 C218 -158.03(19) . . . . ?
C222 C217 C218 C219 -1.1(3) . . . . ?
B200 C217 C218 C219 -177.3(2) . . . . ?
C217 C218 C219 C220 -1.0(3) . . . . ?
C217 C218 C219 C223 178.9(2) . . . . ?
C218 C219 C220 C221 1.3(3) . . . . ?
C223 C219 C220 C221 -178.6(2) . . . . ?
C219 C220 C221 C222 0.6(3) . . . . ?
C219 C220 C221 C224 -176.2(2) . . . . ?
C220 C221 C222 C217 -2.8(3) . . . . ?
C224 C221 C222 C217 173.9(2) . . . . ?
C218 C217 C222 C221 3.0(3) . . . . ?
B200 C217 C222 C221 179.1(2) . . . . ?
C220 C219 C223 F214 -77.9(6) . . . . ?
C218 C219 C223 F214 102.2(6) . . . . ?
C220 C219 C223 F15 99.1(6) . . . . ?
C218 C219 C223 F15 -80.8(6) . . . . ?
C220 C219 C223 F114 -171.9(4) . . . . ?
C218 C219 C223 F114 8.2(5) . . . . ?
C220 C219 C223 F14 -27.8(5) . . . . ?
C218 C219 C223 F14 152.3(5) . . . . ?
C220 C219 C223 F215 40.2(5) . . . . ?
C218 C219 C223 F215 -139.7(4) . . . . ?
C220 C219 C223 F115 -51.4(4) . . . . ?
C218 C219 C223 F115 128.7(4) . . . . ?
C220 C219 C223 F213 154.7(5) . . . . ?
C218 C219 C223 F213 -25.2(6) . . . . ?
C220 C219 C223 F113 63.6(4) . . . . ?
C218 C219 C223 F113 -116.3(4) . . . . ?
C220 C219 C223 F13 -143.3(5) . . . . ?
C218 C219 C223 F13 36.8(5) . . . . ?
C220 C221 C224 F118 54.8(7) . . . . ?
C222 C221 C224 F118 -122.0(7) . . . . ?
C220 C221 C224 F116 177.8(9) . . . . ?
C222 C221 C224 F116 1.0(9) . . . . ?
C220 C221 C224 F18 -127.6(4) . . . . ?
C222 C221 C224 F18 55.7(4) . . . . ?
C220 C221 C224 F16 -4.6(4) . . . . ?
C222 C221 C224 F16 178.6(4) . . . . ?
C220 C221 C224 F17 114.4(5) . . . . ?
C222 C221 C224 F17 -62.4(5) . . . . ?
C220 C221 C224 F117 -60.7(7) . . . . ?
C222 C221 C224 F117 122.5(7) . . . . ?
C209 B200 C225 C230 85.3(2) . . . . ?
C201 B200 C225 C230 -34.3(3) . . . . ?
C217 B200 C225 C230 -153.5(2) . . . . ?
C209 B200 C225 C226 -86.3(2) . . . . ?
C201 B200 C225 C226 154.1(2) . . . . ?
C217 B200 C225 C226 35.0(3) . . . . ?
C230 C225 C226 C227 2.4(4) . . . . ?
B200 C225 C226 C227 174.5(2) . . . . ?
C225 C226 C227 C228 -1.6(4) . . . . ?
C225 C226 C227 C231 177.5(2) . . . . ?
C226 C227 C228 C229 -0.6(4) . . . . ?
C231 C227 C228 C229 -179.8(3) . . . . ?
C227 C228 C229 C230 2.1(4) . . . . ?
C227 C228 C229 C232 -177.3(3) . . . . ?
C228 C229 C230 C225 -1.3(4) . . . . ?
C232 C229 C230 C225 178.1(3) . . . . ?
C226 C225 C230 C229 -0.9(3) . . . . ?
B200 C225 C230 C229 -173.0(2) . . . . ?
C228 C227 C231 F120 -102.7(9) . . . . ?
C226 C227 C231 F120 78.1(9) . . . . ?
C228 C227 C231 F21 -26.3(7) . . . . ?
C226 C227 C231 F21 154.5(6) . . . . ?
C228 C227 C231 F20 96.6(6) . . . . ?
C226 C227 C231 F20 -82.6(7) . . . . ?
C228 C227 C231 F119 21.1(7) . . . . ?
C226 C227 C231 F119 -158.1(6) . . . . ?
C228 C227 C231 F19 -142.5(4) . . . . ?
C226 C227 C231 F19 38.3(5) . . . . ?
C228 C227 C231 F121 137.6(7) . . . . ?
C226 C227 C231 F121 -41.6(7) . . . . ?
C228 C229 C232 F23 -122.8(3) . . . . ?
C230 C229 C232 F23 57.8(4) . . . . ?
C228 C229 C232 F24 -1.8(4) . . . . ?
C230 C229 C232 F24 178.8(3) . . . . ?
C228 C229 C232 F22 118.1(3) . . . . ?
C230 C229 C232 F22 -61.3(4) . . . . ?

_refine_diff_density_max         0.921
_refine_diff_density_min         -0.608
_refine_diff_density_rms         0.064

_vrf_PLAT910_4                   
; 
PROBLEM: Missing # of FCF Reflection(s) Below Th(Min)
	 ... 113 Report
RESPONSE: The low angle data was cut at 4 Ang to remove the 
	  infuence of the beamstop and some reflections are
	  therefore missing. The quality of the data is not
	  significantly affected. 
;

_shelxl_version_number           2014-3


_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: Dichloromethane/pentane'
_chemical_properties_physical    
'Air-sensitive, Moisture-sensitive, Oxygen-sensitive'
####################################################################### 
# 
# 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_5
_database_code_depnum_ccdc_archive 'CCDC 1445279'
_audit_update_record             
;
2016-02-18 deposited with the CCDC.
2016-02-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014
_chemical_formula_moiety         'C32 H12 B F24, C36 H42 B N P2 Rh'
_chemical_formula_sum            'C68 H54 B2 F24 N P2 Rh'
_chemical_formula_weight         1527.59

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh 0.0927 3.6045 '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                   12.9920(3)
_cell_length_b                   13.1179(3)
_cell_length_c                   20.8103(6)
_cell_angle_alpha                106.257(2)
_cell_angle_beta                 93.765(2)
_cell_angle_gamma                95.408(2)
_cell_volume                     3373.93(15)
_cell_formula_units_Z            2
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    15242
_cell_measurement_theta_min      3.4302
_cell_measurement_theta_max      74.8570

_exptl_crystal_description       plate
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.504
_exptl_crystal_F_000             1540
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.10
_exptl_absorpt_coefficient_mu    3.463
_exptl_absorpt_correction_T_min  0.62524
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'SuperNova (Cu) X-ray Source'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Atlas'
_diffrn_detector_area_resol_mean 10.4102
_diffrn_reflns_number            24085
_diffrn_reflns_av_unetI/netI     0.0252
_diffrn_reflns_av_R_equivalents  0.0188
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_theta_min         3.433
_diffrn_reflns_theta_max         75.025
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.962
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.962
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.962
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             13380
_reflns_number_gt                12443
_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 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Several of the CF3 groups of the [BArF4]- anion have significant 
 disorder. 4 groups were modelled as disordered over 2 sites and 
 1 over 3 sites. All F atoms were also described by the ISOR and 
 SIMU commands. In spite of this modelling some of the F atom 
 ellipsoids remain prolate but further attempts to model were not
 successful.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0414P)²+1.2133P] 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         13380
_refine_ls_number_parameters     1052
_refine_ls_number_restraints     792
_refine_ls_R_factor_all          0.0303
_refine_ls_R_factor_gt           0.0278
_refine_ls_wR_factor_ref         0.0741
_refine_ls_wR_factor_gt          0.0725
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_restrained_S_all      1.190
_refine_ls_shift/su_max          0.003
_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
Rh1 Rh 0.87694(2) -0.04708(2) 0.74489(2) 0.01831(4) Uani 1 1 d . . . . .
B1 B 0.77117(16) 0.14828(16) 0.67194(11) 0.0279(4) Uani 1 1 d . . . . .
H1A H 0.8298 0.1534 0.6444 0.033 Uiso 1 1 calc R U . . .
H1B H 0.7859 0.2057 0.7150 0.033 Uiso 1 1 calc R U . . .
C1 C 0.76032(12) 0.03350(13) 0.68627(8) 0.0224(3) Uani 1 1 d . . . . .
C2 C 0.79695(13) -0.05724(14) 0.64268(8) 0.0246(3) Uani 1 1 d . . . . .
H2 H 0.8410 -0.0459 0.6071 0.029 Uiso 1 1 calc R U . . .
C3 C 0.78142(14) -0.16108(14) 0.65056(10) 0.0310(4) Uani 1 1 d . . . . .
H3 H 0.8139 -0.2207 0.6207 0.037 Uiso 1 1 calc R U . . .
C4 C 0.73268(14) -0.17706(15) 0.70523(11) 0.0339(4) Uani 1 1 d . . . . .
H4 H 0.7312 -0.2474 0.7152 0.041 Uiso 1 1 calc R U . . .
C5 C 0.70478(13) -0.08736(16) 0.75298(10) 0.0302(4) Uani 1 1 d . . . . .
H5 H 0.6818 -0.0952 0.7964 0.036 Uiso 1 1 calc R U . . .
C6 C 0.71640(12) 0.01520(14) 0.74304(9) 0.0251(3) Uani 1 1 d . . . . .
H6 H 0.7033 0.0782 0.7804 0.030 Uiso 1 1 calc R U . . .
N1 N 0.66342(12) 0.16354(12) 0.63209(8) 0.0301(3) Uani 1 1 d . . . . .
C7 C 0.6783(2) 0.26792(18) 0.61681(14) 0.0490(6) Uani 1 1 d . . . . .
H7A H 0.6144 0.2787 0.5931 0.074 Uiso 1 1 calc R U . . .
H7B H 0.7356 0.2680 0.5884 0.074 Uiso 1 1 calc R U . . .
H7C H 0.6947 0.3258 0.6589 0.074 Uiso 1 1 calc R U . . .
C8 C 0.63733(18) 0.07803(18) 0.56763(11) 0.0420(5) Uani 1 1 d . . . . .
H8A H 0.6248 0.0087 0.5767 0.063 Uiso 1 1 calc R U . . .
H8B H 0.6952 0.0771 0.5396 0.063 Uiso 1 1 calc R U . . .
H8C H 0.5747 0.0917 0.5440 0.063 Uiso 1 1 calc R U . . .
C9 C 0.57567(17) 0.1650(2) 0.67431(13) 0.0456(5) Uani 1 1 d . . . . .
H9A H 0.5131 0.1786 0.6506 0.068 Uiso 1 1 calc R U . . .
H9B H 0.5928 0.2215 0.7169 0.068 Uiso 1 1 calc R U . . .
H9C H 0.5631 0.0957 0.6834 0.068 Uiso 1 1 calc R U . . .
P1 P 1.04111(3) -0.03607(3) 0.72071(2) 0.01978(8) Uani 1 1 d . . . . .
C10 C 1.12832(13) -0.10637(14) 0.76164(9) 0.0268(3) Uani 1 1 d . . . . .
H10A H 1.1010 -0.1831 0.7487 0.032 Uiso 1 1 calc R U . . .
H10B H 1.1973 -0.1007 0.7445 0.032 Uiso 1 1 calc R U . . .
C11 C 1.14190(14) -0.06413(15) 0.83829(9) 0.0294(4) Uani 1 1 d . . . . .
H11A H 1.1661 0.0134 0.8513 0.035 Uiso 1 1 calc R U . . .
H11B H 1.1967 -0.0999 0.8556 0.035 Uiso 1 1 calc R U . . .
C12 C 1.04282(14) -0.08125(15) 0.87207(9) 0.0273(3) Uani 1 1 d . . . . .
H12A H 1.0605 -0.0590 0.9214 0.033 Uiso 1 1 calc R U . . .
H12B H 1.0180 -0.1586 0.8582 0.033 Uiso 1 1 calc R U . . .
P2 P 0.93664(3) -0.00904(3) 0.85276(2) 0.02174(8) Uani 1 1 d . . . . .
C13 C 1.05470(12) -0.09603(14) 0.63164(8) 0.0230(3) Uani 1 1 d . . . . .
C14 C 1.08089(15) -0.03394(15) 0.58938(10) 0.0296(4) Uani 1 1 d . . . . .
H14 H 1.0942 0.0416 0.6070 0.036 Uiso 1 1 calc R U . . .
C15 C 1.08750(16) -0.08216(17) 0.52171(10) 0.0344(4) Uani 1 1 d . . . . .
H15 H 1.1048 -0.0392 0.4931 0.041 Uiso 1 1 calc R U . . .
C16 C 1.06933(15) -0.19183(16) 0.49531(9) 0.0328(4) Uani 1 1 d . . . . .
H16 H 1.0747 -0.2243 0.4489 0.039 Uiso 1 1 calc R U . . .
C17 C 1.04320(16) -0.25426(15) 0.53696(10) 0.0349(4) Uani 1 1 d . . . . .
H17 H 1.0306 -0.3298 0.5191 0.042 Uiso 1 1 calc R U . . .
C18 C 1.03540(15) -0.20680(15) 0.60457(9) 0.0308(4) Uani 1 1 d . . . . .
H18 H 1.0168 -0.2500 0.6327 0.037 Uiso 1 1 calc R U . . .
C19 C 1.10817(13) 0.09845(14) 0.73732(8) 0.0238(3) Uani 1 1 d . . . . .
C20 C 1.05054(14) 0.18232(15) 0.73835(10) 0.0318(4) Uani 1 1 d . . . . .
H20 H 0.9769 0.1693 0.7324 0.038 Uiso 1 1 calc R U . . .
C21 C 1.09890(17) 0.28524(16) 0.74802(12) 0.0402(5) Uani 1 1 d . . . . .
H21 H 1.0584 0.3419 0.7482 0.048 Uiso 1 1 calc R U . . .
C22 C 1.20567(17) 0.30504(16) 0.75734(11) 0.0390(5) Uani 1 1 d . . . . .
H22 H 1.2390 0.3755 0.7646 0.047 Uiso 1 1 calc R U . . .
C23 C 1.26379(16) 0.22242(18) 0.75607(13) 0.0451(5) Uani 1 1 d . . . . .
H23 H 1.3374 0.2360 0.7618 0.054 Uiso 1 1 calc R U . . .
C24 C 1.21609(15) 0.11943(17) 0.74645(12) 0.0387(5) Uani 1 1 d . . . . .
H24 H 1.2571 0.0631 0.7461 0.046 Uiso 1 1 calc R U . . .
C25 C 0.83787(14) -0.04525(14) 0.90386(8) 0.0253(3) Uani 1 1 d . . . . .
C26 C 0.79707(16) -0.15235(16) 0.88957(10) 0.0335(4) Uani 1 1 d . . . . .
H26 H 0.8223 -0.2048 0.8546 0.040 Uiso 1 1 calc R U . . .
C27 C 0.72015(17) -0.18302(17) 0.92584(11) 0.0372(4) Uani 1 1 d . . . . .
H27 H 0.6932 -0.2562 0.9158 0.045 Uiso 1 1 calc R U . . .
C28 C 0.68259(16) -0.10699(18) 0.97672(10) 0.0376(4) Uani 1 1 d . . . . .
H28 H 0.6303 -0.1279 1.0019 0.045 Uiso 1 1 calc R U . . .
C29 C 0.72166(16) -0.00068(18) 0.99061(10) 0.0366(4) Uani 1 1 d . . . . .
H29 H 0.6953 0.0516 1.0251 0.044 Uiso 1 1 calc R U . . .
C30 C 0.79925(14) 0.03076(16) 0.95467(9) 0.0298(4) Uani 1 1 d . . . . .
H30 H 0.8258 0.1041 0.9648 0.036 Uiso 1 1 calc R U . . .
C31 C 0.97851(14) 0.13161(14) 0.89531(9) 0.0285(4) Uani 1 1 d . . . . .
C32 C 0.92986(18) 0.20803(16) 0.87403(11) 0.0385(4) Uani 1 1 d . . . . .
H32 H 0.8773 0.1859 0.8374 0.046 Uiso 1 1 calc R U . . .
C33 C 0.9571(2) 0.31631(17) 0.90568(13) 0.0491(6) Uani 1 1 d . . . . .
H33 H 0.9228 0.3678 0.8909 0.059 Uiso 1 1 calc R U . . .
C34 C 1.0336(2) 0.34892(18) 0.95835(14) 0.0531(6) Uani 1 1 d . . . . .
H34 H 1.0534 0.4230 0.9794 0.064 Uiso 1 1 calc R U . . .
C35 C 1.0818(2) 0.2741(2) 0.98055(15) 0.0604(7) Uani 1 1 d . . . . .
H35 H 1.1339 0.2969 1.0174 0.072 Uiso 1 1 calc R U . . .
C36 C 1.05473(18) 0.16529(18) 0.94945(12) 0.0446(5) Uani 1 1 d . . . . .
H36 H 1.0882 0.1142 0.9651 0.054 Uiso 1 1 calc R U . . .
B200 B 0.45128(14) 0.57715(14) 0.73091(9) 0.0208(3) Uani 1 1 d . . . . .
C201 C 0.44182(12) 0.70263(13) 0.73404(9) 0.0215(3) Uani 1 1 d . . . . .
C202 C 0.41944(12) 0.73025(13) 0.67487(9) 0.0231(3) Uani 1 1 d . . . . .
H202 H 0.4073 0.6752 0.6334 0.028 Uiso 1 1 calc R U . . .
C203 C 0.41423(12) 0.83575(13) 0.67453(9) 0.0240(3) Uani 1 1 d D . . . .
C204 C 0.43038(12) 0.91832(13) 0.73390(9) 0.0242(3) Uani 1 1 d . . . . .
H204 H 0.4265 0.9903 0.7339 0.029 Uiso 1 1 calc R U . . .
C205 C 0.45244(12) 0.89306(13) 0.79342(9) 0.0232(3) Uani 1 1 d . . . . .
C206 C 0.45959(12) 0.78759(13) 0.79339(9) 0.0222(3) Uani 1 1 d . . . . .
H206 H 0.4770 0.7730 0.8347 0.027 Uiso 1 1 calc R U . . .
C207 C 0.39143(14) 0.85885(14) 0.60899(10) 0.0322(4) Uani 1 1 d D . . . .
F1 F 0.3250(9) 0.7880(6) 0.5667(4) 0.071(2) Uani 0.47(2) 1 d D U P A 1
F2 F 0.3558(10) 0.9524(5) 0.6163(4) 0.072(2) Uani 0.47(2) 1 d D U P A 1
F3 F 0.4765(5) 0.8667(12) 0.5785(5) 0.080(2) Uani 0.47(2) 1 d D U P A 1
F101 F 0.3874(9) 0.9599(3) 0.6143(4) 0.070(2) Uani 0.53(2) 1 d D U P A 2
F102 F 0.4606(6) 0.8270(9) 0.5662(3) 0.072(2) Uani 0.53(2) 1 d D U P A 2
F103 F 0.3021(5) 0.8073(7) 0.5771(4) 0.0636(18) Uani 0.53(2) 1 d D U P A 2
C208 C 0.46908(14) 0.98249(14) 0.85750(9) 0.0278(4) Uani 1 1 d . . . . .
F4 F 0.55956(10) 1.04334(10) 0.86365(7) 0.0483(3) Uani 1 1 d . U . . .
F5 F 0.46833(11) 0.94852(10) 0.91249(6) 0.0425(3) Uani 1 1 d . U . . .
F6 F 0.39540(10) 1.04832(10) 0.86226(7) 0.0467(3) Uani 1 1 d . U . . .
C209 C 0.56840(12) 0.55674(12) 0.70912(9) 0.0212(3) Uani 1 1 d . . . . .
C210 C 0.59021(13) 0.54035(13) 0.64214(9) 0.0237(3) Uani 1 1 d . . . . .
H210 H 0.5347 0.5348 0.6088 0.028 Uiso 1 1 calc R U . . .
C211 C 0.69035(14) 0.53199(13) 0.62278(9) 0.0272(3) Uani 1 1 d D . . . .
C212 C 0.77317(14) 0.53791(14) 0.66968(10) 0.0295(4) Uani 1 1 d . . . . .
H212 H 0.8415 0.5316 0.6565 0.035 Uiso 1 1 calc R U . . .
C213 C 0.75412(13) 0.55330(14) 0.73623(9) 0.0270(3) Uani 1 1 d . . . . .
C214 C 0.65391(13) 0.56399(13) 0.75563(9) 0.0237(3) Uani 1 1 d . . . . .
H214 H 0.6433 0.5766 0.8018 0.028 Uiso 1 1 calc R U . . .
C215 C 0.70968(15) 0.51609(16) 0.55076(11) 0.0392(4) Uani 1 1 d D . . . .
F7 F 0.7985(4) 0.5790(5) 0.5471(3) 0.0365(12) Uani 0.334 1 d D U P B 1
F8 F 0.7284(7) 0.4187(3) 0.5198(3) 0.0543(19) Uani 0.334 1 d D U P B 1
F9 F 0.6370(4) 0.5446(8) 0.5147(3) 0.0526(16) Uani 0.334 1 d D U P B 1
F107 F 0.6579(8) 0.4268(4) 0.5106(2) 0.071(2) Uani 0.333 1 d D U P B 2
F108 F 0.6672(7) 0.5947(5) 0.5288(3) 0.0562(17) Uani 0.333 1 d D U P B 2
F109 F 0.8052(4) 0.5248(10) 0.5388(3) 0.079(2) Uani 0.333 1 d D U P B 2
F207 F 0.7749(5) 0.4375(6) 0.5317(3) 0.0500(17) Uani 0.333 1 d D U P B 3
F208 F 0.6259(4) 0.4764(9) 0.5073(2) 0.068(2) Uani 0.333 1 d D U P B 3
F209 F 0.7567(9) 0.5982(4) 0.5380(3) 0.076(2) Uani 0.333 1 d D U P B 3
C216 C 0.84294(15) 0.55544(17) 0.78638(11) 0.0369(4) Uani 1 1 d . . . . .
F10 F 0.91912(10) 0.63420(13) 0.78934(8) 0.0576(4) Uani 1 1 d . U . . .
F11 F 0.88728(12) 0.46573(12) 0.77097(8) 0.0627(4) Uani 1 1 d . U . . .
F12 F 0.81635(10) 0.57298(14) 0.84873(7) 0.0553(4) Uani 1 1 d . U . . .
C217 C 0.36058(12) 0.49831(13) 0.67632(8) 0.0207(3) Uani 1 1 d . . . . .
C218 C 0.25969(13) 0.52795(13) 0.67179(9) 0.0230(3) Uani 1 1 d . . . . .
H218 H 0.2476 0.5979 0.6964 0.028 Uiso 1 1 calc R U . . .
C219 C 0.17729(13) 0.45879(13) 0.63277(9) 0.0235(3) Uani 1 1 d . . . . .
C220 C 0.19160(13) 0.35622(14) 0.59522(9) 0.0245(3) Uani 1 1 d . . . . .
H220 H 0.1354 0.3088 0.5682 0.029 Uiso 1 1 calc R U . . .
C221 C 0.29001(13) 0.32557(13) 0.59848(8) 0.0223(3) Uani 1 1 d D . . . .
C222 C 0.37285(12) 0.39474(13) 0.63835(8) 0.0221(3) Uani 1 1 d . . . . .
H222 H 0.4395 0.3707 0.6397 0.026 Uiso 1 1 calc R U . . .
C223 C 0.07154(14) 0.49405(15) 0.62929(10) 0.0320(4) Uani 1 1 d . . . . .
F13 F 0.06060(9) 0.58150(10) 0.67834(7) 0.0489(3) Uani 1 1 d . U . . .
F14 F 0.04650(10) 0.51558(12) 0.57137(7) 0.0511(3) Uani 1 1 d . U . . .
F15 F -0.00328(9) 0.41801(10) 0.63249(8) 0.0484(3) Uani 1 1 d . U . . .
C224 C 0.30823(14) 0.21576(14) 0.55869(10) 0.0318(4) Uani 1 1 d D . . . .
F16 F 0.3133(4) 0.1510(3) 0.5992(2) 0.0495(11) Uani 0.601(15) 1 d D U P C 1
F17 F 0.2352(4) 0.1676(4) 0.5111(3) 0.0557(15) Uani 0.601(15) 1 d D U P C 1
F18 F 0.3986(3) 0.2128(3) 0.5334(3) 0.0543(11) Uani 0.601(15) 1 d D U P C 1
F116 F 0.3663(10) 0.2193(5) 0.5076(6) 0.082(3) Uani 0.399(15) 1 d D U P C 2
F117 F 0.3522(11) 0.1593(5) 0.5915(5) 0.086(3) Uani 0.399(15) 1 d D U P C 2
F118 F 0.2205(5) 0.1576(6) 0.5261(5) 0.049(2) Uani 0.399(15) 1 d D U P C 2
C225 C 0.42634(13) 0.55004(13) 0.80099(9) 0.0241(3) Uani 1 1 d . . . . .
C226 C 0.46880(15) 0.46884(14) 0.82137(9) 0.0290(4) Uani 1 1 d . . . . .
H226 H 0.5207 0.4337 0.7967 0.035 Uiso 1 1 calc R U . . .
C227 C 0.43785(18) 0.43746(16) 0.87657(10) 0.0388(5) Uani 1 1 d D . . . .
C228 C 0.3617(2) 0.48554(18) 0.91330(11) 0.0457(5) Uani 1 1 d . . . . .
H228 H 0.3404 0.4644 0.9509 0.055 Uiso 1 1 calc R U . . .
C229 C 0.31724(18) 0.56551(17) 0.89368(11) 0.0408(5) Uani 1 1 d D . . . .
C230 C 0.34922(15) 0.59714(14) 0.83904(10) 0.0304(4) Uani 1 1 d . . . . .
H230 H 0.3177 0.6526 0.8271 0.036 Uiso 1 1 calc R U . . .
C231 C 0.4913(2) 0.3529(2) 0.89658(12) 0.0602(7) Uani 1 1 d D . . . .
F19 F 0.4934(10) 0.2652(6) 0.8477(4) 0.069(3) Uani 0.45(2) 1 d D U P D 1
F20 F 0.5942(4) 0.3904(7) 0.9166(6) 0.074(2) Uani 0.45(2) 1 d D U P D 1
F21 F 0.4567(8) 0.3294(11) 0.9492(5) 0.107(3) Uani 0.45(2) 1 d D U P D 1
F119 F 0.5754(8) 0.3898(6) 0.9373(6) 0.112(3) Uani 0.55(2) 1 d D U P D 2
F120 F 0.4269(9) 0.2976(7) 0.9268(6) 0.103(3) Uani 0.55(2) 1 d D U P D 2
F121 F 0.5158(7) 0.2778(5) 0.8435(3) 0.0503(14) Uani 0.55(2) 1 d D U P D 2
C232 C 0.2323(2) 0.6181(2) 0.93033(14) 0.0668(9) Uani 1 1 d D . . . .
F22 F 0.1570(6) 0.6348(11) 0.8957(3) 0.116(3) Uani 0.414(11) 1 d D U P E 1
F23 F 0.2008(8) 0.5716(6) 0.9758(4) 0.085(3) Uani 0.414(11) 1 d D U P E 1
F24 F 0.2776(6) 0.7165(4) 0.9724(4) 0.091(2) Uani 0.414(11) 1 d D U P E 1
F122 F 0.2201(5) 0.5993(7) 0.9875(2) 0.0849(19) Uani 0.586(11) 1 d D U P E 2
F123 F 0.2318(7) 0.7197(3) 0.9350(5) 0.118(3) Uani 0.586(11) 1 d D U P E 2
F124 F 0.1382(3) 0.5742(5) 0.8931(3) 0.0846(15) Uani 0.586(11) 1 d D U P E 2


_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
Rh1 P1 2.2241(4) . ?
Rh1 P2 2.2272(4) . ?
Rh1 C2 2.2688(16) . ?
Rh1 C5 2.2775(16) . ?
Rh1 C3 2.3059(18) . ?
Rh1 C6 2.3125(16) . ?
Rh1 C4 2.3468(18) . ?
Rh1 C1 2.3837(16) . ?
B1 C1 1.610(2) . ?
B1 N1 1.637(2) . ?
B1 H1A 0.9900 . ?
B1 H1B 0.9900 . ?
C1 C6 1.414(2) . ?
C1 C2 1.423(2) . ?
C2 C3 1.414(3) . ?
C2 H2 1.0000 . ?
C3 C4 1.394(3) . ?
C3 H3 1.0000 . ?
C4 C5 1.406(3) . ?
C4 H4 1.0000 . ?
C5 C6 1.413(3) . ?
C5 H5 1.0000 . ?
C6 H6 1.0000 . ?
N1 C9 1.483(3) . ?
N1 C8 1.483(3) . ?
N1 C7 1.488(2) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
P1 C19 1.8225(17) . ?
P1 C13 1.8272(17) . ?
P1 C10 1.8357(17) . ?
C10 C11 1.527(2) . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C11 C12 1.534(3) . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C12 P2 1.8298(17) . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
P2 C31 1.8213(19) . ?
P2 C25 1.8305(18) . ?
C13 C14 1.393(2) . ?
C13 C18 1.395(3) . ?
C14 C15 1.385(3) . ?
C14 H14 0.9500 . ?
C15 C16 1.380(3) . ?
C15 H15 0.9500 . ?
C16 C17 1.386(3) . ?
C16 H16 0.9500 . ?
C17 C18 1.385(3) . ?
C17 H17 0.9500 . ?
C18 H18 0.9500 . ?
C19 C20 1.384(3) . ?
C19 C24 1.393(2) . ?
C20 C21 1.389(3) . ?
C20 H20 0.9500 . ?
C21 C22 1.378(3) . ?
C21 H21 0.9500 . ?
C22 C23 1.373(3) . ?
C22 H22 0.9500 . ?
C23 C24 1.387(3) . ?
C23 H23 0.9500 . ?
C24 H24 0.9500 . ?
C25 C30 1.392(3) . ?
C25 C26 1.396(3) . ?
C26 C27 1.387(3) . ?
C26 H26 0.9500 . ?
C27 C28 1.387(3) . ?
C27 H27 0.9500 . ?
C28 C29 1.381(3) . ?
C28 H28 0.9500 . ?
C29 C30 1.392(3) . ?
C29 H29 0.9500 . ?
C30 H30 0.9500 . ?
C31 C32 1.390(3) . ?
C31 C36 1.392(3) . ?
C32 C33 1.388(3) . ?
C32 H32 0.9500 . ?
C33 C34 1.374(4) . ?
C33 H33 0.9500 . ?
C34 C35 1.379(4) . ?
C34 H34 0.9500 . ?
C35 C36 1.392(3) . ?
C35 H35 0.9500 . ?
C36 H36 0.9500 . ?
B200 C217 1.639(2) . ?
B200 C225 1.640(2) . ?
B200 C209 1.641(2) . ?
B200 C201 1.646(2) . ?
C201 C202 1.398(2) . ?
C201 C206 1.401(2) . ?
C202 C203 1.394(2) . ?
C202 H202 0.9500 . ?
C203 C204 1.385(2) . ?
C203 C207 1.495(3) . ?
C204 C205 1.388(3) . ?
C204 H204 0.9500 . ?
C205 C206 1.395(2) . ?
C205 C208 1.497(2) . ?
C206 H206 0.9500 . ?
C207 F1 1.294(4) . ?
C207 F101 1.306(4) . ?
C207 F102 1.320(4) . ?
C207 F103 1.320(4) . ?
C207 F3 1.321(5) . ?
C207 F2 1.325(4) . ?
C208 F4 1.335(2) . ?
C208 F6 1.339(2) . ?
C208 F5 1.339(2) . ?
C209 C210 1.402(2) . ?
C209 C214 1.403(2) . ?
C210 C211 1.392(2) . ?
C210 H210 0.9500 . ?
C211 C212 1.386(3) . ?
C211 C215 1.496(3) . ?
C212 C213 1.385(3) . ?
C212 H212 0.9500 . ?
C213 C214 1.396(2) . ?
C213 C216 1.497(3) . ?
C214 H214 0.9500 . ?
C215 F209 1.290(5) . ?
C215 F109 1.283(4) . ?
C215 F9 1.313(4) . ?
C215 F107 1.323(5) . ?
C215 F8 1.314(4) . ?
C215 F208 1.331(4) . ?
C215 F7 1.373(4) . ?
C215 F207 1.385(4) . ?
C215 F108 1.384(4) . ?
C216 F11 1.327(2) . ?
C216 F12 1.328(3) . ?
C216 F10 1.347(3) . ?
C217 C222 1.397(2) . ?
C217 C218 1.407(2) . ?
C218 C219 1.385(2) . ?
C218 H218 0.9500 . ?
C219 C220 1.390(2) . ?
C219 C223 1.494(2) . ?
C220 C221 1.379(2) . ?
C220 H220 0.9500 . ?
C221 C222 1.395(2) . ?
C221 C224 1.496(2) . ?
C222 H222 0.9500 . ?
C223 F13 1.331(2) . ?
C223 F14 1.340(3) . ?
C223 F15 1.344(2) . ?
C224 F117 1.285(5) . ?
C224 F17 1.301(4) . ?
C224 F18 1.317(3) . ?
C224 F118 1.336(4) . ?
C224 F116 1.352(5) . ?
C224 F16 1.356(3) . ?
C225 C226 1.397(3) . ?
C225 C230 1.400(3) . ?
C226 C227 1.395(3) . ?
C226 H226 0.9500 . ?
C227 C228 1.381(3) . ?
C227 C231 1.501(3) . ?
C228 C229 1.387(4) . ?
C228 H228 0.9500 . ?
C229 C230 1.390(3) . ?
C229 C232 1.495(3) . ?
C230 H230 0.9500 . ?
C231 F119 1.302(5) . ?
C231 F19 1.309(5) . ?
C231 F21 1.314(5) . ?
C231 F121 1.338(4) . ?
C231 F120 1.354(5) . ?
C231 F20 1.375(5) . ?
C232 F22 1.249(5) . ?
C232 F122 1.298(4) . ?
C232 F123 1.309(4) . ?
C232 F23 1.328(5) . ?
C232 F124 1.386(5) . ?
C232 F24 1.391(5) . ?

