#------------------------------------------------------------------------------
#$Date: 2016-03-23 21:20:45 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179447 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/44/4334483.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4334483
loop_
_publ_author_name
'Laura J. Sewell'
'Miguel A. Huertos'
'Molly E. Dickinson'
'Andrew S. Weller'
'Guy C. Lloyd-Jones'
_publ_section_title
;
 Dehydrocoupling of Dimethylamine Borane Catalyzed by Rh(PCy3)2H2Cl
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              4509
_journal_page_last               4516
_journal_paper_doi               10.1021/ic302804d
_journal_volume                  52
_journal_year                    2013
_chemical_formula_sum            'C116 H158 B Cl F26 P4 Rh2'
_chemical_formula_weight         2422.38
_space_group_IT_number           13
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yc'
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 109.2920(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   17.1205(2)
_cell_length_b                   16.9183(2)
_cell_length_c                   21.4057(3)
_cell_measurement_reflns_used    13532
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      27.485
_cell_measurement_theta_min      5.097
_cell_volume                     5852.00(13)
_computing_cell_refinement       'Denzo/Scalepack (Otwinowski & Minor 1997)'
_computing_data_collection       'Collect (Nonius BV, 1997-2000)'
_computing_data_reduction        'Denzo/Scalepack (Otwinowski & Minor 1997)'
_computing_molecular_graphics    'ORTEP3 (Farrugia, 1997)'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 2008)'
_diffrn_ambient_temperature      150(2)
_diffrn_detector_area_resol_mean 9
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device       '95mm CCD camera on κ-goniostat'
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_method       CCD
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0503
_diffrn_reflns_av_sigmaI/netI    0.0712
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            25647
_diffrn_reflns_theta_full        27.45
_diffrn_reflns_theta_max         27.45
_diffrn_reflns_theta_min         5.10
_exptl_absorpt_coefficient_mu    0.447
_exptl_absorpt_correction_T_max  1.0
_exptl_absorpt_correction_T_min  0.9
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Denzo/Scalepack (Otwinowski & Minor 1997)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.375
_exptl_crystal_description       block
_exptl_crystal_F_000             2520
_exptl_crystal_size_max          0.42
_exptl_crystal_size_mid          0.32
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.814
_refine_diff_density_min         -0.872
_refine_diff_density_rms         0.085
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.025
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     734
_refine_ls_number_reflns         13278
_refine_ls_number_restraints     198
_refine_ls_restrained_S_all      1.062
_refine_ls_R_factor_all          0.0866
_refine_ls_R_factor_gt           0.0468
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0586P)²+2.9612P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1045
_refine_ls_wR_factor_ref         0.1199
_reflns_number_gt                9146
_reflns_number_total             13278
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic302804d_si_002.cif
_cod_data_source_block           018mh12
_cod_database_code               4334483
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.96750(17) 0.08744(16) 0.34639(14) 0.0212(6) Uani 1 1 d . . .
H1A H 0.9913 0.0797 0.3110 0.025 Uiso 1 1 calc R . .
C2 C 0.96697(18) 0.00533(17) 0.37718(16) 0.0254(7) Uani 1 1 d . . .
H2A H 0.9455 0.0095 0.4137 0.031 Uiso 1 1 calc R . .
H2B H 0.9311 -0.0299 0.3443 0.031 Uiso 1 1 calc R . .
C3 C 1.05518(19) -0.02868(18) 0.40221(16) 0.0304(7) Uani 1 1 d . . .
H3A H 1.0543 -0.0794 0.4230 0.036 Uiso 1 1 calc R . .
H3B H 1.0743 -0.0372 0.3649 0.036 Uiso 1 1 calc R . .
C4 C 1.11527(19) 0.02621(18) 0.45172(17) 0.0323(8) Uani 1 1 d . . .
H4A H 1.1707 0.0044 0.4641 0.039 Uiso 1 1 calc R . .
H4B H 1.1000 0.0300 0.4914 0.039 Uiso 1 1 calc R . .
C5 C 1.11447(18) 0.10865(18) 0.42228(16) 0.0271(7) Uani 1 1 d . . .
H5A H 1.1497 0.1435 0.4558 0.032 Uiso 1 1 calc R . .
H5B H 1.1368 0.1058 0.3862 0.032 Uiso 1 1 calc R . .
C6 C 1.02725(17) 0.14290(17) 0.39674(15) 0.0232(6) Uani 1 1 d . . .
H6A H 1.0287 0.1936 0.3760 0.028 Uiso 1 1 calc R . .
H6B H 1.0073 0.1515 0.4337 0.028 Uiso 1 1 calc R . .
C7 C 0.82782(18) 0.17919(16) 0.37105(14) 0.0226(6) Uani 1 1 d . . .
H7A H 0.7688 0.1893 0.3486 0.027 Uiso 1 1 calc R . .
C8 C 0.8662(2) 0.26129(17) 0.39184(17) 0.0308(7) Uani 1 1 d . . .
H8A H 0.9254 0.2557 0.4139 0.037 Uiso 1 1 calc R . .
H8B H 0.8578 0.2936 0.3527 0.037 Uiso 1 1 calc R . .
C9 C 0.8281(2) 0.3026(2) 0.43818(18) 0.0382(8) Uani 1 1 d . . .
H9A H 0.8566 0.3521 0.4531 0.046 Uiso 1 1 calc R . .
H9B H 0.7704 0.3144 0.4144 0.046 Uiso 1 1 calc R . .
C10 C 0.8339(2) 0.2511(2) 0.49773(19) 0.0413(9) Uani 1 1 d . . .
H10A H 0.8076 0.2779 0.5256 0.050 Uiso 1 1 calc R . .
H10B H 0.8917 0.2429 0.5236 0.050 Uiso 1 1 calc R . .
C11 C 0.7924(2) 0.1714(2) 0.47629(17) 0.0356(8) Uani 1 1 d . . .
H11A H 0.7338 0.1792 0.4531 0.043 Uiso 1 1 calc R . .
H11B H 0.7980 0.1392 0.5151 0.043 Uiso 1 1 calc R . .
C12 C 0.8312(2) 0.12841(18) 0.43111(15) 0.0291(7) Uani 1 1 d . . .
H12A H 0.8020 0.0792 0.4162 0.035 Uiso 1 1 calc R . .
H12B H 0.8884 0.1158 0.4558 0.035 Uiso 1 1 calc R . .
C13 C 0.79419(17) 0.05059(16) 0.27301(15) 0.0225(6) Uani 1 1 d . . .
H13A H 0.8019 0.0125 0.3090 0.027 Uiso 1 1 calc R . .
C14 C 0.70316(18) 0.07367(19) 0.24795(18) 0.0318(8) Uani 1 1 d . . .
