# Electronic Supplementary Material (ESI) for Catalysis Science & Technology.
# This journal is © The Royal Society of Chemistry 2015

####################################################################### 
# 
# 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_z
_database_code_depnum_ccdc_archive 'CCDC 1430675'
_audit_update_record             
;
2015-10-12 deposited with the CCDC.
2015-12-20 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C35 H37 F3 N O7 P2 Rh S'
_chemical_formula_weight         837.57

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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
S S 0.1246 0.1234 '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'

_symmetry_cell_setting           Monoclinic
_symmetry_space_group_name_H-M   P2(1)/c

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   11.2087(4)
_cell_length_b                   15.5479(6)
_cell_length_c                   20.7874(8)
_cell_angle_alpha                90.00
_cell_angle_beta                 97.1850(10)
_cell_angle_gamma                90.00
_cell_volume                     3594.2(2)
_cell_formula_units_Z            4
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_size_max          0.44
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.09
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.548
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1712
_exptl_absorpt_coefficient_mu    0.687
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.7521
_exptl_absorpt_correction_T_max  0.9408
_exptl_absorpt_process_details   sadabs

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            41294
_diffrn_reflns_av_R_equivalents  0.0527
_diffrn_reflns_av_sigmaI/netI    0.0327
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_theta_min         1.64
_diffrn_reflns_theta_max         25.01
_reflns_number_total             6342
_reflns_number_gt                5189
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0569P)²+7.7748P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         6342
_refine_ls_number_parameters     451
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0574
_refine_ls_R_factor_gt           0.0436
_refine_ls_wR_factor_ref         0.1168
_refine_ls_wR_factor_gt          0.1064
_refine_ls_goodness_of_fit_ref   1.032
_refine_ls_restrained_S_all      1.032
_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Rh1 Rh 0.34075(3) 0.961296(19) 0.625349(14) 0.02584(11) Uani 1 1 d . . .
P1 P 0.28678(8) 0.85297(6) 0.68470(5) 0.0238(2) Uani 1 1 d . . .
P2 P 0.03646(9) 0.92254(7) 0.66499(5) 0.0264(2) Uani 1 1 d . . .
O1 O 0.4723(3) 1.0572(2) 0.73490(16) 0.0471(8) Uani 1 1 d . . .
O2 O 0.2590(2) 0.89914(18) 0.54490(13) 0.0343(7) Uani 1 1 d . . .
O3 O 0.3942(2) 1.05741(18) 0.56655(14) 0.0337(6) Uani 1 1 d . . .
O4 O 0.0473(4) 0.8646(3) 0.82600(17) 0.0661(11) Uani 1 1 d . . .
N1 N 0.1389(3) 0.8556(2) 0.70285(15) 0.0250(7) Uani 1 1 d . . .
C1 C -0.0944(3) 0.9295(3) 0.7068(2) 0.0314(9) Uani 1 1 d . . .
C2 C -0.1862(4) 0.8700(3) 0.6926(2) 0.0411(11) Uani 1 1 d . . .
H2A H -0.1802 0.8283 0.6611 0.049 Uiso 1 1 calc R . .
C3 C -0.2862(4) 0.8722(4) 0.7250(3) 0.0546(14) Uani 1 1 d . . .
H3A H -0.3464 0.8313 0.7160 0.066 Uiso 1 1 calc R . .
C4 C -0.2972(4) 0.9346(4) 0.7704(3) 0.0610(16) Uani 1 1 d . . .
H4A H -0.3645 0.9358 0.7924 0.073 Uiso 1 1 calc R . .
C5 C -0.2093(5) 0.9947(4) 0.7833(3) 0.0699(17) Uani 1 1 d . . .
H5A H -0.2182 1.0377 0.8134 0.084 Uiso 1 1 calc R . .
C6 C -0.1066(5) 0.9930(3) 0.7523(3) 0.0519(13) Uani 1 1 d . . .
H6A H -0.0467 1.0341 0.7619 0.062 Uiso 1 1 calc R . .
C7 C 0.0976(3) 1.0279(2) 0.6601(2) 0.0298(9) Uani 1 1 d . . .
C8 C 0.0914(4) 1.0698(3) 0.6005(2) 0.0400(10) Uani 1 1 d . . .