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
P1 Rh1 P2 87.955(15) . . ?
P1 Rh1 C2 99.05(5) . . ?
P2 Rh1 C2 168.20(5) . . ?
P1 Rh1 C5 169.08(5) . . ?
P2 Rh1 C5 99.62(5) . . ?
C2 Rh1 C5 74.88(7) . . ?
P1 Rh1 C3 106.48(5) . . ?
P2 Rh1 C3 150.07(5) . . ?
C2 Rh1 C3 36.01(7) . . ?
C5 Rh1 C3 63.25(7) . . ?
P1 Rh1 C6 148.68(4) . . ?
P2 Rh1 C6 106.43(5) . . ?
C2 Rh1 C6 62.95(6) . . ?
C5 Rh1 C6 35.85(6) . . ?
C3 Rh1 C6 74.73(7) . . ?
P1 Rh1 C4 133.81(5) . . ?
P2 Rh1 C4 117.82(5) . . ?
C2 Rh1 C4 63.50(7) . . ?
C5 Rh1 C4 35.36(7) . . ?
C3 Rh1 C4 34.85(7) . . ?
C6 Rh1 C4 63.64(7) . . ?
P1 Rh1 C1 116.17(4) . . ?
P2 Rh1 C1 132.70(4) . . ?
C2 Rh1 C1 35.51(6) . . ?
C5 Rh1 C1 64.00(6) . . ?
C3 Rh1 C1 64.34(6) . . ?
C6 Rh1 C1 35.01(6) . . ?
C4 Rh1 C1 75.32(6) . . ?
C1 B1 N1 109.82(14) . . ?
C1 B1 H1A 109.7 . . ?
N1 B1 H1A 109.7 . . ?
C1 B1 H1B 109.7 . . ?
N1 B1 H1B 109.7 . . ?
H1A B1 H1B 108.2 . . ?
C6 C1 C2 114.95(15) . . ?
C6 C1 B1 123.30(16) . . ?
C2 C1 B1 121.74(16) . . ?
C6 C1 Rh1 69.74(9) . . ?
C2 C1 Rh1 67.83(9) . . ?
B1 C1 Rh1 131.17(11) . . ?
C3 C2 C1 123.35(17) . . ?
C3 C2 Rh1 73.42(10) . . ?
C1 C2 Rh1 76.66(9) . . ?
C3 C2 H2 118.2 . . ?
C1 C2 H2 118.2 . . ?
Rh1 C2 H2 118.2 . . ?
C4 C3 C2 119.80(17) . . ?
C4 C3 Rh1 74.18(11) . . ?
C2 C3 Rh1 70.57(9) . . ?
C4 C3 H3 119.8 . . ?
C2 C3 H3 119.8 . . ?
Rh1 C3 H3 119.8 . . ?
C3 C4 C5 118.28(17) . . ?
C3 C4 Rh1 70.97(10) . . ?
C5 C4 Rh1 69.63(10) . . ?
C3 C4 H4 120.2 . . ?
C5 C4 H4 120.2 . . ?
Rh1 C4 H4 120.2 . . ?
C4 C5 C6 121.27(17) . . ?
C4 C5 Rh1 75.01(10) . . ?
C6 C5 Rh1 73.42(9) . . ?
C4 C5 H5 119.3 . . ?
C6 C5 H5 119.3 . . ?
Rh1 C5 H5 119.3 . . ?
C5 C6 C1 121.89(17) . . ?
C5 C6 Rh1 70.72(9) . . ?
C1 C6 Rh1 75.25(9) . . ?
C5 C6 H6 118.7 . . ?
C1 C6 H6 118.7 . . ?
Rh1 C6 H6 118.7 . . ?
C9 N1 C8 109.42(17) . . ?
C9 N1 C7 108.43(17) . . ?
C8 N1 C7 108.12(17) . . ?
C9 N1 B1 110.97(15) . . ?
C8 N1 B1 111.60(15) . . ?
C7 N1 B1 108.20(15) . . ?
N1 C7 H7A 109.5 . . ?
N1 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
N1 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C8 H8A 109.5 . . ?
N1 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N1 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
N1 C9 H9A 109.5 . . ?
N1 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
N1 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C19 P1 C13 102.94(8) . . ?
C19 P1 C10 104.98(8) . . ?
C13 P1 C10 102.34(8) . . ?
C19 P1 Rh1 116.17(6) . . ?
C13 P1 Rh1 112.89(5) . . ?
C10 P1 Rh1 115.83(6) . . ?
C11 C10 P1 114.32(12) . . ?
C11 C10 H10A 108.7 . . ?
P1 C10 H10A 108.7 . . ?
C11 C10 H10B 108.7 . . ?
P1 C10 H10B 108.7 . . ?
H10A C10 H10B 107.6 . . ?
C10 C11 C12 114.15(15) . . ?
C10 C11 H11A 108.7 . . ?
C12 C11 H11A 108.7 . . ?
C10 C11 H11B 108.7 . . ?
C12 C11 H11B 108.7 . . ?
H11A C11 H11B 107.6 . . ?
C11 C12 P2 114.96(12) . . ?
C11 C12 H12A 108.5 . . ?
P2 C12 H12A 108.5 . . ?
C11 C12 H12B 108.5 . . ?
P2 C12 H12B 108.5 . . ?
H12A C12 H12B 107.5 . . ?
C31 P2 C12 105.67(9) . . ?
C31 P2 C25 103.54(8) . . ?
C12 P2 C25 101.59(8) . . ?
C31 P2 Rh1 115.74(6) . . ?
C12 P2 Rh1 116.50(6) . . ?
C25 P2 Rh1 112.12(6) . . ?
C14 C13 C18 118.88(16) . . ?
C14 C13 P1 121.81(13) . . ?
C18 C13 P1 119.28(13) . . ?
C15 C14 C13 120.11(17) . . ?
C15 C14 H14 119.9 . . ?
C13 C14 H14 119.9 . . ?
C16 C15 C14 120.77(18) . . ?
C16 C15 H15 119.6 . . ?
C14 C15 H15 119.6 . . ?
C15 C16 C17 119.53(17) . . ?
C15 C16 H16 120.2 . . ?
C17 C16 H16 120.2 . . ?
C18 C17 C16 120.18(18) . . ?
C18 C17 H17 119.9 . . ?
C16 C17 H17 119.9 . . ?
C17 C18 C13 120.52(17) . . ?
C17 C18 H18 119.7 . . ?
C13 C18 H18 119.7 . . ?
C20 C19 C24 118.56(17) . . ?
C20 C19 P1 119.17(13) . . ?
C24 C19 P1 122.23(14) . . ?
C19 C20 C21 120.94(18) . . ?
C19 C20 H20 119.5 . . ?
C21 C20 H20 119.5 . . ?
C22 C21 C20 119.9(2) . . ?
C22 C21 H21 120.0 . . ?
C20 C21 H21 120.0 . . ?
C23 C22 C21 119.71(19) . . ?
C23 C22 H22 120.1 . . ?
C21 C22 H22 120.1 . . ?
C22 C23 C24 120.70(19) . . ?
C22 C23 H23 119.7 . . ?
C24 C23 H23 119.7 . . ?
C23 C24 C19 120.16(19) . . ?
C23 C24 H24 119.9 . . ?
C19 C24 H24 119.9 . . ?
C30 C25 C26 118.94(17) . . ?
C30 C25 P2 122.27(14) . . ?
C26 C25 P2 118.73(14) . . ?
C27 C26 C25 120.69(18) . . ?
C27 C26 H26 119.7 . . ?
C25 C26 H26 119.7 . . ?
C28 C27 C26 120.06(19) . . ?
C28 C27 H27 120.0 . . ?
C26 C27 H27 120.0 . . ?
C29 C28 C27 119.58(18) . . ?
C29 C28 H28 120.2 . . ?
C27 C28 H28 120.2 . . ?
C28 C29 C30 120.73(19) . . ?
C28 C29 H29 119.6 . . ?
C30 C29 H29 119.6 . . ?
C25 C30 C29 119.98(18) . . ?
C25 C30 H30 120.0 . . ?
C29 C30 H30 120.0 . . ?
C32 C31 C36 118.90(18) . . ?
C32 C31 P2 118.42(15) . . ?
C36 C31 P2 122.64(15) . . ?
C33 C32 C31 120.8(2) . . ?
C33 C32 H32 119.6 . . ?
C31 C32 H32 119.6 . . ?
C34 C33 C32 119.9(2) . . ?
C34 C33 H33 120.1 . . ?
C32 C33 H33 120.1 . . ?
C33 C34 C35 120.0(2) . . ?
C33 C34 H34 120.0 . . ?
C35 C34 H34 120.0 . . ?
C34 C35 C36 120.6(2) . . ?
C34 C35 H35 119.7 . . ?
C36 C35 H35 119.7 . . ?
C35 C36 C31 119.8(2) . . ?
C35 C36 H36 120.1 . . ?
C31 C36 H36 120.1 . . ?
C217 B200 C225 102.48(13) . . ?
C217 B200 C209 112.30(13) . . ?
C225 B200 C209 114.31(14) . . ?
C217 B200 C201 110.01(13) . . ?
C225 B200 C201 113.06(13) . . ?
C209 B200 C201 104.87(13) . . ?
C202 C201 C206 116.05(15) . . ?
C202 C201 B200 120.08(14) . . ?
C206 C201 B200 123.80(15) . . ?
C203 C202 C201 122.33(16) . . ?
C203 C202 H202 118.8 . . ?
C201 C202 H202 118.8 . . ?
C204 C203 C202 120.67(16) . . ?
C204 C203 C207 120.25(15) . . ?
C202 C203 C207 119.07(16) . . ?
C203 C204 C205 118.17(15) . . ?
C203 C204 H204 120.9 . . ?
C205 C204 H204 120.9 . . ?
C204 C205 C206 120.97(16) . . ?
C204 C205 C208 117.97(15) . . ?
C206 C205 C208 121.06(16) . . ?
C205 C206 C201 121.78(16) . . ?
C205 C206 H206 119.1 . . ?
C201 C206 H206 119.1 . . ?
F101 C207 F102 106.2(4) . . ?
F101 C207 F103 106.6(4) . . ?
F102 C207 F103 104.3(4) . . ?
F1 C207 F3 107.0(4) . . ?
F1 C207 F2 106.7(4) . . ?
F3 C207 F2 103.9(4) . . ?
F1 C207 C203 114.4(3) . . ?
F101 C207 C203 114.2(3) . . ?
F102 C207 C203 112.8(3) . . ?
F103 C207 C203 112.0(3) . . ?
F3 C207 C203 111.4(3) . . ?
F2 C207 C203 112.7(4) . . ?
F4 C208 F6 106.24(15) . . ?
F4 C208 F5 106.19(16) . . ?
F6 C208 F5 105.99(15) . . ?
F4 C208 C205 112.68(15) . . ?
F6 C208 C205 112.11(15) . . ?
F5 C208 C205 113.10(15) . . ?
C210 C209 C214 115.80(15) . . ?
C210 C209 B200 120.71(14) . . ?
C214 C209 B200 123.24(15) . . ?
C211 C210 C209 122.29(16) . . ?
C211 C210 H210 118.9 . . ?
C209 C210 H210 118.9 . . ?
C212 C211 C210 120.66(17) . . ?
C212 C211 C215 119.17(16) . . ?
C210 C211 C215 120.17(17) . . ?
C213 C212 C211 118.48(16) . . ?
C213 C212 H212 120.8 . . ?
C211 C212 H212 120.8 . . ?
C212 C213 C214 120.64(17) . . ?
C212 C213 C216 118.41(17) . . ?
C214 C213 C216 120.94(17) . . ?
C213 C214 C209 122.11(16) . . ?
C213 C214 H214 118.9 . . ?
C209 C214 H214 118.9 . . ?
F109 C215 F107 111.2(4) . . ?
F9 C215 F8 109.4(4) . . ?
F209 C215 F208 110.2(4) . . ?
F9 C215 F7 104.7(3) . . ?
F8 C215 F7 103.9(3) . . ?
F209 C215 F207 104.3(4) . . ?
F208 C215 F207 102.1(3) . . ?
F109 C215 F108 104.8(4) . . ?
F107 C215 F108 103.0(4) . . ?
F209 C215 C211 115.0(3) . . ?
F109 C215 C211 116.0(3) . . ?
F9 C215 C211 114.5(3) . . ?
F107 C215 C211 112.2(3) . . ?
F8 C215 C211 113.7(3) . . ?
F208 C215 C211 114.2(3) . . ?
F7 C215 C211 109.6(3) . . ?
F207 C215 C211 109.7(3) . . ?
F108 C215 C211 108.4(3) . . ?
F11 C216 F12 108.02(19) . . ?
F11 C216 F10 105.59(17) . . ?
F12 C216 F10 105.37(17) . . ?
F11 C216 C213 112.33(17) . . ?
F12 C216 C213 113.29(16) . . ?
F10 C216 C213 111.70(18) . . ?
C222 C217 C218 115.73(15) . . ?
C222 C217 B200 123.68(14) . . ?
C218 C217 B200 120.10(14) . . ?
C219 C218 C217 122.33(15) . . ?
C219 C218 H218 118.8 . . ?
C217 C218 H218 118.8 . . ?
C218 C219 C220 120.82(15) . . ?
C218 C219 C223 120.41(15) . . ?
C220 C219 C223 118.76(15) . . ?
C221 C220 C219 117.91(15) . . ?
C221 C220 H220 121.0 . . ?
C219 C220 H220 121.0 . . ?
C220 C221 C222 121.34(15) . . ?
C220 C221 C224 119.33(15) . . ?
C222 C221 C224 119.33(15) . . ?
C221 C222 C217 121.86(15) . . ?
C221 C222 H222 119.1 . . ?
C217 C222 H222 119.1 . . ?
F13 C223 F14 106.42(16) . . ?
F13 C223 F15 106.79(16) . . ?
F14 C223 F15 105.05(16) . . ?
F13 C223 C219 113.38(15) . . ?
F14 C223 C219 112.54(16) . . ?
F15 C223 C219 112.08(15) . . ?
F17 C224 F18 109.1(3) . . ?
F117 C224 F118 107.2(4) . . ?
F117 C224 F116 106.8(4) . . ?
F118 C224 F116 102.1(4) . . ?
F17 C224 F16 105.2(3) . . ?
F18 C224 F16 103.5(3) . . ?
F117 C224 C221 116.4(4) . . ?
F17 C224 C221 114.6(3) . . ?
F18 C224 C221 113.4(2) . . ?
F118 C224 C221 112.1(4) . . ?
F116 C224 C221 111.2(3) . . ?
F16 C224 C221 110.3(2) . . ?
C226 C225 C230 115.62(17) . . ?
C226 C225 B200 122.71(15) . . ?
C230 C225 B200 121.06(16) . . ?
C227 C226 C225 122.47(19) . . ?
C227 C226 H226 118.8 . . ?
C225 C226 H226 118.8 . . ?
C228 C227 C226 120.6(2) . . ?
C228 C227 C231 120.7(2) . . ?
C226 C227 C231 118.6(2) . . ?
C227 C228 C229 118.12(19) . . ?
C227 C228 H228 120.9 . . ?
C229 C228 H228 120.9 . . ?
C228 C229 C230 120.9(2) . . ?
C228 C229 C232 120.5(2) . . ?
C230 C229 C232 118.6(2) . . ?
C229 C230 C225 122.22(19) . . ?
C229 C230 H230 118.9 . . ?
C225 C230 H230 118.9 . . ?
F19 C231 F21 110.0(5) . . ?
F119 C231 F121 107.9(4) . . ?
F119 C231 F120 107.5(4) . . ?
F121 C231 F120 103.6(4) . . ?
F19 C231 F20 104.4(5) . . ?
F21 C231 F20 103.9(4) . . ?
F119 C231 C227 114.0(4) . . ?
F19 C231 C227 114.4(4) . . ?
F21 C231 C227 113.9(4) . . ?
F121 C231 C227 112.4(3) . . ?
F120 C231 C227 110.7(4) . . ?
F20 C231 C227 109.2(4) . . ?
F122 C232 F123 111.7(4) . . ?
F22 C232 F23 111.4(5) . . ?
F122 C232 F124 102.8(3) . . ?
F123 C232 F124 101.8(4) . . ?
F22 C232 F24 107.6(5) . . ?
F23 C232 F24 100.0(4) . . ?
F22 C232 C229 117.3(3) . . ?
F122 C232 C229 114.8(4) . . ?
F123 C232 C229 115.6(2) . . ?
F23 C232 C229 112.3(4) . . ?
F124 C232 C229 108.5(3) . . ?
F24 C232 C229 106.6(3) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 B1 C1 C6 -85.7(2) . . . . ?
N1 B1 C1 C2 95.71(19) . . . . ?
N1 B1 C1 Rh1 -177.06(11) . . . . ?
C6 C1 C2 C3 6.5(2) . . . . ?
B1 C1 C2 C3 -174.76(15) . . . . ?
Rh1 C1 C2 C3 59.53(15) . . . . ?
C6 C1 C2 Rh1 -52.99(13) . . . . ?
B1 C1 C2 Rh1 125.72(15) . . . . ?
C1 C2 C3 C4 -3.4(3) . . . . ?
Rh1 C2 C3 C4 57.64(15) . . . . ?
C1 C2 C3 Rh1 -61.04(15) . . . . ?
C2 C3 C4 C5 -3.0(3) . . . . ?
Rh1 C3 C4 C5 52.86(15) . . . . ?
C2 C3 C4 Rh1 -55.89(15) . . . . ?
C3 C4 C5 C6 6.0(3) . . . . ?
Rh1 C4 C5 C6 59.46(15) . . . . ?
C3 C4 C5 Rh1 -53.50(15) . . . . ?
C4 C5 C6 C1 -2.6(3) . . . . ?
Rh1 C5 C6 C1 57.63(15) . . . . ?
C4 C5 C6 Rh1 -60.24(15) . . . . ?
C2 C1 C6 C5 -3.5(2) . . . . ?
B1 C1 C6 C5 177.81(15) . . . . ?
Rh1 C1 C6 C5 -55.54(14) . . . . ?
C2 C1 C6 Rh1 52.02(13) . . . . ?
B1 C1 C6 Rh1 -126.66(15) . . . . ?
C1 B1 N1 C9 63.9(2) . . . . ?
C1 B1 N1 C8 -58.4(2) . . . . ?
C1 B1 N1 C7 -177.24(17) . . . . ?
C19 P1 C10 C11 66.76(14) . . . . ?
C13 P1 C10 C11 173.96(13) . . . . ?
Rh1 P1 C10 C11 -62.79(14) . . . . ?
P1 C10 C11 C12 65.78(18) . . . . ?
C10 C11 C12 P2 -64.45(19) . . . . ?
C11 C12 P2 C31 -70.04(15) . . . . ?
C11 C12 P2 C25 -177.84(13) . . . . ?
C11 C12 P2 Rh1 60.04(15) . . . . ?
C19 P1 C13 C14 -17.60(16) . . . . ?
C10 P1 C13 C14 -126.37(15) . . . . ?
Rh1 P1 C13 C14 108.43(14) . . . . ?
C19 P1 C13 C18 164.32(14) . . . . ?
C10 P1 C13 C18 55.56(16) . . . . ?
Rh1 P1 C13 C18 -69.64(15) . . . . ?
C18 C13 C14 C15 0.0(3) . . . . ?
P1 C13 C14 C15 -178.12(15) . . . . ?
C13 C14 C15 C16 -0.6(3) . . . . ?
C14 C15 C16 C17 0.6(3) . . . . ?
C15 C16 C17 C18 0.0(3) . . . . ?
C16 C17 C18 C13 -0.6(3) . . . . ?
C14 C13 C18 C17 0.6(3) . . . . ?
P1 C13 C18 C17 178.78(15) . . . . ?
C13 P1 C19 C20 99.39(16) . . . . ?
C10 P1 C19 C20 -153.85(15) . . . . ?
Rh1 P1 C19 C20 -24.51(17) . . . . ?
C13 P1 C19 C24 -78.03(18) . . . . ?
C10 P1 C19 C24 28.73(19) . . . . ?
Rh1 P1 C19 C24 158.08(15) . . . . ?
C24 C19 C20 C21 0.2(3) . . . . ?
P1 C19 C20 C21 -177.28(17) . . . . ?
C19 C20 C21 C22 -0.6(3) . . . . ?
C20 C21 C22 C23 0.9(4) . . . . ?
C21 C22 C23 C24 -0.9(4) . . . . ?
C22 C23 C24 C19 0.6(4) . . . . ?
C20 C19 C24 C23 -0.2(3) . . . . ?
P1 C19 C24 C23 177.20(18) . . . . ?
C31 P2 C25 C30 9.70(17) . . . . ?
C12 P2 C25 C30 119.15(16) . . . . ?
Rh1 P2 C25 C30 -115.75(14) . . . . ?
C31 P2 C25 C26 -172.85(15) . . . . ?
C12 P2 C25 C26 -63.40(16) . . . . ?
Rh1 P2 C25 C26 61.70(16) . . . . ?
C30 C25 C26 C27 -0.8(3) . . . . ?
P2 C25 C26 C27 -178.30(16) . . . . ?
C25 C26 C27 C28 0.3(3) . . . . ?
C26 C27 C28 C29 0.5(3) . . . . ?
C27 C28 C29 C30 -0.8(3) . . . . ?
C26 C25 C30 C29 0.4(3) . . . . ?
P2 C25 C30 C29 177.89(14) . . . . ?
C28 C29 C30 C25 0.4(3) . . . . ?
C12 P2 C31 C32 160.71(16) . . . . ?
C25 P2 C31 C32 -92.90(17) . . . . ?
Rh1 P2 C31 C32 30.19(18) . . . . ?
C12 P2 C31 C36 -21.4(2) . . . . ?
C25 P2 C31 C36 85.02(19) . . . . ?
Rh1 P2 C31 C36 -151.89(16) . . . . ?
C36 C31 C32 C33 0.5(3) . . . . ?
P2 C31 C32 C33 178.54(18) . . . . ?
C31 C32 C33 C34 0.6(4) . . . . ?
C32 C33 C34 C35 -1.3(4) . . . . ?
C33 C34 C35 C36 1.0(5) . . . . ?
C34 C35 C36 C31 0.1(4) . . . . ?
C32 C31 C36 C35 -0.9(4) . . . . ?
P2 C31 C36 C35 -178.8(2) . . . . ?
C217 B200 C201 C202 -40.6(2) . . . . ?
C225 B200 C201 C202 -154.53(15) . . . . ?
C209 B200 C201 C202 80.31(18) . . . . ?
C217 B200 C201 C206 142.34(15) . . . . ?
C225 B200 C201 C206 28.5(2) . . . . ?
C209 B200 C201 C206 -96.70(17) . . . . ?
C206 C201 C202 C203 -0.4(2) . . . . ?
B200 C201 C202 C203 -177.67(15) . . . . ?
C201 C202 C203 C204 -0.6(2) . . . . ?
C201 C202 C203 C207 179.09(15) . . . . ?
C202 C203 C204 C205 0.4(2) . . . . ?
C207 C203 C204 C205 -179.30(15) . . . . ?
C203 C204 C205 C206 0.9(2) . . . . ?
C203 C204 C205 C208 -179.57(15) . . . . ?
C204 C205 C206 C201 -2.0(2) . . . . ?
C208 C205 C206 C201 178.47(15) . . . . ?
C202 C201 C206 C205 1.7(2) . . . . ?
B200 C201 C206 C205 178.84(15) . . . . ?
C204 C203 C207 F1 -142.9(7) . . . . ?
C202 C203 C207 F1 37.3(7) . . . . ?
C204 C203 C207 F101 -0.9(6) . . . . ?
C202 C203 C207 F101 179.4(6) . . . . ?
C204 C203 C207 F102 120.4(6) . . . . ?
C202 C203 C207 F102 -59.3(6) . . . . ?
C204 C203 C207 F103 -122.2(5) . . . . ?
C202 C203 C207 F103 58.1(5) . . . . ?
C204 C203 C207 F3 95.6(7) . . . . ?
C202 C203 C207 F3 -84.1(7) . . . . ?
C204 C203 C207 F2 -20.8(7) . . . . ?
C202 C203 C207 F2 159.5(7) . . . . ?
C204 C205 C208 F4 -72.6(2) . . . . ?
C206 C205 C208 F4 106.97(19) . . . . ?
C204 C205 C208 F6 47.2(2) . . . . ?
C206 C205 C208 F6 -133.24(17) . . . . ?
C204 C205 C208 F5 166.96(15) . . . . ?
C206 C205 C208 F5 -13.5(2) . . . . ?
C217 B200 C209 C210 41.8(2) . . . . ?
C225 B200 C209 C210 157.99(14) . . . . ?
C201 B200 C209 C210 -77.64(18) . . . . ?
C217 B200 C209 C214 -144.16(15) . . . . ?
C225 B200 C209 C214 -28.0(2) . . . . ?
C201 B200 C209 C214 96.41(17) . . . . ?
C214 C209 C210 C211 -0.1(2) . . . . ?
B200 C209 C210 C211 174.33(15) . . . . ?
C209 C210 C211 C212 1.1(3) . . . . ?
C209 C210 C211 C215 -179.11(16) . . . . ?
C210 C211 C212 C213 -0.6(3) . . . . ?
C215 C211 C212 C213 179.61(16) . . . . ?
C211 C212 C213 C214 -0.8(3) . . . . ?
C211 C212 C213 C216 177.67(16) . . . . ?
C212 C213 C214 C209 1.8(3) . . . . ?
C216 C213 C214 C209 -176.63(16) . . . . ?
C210 C209 C214 C213 -1.3(2) . . . . ?
B200 C209 C214 C213 -175.62(15) . . . . ?
C212 C211 C215 F209 -72.5(6) . . . . ?
C210 C211 C215 F209 107.7(6) . . . . ?
C212 C211 C215 F109 -10.0(7) . . . . ?
C210 C211 C215 F109 170.2(6) . . . . ?
C212 C211 C215 F9 -159.5(5) . . . . ?
C210 C211 C215 F9 20.7(5) . . . . ?
C212 C211 C215 F107 119.4(5) . . . . ?
C210 C211 C215 F107 -60.4(6) . . . . ?
C212 C211 C215 F8 73.6(5) . . . . ?
C210 C211 C215 F8 -106.2(5) . . . . ?
C212 C211 C215 F208 158.6(5) . . . . ?
C210 C211 C215 F208 -21.2(6) . . . . ?
C212 C211 C215 F7 -42.2(4) . . . . ?
C210 C211 C215 F7 138.0(3) . . . . ?
C212 C211 C215 F207 44.7(4) . . . . ?
C210 C211 C215 F207 -135.1(4) . . . . ?
C212 C211 C215 F108 -127.6(4) . . . . ?
C210 C211 C215 F108 52.6(5) . . . . ?
C212 C213 C216 F11 -58.6(3) . . . . ?
C214 C213 C216 F11 119.9(2) . . . . ?
C212 C213 C216 F12 178.61(17) . . . . ?
C214 C213 C216 F12 -2.9(3) . . . . ?
C212 C213 C216 F10 59.8(2) . . . . ?
C214 C213 C216 F10 -121.71(19) . . . . ?
C225 B200 C217 C222 -91.19(18) . . . . ?
C209 B200 C217 C222 31.9(2) . . . . ?
C201 B200 C217 C222 148.31(15) . . . . ?
C225 B200 C217 C218 80.48(17) . . . . ?
C209 B200 C217 C218 -156.40(15) . . . . ?
C201 B200 C217 C218 -40.0(2) . . . . ?
C222 C217 C218 C219 0.6(2) . . . . ?
B200 C217 C218 C219 -171.69(15) . . . . ?
C217 C218 C219 C220 -0.9(3) . . . . ?
C217 C218 C219 C223 -179.72(17) . . . . ?
C218 C219 C220 C221 0.4(3) . . . . ?
C223 C219 C220 C221 179.26(16) . . . . ?
C219 C220 C221 C222 0.3(3) . . . . ?
C219 C220 C221 C224 -179.97(16) . . . . ?
C220 C221 C222 C217 -0.6(3) . . . . ?
C224 C221 C222 C217 179.70(16) . . . . ?
C218 C217 C222 C221 0.1(2) . . . . ?
B200 C217 C222 C221 172.11(15) . . . . ?
C218 C219 C223 F13 -16.5(3) . . . . ?
C220 C219 C223 F13 164.70(17) . . . . ?
C218 C219 C223 F14 104.4(2) . . . . ?
C220 C219 C223 F14 -74.4(2) . . . . ?
C218 C219 C223 F15 -137.46(18) . . . . ?
C220 C219 C223 F15 43.7(2) . . . . ?
C220 C221 C224 F117 -126.9(8) . . . . ?
C222 C221 C224 F117 52.9(8) . . . . ?
C220 C221 C224 F17 16.7(5) . . . . ?
C222 C221 C224 F17 -163.6(4) . . . . ?
C220 C221 C224 F18 142.8(3) . . . . ?
C222 C221 C224 F18 -37.4(4) . . . . ?
C220 C221 C224 F118 -3.1(6) . . . . ?
C222 C221 C224 F118 176.7(6) . . . . ?
C220 C221 C224 F116 110.5(8) . . . . ?
C222 C221 C224 F116 -69.7(8) . . . . ?
C220 C221 C224 F16 -101.7(3) . . . . ?
C222 C221 C224 F16 78.0(3) . . . . ?
C217 B200 C225 C226 89.07(18) . . . . ?
C209 B200 C225 C226 -32.7(2) . . . . ?
C201 B200 C225 C226 -152.57(16) . . . . ?
C217 B200 C225 C230 -81.59(18) . . . . ?
C209 B200 C225 C230 156.66(15) . . . . ?
C201 B200 C225 C230 36.8(2) . . . . ?
C230 C225 C226 C227 -0.9(3) . . . . ?
B200 C225 C226 C227 -172.05(17) . . . . ?
C225 C226 C227 C228 0.8(3) . . . . ?
C225 C226 C227 C231 -177.23(19) . . . . ?
C226 C227 C228 C229 0.0(3) . . . . ?
C231 C227 C228 C229 178.0(2) . . . . ?
C227 C228 C229 C230 -0.7(3) . . . . ?
C227 C228 C229 C232 178.2(2) . . . . ?
C228 C229 C230 C225 0.6(3) . . . . ?
C232 C229 C230 C225 -178.3(2) . . . . ?
C226 C225 C230 C229 0.2(3) . . . . ?
B200 C225 C230 C229 171.52(17) . . . . ?
C228 C227 C231 F119 -91.1(8) . . . . ?
C226 C227 C231 F119 87.0(8) . . . . ?
C228 C227 C231 F19 129.4(7) . . . . ?
C226 C227 C231 F19 -52.6(8) . . . . ?
C228 C227 C231 F21 1.7(8) . . . . ?
C226 C227 C231 F21 179.8(8) . . . . ?
C228 C227 C231 F121 145.7(5) . . . . ?
C226 C227 C231 F121 -36.2(6) . . . . ?
C228 C227 C231 F120 30.3(7) . . . . ?
C226 C227 C231 F120 -151.6(6) . . . . ?
C228 C227 C231 F20 -114.0(6) . . . . ?
C226 C227 C231 F20 64.1(6) . . . . ?
C228 C229 C232 F22 -137.5(8) . . . . ?
C230 C229 C232 F22 41.4(8) . . . . ?
C228 C229 C232 F122 13.4(5) . . . . ?
C230 C229 C232 F122 -167.7(4) . . . . ?
C228 C229 C232 F123 145.6(6) . . . . ?
C230 C229 C232 F123 -35.5(6) . . . . ?
C228 C229 C232 F23 -6.6(6) . . . . ?
C230 C229 C232 F23 172.3(5) . . . . ?
C228 C229 C232 F124 -101.0(4) . . . . ?
C230 C229 C232 F124 77.9(4) . . . . ?
C228 C229 C232 F24 101.9(5) . . . . ?
C230 C229 C232 F24 -79.2(5) . . . . ?

_refine_diff_density_max         0.727
_refine_diff_density_min         -0.558
_refine_diff_density_rms         0.052

_shelxl_version_number           2014-3


_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: 1,2-difluorobenzene/pentane'
_chemical_properties_physical    
'Air-sensitive, Moisture-sensitive, Oxygen-sensitive'
####################################################################### 
# 
# 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_7
_database_code_depnum_ccdc_archive 'CCDC 1445280'
_audit_update_record             
;
2016-02-18 deposited with the CCDC.
2016-02-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014
_chemical_formula_moiety         'C32 H12 B F24, C23 H48 B N P2 Rh'
_chemical_formula_sum            'C55 H60 B2 F24 N P2 Rh'
_chemical_formula_weight         1377.51

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh 0.0927 3.6045 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      orthorhombic
_space_group_IT_number           61
_space_group_name_H-M_alt        'P b c a'
_space_group_name_Hall           '-P 2ac 2ab'

_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+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'x, -y-1/2, z-1/2'
'-x-1/2, y-1/2, z'

_cell_length_a                   25.3462(3)
_cell_length_b                   18.3643(2)
_cell_length_c                   25.7382(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     11980.2(2)
_cell_formula_units_Z            8
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    31373
_cell_measurement_theta_min      2.9536
_cell_measurement_theta_max      73.1053