H14A H 0.6946 0.1146 0.2147 0.038 Uiso 1 1 calc R . .
H14B H 0.6878 0.0951 0.2843 0.038 Uiso 1 1 calc R . .
C15 C 0.64764(19) 0.0032(2) 0.21822(18) 0.0350(8) Uani 1 1 d . . .
H15A H 0.6514 -0.0352 0.2527 0.042 Uiso 1 1 calc R . .
H15B H 0.5906 0.0208 0.2005 0.042 Uiso 1 1 calc R . .
C16 C 0.6720(2) -0.0355(2) 0.16399(18) 0.0390(9) Uani 1 1 d . . .
H16A H 0.6633 0.0012 0.1275 0.047 Uiso 1 1 calc R . .
H16B H 0.6372 -0.0814 0.1476 0.047 Uiso 1 1 calc R . .
C17 C 0.7621(2) -0.06077(19) 0.18913(18) 0.0376(8) Uani 1 1 d . . .
H17A H 0.7772 -0.0831 0.1529 0.045 Uiso 1 1 calc R . .
H17B H 0.7697 -0.1013 0.2227 0.045 Uiso 1 1 calc R . .
C18 C 0.81800(19) 0.00925(19) 0.21828(16) 0.0296(7) Uani 1 1 d . . .
H18A H 0.8148 0.0469 0.1834 0.036 Uiso 1 1 calc R . .
H18B H 0.8748 -0.0089 0.2362 0.036 Uiso 1 1 calc R . .
C19 C 0.76533(17) 0.41368(17) 0.22001(15) 0.0231(6) Uani 1 1 d . . .
H19A H 0.7393 0.3824 0.2463 0.028 Uiso 1 1 calc R . .
C20 C 0.8453(2) 0.4466(2) 0.26998(17) 0.0340(8) Uani 1 1 d . . .
H20A H 0.8826 0.4033 0.2891 0.041 Uiso 1 1 calc R . .
H20B H 0.8724 0.4810 0.2472 0.041 Uiso 1 1 calc R . .
C21 C 0.8275(2) 0.4929(2) 0.32522(18) 0.0421(9) Uani 1 1 d . . .
H21A H 0.8065 0.4570 0.3513 0.051 Uiso 1 1 calc R . .
H21B H 0.8786 0.5157 0.3542 0.051 Uiso 1 1 calc R . .
C22 C 0.7648(2) 0.5585(2) 0.29766(18) 0.0426(9) Uani 1 1 d . . .
H22A H 0.7887 0.5983 0.2769 0.051 Uiso 1 1 calc R . .
H22B H 0.7512 0.5834 0.3336 0.051 Uiso 1 1 calc R . .
C23 C 0.6861(2) 0.5259(2) 0.24703(18) 0.0396(9) Uani 1 1 d . . .
H23A H 0.6483 0.5691 0.2284 0.047 Uiso 1 1 calc R . .
H23B H 0.6591 0.4901 0.2688 0.047 Uiso 1 1 calc R . .
C24 C 0.7056(2) 0.48208(19) 0.19142(16) 0.0328(8) Uani 1 1 d . . .
H24A H 0.7303 0.5184 0.1682 0.039 Uiso 1 1 calc R . .
H24B H 0.6548 0.4617 0.1599 0.039 Uiso 1 1 calc R . .
C25 C 0.84106(18) 0.40260(17) 0.11531(15) 0.0236(6) Uani 1 1 d . . .
H25A H 0.8759 0.4406 0.1469 0.028 Uiso 1 1 calc R . .
C26 C 0.8993(2) 0.35517(19) 0.08899(17) 0.0316(7) Uani 1 1 d . . .
H26A H 0.8674 0.3182 0.0557 0.038 Uiso 1 1 calc R . .
H26B H 0.9372 0.3251 0.1248 0.038 Uiso 1 1 calc R . .
C27 C 0.9486(2) 0.4097(2) 0.05863(19) 0.0423(9) Uani 1 1 d . . .
H27A H 0.9842 0.4435 0.0928 0.051 Uiso 1 1 calc R . .
H27B H 0.9834 0.3780 0.0407 0.051 Uiso 1 1 calc R . .
C28 C 0.8911(2) 0.4606(2) 0.00391(19) 0.0433(9) Uani 1 1 d . . .
H28A H 0.9238 0.4970 -0.0123 0.052 Uiso 1 1 calc R . .
H28B H 0.8601 0.4271 -0.0326 0.052 Uiso 1 1 calc R . .
C29 C 0.8315(2) 0.5070(2) 0.02875(19) 0.0427(9) Uani 1 1 d . . .
H29A H 0.7936 0.5364 -0.0076 0.051 Uiso 1 1 calc R . .
H29B H 0.8622 0.5446 0.0620 0.051 Uiso 1 1 calc R . .
C30 C 0.7825(2) 0.45205(19) 0.05849(17) 0.0335(8) Uani 1 1 d . . .
H30A H 0.7486 0.4170 0.0244 0.040 Uiso 1 1 calc R . .
H30B H 0.7460 0.4831 0.0752 0.040 Uiso 1 1 calc R . .
C31 C 0.68697(17) 0.31522(17) 0.10174(15) 0.0223(6) Uani 1 1 d . . .
H31A H 0.6638 0.3632 0.0768 0.027 Uiso 1 1 calc R . .
C32 C 0.69801(19) 0.25467(18) 0.05193(16) 0.0278(7) Uani 1 1 d . . .
H32A H 0.7351 0.2762 0.0304 0.033 Uiso 1 1 calc R . .
H32B H 0.7232 0.2072 0.0754 0.033 Uiso 1 1 calc R . .
C33 C 0.6155(2) 0.2334(2) -0.00048(18) 0.0381(8) Uani 1 1 d . . .
H33A H 0.5927 0.2798 -0.0268 0.046 Uiso 1 1 calc R . .
H33B H 0.6246 0.1934 -0.0298 0.046 Uiso 1 1 calc R . .
C34 C 0.5545(2) 0.2027(2) 0.03156(19) 0.0423(9) Uani 1 1 d . . .
H34A H 0.5753 0.1538 0.0548 0.051 Uiso 1 1 calc R . .
H34B H 0.5020 0.1916 -0.0024 0.051 Uiso 1 1 calc R . .
C35 C 0.54194(19) 0.2632(2) 0.07987(18) 0.0361(8) Uani 1 1 d . . .
H35A H 0.5044 0.2418 0.1010 0.043 Uiso 1 1 calc R . .
H35B H 0.5168 0.3104 0.0558 0.043 Uiso 1 1 calc R . .