H8A H 0.0582 1.0420 0.5629 0.048 Uiso 1 1 calc R . .
C9 C 0.1347(5) 1.1527(3) 0.5973(3) 0.0501(12) Uani 1 1 d . . .
H9A H 0.1306 1.1807 0.5575 0.060 Uiso 1 1 calc R . .
C10 C 0.1835(4) 1.1934(3) 0.6526(3) 0.0507(13) Uani 1 1 d . . .
H10A H 0.2129 1.2491 0.6502 0.061 Uiso 1 1 calc R . .
C11 C 0.1899(4) 1.1528(3) 0.7123(3) 0.0435(11) Uani 1 1 d . . .
H11A H 0.2229 1.1815 0.7495 0.052 Uiso 1 1 calc R . .
C12 C 0.1472(4) 1.0698(3) 0.7166(2) 0.0348(9) Uani 1 1 d . . .
H12A H 0.1516 1.0422 0.7566 0.042 Uiso 1 1 calc R . .
C13 C 0.3672(3) 0.8339(2) 0.76526(19) 0.0264(8) Uani 1 1 d . . .
C14 C 0.3690(3) 0.9003(3) 0.81028(19) 0.0299(9) Uani 1 1 d . . .
H14A H 0.3321 0.9524 0.7981 0.036 Uiso 1 1 calc R . .
C15 C 0.4253(4) 0.8897(3) 0.8729(2) 0.0364(10) Uani 1 1 d . . .
H15A H 0.4261 0.9345 0.9026 0.044 Uiso 1 1 calc R . .
C16 C 0.4802(4) 0.8123(3) 0.8911(2) 0.0425(11) Uani 1 1 d . . .
H16A H 0.5186 0.8053 0.9330 0.051 Uiso 1 1 calc R . .
C17 C 0.4784(4) 0.7455(3) 0.8473(2) 0.0388(10) Uani 1 1 d . . .
H17A H 0.5152 0.6935 0.8599 0.047 Uiso 1 1 calc R . .
C18 C 0.4214(3) 0.7557(3) 0.7844(2) 0.0316(9) Uani 1 1 d . . .
H18A H 0.4195 0.7104 0.7551 0.038 Uiso 1 1 calc R . .
C19 C 0.2984(4) 0.7542(3) 0.63916(19) 0.0291(9) Uani 1 1 d . . .
C20 C 0.4133(4) 0.7279(3) 0.6279(2) 0.0377(10) Uani 1 1 d . . .
H20A H 0.4805 0.7578 0.6469 0.045 Uiso 1 1 calc R . .
C21 C 0.4275(5) 0.6577(3) 0.5886(2) 0.0485(12) Uani 1 1 d . . .
H21A H 0.5042 0.6401 0.5819 0.058 Uiso 1 1 calc R . .
C22 C 0.3285(5) 0.6138(3) 0.5594(3) 0.0548(14) Uani 1 1 d . . .
H22A H 0.3382 0.5671 0.5326 0.066 Uiso 1 1 calc R . .
C23 C 0.2159(5) 0.6392(3) 0.5701(2) 0.0461(12) Uani 1 1 d . . .
H23A H 0.1492 0.6094 0.5505 0.055 Uiso 1 1 calc R . .
C24 C 0.2000(4) 0.7086(3) 0.6095(2) 0.0339(9) Uani 1 1 d . . .
H24A H 0.1228 0.7250 0.6162 0.041 Uiso 1 1 calc R . .
C25 C -0.0148(4) 0.8838(3) 0.5850(2) 0.0390(10) Uani 1 1 d . . .
H25A H 0.0522 0.8790 0.5607 0.058 Uiso 1 1 calc R . .
H25B H -0.0726 0.9233 0.5636 0.058 Uiso 1 1 calc R . .
H25C H -0.0516 0.8284 0.5879 0.058 Uiso 1 1 calc R . .
C26 C 0.1055(4) 0.7907(3) 0.8111(2) 0.0401(11) Uani 1 1 d . . .
H26A H 0.0701 0.7414 0.8301 0.048 Uiso 1 1 calc R . .
