 
data_IR-062_a
 
_audit_creation_method            'SHELXL-2018/3'
_shelx_SHELXL_version_number      '2018/3'
_chemical_name_systematic         ?
_chemical_name_common             ?
_chemical_melting_point           ?
_chemical_formula_moiety          ?
_chemical_formula_sum
 'C45 H71 Cl2 O3 P2 Rh' 
_chemical_formula_weight          895.76

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'
 'O'  'O'   0.0492   0.0322
 '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'
 'Cl'  'Cl'   0.3639   0.7018
 '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                    10.92844(7)
_cell_length_b                    12.69071(8)
_cell_length_c                    18.62518(9)
_cell_angle_alpha                 105.9024(5)
_cell_angle_beta                  94.5863(5)
_cell_angle_gamma                 113.4053(6)
_cell_volume                      2227.08(3)
_cell_formula_units_Z             2
_cell_measurement_temperature     100(2)
_cell_measurement_reflns_used   25945
_cell_measurement_theta_min     2.5230
_cell_measurement_theta_max     76.8950
 
_exptl_crystal_description       block
_exptl_crystal_colour             yellow
_exptl_crystal_density_meas       ?
_exptl_crystal_density_method     ?
_exptl_crystal_density_diffrn     1.336          
_exptl_crystal_F_000              948
_exptl_transmission_factor_min    ?
_exptl_transmission_factor_max    ?
_exptl_crystal_size_max                             0.209
_exptl_crystal_size_mid                             0.187
_exptl_crystal_size_min                             0.148
_exptl_absorpt_coefficient_mu     5.168
_shelx_estimated_absorpt_T_min    ?
_shelx_estimated_absorpt_T_max    ?
_exptl_absorpt_correction_T_min                     0.298
_exptl_absorpt_correction_T_max                     1.000
_exptl_absorpt_correction_type            gaussian
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.40.68a (Rigaku Oxford Diffraction, 2019)
Numerical absorption correction based on gaussian integration over
			a multifaceted crystal model
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details    ?
_diffrn_ambient_temperature       100(2)
_diffrn_radiation_wavelength      1.54184
_diffrn_radiation_type            CuK\a
_diffrn_source 'micro-focus sealed X-ray tube'
_diffrn_source_type 'PhotonJet (Cu) X-ray Source'
_diffrn_measurement_device 'four-circle diffractometer'
_diffrn_measurement_device_type 'XtaLAB Synergy, Dualflex, HyPix'
_diffrn_measurement_method        ?
_diffrn_detector_area_resol_mean  ?
_diffrn_reflns_number             28321
_diffrn_reflns_av_unetI/netI      0.0152
_diffrn_reflns_av_R_equivalents   0.0175
_diffrn_reflns_limit_h_min        -13
_diffrn_reflns_limit_h_max        13
_diffrn_reflns_limit_k_min        -16
_diffrn_reflns_limit_k_max        15
_diffrn_reflns_limit_l_min        -21
_diffrn_reflns_limit_l_max        23
_diffrn_reflns_theta_min          2.525
_diffrn_reflns_theta_max          76.930
_diffrn_reflns_theta_full         67.684
_diffrn_measured_fraction_theta_max   0.964
_diffrn_measured_fraction_theta_full  0.999
_diffrn_reflns_Laue_measured_fraction_max    0.964
_diffrn_reflns_Laue_measured_fraction_full   0.999
_diffrn_reflns_point_group_measured_fraction_max   0.964
_diffrn_reflns_point_group_measured_fraction_full  0.999
_reflns_number_total              9052
_reflns_number_gt                 8968
_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 1.171.40.68a (Rigaku OD, 2019)'
_computing_cell_refinement     'CrysAlisPro 1.171.40.68a (Rigaku OD, 2019)'
_computing_data_reduction      'CrysAlisPro 1.171.40.68a (Rigaku OD, 2019)'
_computing_structure_solution 'SHELXT-2018/2 (Sheldrick, 2018)'
_computing_structure_refinement 'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics     ?
_computing_publication_material   ?
_refine_special_details           ?