C36 C 0.62410(18) 0.28515(19) 0.13298(16) 0.0292(7) Uani 1 1 d . . .
H36A H 0.6144 0.3258 0.1615 0.035 Uiso 1 1 calc R . .
H36B H 0.6464 0.2391 0.1600 0.035 Uiso 1 1 calc R . .
C101 C 0.55191(18) 0.61464(18) 0.09165(15) 0.0269(7) Uani 1 1 d . . .
H101 H 0.5614 0.5855 0.0580 0.032 Uiso 1 1 calc R . .
C102 C 0.49151(17) 0.59184(17) 0.11795(15) 0.0239(7) Uani 1 1 d . . .
C103 C 0.47890(17) 0.63439(17) 0.16910(14) 0.0225(6) Uani 1 1 d . . .
H103 H 0.4390 0.6169 0.1866 0.027 Uiso 1 1 calc R . .
C104 C 0.52418(17) 0.70299(16) 0.19552(14) 0.0212(6) Uani 1 1 d . . .
C105 C 0.58370(18) 0.72500(17) 0.16694(15) 0.0247(7) Uani 1 1 d . . .
H105 H 0.6150 0.7703 0.1822 0.030 Uiso 1 1 calc R . .
C106 C 0.59753(18) 0.68138(18) 0.11647(15) 0.0277(7) Uani 1 1 d D A .
C107 C 0.4415(2) 0.52002(19) 0.08980(17) 0.0319(8) Uani 1 1 d . . .
C110 C 0.66571(19) 0.70549(18) 0.09068(16) 0.0351(8) Uani 1 1 d D . .
C200 C 0.42315(17) 0.81085(16) 0.20311(14) 0.0219(6) Uani 1 1 d . . .
C201 C 0.34054(17) 0.78628(17) 0.18428(15) 0.0229(6) Uani 1 1 d . . .
H201 H 0.3278 0.7407 0.2032 0.027 Uiso 1 1 calc R . .
C202 C 0.43761(18) 0.87921(17) 0.17169(15) 0.0239(6) Uani 1 1 d . . .
H202 H 0.4915 0.8979 0.1826 0.029 Uiso 1 1 calc R . .
C203 C 0.37458(18) 0.92034(17) 0.12484(15) 0.0257(7) Uani 1 1 d . . .
C204 C 0.3943(2) 0.99186(19) 0.09250(17) 0.0349(8) Uani 1 1 d . . .
C205 C 0.29319(18) 0.89521(18) 0.10844(15) 0.0269(7) Uani 1 1 d . . .
H205 H 0.2506 0.9232 0.0781 0.032 Uiso 1 1 calc R . .
C206 C 0.27659(18) 0.82740(17) 0.13830(15) 0.0257(7) Uani 1 1 d . . .
C207 C 0.19006(19) 0.79653(19) 0.11999(17) 0.0328(8) Uani 1 1 d . . .
P1 P 0.86516(4) 0.13534(4) 0.30656(4) 0.02024(17) Uani 1 1 d . . .
P2 P 0.78859(4) 0.34235(4) 0.16277(4) 0.01884(16) Uani 1 1 d . . .
Cl1 Cl 1.0000 0.27212(6) 0.2500 0.0278(2) Uani 1 2 d S . .
Rh1 Rh 0.853134(13) 0.238639(13) 0.232268(11) 0.01870(8) Uani 1 1 d . . .
B1 B 0.5000 0.7567(3) 0.2500 0.0207(10) Uani 1 2 d S . .
F1 F 0.41423(13) 0.51991(13) 0.02367(10) 0.0514(6) Uani 1 1 d U . .
F2 F 0.37468(14) 0.51164(14) 0.10745(12) 0.0588(7) Uani 1 1 d U . .
F3 F 0.48470(14) 0.45328(12) 0.10700(13) 0.0646(7) Uani 1 1 d U . .
F4 F 0.33703(14) 1.01034(16) 0.03646(13) 0.0768(9) Uani 1 1 d U . .
F5 F 0.46463(13) 0.98567(15) 0.07973(13) 0.0666(7) Uani 1 1 d U . .
F6 F 0.4052(2) 1.05576(14) 0.13065(15) 0.0915(10) Uani 1 1 d U . .
F7 F 0.17127(14) 0.77015(19) 0.17114(13) 0.0792(9) Uani 1 1 d U . .
F8 F 0.17772(15) 0.73549(16) 0.07948(16) 0.0814(9) Uani 1 1 d U . .
F9 F 0.13329(12) 0.84904(14) 0.08934(14) 0.0663(7) Uani 1 1 d U . .
F10 F 0.6566(3) 0.6755(3) 0.0315(2) 0.0800(15) Uani 0.794(7) 1 d PDU A 1
F11 F 0.73812(17) 0.6832(4) 0.1293(2) 0.0892(17) Uani 0.794(7) 1 d PDU A 1
F12 F 0.6690(3) 0.78212(16) 0.0823(3) 0.0712(13) Uani 0.794(7) 1 d PDU A 1
F110 F 0.7279(6) 0.7414(10) 0.1364(5) 0.067(4) Uani 0.206(7) 1 d PDU A 2
F111 F 0.6434(7) 0.7552(9) 0.0418(7) 0.074(4) Uani 0.206(7) 1 d PDU A 2
F112 F 0.7008(8) 0.6464(5) 0.0714(8) 0.057(4) Uani 0.206(7) 1 d PDU A 2
C502 C 0.5661(3) 0.3216(3) 0.2930(2) 0.0577(11) Uani 1 1 d . B 1
H502 H 0.6109 0.3487 0.3215 0.069 Uiso 0.83 1 calc PR B 2
C501 C 0.5000 0.3613(4) 0.2500 0.0536(15) Uani 1 2 d S . 1
H501 H 0.5000 0.4162 0.2500 0.064 Uiso 0.67 2 calc SPR . 2
C503 C 0.5636(3) 0.2402(3) 0.2923(3) 0.0629(13) Uani 1 1 d . B 1
H503 H 0.6071 0.2124 0.3219 0.075 Uiso 0.83 1 calc PR B 2
F502 F 0.6309(7) 0.3483(7) 0.3258(7) 0.049(3) Uani 0.17 1 d PU C 3
F501 F 0.5000 0.4444(6) 0.2500 0.067(3) Uani 0.33 2 d SPU D 3
F503 F 0.6140(15) 0.2148(13) 0.3304(12) 0.107(7) Uani 0.17 1 d PU E 3
C600 C 0.0000 0.6275(6) 0.2500 0.173(6) Uani 1 2 d SD . .
H600 H 0.0000 0.5725 0.2500 0.208 Uiso 1 2 calc SR . .