H26B H 0.1896 0.7939 0.8289 0.048 Uiso 1 1 calc R . .
C27 C 0.0950(3) 0.7805(3) 0.73912(19) 0.0303(9) Uani 1 1 d . . .
H27A H 0.0113 0.7703 0.7229 0.036 Uiso 1 1 calc R . .
H27B H 0.1400 0.7298 0.7294 0.036 Uiso 1 1 calc R . .
C28 C 0.0584(7) 0.8821(5) 0.8937(3) 0.082(2) Uani 1 1 d . . .
H28A H 0.0162 0.9343 0.9010 0.123 Uiso 1 1 calc R . .
H28B H 0.1418 0.8885 0.9102 0.123 Uiso 1 1 calc R . .
H28C H 0.0245 0.8354 0.9156 0.123 Uiso 1 1 calc R . .
C29 C 0.2170(4) 0.8543(3) 0.4370(2) 0.0467(12) Uani 1 1 d . . .
H29A H 0.1869 0.8063 0.4590 0.070 Uiso 1 1 calc R . .
H29B H 0.2794 0.8352 0.4127 0.070 Uiso 1 1 calc R . .
H29C H 0.1529 0.8793 0.4080 0.070 Uiso 1 1 calc R . .
C30 C 0.2670(4) 0.9206(3) 0.48586(19) 0.0331(9) Uani 1 1 d . . .
C31 C 0.3161(4) 0.9954(3) 0.4655(2) 0.0363(10) Uani 1 1 d . . .
H31A H 0.3095 1.0047 0.4210 0.044 Uiso 1 1 calc R . .
C32 C 0.3756(4) 1.0594(3) 0.5055(2) 0.0338(10) Uani 1 1 d . . .
C33 C 0.4230(4) 1.1367(3) 0.4737(2) 0.0437(11) Uani 1 1 d . . .
H33A H 0.4614 1.1747 0.5064 0.066 Uiso 1 1 calc R . .
H33B H 0.3577 1.1662 0.4487 0.066 Uiso 1 1 calc R . .
H33C H 0.4802 1.1187 0.4457 0.066 Uiso 1 1 calc R . .
C34 C 0.4198(4) 1.0172(3) 0.6943(2) 0.0317(9) Uani 1 1 d . . .
S1 S 0.19235(11) 0.36513(8) 0.39576(7) 0.0479(3) Uani 1 1 d . . .
O5 O 0.2392(6) 0.4454(3) 0.3768(3) 0.1060(19) Uani 1 1 d . . .
O6 O 0.0757(4) 0.3513(4) 0.3696(3) 0.115(2) Uani 1 1 d . . .
O7 O 0.2729(4) 0.2970(3) 0.3908(2) 0.0864(14) Uani 1 1 d . . .
C01 C 0.1904(8) 0.3833(4) 0.4790(3) 0.088(2) Uani 1 1 d . . .
F1 F 0.1478(12) 0.3123(3) 0.5044(3) 0.277(6) Uani 1 1 d . . .
F2 F 0.2956(6) 0.3966(5) 0.5097(3) 0.196(4) Uani 1 1 d . . .
F3 F 0.1192(4) 0.4455(2) 0.49353(18) 0.0835(11) Uani 1 1 d . . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Rh1 C34 1.810(4) . ?
Rh1 O2 2.046(3) . ?
Rh1 O3 2.066(3) . ?
Rh1 P1 2.2161(10) . ?
P1 N1 1.746(3) . ?
P1 C19 1.818(4) . ?
P1 C13 1.824(4) . ?
P2 N1 1.671(3) . ?
P2 C7 1.783(4) . ?
P2 C25 1.794(4) . ?
P2 C1 1.800(4) . ?
O1 C34 1.149(5) . ?
O2 C30 1.286(5) . ?
O3 C32 1.261(5) . ?
O4 C26 1.375(6) . ?
O4 C28 1.424(6) . ?
N1 C27 1.506(5) . ?
C1 C6 1.385(6) . ?
C1 C2 1.388(6) . ?
C2 C3 1.378(7) . ?
C2 H2A 0.9300 . ?
C3 C4 1.369(8) . ?
C3 H3A 0.9300 . ?
C4 C5 1.360(8) . ?