_exptl_crystal_description       plate
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.527
_exptl_crystal_F_000             5584
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.10
_exptl_absorpt_coefficient_mu    3.823
_exptl_absorpt_correction_T_min  0.68954
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'SuperNova (Cu) X-ray Source'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Atlas'
_diffrn_detector_area_resol_mean 10.5035
_diffrn_reflns_number            85542
_diffrn_reflns_av_unetI/netI     0.0185
_diffrn_reflns_av_R_equivalents  0.0351
_diffrn_reflns_limit_h_min       -31
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         3.432
_diffrn_reflns_theta_max         73.256
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             11953
_reflns_number_gt                10310
_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 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 Several of the CF3 groups of the [BArF4]- anions have significant 
 disorder. 3 groups were modelled as disordered over 2 sites. All F
 atoms of these groups were also described by the ISOR command. In 
 spite of this modelling some of the F atom ellipsoids remain prolate
 but further attempts to model were not successful.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1061P)²+53.0085P] 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         11953
_refine_ls_number_parameters     860
_refine_ls_number_restraints     243
_refine_ls_R_factor_all          0.0636
_refine_ls_R_factor_gt           0.0549
_refine_ls_wR_factor_ref         0.1666
_refine_ls_wR_factor_gt          0.1531
_refine_ls_goodness_of_fit_ref   0.841
_refine_ls_restrained_S_all      0.862
_refine_ls_shift/su_max          0.004
_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
Rh1 Rh 0.19418(2) 0.17526(2) 0.50362(2) 0.03255(11) Uani 1 1 d . . . . .
C1 C 0.13292(15) 0.2477(2) 0.55047(15) 0.0393(9) Uani 1 1 d . . . . .
C2 C 0.10641(16) 0.2067(3) 0.51242(19) 0.0457(10) Uani 1 1 d . . . . .
H2 H 0.0881 0.2325 0.4833 0.055 Uiso 1 1 calc R U . . .
C3 C 0.11150(18) 0.1288(3) 0.5108(2) 0.0544(13) Uani 1 1 d . . . . .
H3 H 0.0962 0.1018 0.4807 0.065 Uiso 1 1 calc R U . . .
C4 C 0.1406(2) 0.0906(3) 0.5473(2) 0.0608(14) Uani 1 1 d . . . . .
H4 H 0.1468 0.0372 0.5430 0.073 Uiso 1 1 calc R U . . .
C5 C 0.1678(2) 0.1293(3) 0.58469(19) 0.0533(12) Uani 1 1 d . . . . .
H5 H 0.1939 0.1039 0.6074 0.064 Uiso 1 1 calc R U . . .
C6 C 0.16461(18) 0.2066(2) 0.58503(16) 0.0437(10) Uani 1 1 d . . . . .
H6 H 0.1893 0.2338 0.6083 0.052 Uiso 1 1 calc R U . . .
B1 B 0.1266(2) 0.3350(3) 0.55236(19) 0.0420(10) Uani 1 1 d . . . . .
H1A H 0.1304 0.3555 0.5170 0.050 Uiso 1 1 calc R U . . .
H1B H 0.1543 0.3563 0.5747 0.050 Uiso 1 1 calc R U . . .
N1 N 0.06889(15) 0.3545(2) 0.57538(15) 0.0448(8) Uani 1 1 d . . . . .
H1 H 0.0423 0.3261 0.5551 0.054 Uiso 1 1 calc R U . . .
C7 C 0.0633(2) 0.3335(3) 0.6308(2) 0.0552(13) Uani 1 1 d . . . . .
H7A H 0.0886 0.3609 0.6518 0.083 Uiso 1 1 calc R U . . .
H7B H 0.0701 0.2812 0.6345 0.083 Uiso 1 1 calc R U . . .
H7C H 0.0273 0.3443 0.6425 0.083 Uiso 1 1 calc R U . . .
C8 C 0.0565(2) 0.4327(3) 0.5685(2) 0.0574(12) Uani 1 1 d . . . . .
H8A H 0.0200 0.4418 0.5790 0.086 Uiso 1 1 calc R U . . .
H8B H 0.0610 0.4460 0.5319 0.086 Uiso 1 1 calc R U . . .
H8C H 0.0804 0.4619 0.5899 0.086 Uiso 1 1 calc R U . . .
P1 P 0.20233(4) 0.15470(7) 0.41805(4) 0.0396(2) Uani 1 1 d . . . . .
C9 C 0.26078(19) 0.1855(3) 0.38226(17) 0.0516(11) Uani 1 1 d . . . . .
H9A H 0.2850 0.1436 0.3783 0.062 Uiso 1 1 calc R U . . .
H9B H 0.2495 0.2003 0.3470 0.062 Uiso 1 1 calc R U . . .
C10 C 0.2917(2) 0.2486(3) 0.40639(19) 0.0562(12) Uani 1 1 d . . . . .
H10A H 0.3182 0.2663 0.3811 0.067 Uiso 1 1 calc R U . . .
H10B H 0.2673 0.2892 0.4140 0.067 Uiso 1 1 calc R U . . .
C11 C 0.31946(18) 0.2261(3) 0.45599(19) 0.0512(11) Uani 1 1 d . . . . .
H11A H 0.3464 0.2634 0.4642 0.061 Uiso 1 1 calc R U . . .
H11B H 0.3383 0.1798 0.4494 0.061 Uiso 1 1 calc R U . . .
C12 C 0.1464(2) 0.1981(4) 0.3827(2) 0.0617(14) Uani 1 1 d . . . . .
H12 H 0.1132 0.1812 0.4001 0.074 Uiso 1 1 calc R U . . .
C13 C 0.1486(2) 0.2806(3) 0.3894(2) 0.0677(15) Uani 1 1 d . . . . .
H13A H 0.1790 0.3000 0.3704 0.101 Uiso 1 1 calc R U . . .
H13B H 0.1521 0.2925 0.4263 0.101 Uiso 1 1 calc R U . . .
H13C H 0.1162 0.3024 0.3757 0.101 Uiso 1 1 calc R U . . .
C14 C 0.1417(3) 0.1773(4) 0.3255(2) 0.087(2) Uani 1 1 d . . . . .
H14A H 0.1093 0.1983 0.3110 0.130 Uiso 1 1 calc R U . . .
H14B H 0.1405 0.1241 0.3223 0.130 Uiso 1 1 calc R U . . .
H14C H 0.1723 0.1960 0.3064 0.130 Uiso 1 1 calc R U . . .
C15 C 0.2004(2) 0.0584(3) 0.3962(2) 0.0560(12) Uani 1 1 d . . . . .
H15 H 0.2080 0.0583 0.3580 0.067 Uiso 1 1 calc R U . . .
C16 C 0.2442(2) 0.0146(3) 0.4227(2) 0.0655(15) Uani 1 1 d . . . . .
H16A H 0.2369 0.0113 0.4600 0.098 Uiso 1 1 calc R U . . .
H16B H 0.2781 0.0390 0.4172 0.098 Uiso 1 1 calc R U . . .
H16C H 0.2455 -0.0344 0.4077 0.098 Uiso 1 1 calc R U . . .
C17 C 0.1471(3) 0.0207(4) 0.4039(3) 0.084(2) Uani 1 1 d . . . . .
H17A H 0.1474 -0.0266 0.3863 0.127 Uiso 1 1 calc R U . . .
H17B H 0.1190 0.0511 0.3893 0.127 Uiso 1 1 calc R U . . .
H17C H 0.1407 0.0134 0.4411 0.127 Uiso 1 1 calc R U . . .
P2 P 0.27752(4) 0.21397(6) 0.51319(4) 0.0365(2) Uani 1 1 d . . . . .
C18 C 0.27983(18) 0.3045(3) 0.5456(2) 0.0488(10) Uani 1 1 d . . . . .
H18 H 0.2565 0.3016 0.5768 0.059 Uiso 1 1 calc R U . . .
C19 C 0.2568(2) 0.3629(3) 0.5100(2) 0.0584(13) Uani 1 1 d . . . . .
H19A H 0.2512 0.4078 0.5298 0.088 Uiso 1 1 calc R U . . .
H19B H 0.2230 0.3460 0.4959 0.088 Uiso 1 1 calc R U . . .
H19C H 0.2813 0.3724 0.4813 0.088 Uiso 1 1 calc R U . . .
C20 C 0.3349(2) 0.3285(3) 0.5647(3) 0.0700(16) Uani 1 1 d . . . . .
H20A H 0.3582 0.3357 0.5348 0.105 Uiso 1 1 calc R U . . .
H20B H 0.3496 0.2908 0.5874 0.105 Uiso 1 1 calc R U . . .
H20C H 0.3317 0.3742 0.5841 0.105 Uiso 1 1 calc R U . . .
C21 C 0.32164(19) 0.1580(3) 0.55463(19) 0.0537(12) Uani 1 1 d . . . . .
H21 H 0.3581 0.1785 0.5517 0.064 Uiso 1 1 calc R U . . .
C22 C 0.3062(2) 0.1586(4) 0.6123(2) 0.0667(15) Uani 1 1 d . . . . .
H22A H 0.2724 0.1336 0.6168 0.100 Uiso 1 1 calc R U . . .
H22B H 0.3030 0.2091 0.6243 0.100 Uiso 1 1 calc R U . . .
H22C H 0.3335 0.1337 0.6326 0.100 Uiso 1 1 calc R U . . .
C23 C 0.3233(3) 0.0800(3) 0.5354(2) 0.0664(15) Uani 1 1 d . . . . .
H23A H 0.3515 0.0536 0.5534 0.100 Uiso 1 1 calc R U . . .
H23B H 0.3301 0.0795 0.4979 0.100 Uiso 1 1 calc R U . . .
H23C H 0.2894 0.0563 0.5425 0.100 Uiso 1 1 calc R U . . .
B200 B 0.43673(14) 0.29032(19) 0.73604(13) 0.0217(7) Uani 1 1 d . . . . .
C201 C 0.45207(12) 0.29253(17) 0.67447(12) 0.0223(6) Uani 1 1 d . . . . .
C202 C 0.45884(13) 0.22950(17) 0.64466(12) 0.0236(6) Uani 1 1 d . . . . .
H202 H 0.4565 0.1833 0.6611 0.028 Uiso 1 1 calc R U . . .
C203 C 0.46895(13) 0.23256(18) 0.59125(12) 0.0252(7) Uani 1 1 d . . . . .
C204 C 0.47226(13) 0.29861(18) 0.56567(13) 0.0263(7) Uani 1 1 d . . . . .
H204 H 0.4799 0.3007 0.5296 0.032 Uiso 1 1 calc R U . . .
C205 C 0.46420(13) 0.36159(18) 0.59403(12) 0.0256(7) Uani 1 1 d D . . . .
C206 C 0.45436(13) 0.35850(17) 0.64720(12) 0.0234(6) Uani 1 1 d . . . . .
H206 H 0.4490 0.4027 0.6656 0.028 Uiso 1 1 calc R U . . .
C207 C 0.47817(16) 0.16454(19) 0.56075(14) 0.0312(7) Uani 1 1 d . . . . .
F1 F 0.46049(12) 0.10506(12) 0.58417(9) 0.0495(7) Uani 1 1 d . . . . .
F2 F 0.52911(11) 0.15361(16) 0.55015(13) 0.0593(7) Uani 1 1 d . . . . .
F3 F 0.45452(12) 0.16571(13) 0.51416(9) 0.0480(6) Uani 1 1 d . . . . .
C208 C 0.46585(12) 0.43380(19) 0.56708(12) 0.0328(8) Uani 1 1 d D . . . .
F4 F 0.4406(12) 0.4853(5) 0.5942(6) 0.039(3) Uani 0.46(6) 1 d D U P A 1
F5 F 0.5150(3) 0.4577(10) 0.5609(13) 0.084(5) Uani 0.46(6) 1 d D U P A 1
F6 F 0.4435(12) 0.4333(6) 0.5206(6) 0.054(4) Uani 0.46(6) 1 d D U P A 1
F104 F 0.5135(3) 0.4490(5) 0.5484(5) 0.047(3) Uani 0.54(6) 1 d D U P A 2
F105 F 0.4333(5) 0.4360(5) 0.5259(3) 0.035(2) Uani 0.54(6) 1 d D U P A 2
F106 F 0.4516(6) 0.4887(3) 0.5972(4) 0.042(3) Uani 0.54(6) 1 d D U P A 2
C209 C 0.47080(12) 0.23082(17) 0.76986(12) 0.0214(6) Uani 1 1 d . . . . .
C210 C 0.51867(12) 0.20012(18) 0.75441(12) 0.0237(6) Uani 1 1 d . . . . .
H210 H 0.5315 0.2096 0.7204 0.028 Uiso 1 1 calc R U . . .
C211 C 0.54832(13) 0.15580(19) 0.78753(12) 0.0245(6) Uani 1 1 d . . . . .
C212 C 0.53149(13) 0.14116(18) 0.83783(12) 0.0242(6) Uani 1 1 d . . . . .
H212 H 0.5516 0.1112 0.8605 0.029 Uiso 1 1 calc R U . . .
C213 C 0.48436(12) 0.17196(17) 0.85368(12) 0.0234(6) Uani 1 1 d D . . . .
C214 C 0.45467(12) 0.21544(17) 0.82062(12) 0.0224(6) Uani 1 1 d . . . . .
H214 H 0.4224 0.2353 0.8329 0.027 Uiso 1 1 calc R U . . .
C215 C 0.60093(14) 0.1274(2) 0.77105(14) 0.0339(8) Uani 1 1 d . . . . .
F7 F 0.64044(9) 0.16899(19) 0.78941(12) 0.0611(8) Uani 1 1 d . . . . .
F8 F 0.61050(11) 0.06040(16) 0.78826(11) 0.0609(8) Uani 1 1 d . . . . .
F9 F 0.60713(9) 0.12548(15) 0.71966(8) 0.0447(6) Uani 1 1 d . . . . .
C216 C 0.46583(12) 0.16268(18) 0.90831(13) 0.0326(8) Uani 1 1 d D . . . .
F10 F 0.4698(4) 0.2269(2) 0.9343(2) 0.0448(19) Uani 0.63(3) 1 d D U P B 1
F11 F 0.4154(2) 0.1446(5) 0.9120(2) 0.051(2) Uani 0.63(3) 1 d D U P B 1
F12 F 0.4934(3) 0.1157(5) 0.9358(2) 0.040(2) Uani 0.63(3) 1 d D U P B 1
F110 F 0.4229(6) 0.1192(14) 0.9107(4) 0.089(6) Uani 0.37(3) 1 d D U P B 2
F111 F 0.5013(5) 0.1306(10) 0.9388(4) 0.030(3) Uani 0.37(3) 1 d D U P B 2
F112 F 0.4516(10) 0.2238(6) 0.9315(4) 0.090(6) Uani 0.37(3) 1 d D U P B 2
C217 C 0.45098(13) 0.36811(18) 0.76439(12) 0.0235(6) Uani 1 1 d . . . . .
C218 C 0.49885(13) 0.40364(18) 0.75456(12) 0.0244(6) Uani 1 1 d . . . . .
H218 H 0.5224 0.3833 0.7298 0.029 Uiso 1 1 calc R U . . .
C219 C 0.51315(13) 0.46786(18) 0.77994(13) 0.0268(7) Uani 1 1 d . . . . .
C220 C 0.48015(15) 0.49822(19) 0.81690(14) 0.0317(7) Uani 1 1 d . . . . .
H220 H 0.4896 0.5420 0.8342 0.038 Uiso 1 1 calc R U . . .
C221 C 0.43315(15) 0.4634(2) 0.82808(14) 0.0324(8) Uani 1 1 d . . . . .
C222 C 0.41885(14) 0.39971(19) 0.80205(13) 0.0285(7) Uani 1 1 d . . . . .
H222 H 0.3862 0.3772 0.8103 0.034 Uiso 1 1 calc R U . . .
C223 C 0.56486(15) 0.5024(2) 0.76686(14) 0.0326(7) Uani 1 1 d . . . . .
F13 F 0.60464(9) 0.45628(14) 0.76782(12) 0.0528(7) Uani 1 1 d . . . . .
F14 F 0.56474(11) 0.53230(18) 0.71945(11) 0.0605(8) Uani 1 1 d . . . . .
F15 F 0.57710(11) 0.55716(16) 0.79876(12) 0.0622(8) Uani 1 1 d . . . . .
C224 C 0.39646(19) 0.4916(2) 0.86888(17) 0.0458(10) Uani 1 1 d . . . . .
F16 F 0.38909(15) 0.44378(18) 0.90670(11) 0.0721(9) Uani 1 1 d . . . . .
F17 F 0.34818(12) 0.50494(18) 0.84976(12) 0.0645(8) Uani 1 1 d . . . . .
F18 F 0.41176(14) 0.55428(17) 0.88889(13) 0.0746(10) Uani 1 1 d . . . . .
C225 C 0.37342(13) 0.27350(17) 0.73783(11) 0.0220(6) Uani 1 1 d . . . . .
C226 C 0.33687(14) 0.32656(18) 0.72296(13) 0.0263(7) Uani 1 1 d . . . . .
H226 H 0.3493 0.3736 0.7137 0.032 Uiso 1 1 calc R U . . .
C227 C 0.28280(15) 0.3130(2) 0.72126(14) 0.0310(7) Uani 1 1 d . . . . .
C228 C 0.26293(14) 0.2452(2) 0.73491(14) 0.0314(7) Uani 1 1 d . . . . .
H228 H 0.2261 0.2358 0.7343 0.038 Uiso 1 1 calc R U . . .
C229 C 0.29828(13) 0.19175(19) 0.74947(14) 0.0274(7) Uani 1 1 d D . . . .
C230 C 0.35225(12) 0.20516(17) 0.75075(12) 0.0223(6) Uani 1 1 d . . . . .
H230 H 0.3755 0.1670 0.7606 0.027 Uiso 1 1 calc R U . . .
C231 C 0.24552(16) 0.3733(2) 0.70671(17) 0.0416(9) Uani 1 1 d . . . . .
F19 F 0.26328(13) 0.4134(2) 0.66841(15) 0.0878(13) Uani 1 1 d . . . . .
F20 F 0.23774(14) 0.41852(17) 0.74611(14) 0.0752(10) Uani 1 1 d . . . . .
F21 F 0.19801(11) 0.34964(18) 0.69431(16) 0.0722(10) Uani 1 1 d . . . . .
C232 C 0.27747(13) 0.1177(2) 0.76422(15) 0.0406(9) Uani 1 1 d D . . . .
F22 F 0.2885(8) 0.1030(7) 0.8134(3) 0.089(7) Uani 0.222(10) 1 d D U P C 1
F23 F 0.2288(3) 0.1066(6) 0.7581(7) 0.069(6) Uani 0.222(10) 1 d D U P C 1
F24 F 0.3029(6) 0.0668(4) 0.7379(6) 0.074(6) Uani 0.222(10) 1 d D U P C 1
F122 F 0.2507(2) 0.0881(2) 0.72517(19) 0.082(2) Uani 0.778(10) 1 d D U P C 2
F123 F 0.31245(12) 0.07161(19) 0.7786(3) 0.072(2) Uani 0.778(10) 1 d D U P C 2
F124 F 0.2415(2) 0.1221(2) 0.8010(2) 0.084(2) Uani 0.778(10) 1 d D U P C 2


_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
Rh1 P2 2.2422(10) . ?
Rh1 P1 2.2441(11) . ?
Rh1 C3 2.270(4) . ?
Rh1 C6 2.299(4) . ?
Rh1 C2 2.310(4) . ?
Rh1 C5 2.348(4) . ?
Rh1 C4 2.351(4) . ?
Rh1 C1 2.373(4) . ?
C1 C2 1.406(6) . ?
C1 C6 1.416(6) . ?
C1 B1 1.612(7) . ?
C2 C3 1.437(7) . ?
C2 H2 1.0000 . ?
C3 C4 1.385(8) . ?
C3 H3 1.0000 . ?
C4 C5 1.380(8) . ?
C4 H4 1.0000 . ?
C5 C6 1.423(7) . ?
C5 H5 1.0000 . ?
C6 H6 1.0000 . ?
B1 N1 1.618(6) . ?
B1 H1A 0.9900 . ?
B1 H1B 0.9900 . ?
N1 C8 1.479(6) . ?
N1 C7 1.484(6) . ?
N1 H1 1.0000 . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
P1 C9 1.834(5) . ?
P1 C15 1.856(5) . ?
P1 C12 1.864(5) . ?
C9 C10 1.531(8) . ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C10 C11 1.514(7) . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C11 P2 1.830(5) . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C12 C13 1.527(9) . ?
C12 C14 1.527(7) . ?
C12 H12 1.0000 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 C16 1.531(8) . ?
C15 C17 1.532(8) . ?
C15 H15 1.0000 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
P2 C21 1.856(5) . ?
P2 C18 1.861(5) . ?
C18 C19 1.527(7) . ?
C18 C20 1.543(7) . ?
C18 H18 1.0000 . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 C23 1.517(8) . ?
C21 C22 1.535(7) . ?
C21 H21 1.0000 . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
B200 C201 1.632(5) . ?
B200 C225 1.635(5) . ?
B200 C209 1.642(5) . ?
B200 C217 1.644(5) . ?
C201 C202 1.399(5) . ?
C201 C206 1.401(4) . ?
C202 C203 1.400(4) . ?
C202 H202 0.9500 . ?
C203 C204 1.383(5) . ?
C203 C207 1.494(5) . ?
C204 C205 1.383(5) . ?
C204 H204 0.9500 . ?
C205 C206 1.392(4) . ?
C205 C208 1.497(5) . ?
C206 H206 0.9500 . ?
C207 F1 1.326(4) . ?
C207 F2 1.335(5) . ?
C207 F3 1.341(4) . ?
C208 F106 1.322(6) . ?
C208 F6 1.325(6) . ?
C208 F104 1.331(6) . ?
C208 F5 1.331(6) . ?
C208 F4 1.338(6) . ?
C208 F105 1.345(5) . ?
C209 C210 1.396(5) . ?
C209 C214 1.398(4) . ?
C210 C211 1.398(5) . ?
C210 H210 0.9500 . ?
C211 C212 1.389(4) . ?
C211 C215 1.493(5) . ?
C212 C213 1.383(5) . ?
C212 H212 0.9500 . ?
C213 C214 1.388(4) . ?
C213 C216 1.492(5) . ?
C214 H214 0.9500 . ?
C215 F8 1.330(5) . ?
C215 F9 1.332(4) . ?
C215 F7 1.345(5) . ?
C216 F12 1.317(5) . ?
C216 F112 1.321(6) . ?
C216 F11 1.323(5) . ?
C216 F111 1.330(6) . ?
C216 F110 1.350(6) . ?
C216 F10 1.360(5) . ?
C217 C222 1.393(5) . ?
C217 C218 1.401(5) . ?
C218 C219 1.396(5) . ?
C218 H218 0.9500 . ?
C219 C220 1.384(5) . ?
C219 C223 1.494(5) . ?
C220 C221 1.383(5) . ?
C220 H220 0.9500 . ?
C221 C222 1.396(5) . ?
C221 C224 1.495(5) . ?
C222 H222 0.9500 . ?
C223 F13 1.317(5) . ?
C223 F15 1.335(4) . ?
C223 F14 1.338(4) . ?
C224 F18 1.320(5) . ?
C224 F16 1.324(5) . ?
C224 F17 1.342(6) . ?
C225 C226 1.398(5) . ?
C225 C230 1.405(4) . ?
C226 C227 1.394(5) . ?
C226 H226 0.9500 . ?
C227 C228 1.388(5) . ?
C227 C231 1.504(5) . ?
C228 C229 1.381(5) . ?
C228 H228 0.9500 . ?
C229 C230 1.390(4) . ?
C229 C232 1.507(5) . ?
C230 H230 0.9500 . ?
C231 F19 1.311(5) . ?
C231 F21 1.319(5) . ?
C231 F20 1.326(5) . ?
C232 F23 1.261(6) . ?
C232 F123 1.280(4) . ?
C232 F124 1.316(4) . ?
C232 F24 1.322(6) . ?
C232 F22 1.324(6) . ?
C232 F122 1.329(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
P2 Rh1 P1 94.27(4) . . ?
P2 Rh1 C3 168.46(16) . . ?
P1 Rh1 C3 95.84(14) . . ?
P2 Rh1 C6 97.33(12) . . ?
P1 Rh1 C6 165.18(12) . . ?
C3 Rh1 C6 73.66(17) . . ?
P2 Rh1 C2 144.82(12) . . ?
P1 Rh1 C2 103.11(12) . . ?
C3 Rh1 C2 36.56(19) . . ?
C6 Rh1 C2 62.22(17) . . ?
P2 Rh1 C5 106.56(14) . . ?
P1 Rh1 C5 146.90(14) . . ?
C3 Rh1 C5 61.9(2) . . ?
C6 Rh1 C5 35.64(17) . . ?
C2 Rh1 C5 74.23(18) . . ?
P2 Rh1 C4 134.54(16) . . ?
P1 Rh1 C4 114.29(15) . . ?
C3 Rh1 C4 34.8(2) . . ?
C6 Rh1 C4 62.69(18) . . ?
C2 Rh1 C4 64.03(19) . . ?
C5 Rh1 C4 34.2(2) . . ?
P2 Rh1 C1 112.51(10) . . ?
P1 Rh1 C1 130.77(11) . . ?
C3 Rh1 C1 64.22(16) . . ?
C6 Rh1 C1 35.23(15) . . ?
C2 Rh1 C1 34.90(15) . . ?
C5 Rh1 C1 64.12(16) . . ?
C4 Rh1 C1 75.49(17) . . ?
C2 C1 C6 115.1(4) . . ?
C2 C1 B1 120.4(4) . . ?
C6 C1 B1 124.5(4) . . ?
C2 C1 Rh1 70.1(2) . . ?
C6 C1 Rh1 69.5(2) . . ?
B1 C1 Rh1 129.6(3) . . ?
C1 C2 C3 120.6(5) . . ?
C1 C2 Rh1 75.0(2) . . ?
C3 C2 Rh1 70.2(2) . . ?
C1 C2 H2 119.4 . . ?
C3 C2 H2 119.4 . . ?
Rh1 C2 H2 119.4 . . ?
C4 C3 C2 122.2(5) . . ?
C4 C3 Rh1 75.8(3) . . ?
C2 C3 Rh1 73.2(2) . . ?
C4 C3 H3 118.8 . . ?
C2 C3 H3 118.8 . . ?
Rh1 C3 H3 118.8 . . ?
C5 C4 C3 118.5(5) . . ?
C5 C4 Rh1 72.8(3) . . ?
C3 C4 Rh1 69.4(3) . . ?
C5 C4 H4 120.3 . . ?
C3 C4 H4 120.3 . . ?
Rh1 C4 H4 120.3 . . ?
C4 C5 C6 119.4(5) . . ?
C4 C5 Rh1 73.0(3) . . ?
C6 C5 Rh1 70.3(2) . . ?
C4 C5 H5 119.9 . . ?
C6 C5 H5 119.9 . . ?
Rh1 C5 H5 119.9 . . ?
C1 C6 C5 124.0(5) . . ?
C1 C6 Rh1 75.3(2) . . ?
C5 C6 Rh1 74.1(2) . . ?
C1 C6 H6 117.8 . . ?
C5 C6 H6 117.8 . . ?
Rh1 C6 H6 117.8 . . ?
C1 B1 N1 108.8(3) . . ?
C1 B1 H1A 109.9 . . ?
N1 B1 H1A 109.9 . . ?
C1 B1 H1B 109.9 . . ?
N1 B1 H1B 109.9 . . ?
H1A B1 H1B 108.3 . . ?
C8 N1 C7 110.4(4) . . ?
C8 N1 B1 111.3(4) . . ?
C7 N1 B1 112.4(4) . . ?
C8 N1 H1 107.5 . . ?
C7 N1 H1 107.5 . . ?
B1 N1 H1 107.5 . . ?
N1 C7 H7A 109.5 . . ?
N1 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
N1 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C8 H8A 109.5 . . ?
N1 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N1 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C9 P1 C15 99.4(2) . . ?
C9 P1 C12 103.8(3) . . ?
C15 P1 C12 103.8(3) . . ?
C9 P1 Rh1 121.03(16) . . ?
C15 P1 Rh1 117.10(18) . . ?
C12 P1 Rh1 109.68(17) . . ?
C10 C9 P1 116.3(3) . . ?
C10 C9 H9A 108.2 . . ?
P1 C9 H9A 108.2 . . ?
C10 C9 H9B 108.2 . . ?
P1 C9 H9B 108.2 . . ?
H9A C9 H9B 107.4 . . ?
C11 C10 C9 112.0(4) . . ?
C11 C10 H10A 109.2 . . ?
C9 C10 H10A 109.2 . . ?
C11 C10 H10B 109.2 . . ?
C9 C10 H10B 109.2 . . ?
H10A C10 H10B 107.9 . . ?
C10 C11 P2 116.2(3) . . ?
C10 C11 H11A 108.2 . . ?
P2 C11 H11A 108.2 . . ?
C10 C11 H11B 108.2 . . ?
P2 C11 H11B 108.2 . . ?
H11A C11 H11B 107.4 . . ?
C13 C12 C14 111.1(5) . . ?
C13 C12 P1 110.0(4) . . ?
C14 C12 P1 115.0(4) . . ?
C13 C12 H12 106.8 . . ?
C14 C12 H12 106.8 . . ?
P1 C12 H12 106.8 . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C12 C14 H14A 109.5 . . ?
C12 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C12 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C16 C15 C17 110.1(5) . . ?
C16 C15 P1 110.3(4) . . ?
C17 C15 P1 114.6(4) . . ?
C16 C15 H15 107.2 . . ?
C17 C15 H15 107.2 . . ?
P1 C15 H15 107.2 . . ?
C15 C16 H16A 109.5 . . ?
C15 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C15 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C15 C17 H17A 109.5 . . ?
C15 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C15 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C11 P2 C21 100.4(2) . . ?
C11 P2 C18 103.5(2) . . ?
C21 P2 C18 102.6(2) . . ?
C11 P2 Rh1 119.85(17) . . ?
C21 P2 Rh1 117.07(18) . . ?
C18 P2 Rh1 111.24(15) . . ?
C19 C18 C20 109.7(4) . . ?
C19 C18 P2 110.3(4) . . ?
C20 C18 P2 115.2(4) . . ?
C19 C18 H18 107.1 . . ?
C20 C18 H18 107.1 . . ?
P2 C18 H18 107.1 . . ?
C18 C19 H19A 109.5 . . ?
C18 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
C18 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C18 C20 H20A 109.5 . . ?
C18 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C18 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C23 C21 C22 109.3(5) . . ?
C23 C21 P2 110.6(4) . . ?
C22 C21 P2 113.5(4) . . ?
C23 C21 H21 107.8 . . ?
C22 C21 H21 107.8 . . ?
P2 C21 H21 107.8 . . ?
C21 C22 H22A 109.5 . . ?
C21 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
C21 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C21 C23 H23A 109.5 . . ?
C21 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C21 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C201 B200 C225 105.4(2) . . ?
C201 B200 C209 113.9(3) . . ?
C225 B200 C209 112.0(3) . . ?
C201 B200 C217 110.9(3) . . ?
C225 B200 C217 111.6(3) . . ?
C209 B200 C217 103.1(3) . . ?
C202 C201 C206 115.8(3) . . ?
C202 C201 B200 122.8(3) . . ?
C206 C201 B200 121.2(3) . . ?
C203 C202 C201 121.9(3) . . ?
C203 C202 H202 119.1 . . ?
C201 C202 H202 119.1 . . ?
C204 C203 C202 120.9(3) . . ?
C204 C203 C207 118.3(3) . . ?
C202 C203 C207 120.8(3) . . ?
C205 C204 C203 118.2(3) . . ?
C205 C204 H204 120.9 . . ?
C203 C204 H204 120.9 . . ?
C204 C205 C206 120.7(3) . . ?
C204 C205 C208 119.5(3) . . ?
C206 C205 C208 119.8(3) . . ?
C205 C206 C201 122.4(3) . . ?
C205 C206 H206 118.8 . . ?
C201 C206 H206 118.8 . . ?
F1 C207 F2 107.2(3) . . ?
F1 C207 F3 105.6(3) . . ?
F2 C207 F3 104.6(3) . . ?
F1 C207 C203 113.4(3) . . ?
F2 C207 C203 112.6(3) . . ?
F3 C207 C203 112.8(3) . . ?
F106 C208 F104 107.5(5) . . ?
F6 C208 F5 107.1(5) . . ?
F6 C208 F4 105.7(5) . . ?
F5 C208 F4 106.1(5) . . ?
F106 C208 F105 105.7(5) . . ?
F104 C208 F105 105.5(5) . . ?
F106 C208 C205 113.4(4) . . ?
F6 C208 C205 113.6(5) . . ?
F104 C208 C205 112.3(4) . . ?
F5 C208 C205 112.0(5) . . ?
F4 C208 C205 111.8(5) . . ?
F105 C208 C205 112.0(4) . . ?
C210 C209 C214 116.0(3) . . ?
C210 C209 B200 125.1(3) . . ?
C214 C209 B200 118.4(3) . . ?
C209 C210 C211 121.9(3) . . ?
C209 C210 H210 119.0 . . ?
C211 C210 H210 119.0 . . ?
C212 C211 C210 121.1(3) . . ?
C212 C211 C215 118.1(3) . . ?
C210 C211 C215 120.7(3) . . ?
C213 C212 C211 117.4(3) . . ?
C213 C212 H212 121.3 . . ?
C211 C212 H212 121.3 . . ?
C212 C213 C214 121.5(3) . . ?
C212 C213 C216 120.2(3) . . ?
C214 C213 C216 118.2(3) . . ?
C213 C214 C209 122.0(3) . . ?
C213 C214 H214 119.0 . . ?
C209 C214 H214 119.0 . . ?
F8 C215 F9 106.5(3) . . ?
F8 C215 F7 105.8(3) . . ?
F9 C215 F7 106.0(3) . . ?
F8 C215 C211 113.1(3) . . ?
F9 C215 C211 113.4(3) . . ?
F7 C215 C211 111.5(3) . . ?
F12 C216 F11 108.1(4) . . ?
F112 C216 F111 107.1(5) . . ?
F112 C216 F110 105.2(5) . . ?
F111 C216 F110 104.8(6) . . ?
F12 C216 F10 105.3(4) . . ?
F11 C216 F10 104.7(4) . . ?
F12 C216 C213 114.5(4) . . ?
F112 C216 C213 114.5(6) . . ?
F11 C216 C213 113.6(4) . . ?
F111 C216 C213 113.2(5) . . ?
F110 C216 C213 111.3(5) . . ?
F10 C216 C213 110.0(3) . . ?
C222 C217 C218 116.0(3) . . ?
C222 C217 B200 122.8(3) . . ?
C218 C217 B200 121.0(3) . . ?
C219 C218 C217 122.3(3) . . ?
C219 C218 H218 118.9 . . ?
C217 C218 H218 118.9 . . ?
C220 C219 C218 120.3(3) . . ?
C220 C219 C223 120.9(3) . . ?
C218 C219 C223 118.8(3) . . ?
C221 C220 C219 118.5(3) . . ?
C221 C220 H220 120.7 . . ?
C219 C220 H220 120.7 . . ?
C220 C221 C222 120.8(3) . . ?
C220 C221 C224 121.5(3) . . ?
C222 C221 C224 117.7(3) . . ?
C217 C222 C221 122.1(3) . . ?
C217 C222 H222 119.0 . . ?
C221 C222 H222 119.0 . . ?
F13 C223 F15 107.2(3) . . ?
F13 C223 F14 106.4(3) . . ?
F15 C223 F14 104.6(3) . . ?
F13 C223 C219 113.2(3) . . ?
F15 C223 C219 112.7(3) . . ?
F14 C223 C219 112.2(3) . . ?
F18 C224 F16 109.4(4) . . ?
F18 C224 F17 104.6(4) . . ?
F16 C224 F17 105.2(4) . . ?
F18 C224 C221 113.2(4) . . ?
F16 C224 C221 112.0(4) . . ?
F17 C224 C221 111.9(4) . . ?
C226 C225 C230 115.7(3) . . ?
C226 C225 B200 120.7(3) . . ?
C230 C225 B200 123.4(3) . . ?
C227 C226 C225 122.4(3) . . ?
C227 C226 H226 118.8 . . ?
C225 C226 H226 118.8 . . ?
C228 C227 C226 120.6(3) . . ?
C228 C227 C231 119.7(3) . . ?
C226 C227 C231 119.6(3) . . ?
C229 C228 C227 118.1(3) . . ?
C229 C228 H228 121.0 . . ?
C227 C228 H228 121.0 . . ?
C228 C229 C230 121.3(3) . . ?
C228 C229 C232 118.9(3) . . ?
C230 C229 C232 119.9(3) . . ?
C229 C230 C225 121.9(3) . . ?
C229 C230 H230 119.0 . . ?
C225 C230 H230 119.0 . . ?
F19 C231 F21 108.5(4) . . ?
F19 C231 F20 105.9(4) . . ?
F21 C231 F20 104.8(4) . . ?
F19 C231 C227 112.7(3) . . ?
F21 C231 C227 113.0(4) . . ?
F20 C231 C227 111.4(3) . . ?
F123 C232 F124 108.2(4) . . ?
F23 C232 F24 107.4(6) . . ?
F23 C232 F22 107.1(6) . . ?
F24 C232 F22 104.1(6) . . ?
F123 C232 F122 107.6(4) . . ?
F124 C232 F122 102.5(4) . . ?
F23 C232 C229 117.1(5) . . ?
F123 C232 C229 115.3(3) . . ?
F124 C232 C229 111.5(3) . . ?
F24 C232 C229 109.8(5) . . ?
F22 C232 C229 110.5(5) . . ?
F122 C232 C229 110.9(3) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C6 C1 C2 C3 1.1(5) . . . . ?
B1 C1 C2 C3 -179.4(4) . . . . ?
Rh1 C1 C2 C3 55.6(3) . . . . ?
C6 C1 C2 Rh1 -54.5(3) . . . . ?
B1 C1 C2 Rh1 125.0(3) . . . . ?
C1 C2 C3 C4 2.6(6) . . . . ?
Rh1 C2 C3 C4 60.4(4) . . . . ?
C1 C2 C3 Rh1 -57.9(3) . . . . ?
C2 C3 C4 C5 -3.5(7) . . . . ?
Rh1 C3 C4 C5 55.7(4) . . . . ?
C2 C3 C4 Rh1 -59.2(4) . . . . ?
C3 C4 C5 C6 0.8(6) . . . . ?
Rh1 C4 C5 C6 54.8(3) . . . . ?
C3 C4 C5 Rh1 -54.0(4) . . . . ?
C2 C1 C6 C5 -3.9(6) . . . . ?
B1 C1 C6 C5 176.6(4) . . . . ?
Rh1 C1 C6 C5 -58.7(4) . . . . ?
C2 C1 C6 Rh1 54.8(3) . . . . ?
B1 C1 C6 Rh1 -124.7(4) . . . . ?
C4 C5 C6 C1 3.1(6) . . . . ?
Rh1 C5 C6 C1 59.2(3) . . . . ?
C4 C5 C6 Rh1 -56.1(4) . . . . ?
C2 C1 B1 N1 74.3(5) . . . . ?
C6 C1 B1 N1 -106.3(4) . . . . ?
Rh1 C1 B1 N1 162.7(3) . . . . ?
C1 B1 N1 C8 -168.7(4) . . . . ?
C1 B1 N1 C7 66.9(5) . . . . ?
C15 P1 C9 C10 -152.6(4) . . . . ?
C12 P1 C9 C10 100.5(4) . . . . ?
Rh1 P1 C9 C10 -23.0(5) . . . . ?
P1 C9 C10 C11 69.0(5) . . . . ?
C9 C10 C11 P2 -74.0(5) . . . . ?
C9 P1 C12 C13 -66.7(4) . . . . ?
C15 P1 C12 C13 -170.1(4) . . . . ?
Rh1 P1 C12 C13 64.0(4) . . . . ?
C9 P1 C12 C14 59.6(6) . . . . ?
C15 P1 C12 C14 -43.9(6) . . . . ?
Rh1 P1 C12 C14 -169.8(5) . . . . ?
C9 P1 C15 C16 73.9(4) . . . . ?
C12 P1 C15 C16 -179.3(4) . . . . ?
Rh1 P1 C15 C16 -58.2(4) . . . . ?
C9 P1 C15 C17 -161.2(5) . . . . ?
C12 P1 C15 C17 -54.4(5) . . . . ?
Rh1 P1 C15 C17 66.6(5) . . . . ?
C10 C11 P2 C21 161.2(4) . . . . ?
C10 C11 P2 C18 -93.0(4) . . . . ?
C10 C11 P2 Rh1 31.5(5) . . . . ?
C11 P2 C18 C19 62.1(4) . . . . ?
C21 P2 C18 C19 166.1(3) . . . . ?
Rh1 P2 C18 C19 -67.9(3) . . . . ?
C11 P2 C18 C20 -62.7(5) . . . . ?
C21 P2 C18 C20 41.3(5) . . . . ?
Rh1 P2 C18 C20 167.3(4) . . . . ?
C11 P2 C21 C23 -75.8(4) . . . . ?
C18 P2 C21 C23 177.8(4) . . . . ?
Rh1 P2 C21 C23 55.7(4) . . . . ?
C11 P2 C21 C22 161.0(4) . . . . ?
C18 P2 C21 C22 54.5(5) . . . . ?
Rh1 P2 C21 C22 -67.5(5) . . . . ?
C225 B200 C201 C202 -78.3(4) . . . . ?
C209 B200 C201 C202 45.0(4) . . . . ?
C217 B200 C201 C202 160.8(3) . . . . ?
C225 B200 C201 C206 95.6(3) . . . . ?
C209 B200 C201 C206 -141.1(3) . . . . ?
C217 B200 C201 C206 -25.3(4) . . . . ?
C206 C201 C202 C203 2.0(5) . . . . ?
B200 C201 C202 C203 176.2(3) . . . . ?
C201 C202 C203 C204 -0.5(5) . . . . ?
C201 C202 C203 C207 177.5(3) . . . . ?
C202 C203 C204 C205 -1.3(5) . . . . ?
C207 C203 C204 C205 -179.4(3) . . . . ?
C203 C204 C205 C206 1.6(5) . . . . ?
C203 C204 C205 C208 -178.1(3) . . . . ?
C204 C205 C206 C201 0.0(5) . . . . ?
C208 C205 C206 C201 179.7(3) . . . . ?
C202 C201 C206 C205 -1.7(5) . . . . ?
B200 C201 C206 C205 -176.0(3) . . . . ?
C204 C203 C207 F1 -162.7(3) . . . . ?
C202 C203 C207 F1 19.2(5) . . . . ?
C204 C203 C207 F2 75.3(4) . . . . ?
C202 C203 C207 F2 -102.8(4) . . . . ?
C204 C203 C207 F3 -42.8(5) . . . . ?
C202 C203 C207 F3 139.1(3) . . . . ?
C204 C205 C208 F106 172.6(8) . . . . ?
C206 C205 C208 F106 -7.1(9) . . . . ?
C204 C205 C208 F6 39.4(16) . . . . ?
C206 C205 C208 F6 -140.3(16) . . . . ?
C204 C205 C208 F104 -65.3(7) . . . . ?
C206 C205 C208 F104 114.9(7) . . . . ?
C204 C205 C208 F5 -82.2(18) . . . . ?
C206 C205 C208 F5 98.1(18) . . . . ?
C204 C205 C208 F4 158.9(15) . . . . ?
C206 C205 C208 F4 -20.8(16) . . . . ?
C204 C205 C208 F105 53.1(8) . . . . ?
C206 C205 C208 F105 -126.6(7) . . . . ?
C201 B200 C209 C210 19.0(4) . . . . ?
C225 B200 C209 C210 138.6(3) . . . . ?
C217 B200 C209 C210 -101.3(3) . . . . ?
C201 B200 C209 C214 -169.0(3) . . . . ?
C225 B200 C209 C214 -49.4(4) . . . . ?
C217 B200 C209 C214 70.7(3) . . . . ?
C214 C209 C210 C211 0.9(5) . . . . ?
B200 C209 C210 C211 173.0(3) . . . . ?
C209 C210 C211 C212 -0.8(5) . . . . ?
C209 C210 C211 C215 -176.3(3) . . . . ?
C210 C211 C212 C213 0.1(5) . . . . ?
C215 C211 C212 C213 175.7(3) . . . . ?
C211 C212 C213 C214 0.5(5) . . . . ?
C211 C212 C213 C216 -175.8(3) . . . . ?
C212 C213 C214 C209 -0.4(5) . . . . ?
C216 C213 C214 C209 175.9(3) . . . . ?
C210 C209 C214 C213 -0.3(5) . . . . ?
B200 C209 C214 C213 -172.9(3) . . . . ?
C212 C211 C215 F8 40.4(5) . . . . ?
C210 C211 C215 F8 -144.0(3) . . . . ?
C212 C211 C215 F9 161.8(3) . . . . ?
C210 C211 C215 F9 -22.6(5) . . . . ?
C212 C211 C215 F7 -78.7(4) . . . . ?
C210 C211 C215 F7 96.9(4) . . . . ?
C212 C213 C216 F12 -9.3(7) . . . . ?
C214 C213 C216 F12 174.3(6) . . . . ?
C212 C213 C216 F112 130.2(13) . . . . ?
C214 C213 C216 F112 -46.2(13) . . . . ?
C212 C213 C216 F11 -134.1(5) . . . . ?
C214 C213 C216 F11 49.5(6) . . . . ?
C212 C213 C216 F111 7.0(11) . . . . ?
C214 C213 C216 F111 -169.3(10) . . . . ?
C212 C213 C216 F110 -110.7(13) . . . . ?
C214 C213 C216 F110 72.9(13) . . . . ?
C212 C213 C216 F10 109.0(6) . . . . ?
C214 C213 C216 F10 -67.4(5) . . . . ?
C201 B200 C217 C222 141.1(3) . . . . ?
C225 B200 C217 C222 23.9(4) . . . . ?
C209 B200 C217 C222 -96.5(4) . . . . ?
C201 B200 C217 C218 -43.9(4) . . . . ?
C225 B200 C217 C218 -161.1(3) . . . . ?
C209 B200 C217 C218 78.5(3) . . . . ?
C222 C217 C218 C219 -1.5(5) . . . . ?
B200 C217 C218 C219 -176.8(3) . . . . ?
C217 C218 C219 C220 1.1(5) . . . . ?
C217 C218 C219 C223 -179.7(3) . . . . ?
C218 C219 C220 C221 0.3(5) . . . . ?
C223 C219 C220 C221 -179.0(3) . . . . ?
C219 C220 C221 C222 -1.1(6) . . . . ?
C219 C220 C221 C224 177.8(4) . . . . ?
C218 C217 C222 C221 0.7(5) . . . . ?
B200 C217 C222 C221 175.9(3) . . . . ?
C220 C221 C222 C217 0.6(6) . . . . ?
C224 C221 C222 C217 -178.3(4) . . . . ?
C220 C219 C223 F13 130.0(4) . . . . ?
C218 C219 C223 F13 -49.3(4) . . . . ?
C220 C219 C223 F15 8.2(5) . . . . ?
C218 C219 C223 F15 -171.1(3) . . . . ?
C220 C219 C223 F14 -109.6(4) . . . . ?
C218 C219 C223 F14 71.2(4) . . . . ?
C220 C221 C224 F18 5.1(6) . . . . ?
C222 C221 C224 F18 -176.0(4) . . . . ?
C220 C221 C224 F16 -119.2(4) . . . . ?
C222 C221 C224 F16 59.7(5) . . . . ?
C220 C221 C224 F17 122.9(4) . . . . ?
C222 C221 C224 F17 -58.2(5) . . . . ?
C201 B200 C225 C226 -71.6(4) . . . . ?
C209 B200 C225 C226 163.9(3) . . . . ?
C217 B200 C225 C226 48.8(4) . . . . ?
C201 B200 C225 C230 104.1(3) . . . . ?
C209 B200 C225 C230 -20.3(4) . . . . ?
C217 B200 C225 C230 -135.4(3) . . . . ?
C230 C225 C226 C227 0.3(5) . . . . ?
B200 C225 C226 C227 176.4(3) . . . . ?
C225 C226 C227 C228 0.5(5) . . . . ?
C225 C226 C227 C231 177.9(3) . . . . ?
C226 C227 C228 C229 -0.9(5) . . . . ?
C231 C227 C228 C229 -178.2(3) . . . . ?
C227 C228 C229 C230 0.3(5) . . . . ?
C227 C228 C229 C232 -179.7(3) . . . . ?
C228 C229 C230 C225 0.6(5) . . . . ?
C232 C229 C230 C225 -179.4(3) . . . . ?
C226 C225 C230 C229 -0.9(5) . . . . ?
B200 C225 C230 C229 -176.8(3) . . . . ?
C228 C227 C231 F19 -141.6(4) . . . . ?
C226 C227 C231 F19 41.0(6) . . . . ?
C228 C227 C231 F21 -18.2(6) . . . . ?
C226 C227 C231 F21 164.4(4) . . . . ?
C228 C227 C231 F20 99.5(5) . . . . ?
C226 C227 C231 F20 -77.9(5) . . . . ?
C228 C229 C232 F23 6.0(11) . . . . ?
C230 C229 C232 F23 -174.0(10) . . . . ?
C228 C229 C232 F123 -178.3(5) . . . . ?
C230 C229 C232 F123 1.7(6) . . . . ?
C228 C229 C232 F124 -54.3(5) . . . . ?
C230 C229 C232 F124 125.6(4) . . . . ?
C228 C229 C232 F24 128.8(10) . . . . ?
C230 C229 C232 F24 -51.3(10) . . . . ?
C228 C229 C232 F22 -117.0(10) . . . . ?
C230 C229 C232 F22 63.0(10) . . . . ?
C228 C229 C232 F122 59.2(5) . . . . ?
C230 C229 C232 F122 -120.8(4) . . . . ?