C601 C -0.0596(4) 0.6722(3) 0.2046(4) 0.157(4) Uani 1 1 d D . .
H601 H -0.1015 0.6448 0.1731 0.188 Uiso 1 1 calc R . .
C602 C -0.0631(4) 0.7536(3) 0.2015(3) 0.120(3) Uani 1 1 d D . .
H602 H -0.1044 0.7810 0.1695 0.145 Uiso 1 1 calc R . .
C603 C 0.0000 0.7909(4) 0.2500 0.093(3) Uani 1 2 d SD . .
F600 F 0.0000 0.8677(4) 0.2500 0.184(3) Uani 1 2 d SU . .
C504 C 0.5000 0.1994(4) 0.2500 0.0659(18) Uani 1 2 d S . .
H504 H 0.5000 0.1444 0.2500 0.079 Uiso 1 2 calc SR B 1
H1 H 0.804(2) 0.1845(19) 0.1773(16) 0.037(9) Uiso 1 1 d . F 3
H2 H 0.766(2) 0.2365(19) 0.2353(17) 0.038(9) Uiso 1 1 d . G 3
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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh -1.1178 0.9187 '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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
C6 C1 C2 110.3(2) . .
C6 C1 P1 111.30(19) . .
C2 C1 P1 116.8(2) . .
C6 C1 H1A 105.8 . .
C2 C1 H1A 105.8 . .
P1 C1 H1A 105.8 . .
C3 C2 C1 110.1(2) . .
C3 C2 H2A 109.6 . .
C1 C2 H2A 109.6 . .
C3 C2 H2B 109.6 . .
C1 C2 H2B 109.6 . .
H2A C2 H2B 108.2 . .
C4 C3 C2 112.0(3) . .
C4 C3 H3A 109.2 . .
C2 C3 H3A 109.2 . .
C4 C3 H3B 109.2 . .
C2 C3 H3B 109.2 . .
H3A C3 H3B 107.9 . .
C3 C4 C5 110.9(3) . .
C3 C4 H4A 109.5 . .
C5 C4 H4A 109.5 . .
C3 C4 H4B 109.5 . .
C5 C4 H4B 109.5 . .
H4A C4 H4B 108.0 . .
C6 C5 C4 111.6(2) . .
C6 C5 H5A 109.3 . .
C4 C5 H5A 109.3 . .
C6 C5 H5B 109.3 . .
C4 C5 H5B 109.3 . .
H5A C5 H5B 108.0 . .
C5 C6 C1 111.5(2) . .
C5 C6 H6A 109.3 . .
C1 C6 H6A 109.3 . .
C5 C6 H6B 109.3 . .
C1 C6 H6B 109.3 . .
H6A C6 H6B 108.0 . .
C12 C7 C8 111.7(3) . .
C12 C7 P1 118.2(2) . .
C8 C7 P1 110.9(2) . .
C12 C7 H7A 104.9 . .
C8 C7 H7A 104.9 . .
P1 C7 H7A 104.9 . .
C9 C8 C7 111.6(3) . .
C9 C8 H8A 109.3 . .
C7 C8 H8A 109.3 . .
C9 C8 H8B 109.3 . .
C7 C8 H8B 109.3 . .
H8A C8 H8B 108.0 . .
C10 C9 C8 111.1(3) . .
C10 C9 H9A 109.4 . .
C8 C9 H9A 109.4 . .
C10 C9 H9B 109.4 . .
C8 C9 H9B 109.4 . .
H9A C9 H9B 108.0 . .
C9 C10 C11 111.1(3) . .
C9 C10 H10A 109.4 . .
C11 C10 H10A 109.4 . .
C9 C10 H10B 109.4 . .
C11 C10 H10B 109.4 . .
H10A C10 H10B 108.0 . .
C10 C11 C12 110.7(3) . .
C10 C11 C28 72.97(19) . .
C12 C11 C28 56.01(17) . .
C10 C11 H11A 109.5 . .
C12 C11 H11A 109.5 . .
C28 C11 H11A 85.4 . .
C10 C11 H11B 109.5 . .
C12 C11 H11B 109.5 . .
C28 C11 H11B 163.7 . .
H11A C11 H11B 108.1 . .
C11 C12 C7 111.2(3) . .
C11 C12 H12A 109.4 . .
C7 C12 H12A 109.4 . .
C11 C12 H12B 109.4 . .
C7 C12 H12B 109.4 . .
H12A C12 H12B 108.0 . .
C14 C13 C18 110.4(3) . .
C14 C13 P1 113.6(2) . .
C18 C13 P1 110.0(2) . .
C14 C13 H13A 107.6 . .
C18 C13 H13A 107.6 . .
P1 C13 H13A 107.6 . .
C13 C14 C15 111.7(3) . .
C13 C14 H14A 109.3 . .
C15 C14 H14A 109.3 . .
C13 C14 H14B 109.3 . .
C15 C14 H14B 109.3 . .
H14A C14 H14B 107.9 . .
C16 C15 C14 111.6(3) . .
C16 C15 H15A 109.3 . .
C14 C15 H15A 109.3 . .
C16 C15 H15B 109.3 . .
C14 C15 H15B 109.3 . .
H15A C15 H15B 108.0 . .
C15 C16 C17 110.9(3) . .
C15 C16 H16A 109.5 . .
C17 C16 H16A 109.5 . .
C15 C16 H16B 109.5 . .
C17 C16 H16B 109.5 . .
H16A C16 H16B 108.0 . .
C16 C17 C18 110.8(3) . .
C16 C17 H17A 109.5 . .
C18 C17 H17A 109.5 . .
C16 C17 H17B 109.5 . .
C18 C17 H17B 109.5 . .
H17A C17 H17B 108.1 . .
C17 C18 C13 112.3(3) . .
C17 C18 H18A 109.1 . .
C13 C18 H18A 109.1 . .
C17 C18 H18B 109.1 . .
C13 C18 H18B 109.1 . .
H18A C18 H18B 107.9 . .
C24 C19 C20 109.1(2) . .
C24 C19 P2 119.2(2) . .
C20 C19 P2 111.1(2) . .
C24 C19 H19A 105.4 . .
C20 C19 H19A 105.4 . .
P2 C19 H19A 105.4 . .
C21 C20 C19 111.4(3) . .
C21 C20 H20A 109.4 . .
C19 C20 H20A 109.4 . .
C21 C20 H20B 109.4 . .
C19 C20 H20B 109.4 . .
H20A C20 H20B 108.0 . .
C22 C21 C20 111.7(3) . .
C22 C21 H21A 109.3 . .
C20 C21 H21A 109.3 . .
C22 C21 H21B 109.3 . .
C20 C21 H21B 109.3 . .
H21A C21 H21B 108.0 . .