_refine_ls_structure_factor_coef  Fsqd
_refine_ls_matrix_type            full
_refine_ls_weighting_scheme       calc
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1000P)²] 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          9052
_refine_ls_number_parameters      481
_refine_ls_number_restraints      0
_refine_ls_R_factor_all           0.0303
_refine_ls_R_factor_gt            0.0301
_refine_ls_wR_factor_ref          0.1225
_refine_ls_wR_factor_gt           0.1219
_refine_ls_goodness_of_fit_ref    1.171
_refine_ls_restrained_S_all       1.171
_refine_ls_shift/su_max           0.010
_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 0.51372(2) 0.44767(2) 0.16131(2) 0.01406(8) Uani 1 1 d . . . . .
P1 P 0.75661(4) 0.64769(4) 0.36442(2) 0.01257(11) Uani 1 1 d . . . . .
P2 P 0.69786(4) 0.63386(4) 0.19567(2) 0.01265(11) Uani 1 1 d . . . . .
O1 O 0.31703(13) 0.55081(13) 0.19393(7) 0.0215(3) Uani 1 1 d . . . . .
O2 O 0.64441(14) 0.36829(12) 0.13677(8) 0.0188(3) Uani 1 1 d . . . . .
O3 O 0.35106(15) 0.27264(13) 0.11901(9) 0.0257(3) Uani 1 1 d . . . . .
C1 C 0.81198(17) 0.67618(15) 0.28416(9) 0.0139(3) Uani 1 1 d . . . . .
C2 C 0.96322(18) 0.74895(17) 0.29112(10) 0.0159(3) Uani 1 1 d . . . . .
C3 C 1.04961(19) 0.69585(17) 0.26388(10) 0.0181(3) Uani 1 1 d . . . . .
C4 C 1.1856(2) 0.77046(19) 0.26559(12) 0.0240(4) Uani 1 1 d . . . . .
H4 H 1.241873 0.733684 0.245750 0.029 Uiso 1 1 calc R U . . .
C5 C 1.2404(2) 0.8967(2) 0.29547(13) 0.0264(4) Uani 1 1 d . . . . .
H5 H 1.332365 0.945530 0.295129 0.032 Uiso 1 1 calc R U . . .
C6 C 1.1585(2) 0.95073(18) 0.32605(11) 0.0235(4) Uani 1 1 d . . . . .
H6 H 1.194847 1.036789 0.348070 0.028 Uiso 1 1 calc R U . . .
C7 C 1.02405(19) 0.87777(17) 0.32392(10) 0.0188(3) Uani 1 1 d . . . . .
H7 H 0.969752 0.915633 0.345440 0.023 Uiso 1 1 calc R U . . .
C8 C 1.0037(2) 0.56001(17) 0.23212(11) 0.0208(4) Uani 1 1 d . . . . .
H8A H 0.905096 0.517473 0.227986 0.031 Uiso 1 1 calc R U . . .
H8B H 1.051574 0.535537 0.266335 0.031 Uiso 1 1 calc R U . . .
H8C H 1.024647 0.538847 0.181427 0.031 Uiso 1 1 calc R U . . .
C9 C 0.90911(18) 0.70972(16) 0.44209(9) 0.0152(3) Uani 1 1 d . . . . .
H9 H 0.975535 0.786023 0.435534 0.018 Uiso 1 1 calc R U . . .
C10 C 0.88808(18) 0.74805(17) 0.52473(10) 0.0177(3) Uani 1 1 d . . . . .
H10A H 0.842252 0.802324 0.529801 0.021 Uiso 1 1 calc R U . . .
H10B H 0.828951 0.674971 0.536312 0.021 Uiso 1 1 calc R U . . .
C11 C 1.02667(19) 0.81472(18) 0.58154(10) 0.0210(4) Uani 1 1 d . . . . .
H11A H 1.082350 0.891236 0.572387 0.025 Uiso 1 1 calc R U . . .
H11B H 1.011714 0.836419 0.634264 0.025 Uiso 1 1 calc R U . . .
C12 C 1.1043(2) 0.73709(19) 0.57407(11) 0.0236(4) Uani 1 1 d . . . . .
H12A H 1.054588 0.665725 0.589741 0.028 Uiso 1 1 calc R U . . .
H12B H 1.195611 0.785405 0.608612 0.028 Uiso 1 1 calc R U . . .
C13 C 1.12061(19) 0.69335(18) 0.49177(11) 0.0218(4) Uani 1 1 d . . . . .