_refine_diff_density_max         3.169
_refine_diff_density_min         -1.150
_refine_diff_density_rms         0.094

_vrf_PLAT971_7                   
; 
PROBLEM: Check Calcd Residual Density 0.85A From Rh1 3.00 eA-3  
RESPONSE: There is a peak of residual electron density close to
the Rh1 atom. No evidence of twinning or disorder could be found
and this is likely due to data quality. 
;

_vrf_PLAT094_7                   
; 
PROBLEM: Ratio of Maximum / Minimum Residual Density 2.76 Report  
RESPONSE: The ratio of Maximum / Minimum Residual Density value 
of 2.76 is a little high. No evidence of twinning or disorder 
could be foundand this is likely due to data quality. 
;

_vrf_PLAT213_7                   
; 
PROBLEM: Fxx has ADP max/min Ratio ..... x.x prolat
RESPONSE: The anion CF3 groups contain a significant degree 
of disorder. Attempts have been made to model the disorder but
some ellipsoids are still prolate.
See _refine_special_details. 
;

_vrf_PLAT220_7                   
; 
PROBLEM: Large Non-Solvent F Ueq(max)/Ueq(min) Range 3.1 Ratio
RESPONSE: The anion CF3 groups contain a significant degree 
of disorder. Attempts have been made to model the disorder but
some ellipsoids are still prolate.
See _refine_special_details. 
;

_shelxl_version_number           2014-3


_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: 1,2-difluorobenzene/pentane'
_chemical_properties_physical    
'Air-sensitive, Moisture-sensitive, Oxygen-sensitive'
####################################################################### 
# 
# 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_10
_database_code_depnum_ccdc_archive 'CCDC 1445281'
_audit_update_record             
;
2016-02-18 deposited with the CCDC.
2016-02-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014
_chemical_formula_moiety         'C32 H12 B F24, C26 H56 B N P2 Rh'
_chemical_formula_sum            'C58 H68 B2 F24 N P2 Rh'
_chemical_formula_weight         1421.60

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh 0.0927 3.6045 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 2/c'
_space_group_name_Hall           '-C 2yc'

_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+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   39.5210(18)
_cell_length_b                   12.9114(4)
_cell_length_c                   53.766(2)
_cell_angle_alpha                90
_cell_angle_beta                 110.023(5)
_cell_angle_gamma                90
_cell_volume                     25776.7(19)
_cell_formula_units_Z            16
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    6300
_cell_measurement_theta_min      3.4003
_cell_measurement_theta_max      73.0437

_exptl_crystal_description       block
_exptl_crystal_colour            colourless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.465
_exptl_crystal_F_000             11584
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.28
_exptl_crystal_size_min          0.20
_exptl_absorpt_coefficient_mu    3.571
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_T_min  0.55737
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'SuperNova (Cu) X-ray Source'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Atlas'
_diffrn_detector_area_resol_mean 10.5035
_diffrn_reflns_number            49960
_diffrn_reflns_av_unetI/netI     0.1283
_diffrn_reflns_av_R_equivalents  0.0874
_diffrn_reflns_limit_h_min       -48
_diffrn_reflns_limit_h_max       46
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_l_min       -63
_diffrn_reflns_limit_l_max       65
_diffrn_reflns_theta_min         3.403
_diffrn_reflns_theta_max         73.193
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.963
_diffrn_measured_fraction_theta_full 0.994
_diffrn_reflns_Laue_measured_fraction_max 0.963
_diffrn_reflns_Laue_measured_fraction_full 0.994
_diffrn_reflns_point_group_measured_fraction_max 0.963
_diffrn_reflns_point_group_measured_fraction_full 0.994
_reflns_number_total             24884
_reflns_number_gt                15695
_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 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 The structure has a large R-factor due to the poor quality of the
 crystals and hence the data. The structure also contains a 
 signficant degree of disorder.

 Each Rh centre is also bound to 2 hydride ligands which have been
 detected by NMR spectroscopy and mass spectrometry. Due to the poor
 quality of the data the Rh-bound hydrogen atoms could not be 
 reliably located and refined so they have been omitted.

 The i-propyl groups of the phosphine ligands contain signficant
 disorder. The disorder has been modelled over 2 sites and the
 occupancies allowed to refine freely. The P-C and C-C bonds of
 the disordered components have been fixed to 1.84 and 1.54 Ang
 by the DFIX command respectively. The ellipsoids of the 
 disordered C atoms were described by the ISOR command.

 Some of the CF3 groups of the [BArF4]- anions were also
 disordered.  Some groups were modelled as disordered over 2 sites. 
 All F atoms were also described by the ISOR command.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0930P)²+255.8877P] 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         24884
_refine_ls_number_parameters     1984
_refine_ls_number_restraints     1008
_refine_ls_R_factor_all          0.1404
_refine_ls_R_factor_gt           0.0890
_refine_ls_wR_factor_ref         0.2482
_refine_ls_wR_factor_gt          0.2080
_refine_ls_goodness_of_fit_ref   0.994
_refine_ls_restrained_S_all      1.021
_refine_ls_shift/su_max          0.002
_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
Rh1 Rh 0.01497(2) 0.84510(5) 0.12443(2) 0.03457(15) Uani 1 1 d . . . . .
B1 B -0.0178(3) 0.6996(7) 0.10872(18) 0.040(2) Uani 1 1 d . . . . .
H1A H -0.0278 0.7626 0.1141 0.048 Uiso 1 1 calc R U . . .
H1B H 0.0067 0.7160 0.1087 0.048 Uiso 1 1 calc R U . . .
C1 C -0.0428(3) 0.6653(6) 0.07975(17) 0.043(2) Uani 1 1 d . . . . .
C2 C -0.0809(2) 0.6793(7) 0.07096(19) 0.049(2) Uani 1 1 d . . . . .
H2 H -0.0919 0.7085 0.0825 0.059 Uiso 1 1 calc R U . . .
C3 C -0.1019(3) 0.6501(8) 0.0455(2) 0.059(3) Uani 1 1 d . . . . .
H3 H -0.1272 0.6600 0.0399 0.071 Uiso 1 1 calc R U . . .
C4 C -0.0874(3) 0.6077(8) 0.0282(2) 0.058(3) Uani 1 1 d . . . . .
H4 H -0.1024 0.5877 0.0110 0.070 Uiso 1 1 calc R U . . .
C5 C -0.0499(3) 0.5942(8) 0.03638(19) 0.060(3) Uani 1 1 d . . . . .
H5 H -0.0392 0.5666 0.0245 0.071 Uiso 1 1 calc R U . . .
C6 C -0.0289(3) 0.6208(7) 0.06143(18) 0.047(2) Uani 1 1 d . . . . .
H6 H -0.0037 0.6086 0.0668 0.056 Uiso 1 1 calc R U . . .
N1 N -0.0157(2) 0.6050(6) 0.12985(15) 0.051(2) Uani 1 1 d . . . . .
H1 H 0.0023 0.6269 0.1472 0.061 Uiso 1 1 calc R U . . .
C7 C -0.0501(4) 0.5858(9) 0.1347(2) 0.070(3) Uani 1 1 d . . . . .
H7A H -0.0683 0.5601 0.1184 0.105 Uiso 1 1 calc R U . . .
H7B H -0.0586 0.6506 0.1401 0.105 Uiso 1 1 calc R U . . .
H7C H -0.0462 0.5342 0.1488 0.105 Uiso 1 1 calc R U . . .
C8 C -0.0020(3) 0.5064(7) 0.1224(2) 0.064(3) Uani 1 1 d . . . . .
H8A H 0.0010 0.4549 0.1364 0.095 Uiso 1 1 calc R U . . .
H8B H 0.0212 0.5189 0.1202 0.095 Uiso 1 1 calc R U . . .
H8C H -0.0193 0.4805 0.1058 0.095 Uiso 1 1 calc R U . . .
P1 P 0.04278(6) 0.81697(17) 0.16981(4) 0.0359(4) Uani 1 1 d . . . . .
C9 C 0.0747(3) 0.9203(8) 0.18662(18) 0.051(2) Uani 1 1 d . . . . .
H9 H 0.0833 0.9022 0.2059 0.062 Uiso 1 1 calc R U . . .
C10 C 0.0577(3) 1.0280(8) 0.1846(2) 0.066(3) Uani 1 1 d . . . . .
H10A H 0.0757 1.0771 0.1953 0.100 Uiso 1 1 calc R U . . .
H10B H 0.0373 1.0252 0.1910 0.100 Uiso 1 1 calc R U . . .
H10C H 0.0492 1.0507 0.1661 0.100 Uiso 1 1 calc R U . . .
C11 C 0.1081(3) 0.9219(11) 0.1785(2) 0.067(3) Uani 1 1 d . . . . .
H11A H 0.1011 0.9372 0.1596 0.101 Uiso 1 1 calc R U . . .
H11B H 0.1200 0.8542 0.1822 0.101 Uiso 1 1 calc R U . . .
H11C H 0.1247 0.9754 0.1887 0.101 Uiso 1 1 calc R U . . .
C12 C 0.0729(3) 0.7004(8) 0.1829(2) 0.058(3) Uani 1 1 d . . . . .
H12 H 0.0935 0.7260 0.1983 0.070 Uiso 1 1 calc R U . . .
C13 C 0.0560(4) 0.6095(8) 0.1935(2) 0.071(3) Uani 1 1 d . . . . .
H13A H 0.0352 0.5822 0.1792 0.107 Uiso 1 1 calc R U . . .
H13B H 0.0483 0.6344 0.2080 0.107 Uiso 1 1 calc R U . . .
H13C H 0.0740 0.5545 0.2002 0.107 Uiso 1 1 calc R U . . .
C14 C 0.0891(3) 0.6629(10) 0.1626(2) 0.076(4) Uani 1 1 d . . . . .
H14A H 0.1080 0.6122 0.1708 0.115 Uiso 1 1 calc R U . . .
H14B H 0.0993 0.7219 0.1561 0.115 Uiso 1 1 calc R U . . .
H14C H 0.0702 0.6306 0.1477 0.115 Uiso 1 1 calc R U . . .
C15 C 0.0091(3) 0.8102(9) 0.18729(18) 0.053(2) Uani 1 1 d . . . . .
H15 H -0.0001 0.7375 0.1851 0.063 Uiso 1 1 calc R U . . .
C16 C 0.0248(3) 0.8296(9) 0.21672(19) 0.056(3) Uani 1 1 d . . . . .
H16A H 0.0352 0.8994 0.2199 0.084 Uiso 1 1 calc R U . . .
H16B H 0.0437 0.7785 0.2249 0.084 Uiso 1 1 calc R U . . .
H16C H 0.0058 0.8237 0.2245 0.084 Uiso 1 1 calc R U . . .
C17 C -0.0237(3) 0.8800(10) 0.1742(2) 0.064(3) Uani 1 1 d . . . . .
H17A H -0.0409 0.8727 0.1836 0.096 Uiso 1 1 calc R U . . .
H17B H -0.0353 0.8593 0.1557 0.096 Uiso 1 1 calc R U . . .
H17C H -0.0159 0.9523 0.1750 0.096 Uiso 1 1 calc R U . . .
P2 P -0.00544(6) 0.93581(17) 0.08460(4) 0.0381(5) Uani 1 1 d . . . . .
C18 C -0.0551(2) 0.9471(7) 0.0714(2) 0.050(2) Uani 1 1 d . . . . .
H18 H -0.0642 0.8780 0.0636 0.060 Uiso 1 1 calc R U . . .
C19 C -0.0723(3) 0.9661(10) 0.0926(2) 0.069(3) Uani 1 1 d . . . . .
H19A H -0.0691 1.0388 0.0982 0.104 Uiso 1 1 calc R U . . .
H19B H -0.0608 0.9215 0.1079 0.104 Uiso 1 1 calc R U . . .
H19C H -0.0981 0.9501 0.0853 0.104 Uiso 1 1 calc R U . . .
C20 C -0.0703(3) 1.0259(9) 0.0489(2) 0.076(4) Uani 1 1 d . . . . .
H20A H -0.0967 1.0246 0.0428 0.114 Uiso 1 1 calc R U . . .
H20B H -0.0622 1.0079 0.0341 0.114 Uiso 1 1 calc R U . . .
H20C H -0.0617 1.0954 0.0553 0.114 Uiso 1 1 calc R U . . .
C21 C 0.0123(3) 1.0678(7) 0.08718(18) 0.049(2) Uani 1 1 d . . . . .
H21 H 0.0028 1.0975 0.0689 0.058 Uiso 1 1 calc R U . . .
C22 C 0.0530(3) 1.0738(9) 0.0956(2) 0.063(3) Uani 1 1 d . . . . .
H22A H 0.0601 1.1442 0.0926 0.094 Uiso 1 1 calc R U . . .
H22B H 0.0615 1.0246 0.0852 0.094 Uiso 1 1 calc R U . . .
H22C H 0.0636 1.0567 0.1145 0.094 Uiso 1 1 calc R U . . .
C23 C -0.0008(3) 1.1401(8) 0.1047(2) 0.061(3) Uani 1 1 d . . . . .
H23A H 0.0095 1.2092 0.1048 0.092 Uiso 1 1 calc R U . . .
H23B H 0.0069 1.1127 0.1228 0.092 Uiso 1 1 calc R U . . .
H23C H -0.0271 1.1445 0.0976 0.092 Uiso 1 1 calc R U . . .
C24 C 0.0053(3) 0.8747(8) 0.05680(17) 0.055(3) Uani 1 1 d . . . . .
H24 H -0.0143 0.8232 0.0487 0.066 Uiso 1 1 calc R U . . .
C25 C 0.0057(5) 0.9476(10) 0.0341(2) 0.089(5) Uani 1 1 d . . . . .
H25A H 0.0261 0.9956 0.0406 0.134 Uiso 1 1 calc R U . . .
H25B H -0.0168 0.9870 0.0278 0.134 Uiso 1 1 calc R U . . .
H25C H 0.0082 0.9064 0.0195 0.134 Uiso 1 1 calc R U . . .
C26 C 0.0407(3) 0.8125(10) 0.0665(2) 0.062(3) Uani 1 1 d . . . . .
H26A H 0.0438 0.7756 0.0515 0.094 Uiso 1 1 calc R U . . .
H26B H 0.0397 0.7624 0.0799 0.094 Uiso 1 1 calc R U . . .
H26C H 0.0609 0.8599 0.0741 0.094 Uiso 1 1 calc R U . . .
Rh2 Rh 0.76917(2) 0.80824(4) 0.12478(2) 0.02731(13) Uani 1 1 d . . . . .
B2 B 0.7220(2) 0.7957(7) 0.14139(17) 0.0337(19) Uani 1 1 d . . . . .
H2A H 0.7471 0.7733 0.1508 0.040 Uiso 1 1 calc R U . . .
H2B H 0.7212 0.8298 0.1247 0.040 Uiso 1 1 calc R U . . .
C51 C 0.7102(2) 0.8761(6) 0.15926(15) 0.0339(16) Uani 1 1 d . . . . .
C52 C 0.7219(2) 0.8633(7) 0.18695(15) 0.0371(18) Uani 1 1 d . . . . .
H52 H 0.7372 0.8066 0.1947 0.045 Uiso 1 1 calc R U . . .
C53 C 0.7118(3) 0.9314(8) 0.20339(19) 0.051(2) Uani 1 1 d . . . . .
H53 H 0.7194 0.9192 0.2219 0.061 Uiso 1 1 calc R U . . .
C54 C 0.6910(3) 1.0149(7) 0.1928(2) 0.049(2) Uani 1 1 d . . . . .
H54 H 0.6843 1.0621 0.2039 0.059 Uiso 1 1 calc R U . . .
C55 C 0.6795(3) 1.0305(7) 0.1657(2) 0.053(2) Uani 1 1 d . . . . .
H55 H 0.6651 1.0890 0.1582 0.063 Uiso 1 1 calc R U . . .
C56 C 0.6890(3) 0.9611(7) 0.14937(19) 0.046(2) Uani 1 1 d . . . . .
H56 H 0.6806 0.9730 0.1308 0.055 Uiso 1 1 calc R U . . .
N2 N 0.69607(18) 0.6960(5) 0.13461(13) 0.0374(14) Uani 1 1 d . . . . .
H2C H 0.7061 0.6469 0.1245 0.045 Uiso 1 1 calc R U . . .
C57 C 0.6940(3) 0.6385(7) 0.15804(18) 0.047(2) Uani 1 1 d . . . . .
H57A H 0.6825 0.6824 0.1677 0.070 Uiso 1 1 calc R U . . .
H57B H 0.7183 0.6200 0.1696 0.070 Uiso 1 1 calc R U . . .
H57C H 0.6797 0.5754 0.1521 0.070 Uiso 1 1 calc R U . . .
C58 C 0.6587(3) 0.7240(9) 0.11667(18) 0.055(2) Uani 1 1 d . . . . .
H58A H 0.6433 0.6623 0.1133 0.082 Uiso 1 1 calc R U . . .
H58B H 0.6597 0.7507 0.0999 0.082 Uiso 1 1 calc R U . . .
H58C H 0.6487 0.7772 0.1252 0.082 Uiso 1 1 calc R U . . .
P3 P 0.77610(6) 0.64257(14) 0.11039(4) 0.0313(4) Uani 1 1 d D . . . .
C59A C 0.8027(5) 0.6480(15) 0.0880(3) 0.043(5) Uani 0.567(11) 1 d D U P A 1
H59A H 0.8200 0.7062 0.0952 0.051 Uiso 0.567(11) 1 calc R U P A 1
C60A C 0.8268(4) 0.5567(10) 0.0860(3) 0.042(4) Uani 0.567(11) 1 d D U P A 1
H60A H 0.8125 0.5073 0.0727 0.063 Uiso 0.567(11) 1 calc R U P A 1
H60B H 0.8364 0.5220 0.1032 0.063 Uiso 0.567(11) 1 calc R U P A 1
H60C H 0.8467 0.5827 0.0809 0.063 Uiso 0.567(11) 1 calc R U P A 1
C61A C 0.7785(7) 0.687(2) 0.0602(4) 0.063(6) Uani 0.567(11) 1 d D U P A 1
H61A H 0.7794 0.7626 0.0597 0.095 Uiso 0.567(11) 1 calc R U P A 1
H61B H 0.7536 0.6643 0.0568 0.095 Uiso 0.567(11) 1 calc R U P A 1
H61C H 0.7872 0.6579 0.0467 0.095 Uiso 0.567(11) 1 calc R U P A 1
C59B C 0.8077(7) 0.622(3) 0.0929(5) 0.074(12) Uani 0.433(11) 1 d D U P A 2
H59B H 0.8042 0.5489 0.0861 0.089 Uiso 0.433(11) 1 calc R U P A 2
C60B C 0.8453(7) 0.628(3) 0.1133(6) 0.083(9) Uani 0.433(11) 1 d D U P A 2
H60D H 0.8625 0.6475 0.1047 0.125 Uiso 0.433(11) 1 calc R U P A 2
H60E H 0.8520 0.5598 0.1218 0.125 Uiso 0.433(11) 1 calc R U P A 2
H60F H 0.8457 0.6793 0.1268 0.125 Uiso 0.433(11) 1 calc R U P A 2
C61B C 0.7975(10) 0.693(3) 0.0687(6) 0.073(9) Uani 0.433(11) 1 d D U P A 2
H61D H 0.7988 0.7653 0.0744 0.109 Uiso 0.433(11) 1 calc R U P A 2
H61E H 0.7730 0.6772 0.0570 0.109 Uiso 0.433(11) 1 calc R U P A 2
H61F H 0.8143 0.6821 0.0590 0.109 Uiso 0.433(11) 1 calc R U P A 2
C62A C 0.7380(3) 0.5562(11) 0.0963(3) 0.040(4) Uani 0.567(11) 1 d D U P A 1
H62A H 0.7294 0.5388 0.1113 0.048 Uiso 0.567(11) 1 calc R U P A 1
C63A C 0.7460(5) 0.4527(11) 0.0860(4) 0.053(4) Uani 0.567(11) 1 d D U P A 1
H63A H 0.7247 0.4082 0.0817 0.079 Uiso 0.567(11) 1 calc R U P A 1
H63B H 0.7662 0.4192 0.0997 0.079 Uiso 0.567(11) 1 calc R U P A 1
H63C H 0.7522 0.4639 0.0701 0.079 Uiso 0.567(11) 1 calc R U P A 1
C64A C 0.7066(4) 0.6091(14) 0.0760(3) 0.048(4) Uani 0.567(11) 1 d D U P A 1
H64A H 0.7111 0.6141 0.0592 0.072 Uiso 0.567(11) 1 calc R U P A 1
H64B H 0.7036 0.6787 0.0822 0.072 Uiso 0.567(11) 1 calc R U P A 1
H64C H 0.6846 0.5688 0.0733 0.072 Uiso 0.567(11) 1 calc R U P A 1
C62B C 0.7307(5) 0.5998(17) 0.0862(5) 0.061(7) Uani 0.433(11) 1 d D U P A 2
H62B H 0.7164 0.5759 0.0973 0.074 Uiso 0.433(11) 1 calc R U P A 2
C63B C 0.7302(8) 0.510(2) 0.0677(5) 0.070(8) Uani 0.433(11) 1 d D U P A 2
H63D H 0.7052 0.4921 0.0572 0.105 Uiso 0.433(11) 1 calc R U P A 2
H63E H 0.7420 0.4493 0.0781 0.105 Uiso 0.433(11) 1 calc R U P A 2
H63F H 0.7431 0.5296 0.0557 0.105 Uiso 0.433(11) 1 calc R U P A 2
C64B C 0.7083(7) 0.686(2) 0.0685(5) 0.065(7) Uani 0.433(11) 1 d D U P A 2
H64D H 0.7194 0.7058 0.0554 0.098 Uiso 0.433(11) 1 calc R U P A 2
H64E H 0.7074 0.7458 0.0793 0.098 Uiso 0.433(11) 1 calc R U P A 2
H64F H 0.6838 0.6604 0.0593 0.098 Uiso 0.433(11) 1 calc R U P A 2
C65A C 0.8066(4) 0.5613(12) 0.1375(3) 0.047(4) Uani 0.567(11) 1 d D U P A 1
H65A H 0.8122 0.4972 0.1293 0.057 Uiso 0.567(11) 1 calc R U P A 1
C66A C 0.7872(7) 0.5279(19) 0.1565(4) 0.077(7) Uani 0.567(11) 1 d D U P A 1
H66A H 0.8035 0.4864 0.1709 0.115 Uiso 0.567(11) 1 calc R U P A 1
H66B H 0.7659 0.4865 0.1468 0.115 Uiso 0.567(11) 1 calc R U P A 1
H66C H 0.7796 0.5894 0.1639 0.115 Uiso 0.567(11) 1 calc R U P A 1
C67A C 0.8427(5) 0.6152(15) 0.1527(4) 0.073(6) Uani 0.567(11) 1 d D U P A 1
H67A H 0.8381 0.6767 0.1618 0.110 Uiso 0.567(11) 1 calc R U P A 1
H67B H 0.8546 0.6359 0.1403 0.110 Uiso 0.567(11) 1 calc R U P A 1
H67C H 0.8582 0.5672 0.1658 0.110 Uiso 0.567(11) 1 calc R U P A 1
C65B C 0.7803(6) 0.5480(12) 0.1365(3) 0.049(5) Uani 0.433(11) 1 d D U P A 2
H65B H 0.7563 0.5475 0.1390 0.059 Uiso 0.433(11) 1 calc R U P A 2
C66B C 0.7868(8) 0.4372(13) 0.1302(5) 0.067(7) Uani 0.433(11) 1 d D U P A 2
H66D H 0.8109 0.4314 0.1289 0.101 Uiso 0.433(11) 1 calc R U P A 2
H66E H 0.7687 0.4171 0.1133 0.101 Uiso 0.433(11) 1 calc R U P A 2
H66F H 0.7851 0.3915 0.1443 0.101 Uiso 0.433(11) 1 calc R U P A 2
C67B C 0.8074(6) 0.580(2) 0.1634(4) 0.054(6) Uani 0.433(11) 1 d D U P A 2
H67D H 0.8077 0.5272 0.1766 0.081 Uiso 0.433(11) 1 calc R U P A 2
H67E H 0.8003 0.6467 0.1687 0.081 Uiso 0.433(11) 1 calc R U P A 2
H67F H 0.8314 0.5853 0.1620 0.081 Uiso 0.433(11) 1 calc R U P A 2
P4 P 0.78453(7) 0.98073(15) 0.13530(4) 0.0433(5) Uani 1 1 d D . . . .
C68 C 0.8210(3) 1.0252(7) 0.12348(19) 0.055(3) Uani 1 1 d . . . . .
H68 H 0.8265 1.0986 0.1294 0.066 Uiso 1 1 calc R U . . .
C69 C 0.8106(3) 1.0243(7) 0.09363(17) 0.048(2) Uani 1 1 d . . . . .
H69A H 0.8299 1.0557 0.0886 0.071 Uiso 1 1 calc R U . . .
H69B H 0.7883 1.0640 0.0858 0.071 Uiso 1 1 calc R U . . .
H69C H 0.8067 0.9528 0.0872 0.071 Uiso 1 1 calc R U . . .
C70 C 0.8560(3) 0.9631(8) 0.1356(2) 0.063(3) Uani 1 1 d . U . . .
H70A H 0.8522 0.8918 0.1290 0.094 Uiso 1 1 calc R U . . .
H70B H 0.8628 0.9628 0.1550 0.094 Uiso 1 1 calc R U . . .
H70C H 0.8753 0.9951 0.1307 0.094 Uiso 1 1 calc R U . . .
C71A C 0.7534(5) 1.0853(11) 0.1257(4) 0.031(5) Uani 0.458(18) 1 d D U P B 1
H71A H 0.7393 1.0842 0.1380 0.038 Uiso 0.458(18) 1 calc R U P B 1
C72A C 0.7267(5) 1.0616(18) 0.0980(4) 0.032(5) Uani 0.458(18) 1 d D U P B 1
H72A H 0.7094 1.1186 0.0921 0.048 Uiso 0.458(18) 1 calc R U P B 1
H72B H 0.7138 0.9972 0.0985 0.048 Uiso 0.458(18) 1 calc R U P B 1
H72C H 0.7398 1.0538 0.0856 0.048 Uiso 0.458(18) 1 calc R U P B 1
C73A C 0.7680(5) 1.1956(12) 0.1265(4) 0.029(4) Uani 0.458(18) 1 d D U P B 1
H73A H 0.7796 1.2027 0.1131 0.043 Uiso 0.458(18) 1 calc R U P B 1
H73B H 0.7857 1.2095 0.1441 0.043 Uiso 0.458(18) 1 calc R U P B 1
H73C H 0.7481 1.2452 0.1228 0.043 Uiso 0.458(18) 1 calc R U P B 1
C71B C 0.7441(5) 1.0664(13) 0.1182(4) 0.043(5) Uani 0.542(18) 1 d D U P B 2
H71B H 0.7302 1.0659 0.1307 0.051 Uiso 0.542(18) 1 calc R U P B 2
C72B C 0.7159(7) 1.032(2) 0.0914(5) 0.056(6) Uani 0.542(18) 1 d D U P B 2
H72D H 0.6953 1.0794 0.0865 0.085 Uiso 0.542(18) 1 calc R U P B 2
H72E H 0.7076 0.9615 0.0931 0.085 Uiso 0.542(18) 1 calc R U P B 2
H72F H 0.7270 1.0328 0.0776 0.085 Uiso 0.542(18) 1 calc R U P B 2
C73B C 0.7507(7) 1.1828(13) 0.1150(5) 0.060(6) Uani 0.542(18) 1 d D U P B 2
H73D H 0.7707 1.2071 0.1304 0.090 Uiso 0.542(18) 1 calc R U P B 2
H73E H 0.7289 1.2222 0.1134 0.090 Uiso 0.542(18) 1 calc R U P B 2
H73F H 0.7569 1.1930 0.0990 0.090 Uiso 0.542(18) 1 calc R U P B 2
C74A C 0.8118(4) 1.0116(11) 0.1715(2) 0.023(4) Uani 0.458(18) 1 d D U P B 1
H74A H 0.8366 1.0397 0.1749 0.028 Uiso 0.458(18) 1 calc R U P B 1
C75A C 0.8093(9) 0.916(2) 0.1877(6) 0.065(8) Uani 0.458(18) 1 d D U P B 1
H75A H 0.8333 0.8858 0.1959 0.097 Uiso 0.458(18) 1 calc R U P B 1
H75B H 0.7932 0.8650 0.1761 0.097 Uiso 0.458(18) 1 calc R U P B 1
H75C H 0.7997 0.9366 0.2016 0.097 Uiso 0.458(18) 1 calc R U P B 1
C76A C 0.7891(4) 1.0671(13) 0.1860(3) 0.030(4) Uani 0.458(18) 1 d D U P B 1
H76A H 0.7657 1.0324 0.1818 0.045 Uiso 0.458(18) 1 calc R U P B 1
H76B H 0.7853 1.1395 0.1803 0.045 Uiso 0.458(18) 1 calc R U P B 1
H76C H 0.8018 1.0643 0.2052 0.045 Uiso 0.458(18) 1 calc R U P B 1
C74B C 0.7929(6) 1.0006(13) 0.1710(3) 0.063(6) Uani 0.542(18) 1 d D U P B 2
H74B H 0.7703 0.9889 0.1751 0.075 Uiso 0.542(18) 1 calc R U P B 2
C75B C 0.8241(5) 0.9155(15) 0.1868(3) 0.041(4) Uani 0.542(18) 1 d D U P B 2
H75D H 0.8412 0.9070 0.1773 0.062 Uiso 0.542(18) 1 calc R U P B 2
H75E H 0.8127 0.8488 0.1876 0.062 Uiso 0.542(18) 1 calc R U P B 2
H75F H 0.8370 0.9404 0.2048 0.062 Uiso 0.542(18) 1 calc R U P B 2
C76B C 0.8072(5) 1.1129(13) 0.1787(4) 0.057(5) Uani 0.542(18) 1 d D U P B 2
H76D H 0.8315 1.1190 0.1779 0.085 Uiso 0.542(18) 1 calc R U P B 2
H76E H 0.8079 1.1280 0.1968 0.085 Uiso 0.542(18) 1 calc R U P B 2
H76F H 0.7912 1.1624 0.1664 0.085 Uiso 0.542(18) 1 calc R U P B 2
B200 B 0.1389(2) 0.7789(7) 0.02087(16) 0.0280(17) Uani 1 1 d . . . . .
C201 C 0.17698(19) 0.7194(5) 0.02345(13) 0.0263(14) Uani 1 1 d . . . . .
C202 C 0.1764(2) 0.6123(6) 0.01832(15) 0.0308(15) Uani 1 1 d . . . . .
H202 H 0.1538 0.5778 0.0123 0.037 Uiso 1 1 calc R U . . .
C203 C 0.2074(2) 0.5549(6) 0.02168(15) 0.0329(16) Uani 1 1 d . . . . .
C204 C 0.2408(2) 0.6041(6) 0.02953(14) 0.0333(16) Uani 1 1 d . . . . .
H204 H 0.2620 0.5661 0.0313 0.040 Uiso 1 1 calc R U . . .
C205 C 0.2424(2) 0.7086(6) 0.03470(13) 0.0288(15) Uani 1 1 d . . . . .
C206 C 0.21133(19) 0.7644(6) 0.03202(13) 0.0262(14) Uani 1 1 d . . . . .
H206 H 0.2134 0.8362 0.0362 0.031 Uiso 1 1 calc R U . . .
C207 C 0.2042(2) 0.4417(7) 0.0153(2) 0.049(2) Uani 1 1 d . . . . .
F1 F 0.17641(17) 0.3975(4) 0.02017(17) 0.077(2) Uani 1 1 d . U . . .
F2 F 0.23296(16) 0.3888(4) 0.03038(13) 0.0630(16) Uani 1 1 d . U . . .
F3 F 0.1994(2) 0.4226(5) -0.00929(13) 0.087(2) Uani 1 1 d . U . . .
C208 C 0.2778(2) 0.7623(7) 0.04385(14) 0.0343(17) Uani 1 1 d . . . . .
F4 F 0.30333(13) 0.7102(5) 0.03779(11) 0.0577(15) Uani 1 1 d . U . . .
F5 F 0.29099(13) 0.7773(4) 0.07000(9) 0.0429(11) Uani 1 1 d . U . . .
F6 F 0.27629(14) 0.8571(4) 0.03303(10) 0.0539(14) Uani 1 1 d . U . . .
C209 C 0.13292(19) 0.7497(6) 0.04873(14) 0.0278(14) Uani 1 1 d . . . . .
C210 C 0.14624(19) 0.8115(6) 0.07134(14) 0.0300(15) Uani 1 1 d . . . . .
H210 H 0.1583 0.8741 0.0703 0.036 Uiso 1 1 calc R U . . .
C211 C 0.1424(2) 0.7846(7) 0.09527(15) 0.0359(17) Uani 1 1 d . . . . .
C212 C 0.1258(2) 0.6928(7) 0.09823(16) 0.0422(19) Uani 1 1 d . . . . .
H212 H 0.1232 0.6745 0.1146 0.051 Uiso 1 1 calc R U . . .
C213 C 0.1132(2) 0.6291(7) 0.07627(15) 0.0408(19) Uani 1 1 d D . . . .
C214 C 0.1164(2) 0.6571(6) 0.05216(15) 0.0325(16) Uani 1 1 d . . . . .
H214 H 0.1071 0.6117 0.0375 0.039 Uiso 1 1 calc R U . . .
C215 C 0.1553(2) 0.8596(8) 0.11770(16) 0.047(2) Uani 1 1 d . . . . .
F7 F 0.18807(15) 0.8958(5) 0.12157(11) 0.0601(15) Uani 1 1 d . U . . .
F8 F 0.15546(16) 0.8211(5) 0.14079(10) 0.0647(16) Uani 1 1 d . U . . .
F9 F 0.13359(19) 0.9440(5) 0.11357(12) 0.078(2) Uani 1 1 d . U . . .
C216 C 0.0953(2) 0.5297(7) 0.07855(13) 0.058(3) Uani 1 1 d D . . . .
F10 F 0.0854(5) 0.5261(9) 0.0993(3) 0.118(6) Uani 0.75(2) 1 d D U P C 1
F11 F 0.0662(3) 0.5123(10) 0.0584(2) 0.115(6) Uani 0.75(2) 1 d D U P C 1
F12 F 0.1156(3) 0.4493(5) 0.0803(4) 0.099(5) Uani 0.75(2) 1 d D U P C 1
F110 F 0.0867(9) 0.4729(15) 0.0572(4) 0.069(10) Uani 0.25(2) 1 d D U P C 2
F111 F 0.1152(5) 0.4695(14) 0.0973(5) 0.062(10) Uani 0.25(2) 1 d D U P C 2
F112 F 0.0654(5) 0.5414(11) 0.0834(7) 0.063(9) Uani 0.25(2) 1 d D U P C 2
C217 C 0.1069(2) 0.7375(6) -0.00523(14) 0.0295(15) Uani 1 1 d . . . . .
C218 C 0.1137(2) 0.7159(6) -0.02877(15) 0.0310(16) Uani 1 1 d . . . . .
H218 H 0.1377 0.7216 -0.0287 0.037 Uiso 1 1 calc R U . . .
C219 C 0.0867(2) 0.6863(6) -0.05211(15) 0.0387(18) Uani 1 1 d D . . . .
C220 C 0.0514(2) 0.6761(6) -0.05280(16) 0.0371(18) Uani 1 1 d . . . . .
H220 H 0.0328 0.6544 -0.0685 0.045 Uiso 1 1 calc R U . . .
C221 C 0.0442(2) 0.6985(5) -0.03001(14) 0.0360(17) Uani 1 1 d D . . . .
C222 C 0.0707(2) 0.7292(6) -0.00693(15) 0.0314(15) Uani 1 1 d . . . . .
H222 H 0.0644 0.7451 0.0082 0.038 Uiso 1 1 calc R U . . .
C223 C 0.09613(17) 0.6672(5) -0.07630(16) 0.050(2) Uani 1 1 d D . . . .
F13 F 0.0688(3) 0.6904(18) -0.09846(15) 0.049(5) Uani 0.43(4) 1 d D U P D 1
F14 F 0.1241(4) 0.7184(19) -0.0774(3) 0.063(6) Uani 0.43(4) 1 d D U P D 1
F15 F 0.1024(7) 0.5670(8) -0.0790(3) 0.066(7) Uani 0.43(4) 1 d D U P D 1
F113 F 0.1211(7) 0.5940(18) -0.0725(3) 0.108(7) Uani 0.57(4) 1 d D U P D 2
F114 F 0.0689(3) 0.641(2) -0.09734(19) 0.083(6) Uani 0.57(4) 1 d D U P D 2
F115 F 0.1110(7) 0.7514(12) -0.0829(3) 0.078(6) Uani 0.57(4) 1 d D U P D 2
C224 C 0.0065(2) 0.6895(5) -0.03012(11) 0.047(2) Uani 1 1 d D . . . .
F16 F -0.0084(3) 0.7804(8) -0.0294(4) 0.052(6) Uani 0.37(3) 1 d D U P E 1
F17 F 0.0034(3) 0.6370(17) -0.0103(3) 0.077(8) Uani 0.37(3) 1 d D U P E 1
F18 F -0.0154(3) 0.6448(18) -0.0517(3) 0.069(7) Uani 0.37(3) 1 d D U P E 1
F116 F 0.0006(3) 0.6021(11) -0.0195(4) 0.080(5) Uani 0.63(3) 1 d D U P E 2
F117 F -0.0183(2) 0.6929(16) -0.05362(19) 0.092(6) Uani 0.63(3) 1 d D U P E 2
F118 F -0.0022(3) 0.7621(13) -0.0162(5) 0.122(7) Uani 0.63(3) 1 d D U P E 2
C225 C 0.14045(19) 0.9038(6) 0.01680(14) 0.0282(15) Uani 1 1 d . . . . .
C226 C 0.1602(2) 0.9495(6) 0.00241(15) 0.0304(15) Uani 1 1 d . . . . .
H226 H 0.1743 0.9064 -0.0045 0.036 Uiso 1 1 calc R U . . .
C227 C 0.1598(2) 1.0559(5) -0.00206(15) 0.0375(18) Uani 1 1 d D . . . .
C228 C 0.1389(2) 1.1221(6) 0.00673(16) 0.0378(18) Uani 1 1 d . . . . .
H228 H 0.1385 1.1944 0.0034 0.045 Uiso 1 1 calc R U . . .
C229 C 0.11830(19) 1.0794(5) 0.02052(13) 0.0306(15) Uani 1 1 d D . . . .
C230 C 0.11902(19) 0.9726(6) 0.02528(14) 0.0289(15) Uani 1 1 d . . . . .
H230 H 0.1044 0.9455 0.0346 0.035 Uiso 1 1 calc R U . . .
C231 C 0.1836(2) 1.0980(5) -0.01548(15) 0.071(4) Uani 1 1 d D . . . .
F19 F 0.1780(3) 1.0651(10) -0.03926(15) 0.052(4) Uani 0.51(2) 1 d D U P F 1
F20 F 0.1869(3) 1.1983(5) -0.0149(2) 0.047(4) Uani 0.51(2) 1 d D U P F 1
F21 F 0.2186(2) 1.0677(8) -0.0023(2) 0.054(4) Uani 0.51(2) 1 d D U P F 1
F119 F 0.2154(4) 1.128(2) -0.0010(3) 0.168(11) Uani 0.49(2) 1 d D U P F 2
F120 F 0.1877(4) 1.0365(9) -0.0339(2) 0.047(4) Uani 0.49(2) 1 d D U P F 2
F121 F 0.1687(6) 1.1828(11) -0.0300(5) 0.152(9) Uani 0.49(2) 1 d D U P F 2
C232 C 0.0955(2) 1.1473(5) 0.03055(13) 0.045(2) Uani 1 1 d D . . . .
F22 F 0.1069(3) 1.2443(5) 0.0337(3) 0.082(5) Uani 0.675(19) 1 d D U P G 1
F23 F 0.0624(2) 1.1513(12) 0.0144(2) 0.125(7) Uani 0.675(19) 1 d D U P G 1
F24 F 0.0945(4) 1.1200(7) 0.05360(19) 0.078(4) Uani 0.675(19) 1 d D U P G 1
F122 F 0.0691(4) 1.0970(10) 0.0351(5) 0.068(7) Uani 0.325(19) 1 d D U P G 2
F123 F 0.1133(4) 1.1921(18) 0.0530(3) 0.101(11) Uani 0.325(19) 1 d D U P G 2
F124 F 0.0793(5) 1.2214(13) 0.0143(3) 0.074(8) Uani 0.325(19) 1 d D U P G 2
B300 B 0.8738(2) 0.3473(6) 0.24270(16) 0.0272(16) Uani 1 1 d . . . . .
C301 C 0.83404(19) 0.3047(5) 0.24022(13) 0.0271(14) Uani 1 1 d . . . . .
C302 C 0.8286(2) 0.2200(5) 0.25440(14) 0.0268(14) Uani 1 1 d . . . . .
H302 H 0.8488 0.1901 0.2676 0.032 Uiso 1 1 calc R U . . .
C303 C 0.79477(19) 0.1773(5) 0.25005(14) 0.0283(15) Uani 1 1 d . . . . .
C304 C 0.7647(2) 0.2168(5) 0.23109(14) 0.0306(15) Uani 1 1 d . . . . .
H304 H 0.7416 0.1871 0.2281 0.037 Uiso 1 1 calc R U . . .
C305 C 0.76870(19) 0.3009(6) 0.21640(14) 0.0290(15) Uani 1 1 d . . . . .
C306 C 0.8024(2) 0.3439(6) 0.22102(14) 0.0305(15) Uani 1 1 d . . . . .
H306 H 0.8044 0.4022 0.2108 0.037 Uiso 1 1 calc R U . . .
C307 C 0.7912(2) 0.0833(6) 0.26529(15) 0.0347(17) Uani 1 1 d . . . . .
F51 F 0.81431(15) 0.0821(4) 0.28985(9) 0.0503(13) Uani 1 1 d . U . . .
F52 F 0.75871(16) 0.0719(5) 0.26691(15) 0.078(2) Uani 1 1 d . U . . .
F53 F 0.7971(2) -0.0037(4) 0.25449(12) 0.0720(19) Uani 1 1 d . U . . .
C308 C 0.7366(2) 0.3383(6) 0.19396(16) 0.0364(17) Uani 1 1 d . . . . .
F54 F 0.73138(17) 0.2825(5) 0.17238(10) 0.0679(18) Uani 1 1 d . U . . .
F55 F 0.70632(14) 0.3355(6) 0.19912(11) 0.0647(16) Uani 1 1 d . U . . .
F56 F 0.73929(16) 0.4358(5) 0.18719(14) 0.074(2) Uani 1 1 d . U . . .
C309 C 0.88510(19) 0.2774(5) 0.22130(14) 0.0275(15) Uani 1 1 d . . . . .
C310 C 0.8996(2) 0.1774(5) 0.22818(14) 0.0292(15) Uani 1 1 d . . . . .
H310 H 0.9031 0.1522 0.2455 0.035 Uiso 1 1 calc R U . . .
C311 C 0.9087(2) 0.1153(6) 0.21090(15) 0.0319(16) Uani 1 1 d . . . . .
C312 C 0.9050(2) 0.1495(7) 0.18550(16) 0.0378(18) Uani 1 1 d . . . . .
H312 H 0.9127 0.1080 0.1739 0.045 Uiso 1 1 calc R U . . .
C313 C 0.8895(2) 0.2459(6) 0.17775(15) 0.0344(17) Uani 1 1 d . . . . .
C314 C 0.8796(2) 0.3080(6) 0.19544(14) 0.0319(15) Uani 1 1 d . . . . .
H314 H 0.8686 0.3732 0.1896 0.038 Uiso 1 1 calc R U . . .
C315 C 0.9244(3) 0.0093(8) 0.22012(18) 0.051(2) Uani 1 1 d . . . . .
F57 F 0.91179(17) -0.0318(4) 0.23817(13) 0.0633(16) Uani 1 1 d . U . . .
F58 F 0.9146(2) -0.0595(5) 0.20076(14) 0.084(2) Uani 1 1 d . U . . .
F59 F 0.95945(16) 0.0108(5) 0.23046(15) 0.077(2) Uani 1 1 d . U . . .
C316 C 0.8835(3) 0.2863(7) 0.15058(16) 0.049(2) Uani 1 1 d . . . . .
F60 F 0.89736(17) 0.3793(4) 0.15021(10) 0.0591(15) Uani 1 1 d . U . . .
F61 F 0.84875(18) 0.2951(6) 0.13627(12) 0.090(3) Uani 1 1 d . U . . .
F62 F 0.8970(3) 0.2250(5) 0.13670(12) 0.087(2) Uani 1 1 d . U . . .
C317 C 0.87546(19) 0.4712(6) 0.23703(14) 0.0279(14) Uani 1 1 d . . . . .
C318 C 0.8541(2) 0.5447(5) 0.24352(14) 0.0289(15) Uani 1 1 d . . . . .
H318 H 0.8359 0.5218 0.2501 0.035 Uiso 1 1 calc R U . . .
C319 C 0.8584(2) 0.6519(6) 0.24065(16) 0.0358(17) Uani 1 1 d . . . . .
C320 C 0.8837(2) 0.6880(6) 0.23073(17) 0.0400(18) Uani 1 1 d . . . . .
H320 H 0.8864 0.7601 0.2285 0.048 Uiso 1 1 calc R U . . .
C321 C 0.9051(2) 0.6172(6) 0.22402(17) 0.0415(19) Uani 1 1 d D . . . .
C322 C 0.9017(2) 0.5107(6) 0.22750(17) 0.0378(18) Uani 1 1 d . . . . .
H322 H 0.9175 0.4641 0.2233 0.045 Uiso 1 1 calc R U . . .
C323 C 0.8346(3) 0.7265(7) 0.2485(2) 0.049(2) Uani 1 1 d . . . . .
F63 F 0.8308(2) 0.7016(5) 0.27132(14) 0.076(2) Uani 1 1 d . U . . .
F64 F 0.84775(17) 0.8229(4) 0.25165(13) 0.0597(15) Uani 1 1 d . U . . .
F65 F 0.80196(17) 0.7310(5) 0.23090(15) 0.0752(19) Uani 1 1 d . U . . .
C324 C 0.9324(3) 0.6542(5) 0.21281(17) 0.068(3) Uani 1 1 d D . . . .
F66 F 0.9472(2) 0.7424(5) 0.22203(19) 0.050(3) Uani 0.648(18) 1 d D U P H 1
F67 F 0.9186(4) 0.6737(13) 0.18717(16) 0.141(8) Uani 0.648(18) 1 d D U P H 1
F68 F 0.9586(3) 0.5920(8) 0.2149(4) 0.135(7) Uani 0.648(18) 1 d D U P H 1
F166 F 0.9378(5) 0.5940(10) 0.1953(3) 0.047(5) Uani 0.352(18) 1 d D U P H 2
F167 F 0.9646(3) 0.663(2) 0.2308(3) 0.142(12) Uani 0.352(18) 1 d D U P H 2
F168 F 0.9262(6) 0.7442(10) 0.2018(5) 0.150(13) Uani 0.352(18) 1 d D U P H 2
C325 C 0.90373(17) 0.3312(5) 0.27238(14) 0.0255(14) Uani 1 1 d . . . . .
C326 C 0.89500(19) 0.3342(5) 0.29544(14) 0.0269(14) Uani 1 1 d . . . . .
H326 H 0.8707 0.3461 0.2940 0.032 Uiso 1 1 calc R U . . .
C327 C 0.92077(17) 0.3204(5) 0.32054(14) 0.0293(15) Uani 1 1 d D . . . .
C328 C 0.9569(2) 0.3049(7) 0.32348(15) 0.0383(18) Uani 1 1 d . . . . .
H328 H 0.9745 0.2941 0.3405 0.046 Uiso 1 1 calc R U . . .
C329 C 0.9663(2) 0.3055(6) 0.30100(14) 0.0393(18) Uani 1 1 d D . . . .
C330 C 0.9404(2) 0.3189(6) 0.27611(16) 0.0367(17) Uani 1 1 d . . . . .
H330 H 0.9479 0.3199 0.2611 0.044 Uiso 1 1 calc R U . . .
C331 C 0.90975(15) 0.3165(5) 0.34437(14) 0.043(2) Uani 1 1 d D . . . .
F69 F 0.8808(3) 0.3712(11) 0.34216(19) 0.063(4) Uani 0.64(4) 1 d D U P I 1
F70 F 0.9351(2) 0.3464(12) 0.36649(13) 0.049(3) Uani 0.64(4) 1 d D U P I 1
F71 F 0.9016(4) 0.2194(6) 0.3496(2) 0.058(4) Uani 0.64(4) 1 d D U P I 1
F169 F 0.9371(3) 0.304(3) 0.36674(17) 0.075(8) Uani 0.36(4) 1 d D U P I 2
F170 F 0.8865(8) 0.243(2) 0.3436(4) 0.108(10) Uani 0.36(4) 1 d D U P I 2
F171 F 0.8941(10) 0.4049(16) 0.3476(4) 0.108(11) Uani 0.36(4) 1 d D U P I 2
C332 C 1.0048(2) 0.2918(6) 0.30409(12) 0.060(3) Uani 1 1 d D . . . .
F72 F 1.0232(3) 0.2387(17) 0.3250(3) 0.097(7) Uani 0.57(3) 1 d D U P J 1
F73 F 1.0218(3) 0.3823(9) 0.3076(5) 0.113(7) Uani 0.57(3) 1 d D U P J 1
F74 F 1.0107(3) 0.2500(18) 0.2841(2) 0.094(6) Uani 0.57(3) 1 d D U P J 1
F172 F 1.0123(3) 0.317(2) 0.2830(2) 0.073(7) Uani 0.43(3) 1 d D U P J 2
F173 F 1.0151(4) 0.1940(9) 0.3084(6) 0.108(9) Uani 0.43(3) 1 d D U P J 2
F174 F 1.0271(2) 0.343(2) 0.3235(4) 0.079(7) Uani 0.43(3) 1 d D U P J 2