C21 C22 C23 110.9(3) . .
C21 C22 H22A 109.5 . .
C23 C22 H22A 109.5 . .
C21 C22 H22B 109.5 . .
C23 C22 H22B 109.5 . .
H22A C22 H22B 108.1 . .
C22 C23 C24 111.0(3) . .
C22 C23 Cl1 73.40(17) . .
C24 C23 Cl1 48.10(15) . .
C22 C23 H23A 109.4 . .
C24 C23 H23A 109.4 . .
Cl1 C23 H23A 152.8 . .
C22 C23 H23B 109.4 . .
C24 C23 H23B 109.4 . .
Cl1 C23 H23B 95.8 . .
H23A C23 H23B 108.0 . .
C23 C24 C19 110.1(3) . .
C23 C24 H24A 109.6 . .
C19 C24 H24A 109.6 . .
C23 C24 H24B 109.6 . .
C19 C24 H24B 109.6 . .
H24A C24 H24B 108.2 . .
C26 C25 C30 109.2(3) . .
C26 C25 P2 113.9(2) . .
C30 C25 P2 114.9(2) . .
C26 C25 H25A 106.1 . .
C30 C25 H25A 106.1 . .
P2 C25 H25A 106.1 . .
C25 C26 C27 111.0(3) . .
C25 C26 H26A 109.4 . .
C27 C26 H26A 109.4 . .
C25 C26 H26B 109.4 . .
C27 C26 H26B 109.4 . .
H26A C26 H26B 108.0 . .
C28 C27 C26 111.1(3) . .
C28 C27 H27A 109.4 . .
C26 C27 H27A 109.4 . .
C28 C27 H27B 109.4 . .
C26 C27 H27B 109.4 . .
H27A C27 H27B 108.0 . .
C29 C28 C27 111.2(3) . .
C29 C28 C11 67.18(18) . .
C27 C28 C11 49.30(18) . .
C29 C28 H28A 109.4 . .
C27 C28 H28A 109.4 . .
C11 C28 H28A 146.1 . .
C29 C28 H28B 109.4 . .
C27 C28 H28B 109.4 . .
C11 C28 H28B 104.6 . .
H28A C28 H28B 108.0 . .
C28 C29 C30 111.0(3) . .
C28 C29 H29A 109.4 . .
C30 C29 H29A 109.4 . .
C28 C29 H29B 109.4 . .
C30 C29 H29B 109.4 . .
H29A C29 H29B 108.0 . .
C29 C30 C25 110.8(3) . .
C29 C30 H30A 109.5 . .
C25 C30 H30A 109.5 . .
C29 C30 H30B 109.5 . .
C25 C30 H30B 109.5 . .
H30A C30 H30B 108.1 . .
C36 C31 C32 110.3(2) . .
C36 C31 P2 114.0(2) . .
C32 C31 P2 110.62(19) . .
C36 C31 H31A 107.2 . .
C32 C31 H31A 107.2 . .
P2 C31 H31A 107.2 . .
C33 C32 C31 111.8(3) . .
C33 C32 H32A 109.3 . .
C31 C32 H32A 109.3 . .
C33 C32 H32B 109.3 . .
C31 C32 H32B 109.3 . .
H32A C32 H32B 107.9 . .
C34 C33 C32 110.8(3) . .
C34 C33 H33A 109.5 . .
C32 C33 H33A 109.5 . .
C34 C33 H33B 109.5 . .
C32 C33 H33B 109.5 . .
H33A C33 H33B 108.1 . .
C33 C34 C35 110.5(3) . .
C33 C34 H34A 109.6 . .
C35 C34 H34A 109.6 . .
C33 C34 H34B 109.6 . .
C35 C34 H34B 109.6 . .
H34A C34 H34B 108.1 . .
C34 C35 C36 111.5(3) . .
C34 C35 H35A 109.3 . .
C36 C35 H35A 109.3 . .
C34 C35 H35B 109.3 . .
C36 C35 H35B 109.3 . .
H35A C35 H35B 108.0 . .
C31 C36 C35 111.2(3) . .
C31 C36 H36A 109.4 . .
C35 C36 H36A 109.4 . .
C31 C36 H36B 109.4 . .
C35 C36 H36B 109.4 . .
H36A C36 H36B 108.0 . .
C106 C101 C102 118.4(3) . .
C106 C101 H101 120.8 . .
C102 C101 H101 120.8 . .
C103 C102 C101 120.6(3) . .
C103 C102 C107 121.6(3) . .
C101 C102 C107 117.9(3) . .
C102 C103 C104 122.5(3) . .
C102 C103 H103 118.7 . .
C104 C103 H103 118.7 . .
C105 C104 C103 115.3(3) . .
C105 C104 B1 123.7(2) . .
C103 C104 B1 120.6(3) . .
C106 C105 C104 122.2(3) . .
C106 C105 H105 118.9 . .
C104 C105 H105 118.9 . .
C101 C106 C105 121.0(3) . .
C101 C106 C110 119.4(3) . .
C105 C106 C110 119.5(3) . .
F2 C107 F3 106.4(3) . .
F2 C107 F1 105.6(3) . .
F3 C107 F1 105.0(3) . .
F2 C107 C102 113.9(3) . .
F3 C107 C102 112.7(3) . .
F1 C107 C102 112.5(3) . .
F111 C110 F11 131.8(6) . .
F111 C110 F112 106.6(6) . .
F11 C110 F112 62.3(6) . .
F111 C110 F12 42.6(7) . .
F11 C110 F12 107.4(3) . .
F112 C110 F12 132.0(5) . .
F111 C110 F10 64.4(7) . .
F11 C110 F10 106.5(3) . .
F112 C110 F10 47.4(6) . .
F12 C110 F10 104.1(3) . .
F111 C110 F110 104.3(5) . .
F11 C110 F110 45.6(6) . .
F112 C110 F110 104.0(5) . .
F12 C110 F110 65.8(7) . .
F10 C110 F110 133.7(5) . .
F111 C110 C106 114.5(5) . .
F11 C110 C106 112.4(3) . .
F112 C110 C106 113.9(4) . .
F12 C110 C106 113.1(3) . .
F10 C110 C106 112.7(3) . .
F110 C110 C106 112.6(5) . .
C201 C200 C202 115.4(3) . .
C201 C200 B1 122.6(3) . .
C202 C200 B1 121.3(2) . .
C206 C201 C200 122.6(3) . .
C206 C201 H201 118.7 . .
C200 C201 H201 118.7 . .
C203 C202 C200 122.7(3) . .
C203 C202 H202 118.6 . .
C200 C202 H202 118.6 . .
C205 C203 C202 120.3(3) . .