H13A H 1.164756 0.637883 0.487627 0.026 Uiso 1 1 calc R U . . .
H13B H 1.180426 0.764188 0.478365 0.026 Uiso 1 1 calc R U . . .
C14 C 0.98213(19) 0.62671(17) 0.43559(10) 0.0174(3) Uani 1 1 d . . . . .
H14A H 0.924571 0.552497 0.446578 0.021 Uiso 1 1 calc R U . . .
H14B H 0.995690 0.601378 0.382798 0.021 Uiso 1 1 calc R U . . .
C15 C 0.65315(17) 0.72327(16) 0.40798(10) 0.0150(3) Uani 1 1 d . . . . .
H15 H 0.649477 0.713937 0.459469 0.018 Uiso 1 1 calc R U . . .
C16 C 0.50511(18) 0.66697(16) 0.36390(10) 0.0166(3) Uani 1 1 d . . . . .
H16A H 0.504116 0.674378 0.312331 0.020 Uiso 1 1 calc R U . . .
H16B H 0.460531 0.579241 0.357732 0.020 Uiso 1 1 calc R U . . .
C17 C 0.42507(19) 0.73033(18) 0.40584(11) 0.0205(4) Uani 1 1 d . . . . .
H17A H 0.331040 0.694469 0.375280 0.025 Uiso 1 1 calc R U . . .
H17B H 0.419285 0.716971 0.455640 0.025 Uiso 1 1 calc R U . . .
C18 C 0.4940(2) 0.86676(19) 0.41896(12) 0.0265(4) Uani 1 1 d . . . . .
H18A H 0.492570 0.880305 0.369080 0.032 Uiso 1 1 calc R U . . .
H18B H 0.442940 0.906399 0.448000 0.032 Uiso 1 1 calc R U . . .
C19 C 0.6413(2) 0.92391(18) 0.46308(12) 0.0253(4) Uani 1 1 d . . . . .
H19A H 0.642359 0.916862 0.514737 0.030 Uiso 1 1 calc R U . . .
H19B H 0.685248 1.011560 0.468985 0.030 Uiso 1 1 calc R U . . .
C20 C 0.72202(18) 0.86070(16) 0.42125(10) 0.0180(3) Uani 1 1 d . . . . .
H20A H 0.815990 0.896839 0.451955 0.022 Uiso 1 1 calc R U . . .
H20B H 0.727983 0.874098 0.371468 0.022 Uiso 1 1 calc R U . . .
C21 C 0.64520(18) 0.48594(16) 0.34932(10) 0.0156(3) Uani 1 1 d . . . . .
H21 H 0.563645 0.464187 0.309823 0.019 Uiso 1 1 calc R U . . .
C22 C 0.70256(18) 0.39539(16) 0.31448(10) 0.0170(3) Uani 1 1 d . . . . .
H22A H 0.739080 0.412235 0.269807 0.020 Uiso 1 1 calc R U . . .
H22B H 0.778283 0.405366 0.352676 0.020 Uiso 1 1 calc R U . . .
C23 C 0.5901(2) 0.26460(16) 0.28956(11) 0.0212(4) Uani 1 1 d . . . . .
H23A H 0.517772 0.253267 0.248603 0.025 Uiso 1 1 calc R U . . .
H23B H 0.628713 0.207012 0.268590 0.025 Uiso 1 1 calc R U . . .
C24 C 0.5278(2) 0.23635(17) 0.35652(11) 0.0224(4) Uani 1 1 d . . . . .
H24A H 0.597642 0.238753 0.395034 0.027 Uiso 1 1 calc R U . . .
H24B H 0.451750 0.153266 0.338136 0.027 Uiso 1 1 calc R U . . .
C25 C 0.4747(2) 0.32847(18) 0.39354(11) 0.0218(4) Uani 1 1 d . . . . .
H25A H 0.440114 0.311409 0.438626 0.026 Uiso 1 1 calc R U . . .
H25B H 0.397755 0.319542 0.356679 0.026 Uiso 1 1 calc R U . . .
C26 C 0.5871(2) 0.45947(17) 0.41842(10) 0.0198(4) Uani 1 1 d . . . . .
H26A H 0.661057 0.470678 0.458331 0.024 Uiso 1 1 calc R U . . .