_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
Rh1 P2 2.330(2) . ?
Rh1 P1 2.336(2) . ?
B1 C1 1.596(12) . ?
B1 N1 1.650(11) . ?
B1 H1A 0.9900 . ?
B1 H1B 0.9900 . ?
C1 C6 1.405(13) . ?
C1 C2 1.426(13) . ?
C2 C3 1.388(14) . ?
C2 H2 0.9500 . ?
C3 C4 1.361(16) . ?
C3 H3 0.9500 . ?
C4 C5 1.405(16) . ?
C4 H4 0.9500 . ?
C5 C6 1.362(13) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
N1 C8 1.490(14) . ?
N1 C7 1.493(15) . ?
N1 H1 1.0000 . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
P1 C9 1.844(10) . ?
P1 C15 1.876(10) . ?
P1 C12 1.897(10) . ?
C9 C11 1.527(14) . ?
C9 C10 1.532(15) . ?
C9 H9 1.0000 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 C14 1.522(16) . ?
C12 C13 1.553(16) . ?
C12 H12 1.0000 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 C16 1.510(13) . ?
C15 C17 1.537(14) . ?
C15 H15 1.0000 . ?
C16 H16A 0.9800 . ?
C16 H16B 0.9800 . ?
C16 H16C 0.9800 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
P2 C21 1.830(9) . ?
P2 C18 1.851(9) . ?
P2 C24 1.862(10) . ?
C18 C19 1.534(16) . ?
C18 C20 1.538(13) . ?
C18 H18 1.0000 . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 C22 1.516(14) . ?
C21 C23 1.534(15) . ?
C21 H21 1.0000 . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 C26 1.542(15) . ?
C24 C25 1.547(14) . ?
C24 H24 1.0000 . ?
C25 H25A 0.9800 . ?
C25 H25B 0.9800 . ?
C25 H25C 0.9800 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
Rh2 P3 2.3227(19) . ?
Rh2 P4 2.327(2) . ?
B2 C51 1.588(12) . ?
B2 N2 1.608(11) . ?
B2 H2A 0.9900 . ?
B2 H2B 0.9900 . ?
C51 C56 1.373(12) . ?
C51 C52 1.409(11) . ?
C52 C53 1.400(12) . ?
C52 H52 0.9500 . ?
C53 C54 1.356(14) . ?
C53 H53 0.9500 . ?
C54 C55 1.386(14) . ?
C54 H54 0.9500 . ?
C55 C56 1.393(13) . ?
C55 H55 0.9500 . ?
C56 H56 0.9500 . ?
N2 C57 1.488(11) . ?
N2 C58 1.507(12) . ?
N2 H2C 1.0000 . ?
C57 H57A 0.9800 . ?
C57 H57B 0.9800 . ?
C57 H57C 0.9800 . ?
C58 H58A 0.9800 . ?
C58 H58B 0.9800 . ?
C58 H58C 0.9800 . ?
P3 C62A 1.817(12) . ?
P3 C59B 1.824(19) . ?
P3 C65B 1.825(15) . ?
P3 C59A 1.850(13) . ?
P3 C65A 1.864(13) . ?
P3 C62B 1.903(17) . ?
C59A C60A 1.543(16) . ?
C59A C61A 1.555(17) . ?
C59A H59A 1.0000 . ?
C60A H60A 0.9800 . ?
C60A H60B 0.9800 . ?
C60A H60C 0.9800 . ?
C61A H61A 0.9800 . ?
C61A H61B 0.9800 . ?
C61A H61C 0.9800 . ?
C59B C60B 1.518(19) . ?
C59B C61B 1.533(19) . ?
C59B H59B 1.0000 . ?
C60B H60D 0.9800 . ?
C60B H60E 0.9800 . ?
C60B H60F 0.9800 . ?
C61B H61D 0.9800 . ?
C61B H61E 0.9800 . ?
C61B H61F 0.9800 . ?
C62A C64A 1.507(16) . ?
C62A C63A 1.521(15) . ?
C62A H62A 1.0000 . ?
C63A H63A 0.9800 . ?
C63A H63B 0.9800 . ?
C63A H63C 0.9800 . ?
C64A H64A 0.9800 . ?
C64A H64B 0.9800 . ?
C64A H64C 0.9800 . ?
C62B C63B 1.529(18) . ?
C62B C64B 1.531(18) . ?
C62B H62B 1.0000 . ?
C63B H63D 0.9800 . ?
C63B H63E 0.9800 . ?
C63B H63F 0.9800 . ?
C64B H64D 0.9800 . ?
C64B H64E 0.9800 . ?
C64B H64F 0.9800 . ?
C65A C66A 1.533(17) . ?
C65A C67A 1.546(16) . ?
C65A H65A 1.0000 . ?
C66A H66A 0.9800 . ?
C66A H66B 0.9800 . ?
C66A H66C 0.9800 . ?
C67A H67A 0.9800 . ?
C67A H67B 0.9800 . ?
C67A H67C 0.9800 . ?
C65B C66B 1.513(17) . ?
C65B C67B 1.529(17) . ?
C65B H65B 1.0000 . ?
C66B H66D 0.9800 . ?
C66B H66E 0.9800 . ?
C66B H66F 0.9800 . ?
C67B H67D 0.9800 . ?
C67B H67E 0.9800 . ?
C67B H67F 0.9800 . ?
P4 C71A 1.779(15) . ?
P4 C74B 1.849(14) . ?
P4 C68 1.856(11) . ?
P4 C71B 1.902(15) . ?
P4 C74A 1.915(12) . ?
C68 C69 1.514(13) . ?
C68 C70 1.536(15) . ?
C68 H68 1.0000 . ?
C69 H69A 0.9800 . ?
C69 H69B 0.9800 . ?
C69 H69C 0.9800 . ?
C70 H70A 0.9800 . ?
C70 H70B 0.9800 . ?
C70 H70C 0.9800 . ?
C71A C72A 1.535(17) . ?
C71A C73A 1.532(16) . ?
C71A H71A 1.0000 . ?
C72A H72A 0.9800 . ?
C72A H72B 0.9800 . ?
C72A H72C 0.9800 . ?
C73A H73A 0.9800 . ?
C73A H73B 0.9800 . ?
C73A H73C 0.9800 . ?
C71B C73B 1.547(17) . ?
C71B C72B 1.556(17) . ?
C71B H71B 1.0000 . ?
C72B H72D 0.9800 . ?
C72B H72E 0.9800 . ?
C72B H72F 0.9800 . ?
C73B H73D 0.9800 . ?
C73B H73E 0.9800 . ?
C73B H73F 0.9800 . ?
C74A C75A 1.533(18) . ?
C74A C76A 1.555(15) . ?
C74A H74A 1.0000 . ?
C75A H75A 0.9800 . ?
C75A H75B 0.9800 . ?
C75A H75C 0.9800 . ?
C76A H76A 0.9800 . ?
C76A H76B 0.9800 . ?
C76A H76C 0.9800 . ?
C74B C76B 1.561(17) . ?
C74B C75B 1.653(17) . ?
C74B H74B 1.0000 . ?
C75B H75D 0.9800 . ?
C75B H75E 0.9800 . ?
C75B H75F 0.9800 . ?
C76B H76D 0.9800 . ?
C76B H76E 0.9800 . ?
C76B H76F 0.9800 . ?
B200 C217 1.623(11) . ?
B200 C225 1.632(11) . ?
B200 C209 1.638(10) . ?
B200 C201 1.654(11) . ?
C201 C206 1.402(10) . ?
C201 C202 1.408(10) . ?
C202 C203 1.392(10) . ?
C202 H202 0.9500 . ?
C203 C204 1.391(11) . ?
C203 C207 1.497(12) . ?
C204 C205 1.375(11) . ?
C204 H204 0.9500 . ?
C205 C206 1.387(10) . ?
C205 C208 1.487(10) . ?
C206 H206 0.9500 . ?
C207 F3 1.295(12) . ?
C207 F2 1.335(10) . ?
C207 F1 1.340(12) . ?
C208 F5 1.336(8) . ?
C208 F4 1.343(10) . ?
C208 F6 1.347(9) . ?
C209 C210 1.398(10) . ?
C209 C214 1.404(11) . ?
C210 C211 1.389(11) . ?
C210 H210 0.9500 . ?
C211 C212 1.392(12) . ?
C211 C215 1.493(12) . ?
C212 C213 1.383(12) . ?
C212 H212 0.9500 . ?
C213 C214 1.393(10) . ?
C213 C216 1.491(12) . ?
C214 H214 0.9500 . ?
C215 F7 1.324(11) . ?
C215 F8 1.335(11) . ?
C215 F9 1.358(11) . ?
C216 F12 1.298(8) . ?
C216 F11 1.299(8) . ?
C216 F112 1.300(8) . ?
C216 F10 1.302(8) . ?
C216 F111 1.303(8) . ?
C216 F110 1.307(9) . ?
C217 C222 1.406(11) . ?
C217 C218 1.409(10) . ?
C218 C219 1.395(10) . ?
C218 H218 0.9500 . ?
C219 C220 1.389(11) . ?
C219 C223 1.491(12) . ?
C220 C221 1.381(11) . ?
C220 H220 0.9500 . ?
C221 C222 1.381(10) . ?
C221 C224 1.492(12) . ?
C222 H222 0.9500 . ?
C223 F14 1.306(8) . ?
C223 F114 1.309(8) . ?
C223 F113 1.330(8) . ?
C223 F15 1.334(8) . ?
C223 F115 1.340(8) . ?
C223 F13 1.340(8) . ?
C224 F17 1.303(8) . ?
C224 F117 1.307(8) . ?
C224 F118 1.317(8) . ?
C224 F18 1.318(8) . ?
C224 F16 1.319(8) . ?
C224 F116 1.320(8) . ?
C225 C226 1.403(10) . ?
C225 C230 1.406(10) . ?
C226 C227 1.394(10) . ?
C226 H226 0.9500 . ?
C227 C228 1.381(10) . ?
C227 C231 1.469(13) . ?
C228 C229 1.388(11) . ?
C228 H228 0.9500 . ?
C229 C230 1.401(10) . ?
C229 C232 1.484(11) . ?
C230 H230 0.9500 . ?
C231 F119 1.292(8) . ?
C231 F19 1.294(8) . ?
C231 F20 1.301(8) . ?
C231 F120 1.322(8) . ?
C231 F121 1.356(9) . ?
C231 F21 1.380(8) . ?
C232 F23 1.302(8) . ?
C232 F24 1.303(8) . ?
C232 F123 1.305(8) . ?
C232 F124 1.305(8) . ?
C232 F22 1.321(8) . ?
C232 F122 1.321(8) . ?
B300 C301 1.628(10) . ?
B300 C317 1.634(11) . ?
B300 C309 1.640(11) . ?
B300 C325 1.642(10) . ?
C301 C302 1.392(10) . ?
C301 C306 1.414(10) . ?
C302 C303 1.389(10) . ?
C302 H302 0.9500 . ?
C303 C304 1.372(10) . ?
C303 C307 1.498(10) . ?
C304 C305 1.383(10) . ?
C304 H304 0.9500 . ?
C305 C306 1.386(10) . ?
C305 C308 1.499(10) . ?
C306 H306 0.9500 . ?
C307 F52 1.323(10) . ?
C307 F53 1.323(10) . ?
C307 F51 1.324(9) . ?
C308 F55 1.319(10) . ?
C308 F54 1.320(10) . ?
C308 F56 1.325(10) . ?
C309 C314 1.388(10) . ?
C309 C310 1.410(10) . ?
C310 C311 1.365(10) . ?
C310 H310 0.9500 . ?
C311 C312 1.394(11) . ?
C311 C315 1.515(12) . ?
C312 C313 1.386(12) . ?
C312 H312 0.9500 . ?
C313 C314 1.400(11) . ?
C313 C316 1.492(11) . ?
C314 H314 0.9500 . ?
C315 F59 1.306(11) . ?
C315 F58 1.321(11) . ?
C315 F57 1.341(12) . ?
C316 F62 1.321(12) . ?
C316 F60 1.324(10) . ?
C316 F61 1.328(12) . ?
C317 C318 1.393(10) . ?
C317 C322 1.400(11) . ?
C318 C319 1.410(11) . ?
C318 H318 0.9500 . ?
C319 C320 1.366(12) . ?
C319 C323 1.505(12) . ?
C320 C321 1.375(11) . ?
C320 H320 0.9500 . ?
C321 C322 1.401(11) . ?
C321 C324 1.483(13) . ?
C322 H322 0.9500 . ?
C323 F65 1.315(12) . ?
C323 F63 1.325(11) . ?
C323 F64 1.337(11) . ?
C324 F68 1.285(8) . ?
C324 F168 1.290(9) . ?
C324 F166 1.291(8) . ?
C324 F66 1.299(8) . ?
C324 F167 1.314(9) . ?
C324 F67 1.322(9) . ?
C325 C326 1.397(10) . ?
C325 C330 1.404(10) . ?
C326 C327 1.396(10) . ?
C326 H326 0.9500 . ?
C327 C328 1.395(10) . ?
C327 C331 1.489(11) . ?
C328 C329 1.381(11) . ?
C328 H328 0.9500 . ?
C329 C330 1.388(11) . ?
C329 C332 1.484(12) . ?
C330 H330 0.9500 . ?
C331 F170 1.314(8) . ?
C331 F69 1.315(7) . ?
C331 F70 1.322(7) . ?
C331 F169 1.323(8) . ?
C331 F171 1.337(8) . ?
C331 F71 1.347(8) . ?
C332 F74 1.291(8) . ?
C332 F174 1.293(8) . ?
C332 F72 1.307(8) . ?
C332 F172 1.308(8) . ?
C332 F173 1.323(8) . ?
C332 F73 1.329(8) . ?