C205 C203 C204 119.7(3) . .
C202 C203 C204 120.0(3) . .
F4 C204 F5 106.6(3) . .
F4 C204 F6 106.2(3) . .
F5 C204 F6 103.8(3) . .
F4 C204 C203 113.8(3) . .
F5 C204 C203 113.2(3) . .
F6 C204 C203 112.5(3) . .
C203 C205 C206 118.6(3) . .
C203 C205 H205 120.7 . .
C206 C205 H205 120.7 . .
C205 C206 C201 120.4(3) . .
C205 C206 C207 120.3(3) . .
C201 C206 C207 119.3(3) . .
F7 C207 F8 104.5(3) . .
F7 C207 F9 107.4(3) . .
F8 C207 F9 105.6(3) . .
F7 C207 C206 113.2(3) . .
F8 C207 C206 112.0(3) . .
F9 C207 C206 113.5(3) . .
C7 P1 C1 109.66(13) . .
C7 P1 C13 104.67(14) . .
C1 P1 C13 103.70(13) . .
C7 P1 Rh1 103.52(9) . .
C1 P1 Rh1 119.83(10) . .
C13 P1 Rh1 114.55(10) . .
C19 P2 C31 105.67(13) . .
C19 P2 C25 104.56(14) . .
C31 P2 C25 105.06(13) . .
C19 P2 Rh1 103.20(9) . .
C31 P2 Rh1 113.57(10) . .
C25 P2 Rh1 123.17(9) . .
Rh1 Cl1 Rh1 153.61(5) 2_755 .
Rh1 Cl1 C23 153.53(5) 2_755 .
Rh1 Cl1 C23 52.45(4) . .
P1 Rh1 P2 156.75(3) . .
P1 Rh1 Cl1 102.16(3) . .
P2 Rh1 Cl1 99.71(3) . .
P1 Rh1 H1 88.7(13) . .
P2 Rh1 H1 86.2(12) . .
Cl1 Rh1 H1 122.4(13) . .
P1 Rh1 H2 79.5(12) . .
P2 Rh1 H2 77.3(12) . .
Cl1 Rh1 H2 164.0(13) . .
H1 Rh1 H2 73.4(17) . .
C104 B1 C104 112.5(3) . 2_655
C104 B1 C200 113.86(15) . 2_655
C104 B1 C200 102.37(14) 2_655 2_655
C104 B1 C200 102.37(14) . .
C104 B1 C200 113.86(15) 2_655 .
C200 B1 C200 112.3(3) 2_655 .
C501 C502 C503 117.8(5) . .
C501 C502 H502 121.1 . .
C503 C502 H502 121.1 . .
C502 C501 C502 121.5(6) 2_655 .
C502 C501 H501 119.3 2_655 .
C502 C501 H501 119.3 . .
C504 C503 C502 122.2(5) . .
C504 C503 H503 118.9 . .
C502 C503 H503 118.9 . .
C601 C600 C601 113.4(9) 2 .
C601 C600 H600 123.3 2 .
C601 C600 H600 123.3 . .
C600 C601 C602 126.3(7) . .
C600 C601 H601 116.9 . .
C602 C601 H601 116.9 . .
C603 C602 C601 114.2(6) . .
C603 C602 H602 122.9 . .
C601 C602 H602 122.9 . .
F600 C603 C602 117.2(4) . .
F600 C603 C602 117.2(4) . 2
C602 C603 C602 125.5(8) . 2
C503 C504 C503 118.6(7) . 2_655
C503 C504 H504 120.7 . .
C503 C504 H504 120.7 2_655 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 C6 1.536(4) .
C1 C2 1.539(4) .
C1 P1 1.862(3) .
C1 H1A 0.9800 .
C2 C3 1.538(4) .
C2 H2A 0.9700 .
C2 H2B 0.9700 .
C3 C4 1.524(4) .
C3 H3A 0.9700 .
C3 H3B 0.9700 .
C4 C5 1.529(4) .
C4 H4A 0.9700 .
C4 H4B 0.9700 .
C5 C6 1.525(4) .
C5 H5A 0.9700 .
C5 H5B 0.9700 .
C6 H6A 0.9700 .
C6 H6B 0.9700 .
C7 C12 1.531(4) .
C7 C8 1.538(4) .
C7 P1 1.857(3) .
C7 H7A 0.9800 .
C8 C9 1.525(5) .
C8 H8A 0.9700 .
C8 H8B 0.9700 .
C9 C10 1.520(5) .
C9 H9A 0.9700 .
C9 H9B 0.9700 .
C10 C11 1.524(5) .
C10 H10A 0.9700 .
C10 H10B 0.9700 .
C11 C12 1.527(4) .
C11 H11A 0.9700 .
C11 H11B 0.9700 .
C12 H12A 0.9700 .
C12 H12B 0.9700 .
C13 C14 1.522(4) .
C13 C18 1.531(4) .
C13 P1 1.863(3) .
C13 H13A 0.9800 .
C14 C15 1.527(4) .
C14 H14A 0.9700 .
C14 H14B 0.9700 .
C15 C16 1.507(5) .
C15 H15A 0.9700 .
C15 H15B 0.9700 .
C16 C17 1.518(5) .
C16 H16A 0.9700 .
C16 H16B 0.9700 .
C17 C18 1.521(4) .
C17 H17A 0.9700 .
C17 H17B 0.9700 .
C18 H18A 0.9700 .
C18 H18B 0.9700 .
C19 C24 1.532(4) .
C19 C20 1.536(4) .
C19 P2 1.854(3) .
C19 H19A 0.9800 .
C20 C21 1.531(5) .
C20 H20A 0.9700 .
C20 H20B 0.9700 .
C21 C22 1.521(5) .
C21 H21A 0.9700 .
C21 H21B 0.9700 .
C22 C23 1.526(5) .
C22 H22A 0.9700 .
C22 H22B 0.9700 .
C23 C24 1.530(5) .
C23 H23A 0.9700 .
C23 H23B 0.9700 .
C24 H24A 0.9700 .
C24 H24B 0.9700 .
C25 C26 1.525(4) .
C25 C30 1.542(4) .
C25 P2 1.866(3) .
C25 H25A 0.9800 .
C26 C27 1.532(4) .
C26 H26A 0.9700 .
C26 H26B 0.9700 .
C27 C28 1.523(5) .
C27 H27A 0.9700 .
C27 H27B 0.9700 .
C28 C29 1.516(5) .
C28 H28A 0.9700 .
C28 H28B 0.9700 .
C29 C30 1.526(5) .
C29 H29A 0.9700 .
C29 H29B 0.9700 .
C30 H30A 0.9700 .
C30 H30B 0.9700 .
C31 C36 1.530(4) .