C4 H4A 0.9300 . ?
C5 C6 1.389(7) . ?
C5 H5A 0.9300 . ?
C6 H6A 0.9300 . ?
C7 C8 1.395(6) . ?
C7 C12 1.395(6) . ?
C8 C9 1.381(7) . ?
C8 H8A 0.9300 . ?
C9 C10 1.366(7) . ?
C9 H9A 0.9300 . ?
C10 C11 1.385(7) . ?
C10 H10A 0.9300 . ?
C11 C12 1.384(6) . ?
C11 H11A 0.9300 . ?
C12 H12A 0.9300 . ?
C13 C14 1.392(6) . ?
C13 C18 1.395(5) . ?
C14 C15 1.383(6) . ?
C14 H14A 0.9300 . ?
C15 C16 1.383(6) . ?
C15 H15A 0.9300 . ?
C16 C17 1.379(6) . ?
C16 H16A 0.9300 . ?
C17 C18 1.391(6) . ?
C17 H17A 0.9300 . ?
C18 H18A 0.9300 . ?
C19 C24 1.389(6) . ?
C19 C20 1.398(6) . ?
C20 C21 1.385(6) . ?
C20 H20A 0.9300 . ?
C21 C22 1.377(7) . ?
C21 H21A 0.9300 . ?
C22 C23 1.366(7) . ?
C22 H22A 0.9300 . ?
C23 C24 1.379(6) . ?
C23 H23A 0.9300 . ?
C24 H24A 0.9300 . ?
C25 H25A 0.9600 . ?
C25 H25B 0.9600 . ?
C25 H25C 0.9600 . ?
C26 C27 1.494(6) . ?
C26 H26A 0.9700 . ?
C26 H26B 0.9700 . ?
C27 H27A 0.9700 . ?
C27 H27B 0.9700 . ?
C28 H28A 0.9600 . ?
C28 H28B 0.9600 . ?
C28 H28C 0.9600 . ?
C29 C30 1.505(6) . ?
C29 H29A 0.9600 . ?
C29 H29B 0.9600 . ?
C29 H29C 0.9600 . ?
C30 C31 1.377(6) . ?
C31 C32 1.409(6) . ?
C31 H31A 0.9300 . ?
C32 C33 1.501(6) . ?
C33 H33A 0.9600 . ?
C33 H33B 0.9600 . ?
C33 H33C 0.9600 . ?
S1 O6 1.369(4) . ?
S1 O7 1.404(4) . ?
S1 O5 1.428(4) . ?
S1 C01 1.757(7) . ?
C01 F2 1.285(10) . ?
C01 F3 1.313(8) . ?
C01 F1 1.337(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
C34 Rh1 O2 176.98(15) . . ?
C34 Rh1 O3 88.34(15) . . ?
O2 Rh1 O3 89.51(11) . . ?
C34 Rh1 P1 93.74(12) . . ?
O2 Rh1 P1 88.32(8) . . ?
O3 Rh1 P1 176.86(8) . . ?
N1 P1 C19 105.33(17) . . ?
N1 P1 C13 100.31(16) . . ?
C19 P1 C13 106.35(18) . . ?
N1 P1 Rh1 115.78(11) . . ?
C19 P1 Rh1 108.06(13) . . ?
C13 P1 Rh1 119.78(13) . . ?
N1 P2 C7 110.62(17) . . ?
N1 P2 C25 110.43(19) . . ?
C7 P2 C25 109.7(2) . . ?
N1 P2 C1 111.27(18) . . ?
C7 P2 C1 108.33(19) . . ?
C25 P2 C1 106.4(2) . . ?
C30 O2 Rh1 125.5(3) . . ?
C32 O3 Rh1 126.1(3) . . ?
C26 O4 C28 113.5(5) . . ?
C27 N1 P2 118.1(2) . . ?
C27 N1 P1 117.9(2) . . ?
P2 N1 P1 121.86(18) . . ?
C6 C1 C2 119.1(4) . . ?
C6 C1 P2 121.9(3) . . ?
C2 C1 P2 119.0(3) . . ?
C3 C2 C1 120.4(5) . . ?
C3 C2 H2A 119.8 . . ?
C1 C2 H2A 119.8 . . ?