H26B H 0.549273 0.517272 0.440322 0.024 Uiso 1 1 calc R U . . .
C27 C 0.80061(18) 0.62544(15) 0.12076(9) 0.0155(3) Uani 1 1 d . . . . .
H27 H 0.856286 0.585021 0.134978 0.019 Uiso 1 1 calc R U . . .
C28 C 0.90507(19) 0.74562(17) 0.11547(10) 0.0190(4) Uani 1 1 d . . . . .
H28A H 0.959836 0.800738 0.167142 0.023 Uiso 1 1 calc R U . . .
H28B H 0.856692 0.786018 0.094872 0.023 Uiso 1 1 calc R U . . .
C29 C 1.0006(2) 0.72169(18) 0.06296(11) 0.0237(4) Uani 1 1 d . . . . .
H29A H 1.064390 0.799526 0.058220 0.028 Uiso 1 1 calc R U . . .
H29B H 1.055253 0.688529 0.086236 0.028 Uiso 1 1 calc R U . . .
C30 C 0.9192(2) 0.63158(18) -0.01662(11) 0.0230(4) Uani 1 1 d . . . . .
H30A H 0.874409 0.669154 -0.042810 0.028 Uiso 1 1 calc R U . . .
H30B H 0.982026 0.612252 -0.047439 0.028 Uiso 1 1 calc R U . . .
C31 C 0.8109(2) 0.51413(18) -0.01062(10) 0.0199(4) Uani 1 1 d . . . . .
H31A H 0.856277 0.473047 0.011644 0.024 Uiso 1 1 calc R U . . .
H31B H 0.757085 0.458325 -0.062338 0.024 Uiso 1 1 calc R U . . .
C32 C 0.71529(19) 0.54156(17) 0.03946(10) 0.0172(3) Uani 1 1 d . . . . .
H32A H 0.644528 0.464731 0.041784 0.021 Uiso 1 1 calc R U . . .
H32B H 0.669213 0.582312 0.017399 0.021 Uiso 1 1 calc R U . . .
C33 C 0.64078(18) 0.75401(15) 0.19212(10) 0.0155(3) Uani 1 1 d . . . . .
H33 H 0.574776 0.748288 0.226748 0.019 Uiso 1 1 calc R U . . .
C34 C 0.74509(19) 0.88863(16) 0.22167(10) 0.0185(3) Uani 1 1 d . . . . .
H34A H 0.807067 0.904625 0.185923 0.022 Uiso 1 1 calc R U . . .
H34B H 0.800749 0.907701 0.272172 0.022 Uiso 1 1 calc R U . . .
C35 C 0.6704(2) 0.96992(17) 0.22876(11) 0.0218(4) Uani 1 1 d . . . . .
H35A H 0.738241 1.056406 0.245900 0.026 Uiso 1 1 calc R U . . .
H35B H 0.614578 0.958678 0.267822 0.026 Uiso 1 1 calc R U . . .
C36 C 0.5776(2) 0.93921(18) 0.15216(12) 0.0248(4) Uani 1 1 d . . . . .
H36A H 0.524722 0.987690 0.159762 0.030 Uiso 1 1 calc R U . . .
H36B H 0.634686 0.961789 0.115200 0.030 Uiso 1 1 calc R U . . .
C37 C 0.4794(2) 0.80409(18) 0.11951(11) 0.0227(4) Uani 1 1 d . . . . .
H37A H 0.426869 0.786292 0.068349 0.027 Uiso 1 1 calc R U . . .
H37B H 0.413952 0.783872 0.153007 0.027 Uiso 1 1 calc R U . . .
C38 C 0.55587(18) 0.72485(16) 0.11292(10) 0.0174(3) Uani 1 1 d . . . . .
H38A H 0.616891 0.740636 0.076691 0.021 Uiso 1 1 calc R U . . .
H38B H 0.489768 0.637704 0.093014 0.021 Uiso 1 1 calc R U . . .
C39 C 0.3976(2) 0.51379(17) 0.18188(10) 0.0177(4) Uani 1 1 d . . . . .
C40 C 0.7291(2) 0.22602(19) 0.08989(13) 0.0294(4) Uani 1 1 d . . . . .
H40A H 0.694746 0.138690 0.062208 0.044 Uiso 1 1 calc R U . . .