C31 C32 1.535(4) .
C31 P2 1.855(3) .
C31 H31A 0.9800 .
C32 C33 1.528(4) .
C32 H32A 0.9700 .
C32 H32B 0.9700 .
C33 C34 1.518(5) .
C33 H33A 0.9700 .
C33 H33B 0.9700 .
C34 C35 1.521(5) .
C34 H34A 0.9700 .
C34 H34B 0.9700 .
C35 C36 1.534(4) .
C35 H35A 0.9700 .
C35 H35B 0.9700 .
C36 H36A 0.9700 .
C36 H36B 0.9700 .
C101 C106 1.376(4) .
C101 C102 1.386(4) .
C101 H101 0.9300 .
C102 C103 1.385(4) .
C102 C107 1.494(4) .
C103 C104 1.406(4) .
C103 H103 0.9300 .
C104 C105 1.401(4) .
C104 B1 1.636(4) .
C105 C106 1.392(4) .
C105 H105 0.9300 .
C106 C110 1.503(5) .
C107 F2 1.326(4) .
C107 F3 1.333(4) .
C107 F1 1.336(4) .
C110 F111 1.298(6) .
C110 F11 1.298(4) .
C110 F112 1.302(6) .
C110 F12 1.313(4) .
C110 F10 1.325(4) .
C110 F110 1.332(6) .
C200 C201 1.400(4) .
C200 C202 1.401(4) .
C200 B1 1.644(4) .
C201 C206 1.393(4) .
C201 H201 0.9300 .
C202 C203 1.393(4) .
C202 H202 0.9300 .
C203 C205 1.386(4) .
C203 C204 1.487(4) .
C204 F4 1.312(4) .
C204 F5 1.324(4) .
C204 F6 1.330(4) .
C205 C206 1.388(4) .
C205 H205 0.9300 .
C206 C207 1.496(4) .
C207 F7 1.317(4) .
C207 F8 1.320(4) .
C207 F9 1.320(4) .
P1 Rh1 2.3258(8) .
P2 Rh1 2.3295(7) .
Cl1 Rh1 2.4813(3) 2_755
Cl1 Rh1 2.4813(3) .
Rh1 H1 1.51(3) .
Rh1 H2 1.51(3) .
B1 C104 1.636(4) 2_655
B1 C200 1.644(4) 2_655
C502 C501 1.375(5) .
C502 C503 1.377(6) .
C502 H502 0.9300 .
C501 C502 1.375(5) 2_655
C501 H501 0.9300 .
C503 C504 1.353(6) .
C503 H503 0.9300 .
C600 C601 1.3795(11) 2
C600 C601 1.3795(11) .
C600 H600 0.9300 .
C601 C602 1.3796(11) .
C601 H601 0.9300 .
C602 C603 1.3782(11) .
C602 H602 0.9300 .
C603 F600 1.300(9) .
C603 C602 1.3782(11) 2
C504 C503 1.353(6) 2_655
C504 H504 0.9300 .
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_4
C6 C1 C2 C3 -56.6(3) . .
P1 C1 C2 C3 175.0(2) . .
C1 C2 C3 C4 56.7(4) . .
C2 C3 C4 C5 -55.3(4) . .
C3 C4 C5 C6 54.4(4) . .
C4 C5 C6 C1 -55.5(3) . .
C2 C1 C6 C5 56.6(3) . .
P1 C1 C6 C5 -172.0(2) . .
C12 C7 C8 C9 -53.1(3) . .
P1 C7 C8 C9 172.8(2) . .
C7 C8 C9 C10 54.6(4) . .
C8 C9 C10 C11 -57.1(4) . .
C9 C10 C11 C12 57.9(4) . .
C9 C10 C11 C28 15.7(2) . .
C10 C11 C12 C7 -56.1(4) . .
C28 C11 C12 C7 -5.31(15) . .
C8 C7 C12 C11 53.8(3) . .
P1 C7 C12 C11 -175.8(2) . .
C18 C13 C14 C15 53.5(4) . .
P1 C13 C14 C15 177.5(2) . .
C13 C14 C15 C16 -55.6(4) . .
C14 C15 C16 C17 56.5(4) . .
C15 C16 C17 C18 -56.3(4) . .
C16 C17 C18 C13 55.7(4) . .
C14 C13 C18 C17 -54.1(3) . .
P1 C13 C18 C17 179.8(2) . .
C24 C19 C20 C21 57.4(4) . .
P2 C19 C20 C21 -169.2(2) . .
C19 C20 C21 C22 -55.3(4) . .
C20 C21 C22 C23 54.0(4) . .
C21 C22 C23 C24 -56.0(4) . .
C21 C22 C23 Cl1 -25.4(3) . .
C22 C23 C24 C19 59.1(4) . .
Cl1 C23 C24 C19 18.17(15) . .
C20 C19 C24 C23 -59.0(4) . .
P2 C19 C24 C23 171.9(2) . .
C30 C25 C26 C27 57.6(3) . .
P2 C25 C26 C27 -172.5(2) . .
C25 C26 C27 C28 -56.7(4) . .
C26 C27 C28 C29 55.2(4) . .
C26 C27 C28 C11 27.11(19) . .
C10 C11 C28 C29 -64.7(3) . .
C12 C11 C28 C29 164.5(3) . .
C10 C11 C28 C27 86.8(3) . .
C12 C11 C28 C27 -44.0(3) . .
C27 C28 C29 C30 -55.7(4) . .
C11 C28 C29 C30 -32.9(2) . .
C28 C29 C30 C25 57.5(4) . .
C26 C25 C30 C29 -58.1(4) . .
P2 C25 C30 C29 172.6(2) . .
C36 C31 C32 C33 55.0(3) . .
P2 C31 C32 C33 -178.0(2) . .
C31 C32 C33 C34 -56.6(4) . .
C32 C33 C34 C35 56.9(4) . .
C33 C34 C35 C36 -57.0(4) . .
C32 C31 C36 C35 -54.4(3) . .
P2 C31 C36 C35 -179.5(2) . .
C34 C35 C36 C31 56.1(4) . .
C106 C101 C102 C103 -1.5(4) . .
C106 C101 C102 C107 179.0(3) . .
C101 C102 C103 C104 1.7(4) . .
C107 C102 C103 C104 -178.8(3) . .
C102 C103 C104 C105 -0.6(4) . .
C102 C103 C104 B1 173.0(2) . .
C103 C104 C105 C106 -0.7(4) . .
B1 C104 C105 C106 -174.1(2) . .
C102 C101 C106 C105 0.2(4) . .
C102 C101 C106 C110 177.5(3) . .
C104 C105 C106 C101 0.9(4) . .