C4 C3 C2 120.3(5) . . ?
C4 C3 H3A 119.9 . . ?
C2 C3 H3A 119.9 . . ?
C5 C4 C3 119.8(5) . . ?
C5 C4 H4A 120.1 . . ?
C3 C4 H4A 120.1 . . ?
C4 C5 C6 121.2(5) . . ?
C4 C5 H5A 119.4 . . ?
C6 C5 H5A 119.4 . . ?
C1 C6 C5 119.2(5) . . ?
C1 C6 H6A 120.4 . . ?
C5 C6 H6A 120.4 . . ?
C8 C7 C12 120.0(4) . . ?
C8 C7 P2 120.2(3) . . ?
C12 C7 P2 119.8(3) . . ?
C9 C8 C7 120.0(5) . . ?
C9 C8 H8A 120.0 . . ?
C7 C8 H8A 120.0 . . ?
C10 C9 C8 119.9(5) . . ?
C10 C9 H9A 120.0 . . ?
C8 C9 H9A 120.0 . . ?
C9 C10 C11 120.8(5) . . ?
C9 C10 H10A 119.6 . . ?
C11 C10 H10A 119.6 . . ?
C12 C11 C10 120.3(5) . . ?
C12 C11 H11A 119.9 . . ?
C10 C11 H11A 119.9 . . ?
C11 C12 C7 119.0(4) . . ?
C11 C12 H12A 120.5 . . ?
C7 C12 H12A 120.5 . . ?
C14 C13 C18 119.1(4) . . ?
C14 C13 P1 117.4(3) . . ?
C18 C13 P1 123.4(3) . . ?
C15 C14 C13 120.7(4) . . ?
C15 C14 H14A 119.6 . . ?
C13 C14 H14A 119.6 . . ?
C14 C15 C16 119.7(4) . . ?
C14 C15 H15A 120.1 . . ?
C16 C15 H15A 120.1 . . ?
C17 C16 C15 120.4(4) . . ?
C17 C16 H16A 119.8 . . ?
C15 C16 H16A 119.8 . . ?
C16 C17 C18 120.1(4) . . ?
C16 C17 H17A 119.9 . . ?
C18 C17 H17A 119.9 . . ?
C17 C18 C13 120.0(4) . . ?
C17 C18 H18A 120.0 . . ?
C13 C18 H18A 120.0 . . ?
C24 C19 C20 118.2(4) . . ?
C24 C19 P1 123.9(3) . . ?
C20 C19 P1 117.5(3) . . ?
C21 C20 C19 120.3(4) . . ?
C21 C20 H20A 119.8 . . ?
C19 C20 H20A 119.8 . . ?
C22 C21 C20 120.3(4) . . ?
C22 C21 H21A 119.8 . . ?
C20 C21 H21A 119.8 . . ?
C23 C22 C21 119.7(4) . . ?
C23 C22 H22A 120.2 . . ?
C21 C22 H22A 120.2 . . ?
C22 C23 C24 120.8(4) . . ?
C22 C23 H23A 119.6 . . ?
C24 C23 H23A 119.6 . . ?
C23 C24 C19 120.6(4) . . ?
C23 C24 H24A 119.7 . . ?
C19 C24 H24A 119.7 . . ?
P2 C25 H25A 109.5 . . ?
P2 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
P2 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
O4 C26 C27 109.5(4) . . ?
O4 C26 H26A 109.8 . . ?
C27 C26 H26A 109.8 . . ?
O4 C26 H26B 109.8 . . ?
C27 C26 H26B 109.8 . . ?
H26A C26 H26B 108.2 . . ?
C26 C27 N1 115.4(3) . . ?
C26 C27 H27A 108.4 . . ?
N1 C27 H27A 108.4 . . ?
C26 C27 H27B 108.4 . . ?
N1 C27 H27B 108.4 . . ?
H27A C27 H27B 107.5 . . ?
O4 C28 H28A 109.5 . . ?
O4 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
O4 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
C30 C29 H29A 109.5 . . ?
C30 C29 H29B 109.5 . . ?
H29A C29 H29B 109.5 . . ?
C30 C29 H29C 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
O2 C30 C31 126.2(4) . . ?