H40B H 0.786405 0.247055 0.139609 0.044 Uiso 1 1 calc R U . . .
H40C H 0.783160 0.272622 0.060143 0.044 Uiso 1 1 calc R U . . .
C41 C 0.6109(2) 0.25617(17) 0.10168(10) 0.0200(4) Uani 1 1 d . . . . .
C42 C 0.4781(2) 0.16233(17) 0.07405(11) 0.0243(4) Uani 1 1 d . . . . .
H42 H 0.468368 0.083501 0.046334 0.029 Uiso 1 1 calc R U . . .
C43 C 0.3582(2) 0.17505(18) 0.08388(12) 0.0272(4) Uani 1 1 d . . . . .
C44 C 0.2221(3) 0.0643(2) 0.0506(2) 0.0495(7) Uani 1 1 d . . . . .
H44A H 0.161287 0.083433 0.020324 0.074 Uiso 1 1 calc R U . . .
H44B H 0.181098 0.041124 0.092088 0.074 Uiso 1 1 calc R U . . .
H44C H 0.235612 -0.003297 0.017743 0.074 Uiso 1 1 calc R U . . .
Cl1_1 Cl 0.16521(6) 0.37846(6) 0.30999(3) 0.03892(15) Uani 1 1 d . . . . .
Cl2_1 Cl -0.00447(8) 0.14586(7) 0.18922(5) 0.0610(2) Uani 1 1 d . . . . .
C1_1 C 0.1188(3) 0.2969(2) 0.21012(15) 0.0386(5) Uani 1 1 d . . . . .
H1A_1 H 0.082071 0.338649 0.183009 0.046 Uiso 1 1 calc R U . . .
H1AB_1 H 0.200964 0.296492 0.191454 0.046 Uiso 1 1 calc R 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 C39 1.792(2) . ?
Rh1 O2 2.0637(14) . ?
Rh1 O3 2.0963(14) . ?
Rh1 P2 2.2870(4) . ?
P1 C1 1.7317(17) . ?
P1 C21 1.8488(18) . ?
P1 C9 1.8541(17) . ?
P1 C15 1.8542(17) . ?
P2 C1 1.7929(17) . ?
P2 C27 1.8664(17) . ?
P2 C33 1.8769(18) . ?
O1 C39 1.161(3) . ?
O2 C41 1.274(2) . ?
O3 C43 1.268(3) . ?
C1 C2 1.513(2) . ?
C2 C3 1.413(3) . ?
C2 C7 1.419(3) . ?
C3 C4 1.401(3) . ?
C3 C8 1.510(3) . ?
C4 C5 1.389(3) . ?
C5 C6 1.398(3) . ?
C6 C7 1.381(3) . ?
C9 C14 1.541(2) . ?
C9 C10 1.547(2) . ?
C10 C11 1.538(2) . ?
C11 C12 1.523(3) . ?
C12 C13 1.531(3) . ?
C13 C14 1.531(3) . ?
C15 C16 1.533(2) . ?
C15 C20 1.536(2) . ?
C16 C17 1.532(2) . ?
C17 C18 1.526(3) . ?
C18 C19 1.525(3) . ?
C19 C20 1.536(2) . ?
C21 C22 1.537(2) . ?
C21 C26 1.539(2) . ?
C22 C23 1.532(2) . ?
C23 C24 1.528(3) . ?
C24 C25 1.530(3) . ?
C25 C26 1.534(3) . ?
C27 C28 1.535(2) . ?
C27 C32 1.548(2) . ?
C28 C29 1.546(3) . ?
C29 C30 1.532(3) . ?
C30 C31 1.532(3) . ?
C31 C32 1.533(2) . ?
C33 C34 1.536(2) . ?
C33 C38 1.544(2) . ?
C34 C35 1.536(2) . ?
C35 C36 1.538(3) . ?
C36 C37 1.525(3) . ?
C37 C38 1.530(2) . ?
C40 C41 1.501(3) . ?
C41 C42 1.401(3) . ?
C42 C43 1.402(3) . ?
C43 C44 1.512(3) . ?
Cl1_1 C1_1 1.779(3) . ?
Cl2_1 C1_1 1.759(2) . ?
 
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
C39 Rh1 O2 178.92(6) . . ?