C104 C105 C106 C110 -176.4(3) . .
C103 C102 C107 F2 13.9(4) . .
C101 C102 C107 F2 -166.7(3) . .
C103 C102 C107 F3 -107.5(3) . .
C101 C102 C107 F3 72.0(4) . .
C103 C102 C107 F1 134.0(3) . .
C101 C102 C107 F1 -46.6(4) . .
C101 C106 C110 F111 92.8(10) . .
C105 C106 C110 F111 -89.8(10) . .
C101 C106 C110 F11 -98.7(4) . .
C105 C106 C110 F11 78.7(5) . .
C101 C106 C110 F112 -30.2(9) . .
C105 C106 C110 F112 147.2(9) . .
C101 C106 C110 F12 139.5(4) . .
C105 C106 C110 F12 -43.1(4) . .
C101 C106 C110 F10 21.7(5) . .
C105 C106 C110 F10 -160.9(4) . .
C101 C106 C110 F110 -148.3(9) . .
C105 C106 C110 F110 29.1(9) . .
C202 C200 C201 C206 -1.0(4) . .
B1 C200 C201 C206 -172.0(3) . .
C201 C200 C202 C203 0.0(4) . .
B1 C200 C202 C203 171.1(3) . .
C200 C202 C203 C205 1.4(5) . .
C200 C202 C203 C204 -179.0(3) . .
C205 C203 C204 F4 -20.8(5) . .
C202 C203 C204 F4 159.7(3) . .
C205 C203 C204 F5 -142.7(3) . .
C202 C203 C204 F5 37.8(4) . .
C205 C203 C204 F6 100.1(4) . .
C202 C203 C204 F6 -79.5(4) . .
C202 C203 C205 C206 -1.7(5) . .
C204 C203 C205 C206 178.7(3) . .
C203 C205 C206 C201 0.7(5) . .
C203 C205 C206 C207 -177.6(3) . .
C200 C201 C206 C205 0.7(5) . .
C200 C201 C206 C207 179.0(3) . .
C205 C206 C207 F7 -140.0(3) . .
C201 C206 C207 F7 41.7(4) . .
C205 C206 C207 F8 102.1(4) . .
C201 C206 C207 F8 -76.2(4) . .
C205 C206 C207 F9 -17.3(5) . .
C201 C206 C207 F9 164.4(3) . .
C12 C7 P1 C1 -47.8(3) . .
C8 C7 P1 C1 83.0(2) . .
C12 C7 P1 C13 62.9(3) . .
C8 C7 P1 C13 -166.3(2) . .
C12 C7 P1 Rh1 -176.8(2) . .
C8 C7 P1 Rh1 -46.0(2) . .
C6 C1 P1 C7 -49.1(2) . .
C2 C1 P1 C7 78.9(2) . .
C6 C1 P1 C13 -160.4(2) . .
C2 C1 P1 C13 -32.4(3) . .
C6 C1 P1 Rh1 70.3(2) . .
C2 C1 P1 Rh1 -161.69(19) . .
C14 C13 P1 C7 55.2(3) . .
C18 C13 P1 C7 179.5(2) . .
C14 C13 P1 C1 170.2(2) . .
C18 C13 P1 C1 -65.6(2) . .
C14 C13 P1 Rh1 -57.4(3) . .
C18 C13 P1 Rh1 66.8(2) . .
C24 C19 P2 C31 -47.0(3) . .
C20 C19 P2 C31 -175.2(2) . .
C24 C19 P2 C25 63.6(3) . .
C20 C19 P2 C25 -64.6(2) . .
C24 C19 P2 Rh1 -166.5(2) . .
C20 C19 P2 Rh1 65.3(2) . .
C36 C31 P2 C19 -53.9(2) . .
C32 C31 P2 C19 -179.0(2) . .
C36 C31 P2 C25 -164.2(2) . .
C32 C31 P2 C25 70.8(2) . .
C36 C31 P2 Rh1 58.5(2) . .
C32 C31 P2 Rh1 -66.6(2) . .
C26 C25 P2 C19 153.8(2) . .
C30 C25 P2 C19 -79.3(2) . .
C26 C25 P2 C31 -95.2(2) . .
C30 C25 P2 C31 31.8(3) . .
C26 C25 P2 Rh1 36.9(3) . .
C30 C25 P2 Rh1 163.88(19) . .
C22 C23 Cl1 Rh1 -26.3(3) . 2_755
C24 C23 Cl1 Rh1 114.0(2) . 2_755
C22 C23 Cl1 Rh1 145.9(2) . .
C24 C23 Cl1 Rh1 -73.7(2) . .
C7 P1 Rh1 P2 -49.74(12) . .
C1 P1 Rh1 P2 -172.20(12) . .
C13 P1 Rh1 P2 63.60(13) . .
C7 P1 Rh1 Cl1 110.07(10) . .
C1 P1 Rh1 Cl1 -12.39(11) . .
C13 P1 Rh1 Cl1 -136.59(11) . .
C19 P2 Rh1 P1 61.60(12) . .
C31 P2 Rh1 P1 -52.29(13) . .
C25 P2 Rh1 P1 179.10(12) . .
C19 P2 Rh1 Cl1 -98.38(10) . .
C31 P2 Rh1 Cl1 147.73(11) . .
C25 P2 Rh1 Cl1 19.12(12) . .
Rh1 Cl1 Rh1 P1 42.36(2) 2_755 .
C23 Cl1 Rh1 P1 -129.88(4) . .
Rh1 Cl1 Rh1 P2 -145.59(2) 2_755 .
C23 Cl1 Rh1 P2 42.17(4) . .
C105 C104 B1 C104 -146.2(3) . 2_655
C103 C104 B1 C104 40.7(2) . 2_655
C105 C104 B1 C200 -30.3(4) . 2_655
C103 C104 B1 C200 156.6(3) . 2_655
C105 C104 B1 C200 91.2(3) . .
C103 C104 B1 C200 -81.9(3) . .
C201 C200 B1 C104 88.9(3) . .
C202 C200 B1 C104 -81.6(3) . .
C201 C200 B1 C104 -32.8(4) . 2_655
C202 C200 B1 C104 156.7(3) . 2_655
C201 C200 B1 C200 -148.6(3) . 2_655
C202 C200 B1 C200 40.9(2) . 2_655
C503 C502 C501 C502 -0.9(3) . 2_655
C501 C502 C503 C504 1.8(6) . .
C601 C600 C601 C602 0.4(7) 2 .
C600 C601 C602 C603 -0.8(13) . .
C601 C602 C603 F600 -179.7(6) . .
C601 C602 C603 C602 0.3(6) . 2
C502 C503 C504 C503 -0.9(3) . 2_655