O2 C30 C29 113.7(4) . . ?
C31 C30 C29 120.0(4) . . ?
C30 C31 C32 126.3(4) . . ?
C30 C31 H31A 116.8 . . ?
C32 C31 H31A 116.8 . . ?
O3 C32 C31 125.7(4) . . ?
O3 C32 C33 116.1(4) . . ?
C31 C32 C33 118.2(4) . . ?
C32 C33 H33A 109.5 . . ?
C32 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
C32 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
O1 C34 Rh1 175.0(4) . . ?
O6 S1 O7 116.3(3) . . ?
O6 S1 O5 113.1(4) . . ?
O7 S1 O5 112.1(3) . . ?
O6 S1 C01 106.8(4) . . ?
O7 S1 C01 106.3(3) . . ?
O5 S1 C01 100.5(3) . . ?
F2 C01 F3 108.3(6) . . ?
F2 C01 F1 106.8(8) . . ?
F3 C01 F1 105.1(7) . . ?
F2 C01 S1 113.0(7) . . ?
F3 C01 S1 115.3(5) . . ?
F1 C01 S1 107.7(5) . . ?

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
C34 Rh1 P1 N1 101.12(18) . . . . ?
O2 Rh1 P1 N1 -81.09(15) . . . . ?
O3 Rh1 P1 N1 -127.4(15) . . . . ?
C34 Rh1 P1 C19 -141.09(19) . . . . ?
O2 Rh1 P1 C19 36.70(16) . . . . ?
O3 Rh1 P1 C19 -9.6(16) . . . . ?
C34 Rh1 P1 C13 -19.23(19) . . . . ?
O2 Rh1 P1 C13 158.56(16) . . . . ?
O3 Rh1 P1 C13 112.3(15) . . . . ?
C34 Rh1 O2 C30 -37(3) . . . . ?
O3 Rh1 O2 C30 7.6(3) . . . . ?
P1 Rh1 O2 C30 -170.1(3) . . . . ?
C34 Rh1 O3 C32 175.7(3) . . . . ?
O2 Rh1 O3 C32 -2.2(3) . . . . ?
P1 Rh1 O3 C32 44.0(17) . . . . ?
C7 P2 N1 C27 151.7(3) . . . . ?
C25 P2 N1 C27 -86.7(3) . . . . ?
C1 P2 N1 C27 31.2(3) . . . . ?
C7 P2 N1 P1 -45.4(3) . . . . ?
C25 P2 N1 P1 76.2(3) . . . . ?
C1 P2 N1 P1 -165.9(2) . . . . ?
C19 P1 N1 C27 56.6(3) . . . . ?
C13 P1 N1 C27 -53.7(3) . . . . ?
Rh1 P1 N1 C27 175.9(2) . . . . ?
C19 P1 N1 P2 -106.4(2) . . . . ?
C13 P1 N1 P2 143.3(2) . . . . ?
Rh1 P1 N1 P2 12.9(3) . . . . ?
N1 P2 C1 C6 93.8(4) . . . . ?
C7 P2 C1 C6 -28.0(4) . . . . ?
C25 P2 C1 C6 -145.9(4) . . . . ?
N1 P2 C1 C2 -87.0(4) . . . . ?
C7 P2 C1 C2 151.2(3) . . . . ?
C25 P2 C1 C2 33.4(4) . . . . ?
C6 C1 C2 C3 -2.4(7) . . . . ?
P2 C1 C2 C3 178.4(4) . . . . ?
C1 C2 C3 C4 1.6(7) . . . . ?
C2 C3 C4 C5 0.3(9) . . . . ?
C3 C4 C5 C6 -1.5(10) . . . . ?
C2 C1 C6 C5 1.2(8) . . . . ?
P2 C1 C6 C5 -179.6(4) . . . . ?
C4 C5 C6 C1 0.8(9) . . . . ?
N1 P2 C7 C8 127.0(3) . . . . ?
C25 P2 C7 C8 5.0(4) . . . . ?
C1 P2 C7 C8 -110.8(3) . . . . ?
N1 P2 C7 C12 -55.6(4) . . . . ?
C25 P2 C7 C12 -177.7(3) . . . . ?
C1 P2 C7 C12 66.6(4) . . . . ?