C39 Rh1 O3 90.73(7) . . ?
O2 Rh1 O3 88.19(6) . . ?
C39 Rh1 P2 92.76(6) . . ?
O2 Rh1 P2 88.31(4) . . ?
O3 Rh1 P2 174.07(4) . . ?
C1 P1 C21 114.64(8) . . ?
C1 P1 C9 107.95(8) . . ?
C21 P1 C9 111.56(8) . . ?
C1 P1 C15 117.45(8) . . ?
C21 P1 C15 101.69(8) . . ?
C9 P1 C15 102.94(8) . . ?
C1 P2 C27 105.58(8) . . ?
C1 P2 C33 112.36(8) . . ?
C27 P2 C33 105.92(8) . . ?
C1 P2 Rh1 115.16(6) . . ?
C27 P2 Rh1 106.81(6) . . ?
C33 P2 Rh1 110.31(6) . . ?
C41 O2 Rh1 126.72(13) . . ?
C43 O3 Rh1 126.15(13) . . ?
C2 C1 P1 118.19(12) . . ?
C2 C1 P2 118.49(12) . . ?
P1 C1 P2 123.14(10) . . ?
C3 C2 C7 116.62(16) . . ?
C3 C2 C1 123.43(16) . . ?
C7 C2 C1 119.91(16) . . ?
C4 C3 C2 119.89(17) . . ?
C4 C3 C8 116.68(17) . . ?
C2 C3 C8 123.43(16) . . ?
C5 C4 C3 121.87(19) . . ?
C4 C5 C6 119.09(18) . . ?
C7 C6 C5 119.31(18) . . ?
C6 C7 C2 123.09(18) . . ?
C14 C9 C10 108.90(14) . . ?
C14 C9 P1 113.54(12) . . ?
C10 C9 P1 116.34(12) . . ?
C11 C10 C9 109.96(14) . . ?
C12 C11 C10 111.95(15) . . ?
C11 C12 C13 111.09(15) . . ?
C12 C13 C14 111.12(15) . . ?
C13 C14 C9 110.68(15) . . ?
C16 C15 C20 110.12(14) . . ?
C16 C15 P1 114.50(12) . . ?
C20 C15 P1 111.41(11) . . ?
C17 C16 C15 111.10(14) . . ?
C18 C17 C16 110.81(16) . . ?
C19 C18 C17 110.81(16) . . ?
C18 C19 C20 110.86(16) . . ?
C19 C20 C15 110.93(15) . . ?
C22 C21 C26 109.87(14) . . ?
C22 C21 P1 115.66(12) . . ?
C26 C21 P1 115.58(12) . . ?
C23 C22 C21 110.07(15) . . ?
C24 C23 C22 111.24(15) . . ?
C23 C24 C25 110.88(15) . . ?
C24 C25 C26 111.32(15) . . ?
C25 C26 C21 109.95(15) . . ?
C28 C27 C32 108.55(14) . . ?
C28 C27 P2 117.90(12) . . ?
C32 C27 P2 114.43(12) . . ?
C27 C28 C29 110.42(15) . . ?
C30 C29 C28 111.28(16) . . ?
C31 C30 C29 110.57(15) . . ?
C30 C31 C32 110.83(15) . . ?
C31 C32 C27 108.72(14) . . ?
C34 C33 C38 109.29(14) . . ?
C34 C33 P2 119.63(12) . . ?
C38 C33 P2 112.60(12) . . ?
C33 C34 C35 109.76(15) . . ?
C34 C35 C36 111.38(15) . . ?
C37 C36 C35 111.52(15) . . ?
C36 C37 C38 111.32(16) . . ?
C37 C38 C33 109.79(14) . . ?
O1 C39 Rh1 176.58(16) . . ?
O2 C41 C42 126.58(18) . . ?
O2 C41 C40 114.59(17) . . ?
C42 C41 C40 118.82(17) . . ?
C41 C42 C43 125.43(18) . . ?
O3 C43 C42 126.18(18) . . ?
O3 C43 C44 114.8(2) . . ?
C42 C43 C44 118.99(19) . . ?
Cl2_1 C1_1 Cl1_1 111.52(13) . . ?
 
_refine_diff_density_max    2.001
_refine_diff_density_min   -1.431
_refine_diff_density_rms    0.070