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
P2 Rh1 P1 158.35(8) . . ?
C1 B1 N1 109.6(7) . . ?
C1 B1 H1A 109.8 . . ?
N1 B1 H1A 109.8 . . ?
C1 B1 H1B 109.8 . . ?
N1 B1 H1B 109.8 . . ?
H1A B1 H1B 108.2 . . ?
C6 C1 C2 116.2(8) . . ?
C6 C1 B1 122.5(9) . . ?
C2 C1 B1 121.3(9) . . ?
C3 C2 C1 119.9(10) . . ?
C3 C2 H2 120.0 . . ?
C1 C2 H2 120.0 . . ?
C4 C3 C2 122.2(10) . . ?
C4 C3 H3 118.9 . . ?
C2 C3 H3 118.9 . . ?
C3 C4 C5 118.8(10) . . ?
C3 C4 H4 120.6 . . ?
C5 C4 H4 120.6 . . ?
C6 C5 C4 119.8(10) . . ?
C6 C5 H5 120.1 . . ?
C4 C5 H5 120.1 . . ?
C5 C6 C1 123.0(10) . . ?
C5 C6 H6 118.5 . . ?
C1 C6 H6 118.5 . . ?
C8 N1 C7 110.0(8) . . ?
C8 N1 B1 112.7(8) . . ?
C7 N1 B1 114.1(8) . . ?
C8 N1 H1 106.5 . . ?
C7 N1 H1 106.5 . . ?
B1 N1 H1 106.5 . . ?
N1 C7 H7A 109.5 . . ?
N1 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
N1 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C8 H8A 109.5 . . ?
N1 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N1 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C9 P1 C15 105.7(5) . . ?
C9 P1 C12 99.0(5) . . ?
C15 P1 C12 103.9(5) . . ?
C9 P1 Rh1 113.4(3) . . ?
C15 P1 Rh1 111.7(3) . . ?
C12 P1 Rh1 121.4(3) . . ?
C11 C9 C10 111.6(10) . . ?
C11 C9 P1 112.5(8) . . ?
C10 C9 P1 114.4(7) . . ?
C11 C9 H9 105.8 . . ?
C10 C9 H9 105.8 . . ?
P1 C9 H9 105.8 . . ?
C9 C10 H10A 109.5 . . ?
C9 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C9 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C9 C11 H11A 109.5 . . ?
C9 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C9 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C14 C12 C13 111.3(10) . . ?
C14 C12 P1 110.5(8) . . ?
C13 C12 P1 116.3(8) . . ?
C14 C12 H12 106.0 . . ?
C13 C12 H12 106.0 . . ?
P1 C12 H12 106.0 . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C12 C14 H14A 109.5 . . ?
C12 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C12 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C16 C15 C17 111.2(9) . . ?
C16 C15 P1 114.1(7) . . ?
C17 C15 P1 112.1(7) . . ?
C16 C15 H15 106.2 . . ?
C17 C15 H15 106.2 . . ?
P1 C15 H15 106.2 . . ?
C15 C16 H16A 109.5 . . ?
C15 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C15 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C15 C17 H17A 109.5 . . ?
C15 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C15 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C21 P2 C18 106.5(5) . . ?
C21 P2 C24 105.6(4) . . ?
C18 P2 C24 103.2(5) . . ?
C21 P2 Rh1 113.3(3) . . ?
C18 P2 Rh1 112.3(3) . . ?
C24 P2 Rh1 115.0(3) . . ?
C19 C18 C20 109.1(9) . . ?
C19 C18 P2 114.2(7) . . ?
C20 C18 P2 115.5(7) . . ?
C19 C18 H18 105.7 . . ?
C20 C18 H18 105.7 . . ?
P2 C18 H18 105.7 . . ?
C18 C19 H19A 109.5 . . ?
C18 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
C18 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C18 C20 H20A 109.5 . . ?
C18 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C18 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C22 C21 C23 109.3(8) . . ?
C22 C21 P2 114.2(7) . . ?
C23 C21 P2 114.4(7) . . ?
C22 C21 H21 106.1 . . ?
C23 C21 H21 106.1 . . ?
P2 C21 H21 106.1 . . ?
C21 C22 H22A 109.5 . . ?
C21 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
C21 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C21 C23 H23A 109.5 . . ?
C21 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C21 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C26 C24 C25 109.1(10) . . ?
C26 C24 P2 112.3(6) . . ?
C25 C24 P2 116.3(8) . . ?
C26 C24 H24 106.1 . . ?
C25 C24 H24 106.1 . . ?
P2 C24 H24 106.1 . . ?
C24 C25 H25A 109.5 . . ?
C24 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
C24 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C24 C26 H26A 109.5 . . ?
C24 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C24 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
P3 Rh2 P4 155.75(8) . . ?
C51 B2 N2 111.4(6) . . ?
C51 B2 H2A 109.3 . . ?
N2 B2 H2A 109.3 . . ?
C51 B2 H2B 109.3 . . ?
N2 B2 H2B 109.3 . . ?
H2A B2 H2B 108.0 . . ?
C56 C51 C52 116.1(8) . . ?
C56 C51 B2 123.7(7) . . ?
C52 C51 B2 120.3(7) . . ?
C53 C52 C51 122.1(9) . . ?
C53 C52 H52 118.9 . . ?
C51 C52 H52 118.9 . . ?
C54 C53 C52 119.9(9) . . ?
C54 C53 H53 120.1 . . ?
C52 C53 H53 120.1 . . ?
C53 C54 C55 119.3(8) . . ?
C53 C54 H54 120.4 . . ?
C55 C54 H54 120.4 . . ?
C54 C55 C56 120.6(9) . . ?
C54 C55 H55 119.7 . . ?
C56 C55 H55 119.7 . . ?
C51 C56 C55 122.0(9) . . ?
C51 C56 H56 119.0 . . ?
C55 C56 H56 119.0 . . ?
C57 N2 C58 109.6(7) . . ?
C57 N2 B2 115.1(6) . . ?
C58 N2 B2 111.2(7) . . ?
C57 N2 H2C 106.9 . . ?
C58 N2 H2C 106.9 . . ?
B2 N2 H2C 106.9 . . ?
N2 C57 H57A 109.5 . . ?
N2 C57 H57B 109.5 . . ?
H57A C57 H57B 109.5 . . ?
N2 C57 H57C 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
N2 C58 H58A 109.5 . . ?
N2 C58 H58B 109.5 . . ?
H58A C58 H58B 109.5 . . ?
N2 C58 H58C 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
C59B P3 C65B 113.6(13) . . ?
C62A P3 C59A 109.0(8) . . ?
C62A P3 C65A 101.7(7) . . ?
C59A P3 C65A 99.9(8) . . ?
C59B P3 C62B 104.9(13) . . ?
C65B P3 C62B 98.5(10) . . ?
C62A P3 Rh2 121.9(4) . . ?
C59B P3 Rh2 119.2(13) . . ?
C65B P3 Rh2 110.4(6) . . ?
C59A P3 Rh2 109.9(6) . . ?
C65A P3 Rh2 112.1(5) . . ?
C62B P3 Rh2 107.7(7) . . ?
C60A C59A C61A 111.8(15) . . ?
C60A C59A P3 121.2(12) . . ?
C61A C59A P3 109.7(12) . . ?
C60A C59A H59A 104.1 . . ?
C61A C59A H59A 104.1 . . ?
P3 C59A H59A 104.1 . . ?
C59A C60A H60A 109.5 . . ?
C59A C60A H60B 109.5 . . ?
H60A C60A H60B 109.5 . . ?
C59A C60A H60C 109.5 . . ?
H60A C60A H60C 109.5 . . ?
H60B C60A H60C 109.5 . . ?
C59A C61A H61A 109.5 . . ?
C59A C61A H61B 109.5 . . ?
H61A C61A H61B 109.5 . . ?
C59A C61A H61C 109.5 . . ?
H61A C61A H61C 109.5 . . ?
H61B C61A H61C 109.5 . . ?
C60B C59B C61B 120(3) . . ?
C60B C59B P3 107.0(18) . . ?
C61B C59B P3 108.8(19) . . ?
C60B C59B H59B 107.0 . . ?
C61B C59B H59B 107.0 . . ?
P3 C59B H59B 107.0 . . ?
C59B C60B H60D 109.5 . . ?
C59B C60B H60E 109.5 . . ?
H60D C60B H60E 109.5 . . ?
C59B C60B H60F 109.5 . . ?
H60D C60B H60F 109.5 . . ?
H60E C60B H60F 109.5 . . ?
C59B C61B H61D 109.5 . . ?
C59B C61B H61E 109.5 . . ?
H61D C61B H61E 109.5 . . ?
C59B C61B H61F 109.5 . . ?
H61D C61B H61F 109.5 . . ?
H61E C61B H61F 109.5 . . ?
C64A C62A C63A 110.9(13) . . ?
C64A C62A P3 112.6(10) . . ?
C63A C62A P3 116.4(10) . . ?
C64A C62A H62A 105.3 . . ?
C63A C62A H62A 105.3 . . ?
P3 C62A H62A 105.3 . . ?
C62A C63A H63A 109.5 . . ?
C62A C63A H63B 109.5 . . ?
H63A C63A H63B 109.5 . . ?
C62A C63A H63C 109.5 . . ?
H63A C63A H63C 109.5 . . ?
H63B C63A H63C 109.5 . . ?
C62A C64A H64A 109.5 . . ?
C62A C64A H64B 109.5 . . ?
H64A C64A H64B 109.5 . . ?
C62A C64A H64C 109.5 . . ?
H64A C64A H64C 109.5 . . ?
H64B C64A H64C 109.5 . . ?
C63B C62B C64B 106(2) . . ?
C63B C62B P3 117.7(16) . . ?
C64B C62B P3 115.1(15) . . ?
C63B C62B H62B 105.8 . . ?
C64B C62B H62B 105.8 . . ?
P3 C62B H62B 105.8 . . ?
C62B C63B H63D 109.5 . . ?
C62B C63B H63E 109.5 . . ?
H63D C63B H63E 109.5 . . ?
C62B C63B H63F 109.5 . . ?
H63D C63B H63F 109.5 . . ?
H63E C63B H63F 109.5 . . ?
C62B C64B H64D 109.5 . . ?
C62B C64B H64E 109.5 . . ?
H64D C64B H64E 109.5 . . ?
C62B C64B H64F 109.5 . . ?
H64D C64B H64F 109.5 . . ?
H64E C64B H64F 109.5 . . ?
C66A C65A C67A 110.9(17) . . ?
C66A C65A P3 110.0(11) . . ?
C67A C65A P3 113.2(11) . . ?
C66A C65A H65A 107.5 . . ?
C67A C65A H65A 107.5 . . ?
P3 C65A H65A 107.5 . . ?
C65A C66A H66A 109.5 . . ?
C65A C66A H66B 109.5 . . ?
H66A C66A H66B 109.5 . . ?
C65A C66A H66C 109.5 . . ?
H66A C66A H66C 109.5 . . ?
H66B C66A H66C 109.5 . . ?
C65A C67A H67A 109.5 . . ?
C65A C67A H67B 109.5 . . ?
H67A C67A H67B 109.5 . . ?
C65A C67A H67C 109.5 . . ?
H67A C67A H67C 109.5 . . ?
H67B C67A H67C 109.5 . . ?
C66B C65B C67B 110.3(18) . . ?
C66B C65B P3 115.9(14) . . ?
C67B C65B P3 113.5(14) . . ?
C66B C65B H65B 105.4 . . ?
C67B C65B H65B 105.4 . . ?
P3 C65B H65B 105.4 . . ?
C65B C66B H66D 109.5 . . ?
C65B C66B H66E 109.5 . . ?
H66D C66B H66E 109.5 . . ?
C65B C66B H66F 109.5 . . ?
H66D C66B H66F 109.5 . . ?
H66E C66B H66F 109.5 . . ?
C65B C67B H67D 109.5 . . ?
C65B C67B H67E 109.5 . . ?
H67D C67B H67E 109.5 . . ?
C65B C67B H67F 109.5 . . ?
H67D C67B H67F 109.5 . . ?
H67E C67B H67F 109.5 . . ?
C71A P4 C68 102.0(8) . . ?
C74B P4 C68 115.4(8) . . ?
C74B P4 C71B 104.0(9) . . ?
C68 P4 C71B 106.2(7) . . ?
C71A P4 C74A 103.3(8) . . ?
C68 P4 C74A 92.9(5) . . ?
C71A P4 Rh2 124.0(6) . . ?
C74B P4 Rh2 108.9(6) . . ?
C68 P4 Rh2 112.4(3) . . ?
C71B P4 Rh2 109.5(6) . . ?
C74A P4 Rh2 117.1(4) . . ?
C69 C68 C70 109.1(9) . . ?
C69 C68 P4 113.5(7) . . ?
C70 C68 P4 112.6(7) . . ?
C69 C68 H68 107.1 . . ?
C70 C68 H68 107.1 . . ?
P4 C68 H68 107.1 . . ?
C68 C69 H69A 109.5 . . ?
C68 C69 H69B 109.5 . . ?
H69A C69 H69B 109.5 . . ?
C68 C69 H69C 109.5 . . ?
H69A C69 H69C 109.5 . . ?
H69B C69 H69C 109.5 . . ?
C68 C70 H70A 109.5 . . ?
C68 C70 H70B 109.5 . . ?
H70A C70 H70B 109.5 . . ?
C68 C70 H70C 109.5 . . ?
H70A C70 H70C 109.5 . . ?
H70B C70 H70C 109.5 . . ?
C72A C71A C73A 109.8(15) . . ?
C72A C71A P4 107.9(13) . . ?
C73A C71A P4 118.7(13) . . ?
C72A C71A H71A 106.6 . . ?
C73A C71A H71A 106.6 . . ?
P4 C71A H71A 106.6 . . ?
C71A C72A H72A 109.5 . . ?
C71A C72A H72B 109.5 . . ?
H72A C72A H72B 109.5 . . ?
C71A C72A H72C 109.5 . . ?
H72A C72A H72C 109.5 . . ?
H72B C72A H72C 109.5 . . ?
C71A C73A H73A 109.5 . . ?
C71A C73A H73B 109.5 . . ?
H73A C73A H73B 109.5 . . ?
C71A C73A H73C 109.5 . . ?
H73A C73A H73C 109.5 . . ?
H73B C73A H73C 109.5 . . ?
C73B C71B C72B 105.6(16) . . ?
C73B C71B P4 118.2(14) . . ?
C72B C71B P4 119.8(14) . . ?
C73B C71B H71B 103.7 . . ?
C72B C71B H71B 103.7 . . ?
P4 C71B H71B 103.7 . . ?
C71B C72B H72D 109.5 . . ?
C71B C72B H72E 109.5 . . ?
H72D C72B H72E 109.5 . . ?
C71B C72B H72F 109.5 . . ?
H72D C72B H72F 109.5 . . ?
H72E C72B H72F 109.5 . . ?
C71B C73B H73D 109.5 . . ?
C71B C73B H73E 109.5 . . ?
H73D C73B H73E 109.5 . . ?
C71B C73B H73F 109.5 . . ?
H73D C73B H73F 109.5 . . ?
H73E C73B H73F 109.5 . . ?
C75A C74A C76A 85.5(17) . . ?
C75A C74A P4 106.7(14) . . ?
C76A C74A P4 112.6(10) . . ?
C75A C74A H74A 116.0 . . ?
C76A C74A H74A 116.0 . . ?
P4 C74A H74A 116.0 . . ?
C74A C75A H75A 109.5 . . ?
C74A C75A H75B 109.5 . . ?
H75A C75A H75B 109.5 . . ?
C74A C75A H75C 109.5 . . ?
H75A C75A H75C 109.5 . . ?
H75B C75A H75C 109.5 . . ?
C74A C76A H76A 109.5 . . ?
C74A C76A H76B 109.5 . . ?
H76A C76A H76B 109.5 . . ?
C74A C76A H76C 109.5 . . ?
H76A C76A H76C 109.5 . . ?
H76B C76A H76C 109.5 . . ?
C76B C74B P4 109.0(12) . . ?
C76B C74B C75B 110.0(16) . . ?
P4 C74B C75B 106.1(11) . . ?
C76B C74B H74B 110.5 . . ?
P4 C74B H74B 110.5 . . ?
C75B C74B H74B 110.5 . . ?
C74B C75B H75D 109.5 . . ?
C74B C75B H75E 109.5 . . ?
H75D C75B H75E 109.5 . . ?
C74B C75B H75F 109.5 . . ?
H75D C75B H75F 109.5 . . ?
H75E C75B H75F 109.5 . . ?
C74B C76B H76D 109.5 . . ?
C74B C76B H76E 109.5 . . ?
H76D C76B H76E 109.5 . . ?
C74B C76B H76F 109.5 . . ?
H76D C76B H76F 109.5 . . ?
H76E C76B H76F 109.5 . . ?
C217 B200 C225 105.3(6) . . ?
C217 B200 C209 113.8(6) . . ?
C225 B200 C209 112.0(6) . . ?
C217 B200 C201 109.6(6) . . ?
C225 B200 C201 113.2(6) . . ?
C209 B200 C201 103.2(6) . . ?
C206 C201 C202 114.9(7) . . ?
C206 C201 B200 126.0(6) . . ?
C202 C201 B200 119.1(6) . . ?
C203 C202 C201 122.9(7) . . ?
C203 C202 H202 118.6 . . ?
C201 C202 H202 118.6 . . ?
C204 C203 C202 119.8(7) . . ?
C204 C203 C207 120.9(7) . . ?
C202 C203 C207 119.3(7) . . ?
C205 C204 C203 118.9(7) . . ?
C205 C204 H204 120.5 . . ?
C203 C204 H204 120.5 . . ?
C204 C205 C206 120.7(7) . . ?
C204 C205 C208 119.9(7) . . ?
C206 C205 C208 119.4(7) . . ?
C205 C206 C201 122.8(7) . . ?
C205 C206 H206 118.6 . . ?
C201 C206 H206 118.6 . . ?
F3 C207 F2 108.6(8) . . ?
F3 C207 F1 105.9(8) . . ?
F2 C207 F1 104.4(8) . . ?
F3 C207 C203 113.0(8) . . ?
F2 C207 C203 111.9(7) . . ?
F1 C207 C203 112.5(8) . . ?
F5 C208 F4 105.8(6) . . ?
F5 C208 F6 105.5(6) . . ?
F4 C208 F6 106.1(6) . . ?
F5 C208 C205 113.6(6) . . ?
F4 C208 C205 112.7(7) . . ?
F6 C208 C205 112.5(6) . . ?
C210 C209 C214 115.2(7) . . ?
C210 C209 B200 122.3(7) . . ?
C214 C209 B200 122.3(7) . . ?
C211 C210 C209 122.3(7) . . ?
C211 C210 H210 118.8 . . ?
C209 C210 H210 118.8 . . ?
C210 C211 C212 121.6(8) . . ?
C210 C211 C215 118.1(8) . . ?
C212 C211 C215 120.2(8) . . ?
C213 C212 C211 117.1(7) . . ?
C213 C212 H212 121.5 . . ?
C211 C212 H212 121.5 . . ?
C212 C213 C214 121.2(8) . . ?
C212 C213 C216 118.9(6) . . ?
C214 C213 C216 119.8(7) . . ?
C213 C214 C209 122.5(7) . . ?
C213 C214 H214 118.7 . . ?
C209 C214 H214 118.7 . . ?
F7 C215 F8 107.0(7) . . ?
F7 C215 F9 105.8(9) . . ?
F8 C215 F9 104.6(7) . . ?
F7 C215 C211 113.5(7) . . ?
F8 C215 C211 113.7(9) . . ?
F9 C215 C211 111.5(7) . . ?
F12 C216 F11 105.7(7) . . ?
F12 C216 F10 105.7(7) . . ?
F11 C216 F10 105.6(7) . . ?
F112 C216 F111 105.2(8) . . ?
F112 C216 F110 105.1(8) . . ?
F111 C216 F110 104.6(8) . . ?
F12 C216 C213 113.3(6) . . ?
F11 C216 C213 112.9(6) . . ?
F112 C216 C213 113.9(7) . . ?
F10 C216 C213 113.0(7) . . ?
F111 C216 C213 113.6(7) . . ?
F110 C216 C213 113.5(7) . . ?
C222 C217 C218 115.4(7) . . ?
C222 C217 B200 123.6(7) . . ?
C218 C217 B200 120.7(7) . . ?
C219 C218 C217 122.7(7) . . ?
C219 C218 H218 118.7 . . ?
C217 C218 H218 118.7 . . ?
C220 C219 C218 120.2(8) . . ?
C220 C219 C223 120.7(6) . . ?
C218 C219 C223 119.1(6) . . ?
C221 C220 C219 117.9(7) . . ?
C221 C220 H220 121.0 . . ?
C219 C220 H220 121.0 . . ?
C222 C221 C220 122.1(8) . . ?
C222 C221 C224 118.5(6) . . ?
C220 C221 C224 119.4(6) . . ?
C221 C222 C217 121.6(7) . . ?
C221 C222 H222 119.2 . . ?
C217 C222 H222 119.2 . . ?
F114 C223 F113 107.4(7) . . ?
F14 C223 F15 107.2(7) . . ?
F114 C223 F115 106.3(7) . . ?
F113 C223 F115 104.4(7) . . ?
F14 C223 F13 106.5(7) . . ?
F15 C223 F13 104.1(7) . . ?
F14 C223 C219 115.1(7) . . ?
F114 C223 C219 114.7(7) . . ?
F113 C223 C219 112.2(6) . . ?
F15 C223 C219 111.5(6) . . ?
F115 C223 C219 111.2(6) . . ?
F13 C223 C219 111.8(6) . . ?
F117 C224 F118 105.7(7) . . ?
F17 C224 F18 105.9(7) . . ?
F17 C224 F16 105.7(7) . . ?
F18 C224 F16 104.6(7) . . ?
F117 C224 F116 105.3(7) . . ?
F118 C224 F116 104.1(7) . . ?
F17 C224 C221 114.2(7) . . ?
F117 C224 C221 114.6(7) . . ?
F118 C224 C221 113.4(6) . . ?
F18 C224 C221 113.1(7) . . ?
F16 C224 C221 112.6(6) . . ?
F116 C224 C221 112.7(6) . . ?
C226 C225 C230 115.1(7) . . ?
C226 C225 B200 122.9(6) . . ?
C230 C225 B200 121.7(6) . . ?
C227 C226 C225 122.3(7) . . ?
C227 C226 H226 118.9 . . ?
C225 C226 H226 118.9 . . ?
C228 C227 C226 121.5(7) . . ?
C228 C227 C231 119.9(6) . . ?
C226 C227 C231 118.6(6) . . ?
C227 C228 C229 117.8(7) . . ?
C227 C228 H228 121.1 . . ?
C229 C228 H228 121.1 . . ?
C228 C229 C230 120.6(7) . . ?
C228 C229 C232 119.8(6) . . ?
C230 C229 C232 119.5(6) . . ?
C229 C230 C225 122.6(7) . . ?
C229 C230 H230 118.7 . . ?
C225 C230 H230 118.7 . . ?
F19 C231 F20 109.3(8) . . ?
F119 C231 F120 106.9(8) . . ?
F119 C231 F121 104.2(8) . . ?
F120 C231 F121 101.3(7) . . ?
F19 C231 F21 102.3(7) . . ?
F20 C231 F21 101.2(7) . . ?
F119 C231 C227 117.9(8) . . ?
F19 C231 C227 116.4(7) . . ?
F20 C231 C227 115.8(7) . . ?
F120 C231 C227 114.1(6) . . ?
F121 C231 C227 110.9(7) . . ?
F21 C231 C227 109.9(6) . . ?
F23 C232 F24 106.9(7) . . ?
F123 C232 F124 106.3(7) . . ?
F23 C232 F22 105.6(7) . . ?
F24 C232 F22 104.8(6) . . ?
F123 C232 F122 104.9(7) . . ?
F124 C232 F122 104.3(7) . . ?
F23 C232 C229 112.3(6) . . ?
F24 C232 C229 114.0(6) . . ?
F123 C232 C229 113.3(7) . . ?
F124 C232 C229 114.2(7) . . ?
F22 C232 C229 112.6(6) . . ?
F122 C232 C229 113.0(7) . . ?
C301 B300 C317 114.5(6) . . ?
C301 B300 C309 104.1(6) . . ?
C317 B300 C309 111.7(6) . . ?
C301 B300 C325 113.0(6) . . ?
C317 B300 C325 104.2(6) . . ?
C309 B300 C325 109.5(6) . . ?
C302 C301 C306 114.7(7) . . ?
C302 C301 B300 123.2(6) . . ?
C306 C301 B300 121.7(6) . . ?
C303 C302 C301 122.7(7) . . ?
C303 C302 H302 118.6 . . ?
C301 C302 H302 118.6 . . ?
C304 C303 C302 121.1(7) . . ?
C304 C303 C307 119.2(7) . . ?
C302 C303 C307 119.7(7) . . ?
C303 C304 C305 118.5(7) . . ?
C303 C304 H304 120.8 . . ?
C305 C304 H304 120.8 . . ?
C304 C305 C306 120.2(7) . . ?
C304 C305 C308 118.8(7) . . ?
C306 C305 C308 120.8(7) . . ?
C305 C306 C301 122.9(7) . . ?
C305 C306 H306 118.6 . . ?
C301 C306 H306 118.6 . . ?
F52 C307 F53 104.9(7) . . ?
F52 C307 F51 106.7(7) . . ?
F53 C307 F51 105.1(7) . . ?
F52 C307 C303 113.7(7) . . ?
F53 C307 C303 112.5(7) . . ?
F51 C307 C303 113.1(6) . . ?
F55 C308 F54 106.8(7) . . ?
F55 C308 F56 104.3(7) . . ?
F54 C308 F56 106.3(7) . . ?
F55 C308 C305 113.6(7) . . ?
F54 C308 C305 111.5(7) . . ?
F56 C308 C305 113.7(7) . . ?
C314 C309 C310 115.7(7) . . ?
C314 C309 B300 124.0(6) . . ?
C310 C309 B300 120.2(6) . . ?
C311 C310 C309 122.5(7) . . ?
C311 C310 H310 118.8 . . ?
C309 C310 H310 118.8 . . ?
C310 C311 C312 121.1(7) . . ?
C310 C311 C315 118.8(7) . . ?
C312 C311 C315 120.0(7) . . ?
C313 C312 C311 117.8(7) . . ?
C313 C312 H312 121.1 . . ?
C311 C312 H312 121.1 . . ?
C312 C313 C314 120.5(7) . . ?
C312 C313 C316 121.0(8) . . ?
C314 C313 C316 118.5(8) . . ?
C309 C314 C313 122.2(7) . . ?
C309 C314 H314 118.9 . . ?
C313 C314 H314 118.9 . . ?
F59 C315 F58 109.1(8) . . ?
F59 C315 F57 107.5(8) . . ?
F58 C315 F57 102.9(9) . . ?
F59 C315 C311 112.4(9) . . ?
F58 C315 C311 111.9(7) . . ?
F57 C315 C311 112.5(7) . . ?
F62 C316 F60 106.5(8) . . ?
F62 C316 F61 105.2(8) . . ?
F60 C316 F61 105.4(8) . . ?
F62 C316 C313 112.6(8) . . ?
F60 C316 C313 113.8(7) . . ?
F61 C316 C313 112.6(8) . . ?
C318 C317 C322 115.7(7) . . ?
C318 C317 B300 123.6(6) . . ?
C322 C317 B300 120.4(6) . . ?
C317 C318 C319 122.2(7) . . ?
C317 C318 H318 118.9 . . ?
C319 C318 H318 118.9 . . ?
C320 C319 C318 120.7(8) . . ?
C320 C319 C323 120.2(7) . . ?
C318 C319 C323 119.1(7) . . ?
C319 C320 C321 118.3(7) . . ?
C319 C320 H320 120.8 . . ?
C321 C320 H320 120.8 . . ?
C320 C321 C322 121.4(7) . . ?
C320 C321 C324 119.5(6) . . ?
C322 C321 C324 119.2(7) . . ?
C317 C322 C321 121.6(7) . . ?
C317 C322 H322 119.2 . . ?
C321 C322 H322 119.2 . . ?
F65 C323 F63 106.4(9) . . ?
F65 C323 F64 107.0(7) . . ?
F63 C323 F64 105.8(8) . . ?
F65 C323 C319 112.3(8) . . ?
F63 C323 C319 112.7(7) . . ?
F64 C323 C319 112.2(8) . . ?
F168 C324 F166 105.1(8) . . ?
F68 C324 F66 105.8(8) . . ?
F168 C324 F167 104.1(8) . . ?
F166 C324 F167 103.3(8) . . ?
F68 C324 F67 104.0(8) . . ?
F66 C324 F67 101.7(7) . . ?
F68 C324 C321 116.2(7) . . ?
F168 C324 C321 115.2(8) . . ?
F166 C324 C321 115.2(7) . . ?
F66 C324 C321 114.9(6) . . ?
F167 C324 C321 112.7(8) . . ?
F67 C324 C321 112.7(7) . . ?
C326 C325 C330 115.7(6) . . ?
C326 C325 B300 123.0(6) . . ?
C330 C325 B300 121.2(7) . . ?
C327 C326 C325 122.3(6) . . ?
C327 C326 H326 118.9 . . ?
C325 C326 H326 118.9 . . ?
C328 C327 C326 120.5(7) . . ?
C328 C327 C331 119.1(6) . . ?
C326 C327 C331 120.3(5) . . ?
C329 C328 C327 118.1(7) . . ?
C329 C328 H328 120.9 . . ?
C327 C328 H328 120.9 . . ?
C328 C329 C330 121.0(7) . . ?
C328 C329 C332 118.3(6) . . ?
C330 C329 C332 120.7(6) . . ?
C329 C330 C325 122.3(7) . . ?
C329 C330 H330 118.8 . . ?
C325 C330 H330 118.8 . . ?
F69 C331 F70 106.9(6) . . ?
F170 C331 F169 106.7(7) . . ?
F170 C331 F171 105.7(7) . . ?
F169 C331 F171 104.7(7) . . ?
F69 C331 F71 104.9(6) . . ?
F70 C331 F71 104.2(6) . . ?
F170 C331 C327 113.9(7) . . ?
F69 C331 C327 113.9(6) . . ?
F70 C331 C327 114.2(6) . . ?
F169 C331 C327 113.4(7) . . ?
F171 C331 C327 111.6(7) . . ?
F71 C331 C327 111.8(6) . . ?
F74 C332 F72 106.9(7) . . ?
F174 C332 F172 105.9(7) . . ?
F174 C332 F173 105.4(7) . . ?
F172 C332 F173 104.1(7) . . ?
F74 C332 F73 104.9(7) . . ?
F72 C332 F73 103.6(7) . . ?
F74 C332 C329 115.2(6) . . ?
F174 C332 C329 114.7(6) . . ?
F72 C332 C329 114.0(6) . . ?
F172 C332 C329 113.7(6) . . ?
F173 C332 C329 112.1(7) . . ?
F73 C332 C329 111.1(6) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 B1 C1 C6 -94.3(10) . . . . ?
N1 B1 C1 C2 86.3(10) . . . . ?
C6 C1 C2 C3 -0.5(13) . . . . ?
B1 C1 C2 C3 179.0(8) . . . . ?
C1 C2 C3 C4 0.1(15) . . . . ?
C2 C3 C4 C5 -0.7(16) . . . . ?
C3 C4 C5 C6 1.8(15) . . . . ?
C4 C5 C6 C1 -2.3(15) . . . . ?
C2 C1 C6 C5 1.6(13) . . . . ?
B1 C1 C6 C5 -177.8(9) . . . . ?
C1 B1 N1 C8 57.4(11) . . . . ?
C1 B1 N1 C7 -68.9(11) . . . . ?
C15 P1 C9 C11 168.6(8) . . . . ?
C12 P1 C9 C11 61.3(8) . . . . ?
Rh1 P1 C9 C11 -68.7(8) . . . . ?
C15 P1 C9 C10 -62.7(8) . . . . ?
C12 P1 C9 C10 -169.9(8) . . . . ?
Rh1 P1 C9 C10 60.0(8) . . . . ?
C9 P1 C12 C14 -98.9(9) . . . . ?
C15 P1 C12 C14 152.4(8) . . . . ?
Rh1 P1 C12 C14 25.7(10) . . . . ?
C9 P1 C12 C13 133.0(8) . . . . ?
C15 P1 C12 C13 24.2(9) . . . . ?
Rh1 P1 C12 C13 -102.4(8) . . . . ?
C9 P1 C15 C16 -35.9(9) . . . . ?
C12 P1 C15 C16 67.8(9) . . . . ?
Rh1 P1 C15 C16 -159.7(7) . . . . ?
C9 P1 C15 C17 91.7(8) . . . . ?
C12 P1 C15 C17 -164.6(8) . . . . ?
Rh1 P1 C15 C17 -32.1(9) . . . . ?
C21 P2 C18 C19 -85.7(8) . . . . ?
C24 P2 C18 C19 163.4(8) . . . . ?
Rh1 P2 C18 C19 38.9(8) . . . . ?
C21 P2 C18 C20 42.1(10) . . . . ?
C24 P2 C18 C20 -68.9(9) . . . . ?
Rh1 P2 C18 C20 166.6(8) . . . . ?
C18 P2 C21 C22 -175.3(7) . . . . ?
C24 P2 C21 C22 -66.0(8) . . . . ?
Rh1 P2 C21 C22 60.7(8) . . . . ?
C18 P2 C21 C23 57.8(8) . . . . ?
C24 P2 C21 C23 167.1(7) . . . . ?
Rh1 P2 C21 C23 -66.2(8) . . . . ?
C21 P2 C24 C26 95.0(8) . . . . ?
C18 P2 C24 C26 -153.3(7) . . . . ?
Rh1 P2 C24 C26 -30.7(8) . . . . ?
C21 P2 C24 C25 -31.7(11) . . . . ?
C18 P2 C24 C25 79.9(10) . . . . ?
Rh1 P2 C24 C25 -157.4(9) . . . . ?
N2 B2 C51 C56 -96.9(9) . . . . ?
N2 B2 C51 C52 83.9(9) . . . . ?
C56 C51 C52 C53 1.8(12) . . . . ?
B2 C51 C52 C53 -179.0(8) . . . . ?
C51 C52 C53 C54 -2.3(13) . . . . ?
C52 C53 C54 C55 1.1(14) . . . . ?
C53 C54 C55 C56 0.4(15) . . . . ?
C52 C51 C56 C55 -0.2(13) . . . . ?
B2 C51 C56 C55 -179.5(8) . . . . ?
C54 C55 C56 C51 -0.9(15) . . . . ?
C51 B2 N2 C57 -57.5(9) . . . . ?
C51 B2 N2 C58 67.8(8) . . . . ?
C62A P3 C59A C60A -74.0(16) . . . . ?
C59B P3 C59A C60A 14(6) . . . . ?
C65B P3 C59A C60A 12(2) . . . . ?
C65A P3 C59A C60A 32.1(16) . . . . ?
C62B P3 C59A C60A -96.7(16) . . . . ?
Rh2 P3 C59A C60A 150.0(13) . . . . ?
C62A P3 C59A C61A 58.7(16) . . . . ?
C59B P3 C59A C61A 147(7) . . . . ?
C65B P3 C59A C61A 145.0(15) . . . . ?
C65A P3 C59A C61A 164.8(15) . . . . ?
C62B P3 C59A C61A 36.0(16) . . . . ?
Rh2 P3 C59A C61A -77.3(15) . . . . ?
C62A P3 C59B C60B -141(2) . . . . ?
C65B P3 C59B C60B -59(3) . . . . ?
C59A P3 C59B C60B 123(8) . . . . ?
C65A P3 C59B C60B -40(2) . . . . ?
C62B P3 C59B C60B -166(2) . . . . ?
Rh2 P3 C59B C60B 74(3) . . . . ?
C62A P3 C59B C61B 88(3) . . . . ?
C65B P3 C59B C61B 170(2) . . . . ?
C59A P3 C59B C61B -8(5) . . . . ?
C65A P3 C59B C61B -170(3) . . . . ?
C62B P3 C59B C61B 64(3) . . . . ?
Rh2 P3 C59B C61B -57(3) . . . . ?
C59B P3 C62A C64A -97.4(15) . . . . ?
C65B P3 C62A C64A 152.0(13) . . . . ?
C59A P3 C62A C64A -83.2(12) . . . . ?
C65A P3 C62A C64A 172.0(11) . . . . ?
C62B P3 C62A C64A -11(2) . . . . ?
Rh2 P3 C62A C64A 46.5(12) . . . . ?
C59B P3 C62A C63A 32.2(18) . . . . ?
C65B P3 C62A C63A -78.4(15) . . . . ?
C59A P3 C62A C63A 46.5(15) . . . . ?
C65A P3 C62A C63A -58.4(14) . . . . ?
C62B P3 C62A C63A 118(3) . . . . ?
Rh2 P3 C62A C63A 176.1(11) . . . . ?
C62A P3 C65A C66A -57.3(15) . . . . ?
C59B P3 C65A C66A -165.2(19) . . . . ?
C65B P3 C65A C66A -19.3(15) . . . . ?
C59A P3 C65A C66A -169.3(15) . . . . ?
C62B P3 C65A C66A -59.0(18) . . . . ?
Rh2 P3 C65A C66A 74.4(15) . . . . ?
C62A P3 C65A C67A 178.1(12) . . . . ?
C59B P3 C65A C67A 70.2(17) . . . . ?
C65B P3 C65A C67A -144(2) . . . . ?
C59A P3 C65A C67A 66.1(14) . . . . ?
C62B P3 C65A C67A 176.4(14) . . . . ?
Rh2 P3 C65A C67A -50.2(13) . . . . ?
C62A P3 C65B C66B 63.8(18) . . . . ?
C59B P3 C65B C66B -40(2) . . . . ?
C59A P3 C65B C66B -40(2) . . . . ?
C65A P3 C65B C66B -78(2) . . . . ?
C62B P3 C65B C66B 70(2) . . . . ?
Rh2 P3 C65B C66B -177.1(16) . . . . ?
C62A P3 C65B C67B -167.2(18) . . . . ?
C59B P3 C65B C67B 89(2) . . . . ?
C59A P3 C65B C67B 89.5(17) . . . . ?
C65A P3 C65B C67B 51.3(17) . . . . ?
C62B P3 C65B C67B -160.5(17) . . . . ?
Rh2 P3 C65B C67B -48.0(18) . . . . ?
C71A P4 C68 C69 -70.8(10) . . . . ?
C74B P4 C68 C69 -170.2(8) . . . . ?
C71B P4 C68 C69 -55.6(10) . . . . ?
C74A P4 C68 C69 -175.0(8) . . . . ?
Rh2 P4 C68 C69 64.1(8) . . . . ?
C71A P4 C68 C70 164.7(9) . . . . ?
C74B P4 C68 C70 65.3(9) . . . . ?
C71B P4 C68 C70 179.9(9) . . . . ?
C74A P4 C68 C70 60.5(8) . . . . ?
Rh2 P4 C68 C70 -60.4(7) . . . . ?
C74B P4 C71A C72A -151.9(15) . . . . ?
C68 P4 C71A C72A 91.3(14) . . . . ?
C71B P4 C71A C72A -16(4) . . . . ?
C74A P4 C71A C72A -172.8(13) . . . . ?
Rh2 P4 C71A C72A -36.5(17) . . . . ?
C74B P4 C71A C73A 82.4(17) . . . . ?
C68 P4 C71A C73A -34.4(17) . . . . ?
C71B P4 C71A C73A -142(6) . . . . ?
C74A P4 C71A C73A 61.5(17) . . . . ?
Rh2 P4 C71A C73A -162.2(12) . . . . ?
C71A P4 C74B C76B -58.4(15) . . . . ?
C68 P4 C74B C76B 46.4(16) . . . . ?
C71B P4 C74B C76B -69.4(16) . . . . ?
C74A P4 C74B C76B 58.8(19) . . . . ?
Rh2 P4 C74B C76B 173.9(12) . . . . ?
C71A P4 C74B C75B -176.8(14) . . . . ?
C68 P4 C74B C75B -72.0(14) . . . . ?
C71B P4 C74B C75B 172.2(13) . . . . ?
C74A P4 C74B C75B -60(2) . . . . ?
Rh2 P4 C74B C75B 55.5(14) . . . . ?
C217 B200 C201 C206 142.1(7) . . . . ?
C225 B200 C201 C206 24.9(10) . . . . ?
C209 B200 C201 C206 -96.3(8) . . . . ?
C217 B200 C201 C202 -42.0(9) . . . . ?
C225 B200 C201 C202 -159.3(6) . . . . ?
C209 B200 C201 C202 79.5(8) . . . . ?
C206 C201 C202 C203 0.6(11) . . . . ?
B200 C201 C202 C203 -175.7(7) . . . . ?
C201 C202 C203 C204 -2.3(12) . . . . ?
C201 C202 C203 C207 -179.0(8) . . . . ?
C202 C203 C204 C205 2.2(11) . . . . ?
C207 C203 C204 C205 178.8(8) . . . . ?
C203 C204 C205 C206 -0.3(11) . . . . ?
C203 C204 C205 C208 178.3(7) . . . . ?
C204 C205 C206 C201 -1.5(11) . . . . ?
C208 C205 C206 C201 179.9(6) . . . . ?
C202 C201 C206 C205 1.4(10) . . . . ?
B200 C201 C206 C205 177.3(6) . . . . ?
C204 C203 C207 F3 -89.2(10) . . . . ?
C202 C203 C207 F3 87.4(11) . . . . ?
C204 C203 C207 F2 33.7(12) . . . . ?
C202 C203 C207 F2 -149.6(8) . . . . ?
C204 C203 C207 F1 150.9(8) . . . . ?
C202 C203 C207 F1 -32.5(12) . . . . ?
C204 C205 C208 F5 -99.4(8) . . . . ?
C206 C205 C208 F5 79.2(9) . . . . ?
C204 C205 C208 F4 21.0(10) . . . . ?
C206 C205 C208 F4 -160.4(6) . . . . ?
C204 C205 C208 F6 140.8(7) . . . . ?
C206 C205 C208 F6 -40.5(9) . . . . ?
C217 B200 C209 C210 -150.7(7) . . . . ?
C225 B200 C209 C210 -31.5(9) . . . . ?
C201 B200 C209 C210 90.6(8) . . . . ?
C217 B200 C209 C214 34.1(9) . . . . ?
C225 B200 C209 C214 153.3(7) . . . . ?
C201 B200 C209 C214 -84.6(8) . . . . ?
C214 C209 C210 C211 -1.9(11) . . . . ?
B200 C209 C210 C211 -177.4(7) . . . . ?
C209 C210 C211 C212 1.6(12) . . . . ?
C209 C210 C211 C215 -175.7(7) . . . . ?
C210 C211 C212 C213 0.0(12) . . . . ?
C215 C211 C212 C213 177.2(7) . . . . ?
C211 C212 C213 C214 -1.1(12) . . . . ?
C211 C212 C213 C216 179.8(6) . . . . ?
C212 C213 C214 C209 0.8(12) . . . . ?
C216 C213 C214 C209 179.9(6) . . . . ?
C210 C209 C214 C213 0.7(11) . . . . ?
B200 C209 C214 C213 176.3(7) . . . . ?
C210 C211 C215 F7 -48.0(11) . . . . ?
C212 C211 C215 F7 134.7(8) . . . . ?
C210 C211 C215 F8 -170.7(7) . . . . ?
C212 C211 C215 F8 12.0(11) . . . . ?
C210 C211 C215 F9 71.4(10) . . . . ?
C212 C211 C215 F9 -106.0(10) . . . . ?
C212 C213 C216 F12 -103.6(11) . . . . ?
C214 C213 C216 F12 77.3(11) . . . . ?
C212 C213 C216 F11 136.3(11) . . . . ?
C214 C213 C216 F11 -42.8(12) . . . . ?
C212 C213 C216 F112 64.2(18) . . . . ?
C214 C213 C216 F112 -114.9(18) . . . . ?
C212 C213 C216 F10 16.5(12) . . . . ?
C214 C213 C216 F10 -162.6(11) . . . . ?
C212 C213 C216 F111 -56.2(18) . . . . ?
C214 C213 C216 F111 124.7(18) . . . . ?
C212 C213 C216 F110 -175.5(18) . . . . ?
C214 C213 C216 F110 5.3(18) . . . . ?
C225 B200 C217 C222 -90.4(8) . . . . ?
C209 B200 C217 C222 32.5(10) . . . . ?
C201 B200 C217 C222 147.5(7) . . . . ?
C225 B200 C217 C218 84.0(8) . . . . ?
C209 B200 C217 C218 -153.0(7) . . . . ?
C201 B200 C217 C218 -38.1(9) . . . . ?
C222 C217 C218 C219 -1.1(11) . . . . ?
B200 C217 C218 C219 -176.0(7) . . . . ?
C217 C218 C219 C220 -0.7(12) . . . . ?
C217 C218 C219 C223 178.6(6) . . . . ?
C218 C219 C220 C221 1.6(11) . . . . ?
C223 C219 C220 C221 -177.7(6) . . . . ?
C219 C220 C221 C222 -0.7(11) . . . . ?
C219 C220 C221 C224 179.3(6) . . . . ?
C220 C221 C222 C217 -1.2(12) . . . . ?
C224 C221 C222 C217 178.8(6) . . . . ?
C218 C217 C222 C221 2.0(11) . . . . ?
B200 C217 C222 C221 176.7(7) . . . . ?
C220 C219 C223 F14 152.0(15) . . . . ?
C218 C219 C223 F14 -27.3(15) . . . . ?
C220 C219 C223 F114 0.3(17) . . . . ?
C218 C219 C223 F114 -179.0(15) . . . . ?
C220 C219 C223 F113 -122.6(16) . . . . ?
C218 C219 C223 F113 58.1(16) . . . . ?
C220 C219 C223 F15 -85.6(14) . . . . ?
C218 C219 C223 F15 95.0(13) . . . . ?
C220 C219 C223 F115 121.0(15) . . . . ?
C218 C219 C223 F115 -58.3(15) . . . . ?
C220 C219 C223 F13 30.4(14) . . . . ?
C218 C219 C223 F13 -148.9(13) . . . . ?
C222 C221 C224 F17 -49.1(14) . . . . ?
C220 C221 C224 F17 130.9(14) . . . . ?
C222 C221 C224 F117 159.2(11) . . . . ?
C220 C221 C224 F117 -20.7(13) . . . . ?
C222 C221 C224 F118 37.7(14) . . . . ?
C220 C221 C224 F118 -142.3(14) . . . . ?
C222 C221 C224 F18 -170.2(14) . . . . ?
C220 C221 C224 F18 9.8(15) . . . . ?
C222 C221 C224 F16 71.5(12) . . . . ?
C220 C221 C224 F16 -108.5(12) . . . . ?
C222 C221 C224 F116 -80.3(12) . . . . ?
C220 C221 C224 F116 99.8(12) . . . . ?
C217 B200 C225 C226 -85.3(8) . . . . ?
C209 B200 C225 C226 150.6(7) . . . . ?
C201 B200 C225 C226 34.5(10) . . . . ?
C217 B200 C225 C230 88.1(8) . . . . ?
C209 B200 C225 C230 -35.9(10) . . . . ?
C201 B200 C225 C230 -152.1(7) . . . . ?
C230 C225 C226 C227 2.8(11) . . . . ?
B200 C225 C226 C227 176.6(7) . . . . ?
C225 C226 C227 C228 -2.3(13) . . . . ?
C225 C226 C227 C231 175.2(6) . . . . ?
C226 C227 C228 C229 0.7(12) . . . . ?
C231 C227 C228 C229 -176.7(6) . . . . ?
C227 C228 C229 C230 0.0(11) . . . . ?
C227 C228 C229 C232 179.5(7) . . . . ?
C228 C229 C230 C225 0.7(11) . . . . ?
C232 C229 C230 C225 -178.8(6) . . . . ?
C226 C225 C230 C229 -2.0(11) . . . . ?
B200 C225 C230 C229 -175.9(7) . . . . ?
C228 C227 C231 F119 86.1(14) . . . . ?
C226 C227 C231 F119 -91.4(16) . . . . ?
C228 C227 C231 F19 -121.2(10) . . . . ?
C226 C227 C231 F19 61.3(11) . . . . ?
C228 C227 C231 F20 9.3(10) . . . . ?
C226 C227 C231 F20 -168.2(8) . . . . ?
C228 C227 C231 F120 -147.3(11) . . . . ?
C226 C227 C231 F120 35.2(12) . . . . ?
C228 C227 C231 F121 -33.8(13) . . . . ?
C226 C227 C231 F121 148.8(14) . . . . ?
C228 C227 C231 F21 123.1(8) . . . . ?
C226 C227 C231 F21 -54.3(9) . . . . ?
C228 C229 C232 F23 95.8(11) . . . . ?
C230 C229 C232 F23 -84.7(11) . . . . ?
C228 C229 C232 F24 -142.5(9) . . . . ?
C230 C229 C232 F24 37.0(10) . . . . ?
C228 C229 C232 F123 -82.3(15) . . . . ?
C230 C229 C232 F123 97.3(15) . . . . ?
C228 C229 C232 F124 39.6(14) . . . . ?
C230 C229 C232 F124 -140.9(13) . . . . ?
C228 C229 C232 F22 -23.2(10) . . . . ?
C230 C229 C232 F22 156.3(9) . . . . ?
C228 C229 C232 F122 158.6(13) . . . . ?
C230 C229 C232 F122 -21.9(13) . . . . ?
C317 B300 C301 C302 -151.3(7) . . . . ?
C309 B300 C301 C302 86.4(8) . . . . ?
C325 B300 C301 C302 -32.3(10) . . . . ?
C317 B300 C301 C306 36.4(10) . . . . ?
C309 B300 C301 C306 -85.9(8) . . . . ?
C325 B300 C301 C306 155.4(7) . . . . ?
C306 C301 C302 C303 0.0(10) . . . . ?
B300 C301 C302 C303 -172.8(7) . . . . ?
C301 C302 C303 C304 0.5(11) . . . . ?
C301 C302 C303 C307 177.5(7) . . . . ?
C302 C303 C304 C305 -0.3(11) . . . . ?
C307 C303 C304 C305 -177.3(7) . . . . ?
C303 C304 C305 C306 -0.3(11) . . . . ?
C303 C304 C305 C308 174.3(7) . . . . ?
C304 C305 C306 C301 0.9(12) . . . . ?
C308 C305 C306 C301 -173.6(7) . . . . ?
C302 C301 C306 C305 -0.7(11) . . . . ?
B300 C301 C306 C305 172.2(7) . . . . ?
C304 C303 C307 F52 -26.0(11) . . . . ?
C302 C303 C307 F52 157.0(7) . . . . ?
C304 C303 C307 F53 93.1(9) . . . . ?
C302 C303 C307 F53 -83.9(9) . . . . ?
C304 C303 C307 F51 -148.0(7) . . . . ?
C302 C303 C307 F51 35.0(10) . . . . ?
C304 C305 C308 F55 39.1(11) . . . . ?
C306 C305 C308 F55 -146.4(8) . . . . ?
C304 C305 C308 F54 -81.7(9) . . . . ?
C306 C305 C308 F54 92.8(9) . . . . ?
C304 C305 C308 F56 158.1(8) . . . . ?
C306 C305 C308 F56 -27.3(11) . . . . ?
C301 B300 C309 C314 94.4(8) . . . . ?
C317 B300 C309 C314 -29.7(10) . . . . ?
C325 B300 C309 C314 -144.6(7) . . . . ?
C301 B300 C309 C310 -81.9(8) . . . . ?
C317 B300 C309 C310 154.0(6) . . . . ?
C325 B300 C309 C310 39.1(9) . . . . ?
C314 C309 C310 C311 2.0(11) . . . . ?
B300 C309 C310 C311 178.6(7) . . . . ?
C309 C310 C311 C312 1.7(12) . . . . ?
C309 C310 C311 C315 179.5(8) . . . . ?
C310 C311 C312 C313 -4.1(12) . . . . ?
C315 C311 C312 C313 178.2(7) . . . . ?
C311 C312 C313 C314 2.7(11) . . . . ?
C311 C312 C313 C316 -177.9(7) . . . . ?
C310 C309 C314 C313 -3.4(11) . . . . ?
B300 C309 C314 C313 -179.9(6) . . . . ?
C312 C313 C314 C309 1.1(11) . . . . ?
C316 C313 C314 C309 -178.3(7) . . . . ?
C310 C311 C315 F59 -90.5(10) . . . . ?
C312 C311 C315 F59 87.2(10) . . . . ?
C310 C311 C315 F58 146.3(9) . . . . ?
C312 C311 C315 F58 -35.9(13) . . . . ?
C310 C311 C315 F57 31.0(11) . . . . ?
C312 C311 C315 F57 -151.2(8) . . . . ?
C312 C313 C316 F62 -5.4(11) . . . . ?
C314 C313 C316 F62 174.0(7) . . . . ?
C312 C313 C316 F60 -126.8(9) . . . . ?
C314 C313 C316 F60 52.7(12) . . . . ?
C312 C313 C316 F61 113.4(10) . . . . ?
C314 C313 C316 F61 -67.2(10) . . . . ?
C301 B300 C317 C318 33.6(10) . . . . ?
C309 B300 C317 C318 151.6(7) . . . . ?
C325 B300 C317 C318 -90.3(8) . . . . ?
C301 B300 C317 C322 -152.9(7) . . . . ?
C309 B300 C317 C322 -34.9(9) . . . . ?
C325 B300 C317 C322 83.2(8) . . . . ?
C322 C317 C318 C319 0.1(11) . . . . ?
B300 C317 C318 C319 173.9(7) . . . . ?
C317 C318 C319 C320 1.4(13) . . . . ?
C317 C318 C319 C323 -179.0(8) . . . . ?
C318 C319 C320 C321 -1.0(13) . . . . ?
C323 C319 C320 C321 179.4(8) . . . . ?
C319 C320 C321 C322 -0.8(13) . . . . ?
C319 C320 C321 C324 179.1(7) . . . . ?
C318 C317 C322 C321 -2.0(12) . . . . ?
B300 C317 C322 C321 -176.0(7) . . . . ?
C320 C321 C322 C317 2.4(14) . . . . ?
C324 C321 C322 C317 -177.5(7) . . . . ?
C320 C319 C323 F65 103.1(10) . . . . ?
C318 C319 C323 F65 -76.5(10) . . . . ?
C320 C319 C323 F63 -136.8(9) . . . . ?
C318 C319 C323 F63 43.6(12) . . . . ?
C320 C319 C323 F64 -17.5(12) . . . . ?
C318 C319 C323 F64 162.9(8) . . . . ?
C320 C321 C324 F68 158.3(11) . . . . ?
C322 C321 C324 F68 -21.8(12) . . . . ?
C320 C321 C324 F168 -23.0(15) . . . . ?
C322 C321 C324 F168 156.9(15) . . . . ?
C320 C321 C324 F166 -145.6(12) . . . . ?
C322 C321 C324 F166 34.3(13) . . . . ?
C320 C321 C324 F66 34.1(10) . . . . ?
C322 C321 C324 F66 -146.0(9) . . . . ?
C320 C321 C324 F167 96.2(14) . . . . ?
C322 C321 C324 F167 -83.9(15) . . . . ?
C320 C321 C324 F67 -81.8(11) . . . . ?
C322 C321 C324 F67 98.1(11) . . . . ?
C301 B300 C325 C326 -31.9(10) . . . . ?
C317 B300 C325 C326 93.0(8) . . . . ?
C309 B300 C325 C326 -147.4(7) . . . . ?
C301 B300 C325 C330 151.7(7) . . . . ?
C317 B300 C325 C330 -83.4(8) . . . . ?
C309 B300 C325 C330 36.2(9) . . . . ?
C330 C325 C326 C327 -3.3(10) . . . . ?
B300 C325 C326 C327 -179.9(6) . . . . ?
C325 C326 C327 C328 1.3(11) . . . . ?
C325 C326 C327 C331 -175.4(6) . . . . ?
C326 C327 C328 C329 1.2(12) . . . . ?
C331 C327 C328 C329 177.9(7) . . . . ?
C327 C328 C329 C330 -1.4(13) . . . . ?
C327 C328 C329 C332 178.4(7) . . . . ?
C328 C329 C330 C325 -0.8(13) . . . . ?
C332 C329 C330 C325 179.4(7) . . . . ?
C326 C325 C330 C329 3.1(11) . . . . ?
B300 C325 C330 C329 179.8(7) . . . . ?
C328 C327 C331 F170 -118(2) . . . . ?
C326 C327 C331 F170 58(2) . . . . ?
C328 C327 C331 F69 153.5(10) . . . . ?
C326 C327 C331 F69 -29.8(10) . . . . ?
C328 C327 C331 F70 30.2(11) . . . . ?
C326 C327 C331 F70 -153.1(9) . . . . ?
C328 C327 C331 F169 4.0(19) . . . . ?
C326 C327 C331 F169 -179.3(17) . . . . ?
C328 C327 C331 F171 122(2) . . . . ?
C326 C327 C331 F171 -61.4(19) . . . . ?
C328 C327 C331 F71 -87.8(10) . . . . ?
C326 C327 C331 F71 88.9(9) . . . . ?
C328 C329 C332 F74 151.8(14) . . . . ?
C330 C329 C332 F74 -28.4(15) . . . . ?
C328 C329 C332 F174 -42.7(16) . . . . ?
C330 C329 C332 F174 137.1(16) . . . . ?
C328 C329 C332 F72 27.6(14) . . . . ?
C330 C329 C332 F72 -152.6(14) . . . . ?
C328 C329 C332 F172 -164.8(15) . . . . ?
C330 C329 C332 F172 15.0(16) . . . . ?
C328 C329 C332 F173 77.4(16) . . . . ?
C330 C329 C332 F173 -102.8(17) . . . . ?
C328 C329 C332 F73 -89.0(14) . . . . ?
C330 C329 C332 F73 90.8(14) . . . . ?