C12 C7 C8 C9 0.2(6) . . . . ?
P2 C7 C8 C9 177.5(3) . . . . ?
C7 C8 C9 C10 0.0(7) . . . . ?
C8 C9 C10 C11 -0.3(7) . . . . ?
C9 C10 C11 C12 0.4(7) . . . . ?
C10 C11 C12 C7 -0.2(6) . . . . ?
C8 C7 C12 C11 -0.1(6) . . . . ?
P2 C7 C12 C11 -177.4(3) . . . . ?
N1 P1 C13 C14 -69.2(3) . . . . ?
C19 P1 C13 C14 -178.6(3) . . . . ?
Rh1 P1 C13 C14 58.7(3) . . . . ?
N1 P1 C13 C18 107.9(3) . . . . ?
C19 P1 C13 C18 -1.6(4) . . . . ?
Rh1 P1 C13 C18 -124.3(3) . . . . ?
C18 C13 C14 C15 1.0(6) . . . . ?
P1 C13 C14 C15 178.1(3) . . . . ?
C13 C14 C15 C16 -0.1(6) . . . . ?
C14 C15 C16 C17 -0.5(7) . . . . ?
C15 C16 C17 C18 0.2(7) . . . . ?
C16 C17 C18 C13 0.7(6) . . . . ?
C14 C13 C18 C17 -1.3(6) . . . . ?
P1 C13 C18 C17 -178.3(3) . . . . ?
N1 P1 C19 C24 17.8(4) . . . . ?
C13 P1 C19 C24 123.7(4) . . . . ?
Rh1 P1 C19 C24 -106.5(3) . . . . ?
N1 P1 C19 C20 -169.2(3) . . . . ?
C13 P1 C19 C20 -63.3(4) . . . . ?
Rh1 P1 C19 C20 66.5(3) . . . . ?
C24 C19 C20 C21 -0.7(6) . . . . ?
P1 C19 C20 C21 -174.1(4) . . . . ?
C19 C20 C21 C22 1.0(7) . . . . ?
C20 C21 C22 C23 -0.8(8) . . . . ?
C21 C22 C23 C24 0.3(8) . . . . ?
C22 C23 C24 C19 0.0(7) . . . . ?
C20 C19 C24 C23 0.2(6) . . . . ?
P1 C19 C24 C23 173.1(3) . . . . ?
C28 O4 C26 C27 -176.7(4) . . . . ?
O4 C26 C27 N1 55.3(5) . . . . ?
P2 N1 C27 C26 -102.1(4) . . . . ?
P1 N1 C27 C26 94.3(4) . . . . ?
Rh1 O2 C30 C31 -10.3(6) . . . . ?
Rh1 O2 C30 C29 169.2(3) . . . . ?
O2 C30 C31 C32 5.5(7) . . . . ?
C29 C30 C31 C32 -174.0(4) . . . . ?
Rh1 O3 C32 C31 -1.1(6) . . . . ?
Rh1 O3 C32 C33 179.7(3) . . . . ?
C30 C31 C32 O3 0.9(7) . . . . ?
C30 C31 C32 C33 -179.9(4) . . . . ?
O2 Rh1 C34 O1 45(6) . . . . ?
O3 Rh1 C34 O1 0(4) . . . . ?
P1 Rh1 C34 O1 178(100) . . . . ?
O6 S1 C01 F2 179.5(6) . . . . ?
O7 S1 C01 F2 54.7(6) . . . . ?
O5 S1 C01 F2 -62.3(6) . . . . ?
O6 S1 C01 F3 -55.2(7) . . . . ?
O7 S1 C01 F3 180.0(6) . . . . ?
O5 S1 C01 F3 63.0(7) . . . . ?
O6 S1 C01 F1 61.7(8) . . . . ?
O7 S1 C01 F1 -63.1(8) . . . . ?
O5 S1 C01 F1 180.0(7) . . . . ?

_diffrn_measured_fraction_theta_max 1.000
_diffrn_reflns_theta_full        25.01
_diffrn_measured_fraction_theta_full 1.000
_refine_diff_density_max         1.294
_refine_diff_density_min         -0.697
_refine_diff_density_rms         0.090