_refine_diff_density_max         1.666
_refine_diff_density_min         -1.725
_refine_diff_density_rms         0.120

_vrf_PLAT213_10                  
; 
PROBLEM: Atom F166 has ADP max/min Ratio ..... 4.6 prolat
RESPONSE: The structure contains a significant degree of disorder
and modelling has been attempted, unfortunately some of the 
ellipsoids remain prolate.
See _refine_special_details. 
;

_vrf_PLAT414_10                  
; 
PROBLEM: Short Intra D-H..H-X  H2C..H62B..1.88 Ang. 
RESPONSE: The structure contains a significant degree of disorder 
and modelling has been attempted, but allied to the poor data
quality, the position of the hydrogen atoms is somewhat
uncertain and hence some short contacts are present.
See _refine_special_details. 
;

_vrf_PLAT973_10                  
; 
PROBLEM: Check Calcd Positive Residual Density on Rh2 1.54 eA-3  
RESPONSE: The error is likely due to the poor quality of the data 
resulting from poor crystal quality.
;

_shelxl_version_number           2014-3

_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: 1,2-difluorobenzene/pentane'
_chemical_properties_physical    
'Air-sensitive, Moisture-sensitive, Oxygen-sensitive'
####################################################################### 
# 
# 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_11
_database_code_depnum_ccdc_archive 'CCDC 1445282'
_audit_update_record             
;
2016-02-18 deposited with the CCDC.
2016-02-24 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014
_chemical_formula_moiety         'C32 H12 B F24, C26 H54 B N P2 Rh'
_chemical_formula_sum            'C58 H66 B2 F24 N P2 Rh'
_chemical_formula_weight         1419.58

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh 0.0927 3.6045 '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                   12.3669(8)
_cell_length_b                   14.4784(13)
_cell_length_c                   18.9906(11)
_cell_angle_alpha                103.872(6)
_cell_angle_beta                 103.598(5)
_cell_angle_gamma                91.524(6)
_cell_volume                     3196.2(4)
_cell_formula_units_Z            2
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    4812
_cell_measurement_theta_min      3.1536
_cell_measurement_theta_max      74.9669

_exptl_crystal_description       plate
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.475
_exptl_crystal_F_000             1444
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.08
_exptl_absorpt_coefficient_mu    3.600
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_T_min  0.54978
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'SuperNova (Cu) X-ray Source'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Atlas'
_diffrn_detector_area_resol_mean 10.4102
_diffrn_reflns_number            23146
_diffrn_reflns_av_unetI/netI     0.1202
_diffrn_reflns_av_R_equivalents  0.0785
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_theta_min         3.156
_diffrn_reflns_theta_max         75.137
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.958
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.958
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.958
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             12646
_reflns_number_gt                7740
_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 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.35.21 (release 20-01-2012 CrysAlis171 .NET)
(compiled Jan 23 2012,18:06:46)
;
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 The R-factor of the structure is rather high due to poor data
 quality resulting from a poorly diffracting crystal.

 The hydride H1 was located in the difference map and the Rh-H
 distance fixed to 1.44 Ang by the DFIX command. The presence of
 this hydride has also been determined by NMR spectroscopy and 
 mass spectrometry.

 The i-propyl groups of the phosphine ligands contain signficant
 disorder. The disorder has been modelled over 2 sites and the
 occupancies allowed to refine freely. The P-C and C-C bonds of
 the disordered components have been fixed to 1.84 and 1.54 Ang
 by the DFIX command respectively. Certain atoms have been fixed
 to the same position using the EXYZ and EADP commands. The 
 ellipsoids of the disordered C atoms were described by the ISOR
 command.

 Some of the CF3 groups of the [BArF4]- anion were also
 disordered.  4 groups were modelled as disordered over 2 sites. 
 All F atoms were also described by the ISOR command.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1149P)²+6.2786P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         12646
_refine_ls_number_parameters     1000
_refine_ls_number_restraints     553
_refine_ls_R_factor_all          0.1292
_refine_ls_R_factor_gt           0.0834
_refine_ls_wR_factor_ref         0.2658
_refine_ls_wR_factor_gt          0.2230
_refine_ls_goodness_of_fit_ref   0.999
_refine_ls_restrained_S_all      1.019
_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
Rh1 Rh 0.90096(5) 0.80426(5) 0.75121(3) 0.04892(19) Uani 1 1 d D . . . .
H1 H 0.989(4) 0.851(4) 0.730(4) 0.034(17) Uiso 1 1 d D . . . .
B1 B 0.8050(7) 0.8008(8) 0.8175(6) 0.059(2) Uani 1 1 d . . . . .
C1 C 0.7183(7) 0.7207(7) 0.7654(5) 0.057(2) Uani 1 1 d . . . . .
C2 C 0.7063(6) 0.6338(7) 0.7838(5) 0.058(2) Uani 1 1 d . . . . .
H2 H 0.7480 0.6263 0.8307 0.069 Uiso 1 1 calc R U . . .
C3 C 0.6342(7) 0.5581(7) 0.7347(5) 0.066(2) Uani 1 1 d . . . . .
H3 H 0.6257 0.5002 0.7488 0.079 Uiso 1 1 calc R U . . .
C4 C 0.5751(9) 0.5663(9) 0.6658(7) 0.087(3) Uani 1 1 d . . . . .
H4 H 0.5260 0.5142 0.6325 0.105 Uiso 1 1 calc R U . . .
C5 C 0.5870(10) 0.6483(11) 0.6456(7) 0.105(5) Uani 1 1 d . . . . .
H5 H 0.5488 0.6537 0.5974 0.126 Uiso 1 1 calc R U . . .
C6 C 0.6568(7) 0.7263(9) 0.6971(6) 0.083(4) Uani 1 1 d . . . . .
H6 H 0.6610 0.7851 0.6836 0.100 Uiso 1 1 calc R U . . .
N1 N 0.8016(8) 0.8465(7) 0.8913(5) 0.079(2) Uani 1 1 d . . . . .
C7 C 0.8892(11) 0.9207(10) 0.9424(8) 0.101(4) Uani 1 1 d . . . . .
H7A H 0.9491 0.9281 0.9179 0.152 Uiso 1 1 calc R U . . .
H7B H 0.9198 0.9013 0.9886 0.152 Uiso 1 1 calc R U . . .
H7C H 0.8564 0.9817 0.9545 0.152 Uiso 1 1 calc R U . . .
C8 C 0.7104(11) 0.8332(10) 0.9247(7) 0.100(4) Uani 1 1 d . . . . .
H8A H 0.6531 0.7858 0.8887 0.150 Uiso 1 1 calc R U . . .
H8B H 0.6780 0.8940 0.9380 0.150 Uiso 1 1 calc R U . . .
H8C H 0.7384 0.8107 0.9698 0.150 Uiso 1 1 calc R U . . .
P1 P 1.02122(15) 0.69057(14) 0.78109(10) 0.0441(4) Uani 1 1 d D . . . .
C9 C 0.9595(6) 0.5649(6) 0.7505(4) 0.0509(17) Uani 1 1 d . . . . .
H9 H 0.9051 0.5603 0.7812 0.061 Uiso 1 1 calc R U . . .
C10 C 1.0443(8) 0.4906(6) 0.7650(5) 0.063(2) Uani 1 1 d . . . . .
H10A H 1.0041 0.4276 0.7545 0.095 Uiso 1 1 calc R U . . .
H10B H 1.0871 0.5093 0.8175 0.095 Uiso 1 1 calc R U . . .
H10C H 1.0954 0.4879 0.7323 0.095 Uiso 1 1 calc R U . . .
C11 C 0.8925(8) 0.5382(7) 0.6692(5) 0.067(2) Uani 1 1 d . . . . .
H11A H 0.9435 0.5322 0.6363 0.101 Uiso 1 1 calc R U . . .
H11B H 0.8427 0.5880 0.6603 0.101 Uiso 1 1 calc R U . . .
H11C H 0.8480 0.4772 0.6586 0.101 Uiso 1 1 calc R U . . .
C12 C 1.0987(6) 0.7041(6) 0.8795(4) 0.0497(17) Uani 1 1 d . . . . .
H12 H 1.1589 0.6593 0.8788 0.060 Uiso 1 1 calc R U . . .
C13 C 1.0226(7) 0.6727(7) 0.9235(5) 0.062(2) Uani 1 1 d . . . . .
H13A H 1.0633 0.6837 0.9761 0.093 Uiso 1 1 calc R U . . .
H13B H 0.9984 0.6046 0.9027 0.093 Uiso 1 1 calc R U . . .
H13C H 0.9571 0.7096 0.9199 0.093 Uiso 1 1 calc R U . . .
C14 C 1.1556(7) 0.8036(7) 0.9171(5) 0.065(2) Uani 1 1 d . . . . .
H14A H 1.0990 0.8496 0.9199 0.098 Uiso 1 1 calc R U . . .
H14B H 1.2054 0.8202 0.8879 0.098 Uiso 1 1 calc R U . . .
H14C H 1.1991 0.8054 0.9677 0.098 Uiso 1 1 calc R U . . .
C15A C 1.1191(9) 0.6817(11) 0.7203(7) 0.050(3) Uani 0.68(2) 1 d D U P A 1
H15A H 1.1366 0.6138 0.7050 0.060 Uiso 0.68(2) 1 calc R U P A 1
C16A C 1.2298(10) 0.7472(11) 0.7564(8) 0.067(4) Uani 0.68(2) 1 d D U P A 1
H16A H 1.2840 0.7281 0.7265 0.100 Uiso 0.68(2) 1 calc R U P A 1
H16B H 1.2601 0.7410 0.8074 0.100 Uiso 0.68(2) 1 calc R U P A 1
H16C H 1.2150 0.8137 0.7580 0.100 Uiso 0.68(2) 1 calc R U P A 1
C17A C 1.0685(9) 0.7155(9) 0.6507(5) 0.080(3) Uani 0.68(2) 1 d D . P A 1
H17A H 1.0524 0.7823 0.6656 0.121 Uiso 0.68(2) 1 calc R U P A 1
H17B H 0.9991 0.6759 0.6227 0.121 Uiso 0.68(2) 1 calc R U P A 1
H17C H 1.1214 0.7100 0.6191 0.121 Uiso 0.68(2) 1 calc R U P A 1
C15B C 1.1311(16) 0.717(2) 0.7333(12) 0.052(9) Uani 0.32(2) 1 d D U P A 2
H15B H 1.1546 0.7868 0.7568 0.063 Uiso 0.32(2) 1 calc R U P A 2
C16B C 1.240(3) 0.668(3) 0.756(2) 0.084(11) Uani 0.32(2) 1 d D U P A 2
H16D H 1.2199 0.6011 0.7542 0.126 Uiso 0.32(2) 1 calc R U P A 2
H16E H 1.2805 0.7010 0.8074 0.126 Uiso 0.32(2) 1 calc R U P A 2
H16F H 1.2868 0.6705 0.7218 0.126 Uiso 0.32(2) 1 calc R U P A 2
C17B C 1.0685(9) 0.7155(9) 0.6507(5) 0.080(3) Uani 0.32(2) 1 d D . P A 2
H17D H 1.0775 0.7791 0.6424 0.121 Uiso 0.32(2) 1 calc R U P A 2
H17E H 0.9889 0.6966 0.6425 0.121 Uiso 0.32(2) 1 calc R U P A 2
H17F H 1.1000 0.6694 0.6158 0.121 Uiso 0.32(2) 1 calc R U P A 2
P2 P 0.84040(17) 0.93642(17) 0.70595(15) 0.0609(6) Uani 1 1 d D . . . .
C18A C 0.8364(13) 0.8903(10) 0.6017(7) 0.084(4) Uani 0.739(11) 1 d D U P B 1
H18A H 0.9141 0.8746 0.5995 0.101 Uiso 0.739(11) 1 calc R U P B 1
C19A C 0.7648(12) 0.8026(9) 0.5637(6) 0.104(4) Uani 0.739(11) 1 d D U P B 1
H19A H 0.6889 0.8118 0.5695 0.156 Uiso 0.739(11) 1 calc R U P B 1
H19B H 0.7937 0.7508 0.5858 0.156 Uiso 0.739(11) 1 calc R U P B 1
H19C H 0.7637 0.7861 0.5104 0.156 Uiso 0.739(11) 1 calc R U P B 1
C20A C 0.8046(17) 0.9611(14) 0.5515(10) 0.103(6) Uani 0.739(11) 1 d D U P B 1
H20A H 0.8155 0.9331 0.5016 0.154 Uiso 0.739(11) 1 calc R U P B 1
H20B H 0.8520 1.0212 0.5741 0.154 Uiso 0.739(11) 1 calc R U P B 1
H20C H 0.7261 0.9736 0.5473 0.154 Uiso 0.739(11) 1 calc R U P B 1
C18B C 0.750(2) 0.9043(13) 0.6109(10) 0.053(7) Uani 0.261(11) 1 d D U P B 2
H18B H 0.6740 0.8950 0.6199 0.064 Uiso 0.261(11) 1 calc R U P B 2
C19B C 0.7648(12) 0.8026(9) 0.5637(6) 0.104(4) Uani 0.261(11) 1 d D U P B 2
H19D H 0.7154 0.7906 0.5133 0.156 Uiso 0.261(11) 1 calc R U P B 2
H19E H 0.7460 0.7541 0.5881 0.156 Uiso 0.261(11) 1 calc R U P B 2
H19F H 0.8426 0.7997 0.5604 0.156 Uiso 0.261(11) 1 calc R U P B 2
C20B C 0.741(4) 0.996(3) 0.581(3) 0.082(12) Uani 0.261(11) 1 d D U P B 2
H20D H 0.8162 1.0206 0.5823 0.123 Uiso 0.261(11) 1 calc R U P B 2
H20E H 0.7074 1.0438 0.6130 0.123 Uiso 0.261(11) 1 calc R U P B 2
H20F H 0.6949 0.9798 0.5297 0.123 Uiso 0.261(11) 1 calc R U P B 2
C21A C 0.9481(11) 1.0352(10) 0.7342(9) 0.071(4) Uani 0.739(11) 1 d D U P B 1
H21A H 0.9166 1.0855 0.7092 0.085 Uiso 0.739(11) 1 calc R U P B 1
C22A C 0.9727(16) 1.0791(13) 0.8183(10) 0.104(6) Uani 0.739(11) 1 d D U P B 1
H22A H 1.0160 1.0367 0.8449 0.156 Uiso 0.739(11) 1 calc R U P B 1
H22B H 0.9022 1.0877 0.8332 0.156 Uiso 0.739(11) 1 calc R U P B 1
H22C H 1.0156 1.1412 0.8307 0.156 Uiso 0.739(11) 1 calc R U P B 1
C23A C 1.0544(13) 1.0083(14) 0.7079(12) 0.096(5) Uani 0.739(11) 1 d D U P B 1
H23A H 1.1070 1.0652 0.7214 0.144 Uiso 0.739(11) 1 calc R U P B 1
H23B H 1.0348 0.9824 0.6534 0.144 Uiso 0.739(11) 1 calc R U P B 1
H23C H 1.0892 0.9600 0.7321 0.144 Uiso 0.739(11) 1 calc R U P B 1
C21B C 0.955(2) 1.021(2) 0.7059(18) 0.047(8) Uani 0.261(11) 1 d D U P B 2
H21B H 0.9218 1.0682 0.6784 0.057 Uiso 0.261(11) 1 calc R U P B 2
C22B C 1.025(5) 1.076(4) 0.783(2) 0.110(17) Uani 0.261(11) 1 d D U P B 2
H22D H 1.0169 1.0412 0.8206 0.164 Uiso 0.261(11) 1 calc R U P B 2
H22E H 0.9992 1.1395 0.7966 0.164 Uiso 0.261(11) 1 calc R U P B 2
H22F H 1.1037 1.0816 0.7823 0.164 Uiso 0.261(11) 1 calc R U P B 2
C23B C 1.037(4) 0.968(4) 0.665(3) 0.099(17) Uani 0.261(11) 1 d D U P B 2
H23D H 1.0945 1.0144 0.6626 0.149 Uiso 0.261(11) 1 calc R U P B 2
H23E H 0.9967 0.9339 0.6139 0.149 Uiso 0.261(11) 1 calc R U P B 2
H23F H 1.0721 0.9224 0.6918 0.149 Uiso 0.261(11) 1 calc R U P B 2
C24A C 0.7043(11) 0.9808(10) 0.7048(8) 0.079(4) Uani 0.739(11) 1 d D U P B 1
H24A H 0.6484 0.9378 0.6618 0.095 Uiso 0.739(11) 1 calc R U P B 1
C25A C 0.6684(16) 0.9808(14) 0.7758(9) 0.105(5) Uani 0.739(11) 1 d D U P B 1
H25A H 0.7312 0.9665 0.8128 0.157 Uiso 0.739(11) 1 calc R U P B 1
H25B H 0.6059 0.9322 0.7645 0.157 Uiso 0.739(11) 1 calc R U P B 1
H25C H 0.6451 1.0437 0.7961 0.157 Uiso 0.739(11) 1 calc R U P B 1
C26A C 0.6978(13) 1.0828(10) 0.6952(11) 0.131(6) Uani 0.739(11) 1 d D U P B 1
H26A H 0.6201 1.0988 0.6876 0.197 Uiso 0.739(11) 1 calc R U P B 1
H26B H 0.7252 1.0872 0.6516 0.197 Uiso 0.739(11) 1 calc R U P B 1
H26C H 0.7438 1.1276 0.7402 0.197 Uiso 0.739(11) 1 calc R U P B 1
C24B C 0.757(3) 1.025(2) 0.7530(14) 0.079(4) Uani 0.261(11) 1 d D U P B 2
H24B H 0.6914 0.9812 0.7493 0.095 Uiso 0.261(11) 1 calc R U P B 2
C25B C 0.794(4) 1.061(4) 0.8388(17) 0.105(5) Uani 0.261(11) 1 d D U P B 2
H25D H 0.8760 1.0664 0.8550 0.157 Uiso 0.261(11) 1 calc R U P B 2
H25E H 0.7635 1.0156 0.8614 0.157 Uiso 0.261(11) 1 calc R U P B 2
H25F H 0.7670 1.1237 0.8547 0.157 Uiso 0.261(11) 1 calc R U P B 2
C26B C 0.6978(13) 1.0828(10) 0.6952(11) 0.131(6) Uani 0.261(11) 1 d D U P B 2
H26D H 0.7491 1.0956 0.6658 0.197 Uiso 0.261(11) 1 calc R U P B 2
H26E H 0.6770 1.1433 0.7225 0.197 Uiso 0.261(11) 1 calc R U P B 2
H26F H 0.6305 1.0447 0.6616 0.197 Uiso 0.261(11) 1 calc R U P B 2
B200 B 0.3689(6) 0.2995(6) 0.7486(4) 0.0353(14) Uani 1 1 d . . . . .
C201 C 0.3515(5) 0.3746(5) 0.8227(3) 0.0366(13) Uani 1 1 d . . . . .
C202 C 0.2691(5) 0.3535(5) 0.8576(3) 0.0371(13) Uani 1 1 d . . . . .
H202 H 0.2265 0.2934 0.8385 0.044 Uiso 1 1 calc R U . . .
C203 C 0.2478(5) 0.4174(5) 0.9189(3) 0.0395(14) Uani 1 1 d . . . . .
C204 C 0.3050(5) 0.5070(5) 0.9477(4) 0.0436(15) Uani 1 1 d . . . . .
H204 H 0.2896 0.5508 0.9894 0.052 Uiso 1 1 calc R U . . .
C205 C 0.3859(5) 0.5309(5) 0.9136(3) 0.0412(14) Uani 1 1 d D . . . .
C206 C 0.4087(5) 0.4663(5) 0.8522(3) 0.0372(13) Uani 1 1 d . . . . .
H206 H 0.4641 0.4847 0.8299 0.045 Uiso 1 1 calc R U . . .
C207 C 0.1628(6) 0.3902(6) 0.9573(4) 0.0467(16) Uani 1 1 d . . . . .
F1 F 0.1118(5) 0.3022(4) 0.9255(3) 0.0832(17) Uani 1 1 d . U . . .
F2 F 0.2073(4) 0.3916(5) 1.0282(3) 0.0747(16) Uani 1 1 d . U . . .
F3 F 0.0822(4) 0.4478(5) 0.9583(3) 0.0757(16) Uani 1 1 d . U . . .
C208 C 0.4480(5) 0.6280(5) 0.9430(3) 0.0495(17) Uani 1 1 d D . . . .
F4 F 0.5539(5) 0.6263(5) 0.9449(7) 0.090(4) Uani 0.692(19) 1 d D U P C 1
F5 F 0.4458(12) 0.6675(7) 1.0118(5) 0.118(6) Uani 0.692(19) 1 d D U P C 1
F6 F 0.4113(8) 0.6871(6) 0.9046(7) 0.098(5) Uani 0.692(19) 1 d D U P C 1
F104 F 0.3824(10) 0.6962(6) 0.9528(14) 0.075(7) Uani 0.308(19) 1 d D U P C 2
F105 F 0.503(2) 0.6498(12) 0.8977(10) 0.111(11) Uani 0.308(19) 1 d D U P C 2
F106 F 0.5194(17) 0.6400(9) 1.0061(9) 0.087(9) Uani 0.308(19) 1 d D U P C 2
C209 C 0.4913(5) 0.3130(5) 0.7324(3) 0.0351(13) Uani 1 1 d . . . . .
C210 C 0.5895(5) 0.3273(5) 0.7898(3) 0.0392(14) Uani 1 1 d . . . . .
H210 H 0.5842 0.3362 0.8401 0.047 Uiso 1 1 calc R U . . .
C211 C 0.6948(5) 0.3290(5) 0.7754(4) 0.0422(15) Uani 1 1 d . . . . .
C212 C 0.7066(6) 0.3153(6) 0.7030(4) 0.0451(16) Uani 1 1 d . . . . .
H212 H 0.7784 0.3174 0.6933 0.054 Uiso 1 1 calc R U . . .
C213 C 0.6108(5) 0.2987(5) 0.6453(4) 0.0477(17) Uani 1 1 d D . . . .
C214 C 0.5057(5) 0.2973(5) 0.6595(3) 0.0391(14) Uani 1 1 d . . . . .
H214 H 0.4416 0.2854 0.6185 0.047 Uiso 1 1 calc R U . . .
C215 C 0.7989(6) 0.3478(6) 0.8382(4) 0.0496(17) Uani 1 1 d . . . . .
F7 F 0.8357(5) 0.4392(5) 0.8594(4) 0.095(2) Uani 1 1 d . U . . .
F8 F 0.7845(4) 0.3260(6) 0.8984(3) 0.094(2) Uani 1 1 d . U . . .
F9 F 0.8839(4) 0.3039(5) 0.8203(3) 0.0832(18) Uani 1 1 d . U . . .
C216 C 0.6211(4) 0.2816(5) 0.5658(4) 0.063(2) Uani 1 1 d D . . . .
F10 F 0.6714(13) 0.3528(6) 0.5525(6) 0.121(5) Uani 0.718(19) 1 d D U P D 1
F11 F 0.6813(8) 0.2080(6) 0.5486(4) 0.072(3) Uani 0.718(19) 1 d D U P D 1
F12 F 0.5255(6) 0.2573(11) 0.5159(3) 0.104(5) Uani 0.718(19) 1 d D U P D 1
F110 F 0.606(3) 0.1930(8) 0.5289(8) 0.122(11) Uani 0.282(19) 1 d D U P D 2
F111 F 0.5471(15) 0.3274(18) 0.5272(7) 0.074(7) Uani 0.282(19) 1 d D U P D 2
F112 F 0.7178(10) 0.3166(17) 0.5615(7) 0.071(7) Uani 0.282(19) 1 d D U P D 2
C217 C 0.3603(5) 0.1880(5) 0.7537(3) 0.0380(13) Uani 1 1 d . . . . .
C218 C 0.3433(6) 0.1115(5) 0.6897(4) 0.0443(15) Uani 1 1 d . . . . .
H218 H 0.3267 0.1248 0.6419 0.053 Uiso 1 1 calc R U . . .
C219 C 0.3498(6) 0.0182(6) 0.6936(4) 0.0527(17) Uani 1 1 d D . . . .
C220 C 0.3703(7) -0.0067(6) 0.7610(5) 0.0575(19) Uani 1 1 d . . . . .
H220 H 0.3717 -0.0715 0.7632 0.069 Uiso 1 1 calc R U . . .
C221 C 0.3891(6) 0.0683(5) 0.8264(4) 0.0530(18) Uani 1 1 d D . . . .
C222 C 0.3846(6) 0.1622(6) 0.8221(4) 0.0466(16) Uani 1 1 d . . . . .
H222 H 0.3985 0.2113 0.8673 0.056 Uiso 1 1 calc R U . . .
C223 C 0.3384(5) -0.0586(6) 0.6221(5) 0.075(3) Uani 1 1 d D . . . .
F13 F 0.2366(11) -0.097(2) 0.5917(14) 0.122(13) Uani 0.30(4) 1 d D U P E 1
F14 F 0.372(3) -0.0280(11) 0.5707(9) 0.092(10) Uani 0.30(4) 1 d D U P E 1
F15 F 0.399(3) -0.1296(14) 0.6330(8) 0.094(10) Uani 0.30(4) 1 d D U P E 1
F113 F 0.4127(12) -0.0449(10) 0.5857(6) 0.096(5) Uani 0.70(4) 1 d D U P E 2
F114 F 0.346(2) -0.1442(5) 0.6322(6) 0.139(6) Uani 0.70(4) 1 d D U P E 2
F115 F 0.2412(8) -0.0616(11) 0.5744(6) 0.095(5) Uani 0.70(4) 1 d D U P E 2
C224 C 0.4107(6) 0.0435(5) 0.8991(5) 0.086(3) Uani 1 1 d D . . . .
F16 F 0.4469(9) 0.1170(6) 0.9577(3) 0.084(3) Uani 0.76(2) 1 d D U P F 1
F17 F 0.3196(9) 0.0075(8) 0.9118(4) 0.122(5) Uani 0.76(2) 1 d D U P F 1
F18 F 0.4840(12) -0.0194(9) 0.9060(6) 0.162(7) Uani 0.76(2) 1 d D U P F 1
F116 F 0.419(2) -0.0484(7) 0.8932(8) 0.071(9) Uani 0.24(2) 1 d D U P F 2
F117 F 0.5047(18) 0.0862(18) 0.9459(10) 0.121(14) Uani 0.24(2) 1 d D U P F 2
F118 F 0.332(2) 0.066(2) 0.9349(12) 0.150(17) Uani 0.24(2) 1 d D U P F 2
C225 C 0.2706(5) 0.3199(5) 0.6803(3) 0.0353(13) Uani 1 1 d . . . . .
C226 C 0.2848(6) 0.3956(5) 0.6487(3) 0.0404(14) Uani 1 1 d . . . . .
H226 H 0.3536 0.4344 0.6662 0.048 Uiso 1 1 calc R U . . .
C227 C 0.2023(5) 0.4165(5) 0.5926(4) 0.0415(14) Uani 1 1 d . . . . .
C228 C 0.0991(6) 0.3615(6) 0.5662(4) 0.0442(16) Uani 1 1 d . . . . .
H228 H 0.0423 0.3747 0.5275 0.053 Uiso 1 1 calc R U . . .
C229 C 0.0829(6) 0.2888(6) 0.5975(4) 0.0456(16) Uani 1 1 d . . . . .
C230 C 0.1666(5) 0.2658(5) 0.6527(3) 0.0405(14) Uani 1 1 d . . . . .
H230 H 0.1529 0.2129 0.6719 0.049 Uiso 1 1 calc R U . . .
C231 C 0.2276(7) 0.4943(6) 0.5573(5) 0.0569(19) Uani 1 1 d . . . . .
F19 F 0.2906(5) 0.5681(4) 0.6056(3) 0.0811(16) Uani 1 1 d . U . . .
F20 F 0.2799(6) 0.4624(5) 0.5040(4) 0.0903(19) Uani 1 1 d . U . . .
F21 F 0.1351(5) 0.5275(4) 0.5236(3) 0.0830(17) Uani 1 1 d . U . . .
C232 C -0.0259(6) 0.2274(7) 0.5703(4) 0.058(2) Uani 1 1 d . . . . .
F22 F -0.0991(4) 0.2532(6) 0.5183(3) 0.093(2) Uani 1 1 d . U . . .
F23 F -0.0740(4) 0.2238(5) 0.6254(3) 0.0752(15) Uani 1 1 d . U . . .
F24 F -0.0117(5) 0.1357(5) 0.5413(4) 0.100(2) Uani 1 1 d . U . . .


_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
Rh1 B1 1.929(9) . ?
Rh1 P1 2.3292(18) . ?
Rh1 P2 2.350(2) . ?
Rh1 H1 1.45(2) . ?
B1 N1 1.411(14) . ?
B1 C1 1.536(14) . ?
C1 C6 1.362(12) . ?
C1 C2 1.398(11) . ?
C2 C3 1.390(13) . ?
C2 H2 0.9500 . ?
C3 C4 1.374(14) . ?
C3 H3 0.9500 . ?
C4 C5 1.347(16) . ?
C4 H4 0.9500 . ?
C5 C6 1.414(18) . ?
C5 H5 0.9500 . ?
C6 H6 0.9500 . ?
N1 C8 1.446(15) . ?
N1 C7 1.488(16) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
P1 C15A 1.847(11) . ?
P1 C12 1.850(7) . ?
P1 C9 1.855(9) . ?
P1 C15B 1.882(17) . ?
C9 C11 1.522(11) . ?
C9 C10 1.550(11) . ?
C9 H9 1.0000 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 C14 1.515(12) . ?
C12 C13 1.523(11) . ?
C12 H12 1.0000 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15A C17A 1.520(13) . ?
C15A C16A 1.557(14) . ?
C15A H15A 1.0000 . ?
C16A H16A 0.9800 . ?
C16A H16B 0.9800 . ?
C16A H16C 0.9800 . ?
C17A H17A 0.9800 . ?
C17A H17B 0.9800 . ?
C17A H17C 0.9800 . ?
C15B C16B 1.560(19) . ?
C15B H15B 1.0000 . ?
C16B H16D 0.9800 . ?
C16B H16E 0.9800 . ?
C16B H16F 0.9800 . ?
P2 C24A 1.815(12) . ?
P2 C21A 1.817(12) . ?
P2 C18B 1.832(17) . ?
P2 C21B 1.845(18) . ?
P2 C24B 1.864(18) . ?
P2 C18A 1.921(13) . ?
C18A C19A 1.455(14) . ?
C18A C20A 1.558(14) . ?
C18A H18A 1.0000 . ?
C19A H19A 0.9800 . ?
C19A H19B 0.9800 . ?
C19A H19C 0.9800 . ?
C20A H20A 0.9800 . ?
C20A H20B 0.9800 . ?
C20A H20C 0.9800 . ?
C18B C20B 1.552(19) . ?
C18B H18B 1.0000 . ?
C20B H20D 0.9800 . ?
C20B H20E 0.9800 . ?
C20B H20F 0.9800 . ?
C21A C22A 1.523(17) . ?
C21A C23A 1.541(16) . ?
C21A H21A 1.0000 . ?
C22A H22A 0.9800 . ?
C22A H22B 0.9800 . ?
C22A H22C 0.9800 . ?
C23A H23A 0.9800 . ?
C23A H23B 0.9800 . ?
C23A H23C 0.9800 . ?
C21B C23B 1.53(2) . ?
C21B C22B 1.53(2) . ?
C21B H21B 1.0000 . ?
C22B H22D 0.9800 . ?
C22B H22E 0.9800 . ?
C22B H22F 0.9800 . ?
C23B H23D 0.9800 . ?
C23B H23E 0.9800 . ?
C23B H23F 0.9800 . ?
C24A C25A 1.515(15) . ?
C24A C26A 1.533(14) . ?
C24A H24A 1.0000 . ?
C25A H25A 0.9800 . ?
C25A H25B 0.9800 . ?
C25A H25C 0.9800 . ?
C26A H26A 0.9800 . ?
C26A H26B 0.9800 . ?
C26A H26C 0.9800 . ?
C24B C25B 1.54(2) . ?
C24B H24B 1.0000 . ?
C25B H25D 0.9800 . ?
C25B H25E 0.9800 . ?
C25B H25F 0.9800 . ?
B200 C201 1.622(10) . ?
B200 C209 1.630(9) . ?
B200 C217 1.642(10) . ?
B200 C225 1.645(8) . ?
C201 C202 1.403(9) . ?
C201 C206 1.408(9) . ?
C202 C203 1.387(9) . ?
C202 H202 0.9500 . ?
C203 C204 1.382(10) . ?
C203 C207 1.507(9) . ?
C204 C205 1.391(10) . ?
C204 H204 0.9500 . ?
C205 C206 1.399(9) . ?
C205 C208 1.496(10) . ?
C206 H206 0.9500 . ?
C207 F3 1.318(9) . ?
C207 F2 1.323(8) . ?
C207 F1 1.340(10) . ?
C208 F6 1.279(7) . ?
C208 F106 1.281(7) . ?
C208 F104 1.302(8) . ?
C208 F5 1.302(7) . ?
C208 F105 1.303(8) . ?
C208 F4 1.303(7) . ?
C209 C210 1.401(8) . ?
C209 C214 1.403(8) . ?
C210 C211 1.392(9) . ?
C210 H210 0.9500 . ?
C211 C212 1.385(10) . ?
C211 C215 1.503(9) . ?
C212 C213 1.382(9) . ?
C212 H212 0.9500 . ?
C213 C214 1.388(9) . ?
C213 C216 1.507(10) . ?
C214 H214 0.9500 . ?
C215 F8 1.304(9) . ?
C215 F9 1.314(9) . ?
C215 F7 1.322(10) . ?
C216 F110 1.291(8) . ?
C216 F10 1.295(7) . ?
C216 F12 1.308(7) . ?
C216 F112 1.315(8) . ?
C216 F111 1.328(8) . ?
C216 F11 1.337(7) . ?
C217 C218 1.403(10) . ?
C217 C222 1.404(9) . ?
C218 C219 1.375(10) . ?
C218 H218 0.9500 . ?
C219 C220 1.381(11) . ?
C219 C223 1.509(13) . ?
C220 C221 1.407(12) . ?
C220 H220 0.9500 . ?
C221 C222 1.384(10) . ?
C221 C224 1.474(11) . ?
C222 H222 0.9500 . ?
C223 F13 1.300(8) . ?
C223 F114 1.301(8) . ?
C223 F14 1.308(9) . ?
C223 F113 1.311(8) . ?
C223 F115 1.317(8) . ?
C223 F15 1.318(9) . ?
C224 F18 1.309(8) . ?
C224 F118 1.314(9) . ?
C224 F116 1.317(8) . ?
C224 F117 1.317(9) . ?
C224 F16 1.320(8) . ?
C224 F17 1.325(8) . ?
C225 C226 1.396(9) . ?
C225 C230 1.405(9) . ?
C226 C227 1.388(9) . ?
C226 H226 0.9500 . ?
C227 C228 1.402(10) . ?
C227 C231 1.505(11) . ?
C228 C229 1.359(11) . ?
C228 H228 0.9500 . ?
C229 C230 1.399(9) . ?
C229 C232 1.503(11) . ?
C230 H230 0.9500 . ?
C231 F19 1.318(10) . ?
C231 F20 1.325(11) . ?
C231 F21 1.334(9) . ?
C232 F22 1.306(9) . ?
C232 F23 1.331(9) . ?
C232 F24 1.343(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
B1 Rh1 P1 100.2(3) . . ?
B1 Rh1 P2 100.6(3) . . ?
P1 Rh1 P2 157.55(7) . . ?
B1 Rh1 H1 151(3) . . ?
P1 Rh1 H1 89(3) . . ?
P2 Rh1 H1 68(3) . . ?
N1 B1 C1 123.7(8) . . ?
N1 B1 Rh1 138.0(8) . . ?
C1 B1 Rh1 98.3(7) . . ?
C6 C1 C2 116.5(9) . . ?
C6 C1 B1 123.0(8) . . ?
C2 C1 B1 120.3(7) . . ?
C3 C2 C1 121.0(8) . . ?
C3 C2 H2 119.5 . . ?
C1 C2 H2 119.5 . . ?
C4 C3 C2 120.6(9) . . ?
C4 C3 H3 119.7 . . ?
C2 C3 H3 119.7 . . ?
C5 C4 C3 119.8(11) . . ?
C5 C4 H4 120.1 . . ?
C3 C4 H4 120.1 . . ?
C4 C5 C6 119.2(10) . . ?
C4 C5 H5 120.4 . . ?
C6 C5 H5 120.4 . . ?
C1 C6 C5 122.8(10) . . ?
C1 C6 H6 118.6 . . ?
C5 C6 H6 118.6 . . ?
B1 N1 C8 125.0(10) . . ?
B1 N1 C7 123.1(9) . . ?
C8 N1 C7 111.8(10) . . ?
N1 C7 H7A 109.5 . . ?
N1 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
N1 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N1 C8 H8A 109.5 . . ?
N1 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
N1 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C15A P1 C12 110.3(4) . . ?
C15A P1 C9 98.8(6) . . ?
C12 P1 C9 103.7(3) . . ?
C12 P1 C15B 104.3(7) . . ?
C9 P1 C15B 114.8(11) . . ?
C15A P1 Rh1 106.5(4) . . ?
C12 P1 Rh1 119.6(3) . . ?
C9 P1 Rh1 116.0(2) . . ?
C15B P1 Rh1 98.3(8) . . ?
C11 C9 C10 110.7(7) . . ?
C11 C9 P1 112.2(6) . . ?
C10 C9 P1 114.4(6) . . ?
C11 C9 H9 106.3 . . ?
C10 C9 H9 106.3 . . ?
P1 C9 H9 106.3 . . ?
C9 C10 H10A 109.5 . . ?
C9 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C9 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C9 C11 H11A 109.5 . . ?
C9 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C9 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C14 C12 C13 112.1(7) . . ?
C14 C12 P1 113.1(5) . . ?
C13 C12 P1 110.3(5) . . ?
C14 C12 H12 107.0 . . ?
C13 C12 H12 107.0 . . ?
P1 C12 H12 107.0 . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C12 C14 H14A 109.5 . . ?
C12 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C12 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C17A C15A C16A 103.6(10) . . ?
C17A C15A P1 110.6(7) . . ?
C16A C15A P1 114.2(10) . . ?
C17A C15A H15A 109.4 . . ?
C16A C15A H15A 109.4 . . ?
P1 C15A H15A 109.4 . . ?
C15A C16A H16A 109.5 . . ?
C15A C16A H16B 109.5 . . ?
H16A C16A H16B 109.5 . . ?
C15A C16A H16C 109.5 . . ?
H16A C16A H16C 109.5 . . ?
H16B C16A H16C 109.5 . . ?
C15A C17A H17A 109.5 . . ?
C15A C17A H17B 109.5 . . ?
H17A C17A H17B 109.5 . . ?
C15A C17A H17C 109.5 . . ?
H17A C17A H17C 109.5 . . ?
H17B C17A H17C 109.5 . . ?
C16B C15B P1 112.2(18) . . ?
C16B C15B H15B 103.5 . . ?
P1 C15B H15B 103.5 . . ?
C15B C16B H16D 109.5 . . ?
C15B C16B H16E 109.5 . . ?
H16D C16B H16E 109.5 . . ?
C15B C16B H16F 109.5 . . ?
H16D C16B H16F 109.5 . . ?
H16E C16B H16F 109.5 . . ?
C24A P2 C21A 110.4(7) . . ?
C18B P2 C21B 106.8(13) . . ?
C18B P2 C24B 99.7(12) . . ?
C21B P2 C24B 97.7(18) . . ?
C24A P2 C18A 103.5(7) . . ?
C21A P2 C18A 101.0(7) . . ?
C24A P2 Rh1 124.3(4) . . ?
C21A P2 Rh1 112.8(5) . . ?
C18B P2 Rh1 113.8(6) . . ?
C21B P2 Rh1 114.0(12) . . ?
C24B P2 Rh1 122.5(8) . . ?
C18A P2 Rh1 101.0(4) . . ?
C19A C18A C20A 106.2(12) . . ?
C19A C18A P2 114.5(9) . . ?
C20A C18A P2 116.9(12) . . ?
C19A C18A H18A 106.1 . . ?
C20A C18A H18A 106.1 . . ?
P2 C18A H18A 106.1 . . ?
C18A C19A H19A 109.5 . . ?
C18A C19A H19B 109.5 . . ?
H19A C19A H19B 109.5 . . ?
C18A C19A H19C 109.5 . . ?
H19A C19A H19C 109.5 . . ?
H19B C19A H19C 109.5 . . ?
C18A C20A H20A 109.5 . . ?
C18A C20A H20B 109.5 . . ?
H20A C20A H20B 109.5 . . ?
C18A C20A H20C 109.5 . . ?
H20A C20A H20C 109.5 . . ?
H20B C20A H20C 109.5 . . ?
C20B C18B P2 108(2) . . ?
C20B C18B H18B 102.5 . . ?
P2 C18B H18B 102.5 . . ?
C18B C20B H20D 109.5 . . ?
C18B C20B H20E 109.5 . . ?
H20D C20B H20E 109.5 . . ?
C18B C20B H20F 109.5 . . ?
H20D C20B H20F 109.5 . . ?
H20E C20B H20F 109.5 . . ?
C22A C21A C23A 112.5(14) . . ?
C22A C21A P2 110.5(11) . . ?
C23A C21A P2 113.2(11) . . ?
C22A C21A H21A 106.8 . . ?
C23A C21A H21A 106.8 . . ?
P2 C21A H21A 106.8 . . ?
C21A C22A H22A 109.5 . . ?
C21A C22A H22B 109.5 . . ?
H22A C22A H22B 109.5 . . ?
C21A C22A H22C 109.5 . . ?
H22A C22A H22C 109.5 . . ?
H22B C22A H22C 109.5 . . ?
C21A C23A H23A 109.5 . . ?
C21A C23A H23B 109.5 . . ?
H23A C23A H23B 109.5 . . ?
C21A C23A H23C 109.5 . . ?
H23A C23A H23C 109.5 . . ?
H23B C23A H23C 109.5 . . ?
C23B C21B C22B 106(4) . . ?
C23B C21B P2 111(3) . . ?
C22B C21B P2 116(3) . . ?
C23B C21B H21B 108.1 . . ?
C22B C21B H21B 108.1 . . ?
P2 C21B H21B 108.1 . . ?
C21B C22B H22D 109.5 . . ?
C21B C22B H22E 109.5 . . ?
H22D C22B H22E 109.5 . . ?
C21B C22B H22F 109.5 . . ?
H22D C22B H22F 109.5 . . ?
H22E C22B H22F 109.5 . . ?
C21B C23B H23D 109.5 . . ?
C21B C23B H23E 109.5 . . ?
H23D C23B H23E 109.5 . . ?
C21B C23B H23F 109.5 . . ?
H23D C23B H23F 109.5 . . ?
H23E C23B H23F 109.5 . . ?
C25A C24A C26A 106.6(13) . . ?
C25A C24A P2 112.4(10) . . ?
C26A C24A P2 113.7(10) . . ?
C25A C24A H24A 108.0 . . ?
C26A C24A H24A 108.0 . . ?
P2 C24A H24A 108.0 . . ?
C24A C25A H25A 109.5 . . ?
C24A C25A H25B 109.5 . . ?
H25A C25A H25B 109.5 . . ?
C24A C25A H25C 109.5 . . ?
H25A C25A H25C 109.5 . . ?
H25B C25A H25C 109.5 . . ?
C24A C26A H26A 109.5 . . ?
C24A C26A H26B 109.5 . . ?
H26A C26A H26B 109.5 . . ?
C24A C26A H26C 109.5 . . ?
H26A C26A H26C 109.5 . . ?
H26B C26A H26C 109.5 . . ?
C25B C24B P2 118(2) . . ?
C25B C24B H24B 98.3 . . ?
P2 C24B H24B 98.3 . . ?
C24B C25B H25D 109.5 . . ?
C24B C25B H25E 109.5 . . ?
H25D C25B H25E 109.5 . . ?
C24B C25B H25F 109.5 . . ?
H25D C25B H25F 109.5 . . ?
H25E C25B H25F 109.5 . . ?
C201 B200 C209 114.3(5) . . ?
C201 B200 C217 113.0(5) . . ?
C209 B200 C217 103.1(5) . . ?
C201 B200 C225 103.7(5) . . ?
C209 B200 C225 110.4(5) . . ?
C217 B200 C225 112.6(5) . . ?
C202 C201 C206 115.7(6) . . ?
C202 C201 B200 120.3(6) . . ?
C206 C201 B200 123.8(6) . . ?
C203 C202 C201 122.3(6) . . ?
C203 C202 H202 118.8 . . ?
C201 C202 H202 118.8 . . ?
C204 C203 C202 121.4(6) . . ?
C204 C203 C207 117.9(6) . . ?
C202 C203 C207 120.7(7) . . ?
C203 C204 C205 117.8(6) . . ?
C203 C204 H204 121.1 . . ?
C205 C204 H204 121.1 . . ?
C204 C205 C206 121.0(7) . . ?
C204 C205 C208 118.9(6) . . ?
C206 C205 C208 120.1(5) . . ?
C205 C206 C201 121.7(6) . . ?
C205 C206 H206 119.1 . . ?
C201 C206 H206 119.1 . . ?
F3 C207 F2 105.7(6) . . ?
F3 C207 F1 105.7(6) . . ?
F2 C207 F1 105.6(7) . . ?
F3 C207 C203 113.1(6) . . ?
F2 C207 C203 112.5(6) . . ?
F1 C207 C203 113.6(6) . . ?
F106 C208 F104 105.4(7) . . ?
F6 C208 F5 106.6(6) . . ?
F106 C208 F105 105.8(7) . . ?
F104 C208 F105 104.2(7) . . ?
F6 C208 F4 105.8(6) . . ?
F5 C208 F4 104.4(6) . . ?
F6 C208 C205 113.7(5) . . ?
F106 C208 C205 114.5(7) . . ?
F104 C208 C205 112.9(6) . . ?
F5 C208 C205 112.8(6) . . ?
F105 C208 C205 113.2(7) . . ?
F4 C208 C205 112.8(5) . . ?
C210 C209 C214 115.8(6) . . ?
C210 C209 B200 121.6(5) . . ?
C214 C209 B200 122.1(5) . . ?
C211 C210 C209 121.9(6) . . ?
C211 C210 H210 119.0 . . ?
C209 C210 H210 119.0 . . ?
C212 C211 C210 121.0(6) . . ?
C212 C211 C215 118.0(6) . . ?
C210 C211 C215 120.9(6) . . ?
C213 C212 C211 118.0(6) . . ?
C213 C212 H212 121.0 . . ?
C211 C212 H212 121.0 . . ?
C212 C213 C214 121.1(6) . . ?
C212 C213 C216 119.2(5) . . ?
C214 C213 C216 119.7(5) . . ?
C213 C214 C209 122.1(6) . . ?
C213 C214 H214 118.9 . . ?
C209 C214 H214 118.9 . . ?
F8 C215 F9 107.6(7) . . ?
F8 C215 F7 105.7(7) . . ?
F9 C215 F7 104.1(7) . . ?
F8 C215 C211 113.4(6) . . ?
F9 C215 C211 113.9(6) . . ?
F7 C215 C211 111.3(6) . . ?
F10 C216 F12 108.6(6) . . ?
F110 C216 F112 107.8(7) . . ?
F110 C216 F111 106.7(7) . . ?
F112 C216 F111 103.8(7) . . ?
F10 C216 F11 105.0(6) . . ?
F12 C216 F11 103.8(6) . . ?
F110 C216 C213 114.4(7) . . ?
F10 C216 C213 113.9(6) . . ?
F12 C216 C213 113.5(5) . . ?
F112 C216 C213 112.6(6) . . ?
F111 C216 C213 110.9(6) . . ?
F11 C216 C213 111.2(5) . . ?
C218 C217 C222 115.1(7) . . ?
C218 C217 B200 121.6(6) . . ?
C222 C217 B200 122.7(6) . . ?
C219 C218 C217 122.6(6) . . ?
C219 C218 H218 118.7 . . ?
C217 C218 H218 118.7 . . ?
C218 C219 C220 121.9(8) . . ?
C218 C219 C223 118.7(6) . . ?
C220 C219 C223 119.3(7) . . ?
C219 C220 C221 117.1(8) . . ?
C219 C220 H220 121.5 . . ?
C221 C220 H220 121.5 . . ?
C222 C221 C220 120.6(7) . . ?
C222 C221 C224 121.3(6) . . ?
C220 C221 C224 118.1(6) . . ?
C221 C222 C217 122.7(7) . . ?
C221 C222 H222 118.6 . . ?
C217 C222 H222 118.6 . . ?
F13 C223 F14 106.6(8) . . ?
F114 C223 F113 107.5(7) . . ?
F114 C223 F115 105.6(7) . . ?
F113 C223 F115 104.8(7) . . ?
F13 C223 F15 106.2(8) . . ?
F14 C223 F15 105.1(8) . . ?
F13 C223 C219 113.5(8) . . ?
F114 C223 C219 113.6(7) . . ?
F14 C223 C219 113.0(7) . . ?
F113 C223 C219 112.8(6) . . ?
F115 C223 C219 111.9(7) . . ?
F15 C223 C219 111.9(7) . . ?
F118 C224 F116 105.4(8) . . ?
F118 C224 F117 105.6(8) . . ?
F116 C224 F117 105.2(8) . . ?
F18 C224 F16 105.9(7) . . ?
F18 C224 F17 106.0(7) . . ?
F16 C224 F17 103.4(6) . . ?
F18 C224 C221 113.7(7) . . ?
F118 C224 C221 113.5(8) . . ?
F116 C224 C221 113.2(7) . . ?
F117 C224 C221 113.1(7) . . ?
F16 C224 C221 114.2(6) . . ?
F17 C224 C221 112.7(6) . . ?
C226 C225 C230 116.1(6) . . ?
C226 C225 B200 121.2(6) . . ?
C230 C225 B200 122.7(6) . . ?
C227 C226 C225 122.5(6) . . ?
C227 C226 H226 118.7 . . ?
C225 C226 H226 118.7 . . ?
C226 C227 C228 120.2(7) . . ?
C226 C227 C231 119.1(6) . . ?
C228 C227 C231 120.5(6) . . ?
C229 C228 C227 118.0(6) . . ?
C229 C228 H228 121.0 . . ?
C227 C228 H228 121.0 . . ?
C228 C229 C230 122.1(7) . . ?
C228 C229 C232 119.9(6) . . ?
C230 C229 C232 118.0(7) . . ?
C229 C230 C225 120.9(6) . . ?
C229 C230 H230 119.5 . . ?
C225 C230 H230 119.5 . . ?
F19 C231 F20 107.3(8) . . ?
F19 C231 F21 107.2(7) . . ?
F20 C231 F21 105.3(7) . . ?
F19 C231 C227 113.1(6) . . ?
F20 C231 C227 111.2(7) . . ?
F21 C231 C227 112.2(7) . . ?
F22 C232 F23 107.8(7) . . ?
F22 C232 F24 106.1(8) . . ?
F23 C232 F24 103.8(8) . . ?
F22 C232 C229 114.1(7) . . ?
F23 C232 C229 112.5(7) . . ?
F24 C232 C229 111.8(7) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 B1 C1 C6 122.5(11) . . . . ?
Rh1 B1 C1 C6 -59.3(11) . . . . ?
N1 B1 C1 C2 -63.2(12) . . . . ?
Rh1 B1 C1 C2 114.9(7) . . . . ?
C6 C1 C2 C3 -0.5(13) . . . . ?
B1 C1 C2 C3 -175.2(8) . . . . ?
C1 C2 C3 C4 1.7(14) . . . . ?
C2 C3 C4 C5 0.0(18) . . . . ?
C3 C4 C5 C6 -3(2) . . . . ?
C2 C1 C6 C5 -2.2(17) . . . . ?
B1 C1 C6 C5 172.3(11) . . . . ?
C4 C5 C6 C1 4(2) . . . . ?
C1 B1 N1 C8 -7.9(15) . . . . ?
Rh1 B1 N1 C8 174.8(9) . . . . ?
C1 B1 N1 C7 176.9(9) . . . . ?
Rh1 B1 N1 C7 -0.4(16) . . . . ?
C15A P1 C9 C11 -65.6(7) . . . . ?
C12 P1 C9 C11 -179.2(6) . . . . ?
C15B P1 C9 C11 -66.0(9) . . . . ?
Rh1 P1 C9 C11 47.7(7) . . . . ?
C15A P1 C9 C10 61.6(7) . . . . ?
C12 P1 C9 C10 -52.0(6) . . . . ?
C15B P1 C9 C10 61.1(9) . . . . ?
Rh1 P1 C9 C10 174.8(5) . . . . ?
C15A P1 C12 C14 75.9(8) . . . . ?
C9 P1 C12 C14 -179.1(6) . . . . ?
C15B P1 C12 C14 60.4(12) . . . . ?
Rh1 P1 C12 C14 -48.0(7) . . . . ?
C15A P1 C12 C13 -157.7(7) . . . . ?
C9 P1 C12 C13 -52.7(7) . . . . ?
C15B P1 C12 C13 -173.2(12) . . . . ?
Rh1 P1 C12 C13 78.4(6) . . . . ?
C12 P1 C15A C17A -154.1(9) . . . . ?
C9 P1 C15A C17A 97.6(10) . . . . ?
C15B P1 C15A C17A -84(3) . . . . ?
Rh1 P1 C15A C17A -22.9(11) . . . . ?
C12 P1 C15A C16A -37.8(11) . . . . ?
C9 P1 C15A C16A -146.1(10) . . . . ?
C15B P1 C15A C16A 32(3) . . . . ?
Rh1 P1 C15A C16A 93.4(9) . . . . ?
C15A P1 C15B C16B -70(4) . . . . ?
C12 P1 C15B C16B 44(3) . . . . ?
C9 P1 C15B C16B -69(3) . . . . ?
Rh1 P1 C15B C16B 168(2) . . . . ?
C24A P2 C18B C20B 75(2) . . . . ?
C21A P2 C18B C20B -27(3) . . . . ?
C21B P2 C18B C20B -39(3) . . . . ?
C24B P2 C18B C20B 62(3) . . . . ?
C18A P2 C18B C20B -91(3) . . . . ?
Rh1 P2 C18B C20B -166(2) . . . . ?
C24A P2 C21A C22A 75.4(13) . . . . ?
C18B P2 C21A C22A 152.5(13) . . . . ?
C21B P2 C21A C22A -166(6) . . . . ?
C24B P2 C21A C22A 54.5(13) . . . . ?
C18A P2 C21A C22A -175.6(12) . . . . ?
Rh1 P2 C21A C22A -68.6(12) . . . . ?
C24A P2 C21A C23A -157.5(11) . . . . ?
C18B P2 C21A C23A -80.4(15) . . . . ?
C21B P2 C21A C23A -39(5) . . . . ?
C24B P2 C21A C23A -178.4(14) . . . . ?
C18A P2 C21A C23A -48.4(13) . . . . ?
Rh1 P2 C21A C23A 58.6(13) . . . . ?
C24A P2 C21B C23B -149(3) . . . . ?
C21A P2 C21B C23B 143(7) . . . . ?
C18B P2 C21B C23B -74(3) . . . . ?
C24B P2 C21B C23B -176(3) . . . . ?
C18A P2 C21B C23B -46(3) . . . . ?
Rh1 P2 C21B C23B 53(3) . . . . ?
C24A P2 C21B C22B 91(3) . . . . ?
C21A P2 C21B C22B 22(4) . . . . ?
C18B P2 C21B C22B 166(3) . . . . ?
C24B P2 C21B C22B 63(3) . . . . ?
C18A P2 C21B C22B -167(3) . . . . ?
Rh1 P2 C21B C22B -68(3) . . . . ?
C21A P2 C24A C25A -97.5(13) . . . . ?
C18B P2 C24A C25A 146.6(15) . . . . ?
C21B P2 C24A C25A -114.9(16) . . . . ?
C24B P2 C24A C25A -57(2) . . . . ?
C18A P2 C24A C25A 155.1(12) . . . . ?
Rh1 P2 C24A C25A 41.3(14) . . . . ?
C21A P2 C24A C26A 23.8(14) . . . . ?
C18B P2 C24A C26A -92.1(14) . . . . ?
C21B P2 C24A C26A 6.4(18) . . . . ?
C24B P2 C24A C26A 64.4(19) . . . . ?
C18A P2 C24A C26A -83.6(12) . . . . ?
Rh1 P2 C24A C26A 162.6(10) . . . . ?
C24A P2 C24B C25B 149(5) . . . . ?
C21A P2 C24B C25B -69(4) . . . . ?
C18B P2 C24B C25B 171(3) . . . . ?
C21B P2 C24B C25B -81(4) . . . . ?
C18A P2 C24B C25B -169(3) . . . . ?
Rh1 P2 C24B C25B 44(4) . . . . ?
C209 B200 C201 C202 -158.7(5) . . . . ?
C217 B200 C201 C202 -41.1(8) . . . . ?
C225 B200 C201 C202 81.1(7) . . . . ?
C209 B200 C201 C206 27.0(8) . . . . ?
C217 B200 C201 C206 144.6(6) . . . . ?
C225 B200 C201 C206 -93.2(7) . . . . ?
C206 C201 C202 C203 -2.2(9) . . . . ?
B200 C201 C202 C203 -176.9(6) . . . . ?
C201 C202 C203 C204 1.9(10) . . . . ?
C201 C202 C203 C207 -176.8(6) . . . . ?
C202 C203 C204 C205 -0.7(9) . . . . ?
C207 C203 C204 C205 178.0(6) . . . . ?
C203 C204 C205 C206 -0.1(9) . . . . ?
C203 C204 C205 C208 179.2(5) . . . . ?
C204 C205 C206 C201 -0.3(9) . . . . ?
C208 C205 C206 C201 -179.6(5) . . . . ?
C202 C201 C206 C205 1.4(9) . . . . ?
B200 C201 C206 C205 176.0(6) . . . . ?
C204 C203 C207 F3 59.6(8) . . . . ?
C202 C203 C207 F3 -121.7(7) . . . . ?
C204 C203 C207 F2 -60.1(9) . . . . ?
C202 C203 C207 F2 118.6(7) . . . . ?
C204 C203 C207 F1 180.0(6) . . . . ?
C202 C203 C207 F1 -1.3(9) . . . . ?
C204 C205 C208 F6 -100.0(9) . . . . ?
C206 C205 C208 F6 79.3(9) . . . . ?
C204 C205 C208 F106 72.7(15) . . . . ?
C206 C205 C208 F106 -108.0(15) . . . . ?
C204 C205 C208 F104 -47.9(14) . . . . ?
C206 C205 C208 F104 131.4(14) . . . . ?
C204 C205 C208 F5 21.6(10) . . . . ?
C206 C205 C208 F5 -159.2(9) . . . . ?
C204 C205 C208 F105 -165.9(15) . . . . ?
C206 C205 C208 F105 13.3(16) . . . . ?
C204 C205 C208 F4 139.5(8) . . . . ?
C206 C205 C208 F4 -41.2(9) . . . . ?
C201 B200 C209 C210 44.7(9) . . . . ?
C217 B200 C209 C210 -78.4(7) . . . . ?
C225 B200 C209 C210 161.1(6) . . . . ?
C201 B200 C209 C214 -144.7(6) . . . . ?
C217 B200 C209 C214 92.2(7) . . . . ?
C225 B200 C209 C214 -28.3(9) . . . . ?
C214 C209 C210 C211 2.0(10) . . . . ?
B200 C209 C210 C211 173.2(7) . . . . ?
C209 C210 C211 C212 -0.7(11) . . . . ?
C209 C210 C211 C215 177.9(7) . . . . ?
C210 C211 C212 C213 -0.9(11) . . . . ?
C215 C211 C212 C213 -179.6(7) . . . . ?
C211 C212 C213 C214 1.1(11) . . . . ?
C211 C212 C213 C216 -178.8(6) . . . . ?
C212 C213 C214 C209 0.2(11) . . . . ?
C216 C213 C214 C209 -179.8(6) . . . . ?
C210 C209 C214 C213 -1.7(10) . . . . ?
B200 C209 C214 C213 -172.9(6) . . . . ?
C212 C211 C215 F8 -156.7(8) . . . . ?
C210 C211 C215 F8 24.6(11) . . . . ?
C212 C211 C215 F9 -33.2(11) . . . . ?
C210 C211 C215 F9 148.2(8) . . . . ?
C212 C211 C215 F7 84.2(9) . . . . ?
C210 C211 C215 F7 -94.4(9) . . . . ?
C212 C213 C216 F110 101.2(16) . . . . ?
C214 C213 C216 F110 -78.7(16) . . . . ?
C212 C213 C216 F10 -61.5(11) . . . . ?
C214 C213 C216 F10 118.6(10) . . . . ?
C212 C213 C216 F12 173.5(9) . . . . ?
C214 C213 C216 F12 -6.4(10) . . . . ?
C212 C213 C216 F112 -22.3(14) . . . . ?
C214 C213 C216 F112 157.8(13) . . . . ?
C212 C213 C216 F111 -138.1(14) . . . . ?
C214 C213 C216 F111 41.9(14) . . . . ?
C212 C213 C216 F11 56.9(9) . . . . ?
C214 C213 C216 F11 -123.0(8) . . . . ?
C201 B200 C217 C218 162.9(6) . . . . ?
C209 B200 C217 C218 -73.2(7) . . . . ?
C225 B200 C217 C218 45.8(8) . . . . ?
C201 B200 C217 C222 -26.2(8) . . . . ?
C209 B200 C217 C222 97.7(7) . . . . ?
C225 B200 C217 C222 -143.3(6) . . . . ?
C222 C217 C218 C219 0.1(10) . . . . ?
B200 C217 C218 C219 171.6(6) . . . . ?
C217 C218 C219 C220 2.0(12) . . . . ?
C217 C218 C219 C223 -175.7(6) . . . . ?
C218 C219 C220 C221 -2.6(12) . . . . ?
C223 C219 C220 C221 175.1(6) . . . . ?
C219 C220 C221 C222 1.3(11) . . . . ?
C219 C220 C221 C224 179.7(6) . . . . ?
C220 C221 C222 C217 0.7(11) . . . . ?
C224 C221 C222 C217 -177.7(6) . . . . ?
C218 C217 C222 C221 -1.4(10) . . . . ?
B200 C217 C222 C221 -172.8(6) . . . . ?
C218 C219 C223 F13 -93(2) . . . . ?
C220 C219 C223 F13 89(2) . . . . ?
C218 C219 C223 F114 -179.8(13) . . . . ?
C220 C219 C223 F114 2.4(14) . . . . ?
C218 C219 C223 F14 28.7(19) . . . . ?
C220 C219 C223 F14 -149.1(19) . . . . ?
C218 C219 C223 F113 57.6(13) . . . . ?
C220 C219 C223 F113 -120.2(12) . . . . ?
C218 C219 C223 F115 -60.3(12) . . . . ?
C220 C219 C223 F115 121.9(11) . . . . ?
C218 C219 C223 F15 147.0(19) . . . . ?
C220 C219 C223 F15 -30.7(19) . . . . ?
C222 C221 C224 F18 -134.7(10) . . . . ?
C220 C221 C224 F18 46.9(11) . . . . ?
C222 C221 C224 F118 63.7(18) . . . . ?
C220 C221 C224 F118 -114.7(18) . . . . ?
C222 C221 C224 F116 -176.2(14) . . . . ?
C220 C221 C224 F116 5.4(16) . . . . ?
C222 C221 C224 F117 -56.6(16) . . . . ?
C220 C221 C224 F117 124.9(17) . . . . ?
C222 C221 C224 F16 -13.1(10) . . . . ?
C220 C221 C224 F16 168.5(8) . . . . ?
C222 C221 C224 F17 104.6(9) . . . . ?
C220 C221 C224 F17 -73.8(9) . . . . ?
C201 B200 C225 C226 81.3(7) . . . . ?
C209 B200 C225 C226 -41.6(8) . . . . ?
C217 B200 C225 C226 -156.2(6) . . . . ?
C201 B200 C225 C230 -95.9(7) . . . . ?
C209 B200 C225 C230 141.3(6) . . . . ?
C217 B200 C225 C230 26.7(8) . . . . ?
C230 C225 C226 C227 -0.7(10) . . . . ?
B200 C225 C226 C227 -178.0(6) . . . . ?
C225 C226 C227 C228 0.8(10) . . . . ?
C225 C226 C227 C231 -175.1(7) . . . . ?
C226 C227 C228 C229 0.6(10) . . . . ?
C231 C227 C228 C229 176.5(7) . . . . ?
C227 C228 C229 C230 -2.2(11) . . . . ?
C227 C228 C229 C232 -179.4(7) . . . . ?
C228 C229 C230 C225 2.4(11) . . . . ?
C232 C229 C230 C225 179.6(7) . . . . ?
C226 C225 C230 C229 -0.8(10) . . . . ?
B200 C225 C230 C229 176.4(6) . . . . ?
C226 C227 C231 F19 -38.2(10) . . . . ?
C228 C227 C231 F19 145.9(7) . . . . ?
C226 C227 C231 F20 82.7(9) . . . . ?
C228 C227 C231 F20 -93.3(9) . . . . ?
C226 C227 C231 F21 -159.7(7) . . . . ?
C228 C227 C231 F21 24.4(11) . . . . ?
C228 C229 C232 F22 -2.2(11) . . . . ?
C230 C229 C232 F22 -179.5(7) . . . . ?
C228 C229 C232 F23 -125.4(8) . . . . ?
C230 C229 C232 F23 57.3(10) . . . . ?
C228 C229 C232 F24 118.3(8) . . . . ?
C230 C229 C232 F24 -59.0(9) . . . . ?

_refine_diff_density_max         0.845
_refine_diff_density_min         -1.555
_refine_diff_density_rms         0.103

_vrf_PLAT213_11                  
; 
PROBLEM:  Atom F106 has ADP max/min Ratio ..... 3.4 prolat
RESPONSE: The structure contains a significant degree of disorder
and modelling has been attempted, unfortunately some of the 
ellipsoids remain prolate.
See _refine_special_details. 
;

_vrf_PLAT412_11                  
; 
PROBLEM:  Short Intra XH3 .. XHn H1 .. H17A .. 1.73 Ang 
RESPONSE: The structure contains a significant degree of disorder 
and modelling has been attempted, but allied to the poor data
quality, the position of the hydrogen atoms is somewhat
uncertain and hence some short contacts are present.
See _refine_special_details. 
;

_vrf_RFACR01_11                  
; 
PROBLEM: The value of the weighted R factor is > 0.25
 Weighted R factor given 0.266 
RESPONSE: The weighted R-factor is high due to the poor quality 
of the data resulting from poor crystal quality.
;

_vrf_PLAT084_11                  
; 
PROBLEM: High wR2 Value (i.e. > 0.25) ............ 0.27 Report 
RESPONSE: The weighted R-factor is high due to the poor quality 
of the data resulting from poor crystal quality.
;

_shelxl_version_number           2014-3


_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: 1,2-difluorobenzene/pentane'
_chemical_properties_physical    
'Air-sensitive, Moisture-sensitive, Oxygen-sensitive'
