# Electronic Supplementary Material (ESI) for Inorganic Chemistry Frontiers.
# This journal is © the Partner Organisations 2024

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

data_1
_database_code_depnum_ccdc_archive 'CCDC 2308646'
loop_
_audit_author_name
_audit_author_address
'Weibin Yu'
;Anhui University of Technology
China
;
_audit_update_record             
;
2023-11-17 deposited with the CCDC.	2024-03-25 downloaded from the CCDC.
;
_audit_creation_date             2022-02-21
_audit_creation_method           
;
Olex2 1.5
(compiled 2021.12.09 svn.r5202d8cf for OlexSys, GUI svn.r6439)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C44 H60 Cl4 N4 Rh4, 2(C H3 N O2)'
_chemical_formula_sum            'C46 H66 Cl4 N6 O4 Rh4'
_chemical_formula_weight         1320.48
_chemical_melting_point          ?
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'
Cl Cl 0.1484 0.1585 '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'
Rh Rh -1.1178 0.9187 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_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'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'x+1/2, -y+1/2, -z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'-x-1/2, y-1/2, z'
'x, -y-1/2, z-1/2'

_cell_length_a                   16.349(4)
_cell_length_b                   14.417(3)
_cell_length_c                   22.659(5)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     5341(2)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    4033
_cell_measurement_temperature    296.15
_cell_measurement_theta_max      22.90
_cell_measurement_theta_min      2.19
_shelx_estimated_absorpt_T_max   0.749
_shelx_estimated_absorpt_T_min   0.712
_exptl_absorpt_coefficient_mu    1.460
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.6718
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction.
wR2(int) was 0.0761 before and 0.0556 after correction.
The Ratio of minimum to maximum transmission is 0.9015.
The λ/2 correction factor is 0.00150.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'metallic dark red'
_exptl_crystal_colour_lustre     metallic
_exptl_crystal_colour_modifier   dark
_exptl_crystal_colour_primary    red
_exptl_crystal_density_diffrn    1.642
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             2656
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.23
_exptl_crystal_size_min          0.21
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0592
_diffrn_reflns_av_unetI/netI     0.0417
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            26771
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.023
_diffrn_reflns_theta_max         25.023
_diffrn_reflns_theta_min         2.087
_diffrn_ambient_temperature      296.15
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           30.0
_diffrn_source_power             1.5
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                3598
_reflns_number_total             4706
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT v8.34A (Bruker, 2013)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT v8.34A (Bruker, 2013)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2014/4 (Sheldrick, 2014)'
_refine_diff_density_max         0.510
_refine_diff_density_min         -0.417
_refine_diff_density_rms         0.093
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.032
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     300
_refine_ls_number_reflns         4706
_refine_ls_number_restraints     265
_refine_ls_R_factor_all          0.0532
_refine_ls_R_factor_gt           0.0346
_refine_ls_restrained_S_all      1.066
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0360P)²+4.7931P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0759
_refine_ls_wR_factor_ref         0.0855
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.5 times of:
  All C(H,H,H) groups
2. Rigid bond restraints
 All non-hydrogen atoms
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
3. Uiso/Uaniso restraints and constraints
All non-hydrogen atoms have similar U: within 2A with sigma of 0.01 and sigma
for terminal atoms of 0.02 within 2A
4.a Idealised Me refined as rotating group:
 C12(H12A,H12B,H12C), C23(H23A,H23B,H23C), C7(H7A,H7B,H7C), C15(H15A,H15B,
 H15C), C11(H11A,H11B,H11C), C17(H17A,H17B,H17C), C9(H9A,H9B,H9C), C19(H19A,
 H19B,H19C), C5(H5A,H5B,H5C), C21(H21A,H21B,H21C), C2(H2A,H2B,H2C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
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 0.20531(2) -0.01422(2) 0.56094(2) 0.03157(11) Uani 1 1 d . U . . .
Rh2 Rh 0.07418(2) 0.14951(2) 0.37840(2) 0.03193(11) Uani 1 1 d . U . . .
Cl1 Cl 0.03693(8) 0.29452(9) 0.42361(6) 0.0576(4) Uani 1 1 d . U . . .
Cl2 Cl 0.18210(9) 0.09714(10) 0.63959(6) 0.0578(4) Uani 1 1 d . U . . .
C1 C 0.1352(2) 0.1057(3) 0.45170(18) 0.0290(9) Uani 1 1 d . U . . .
N1 N -0.0857(2) 0.0576(3) 0.42619(17) 0.0432(10) Uani 1 1 d . U . . .
N3 N 0.1628(2) 0.0745(3) 0.49211(17) 0.0376(9) Uani 1 1 d . U . . .
C4 C -0.0256(3) 0.0902(3) 0.41274(19) 0.0326(10) Uani 1 1 d . U . . .
C6 C 0.1746(3) 0.1250(5) 0.3162(2) 0.0572(13) Uani 1 1 d . U . . .
C8 C 0.1117(3) 0.0587(4) 0.3087(2) 0.0447(11) Uani 1 1 d . U . . .
C10 C 0.2752(3) -0.1068(4) 0.5069(2) 0.0443(11) Uani 1 1 d . U . . .
C12 C 0.3756(3) 0.0309(4) 0.4867(3) 0.0671(16) Uani 1 1 d . U . . .
H12A H 0.339359 0.057005 0.457754 0.101 Uiso 1 1 calc R U . . .
H12B H 0.418117 -0.003236 0.467155 0.101 Uiso 1 1 calc R U . . .
H12C H 0.399431 0.079878 0.509679 0.101 Uiso 1 1 calc R U . . .
C14 C 0.2801(3) -0.1102(3) 0.6082(2) 0.0427(11) Uani 1 1 d . U . . .
C16 C 0.0407(3) 0.1054(4) 0.2892(2) 0.0430(11) Uani 1 1 d . U . . .
C18 C 0.1427(4) 0.2119(4) 0.3048(2) 0.0609(13) Uani 1 1 d . U . . .
C20 C 0.3316(3) -0.0359(3) 0.5885(2) 0.0437(11) Uani 1 1 d . U . . .
C22 C 0.3285(3) -0.0329(3) 0.5264(2) 0.0435(11) Uani 1 1 d . U . . .
C23 C 0.3813(3) 0.0253(4) 0.6282(3) 0.0689(17) Uani 1 1 d . U . . .
H23A H 0.412325 0.068217 0.604761 0.103 Uiso 1 1 calc R U . . .
H23B H 0.417976 -0.012123 0.651205 0.103 Uiso 1 1 calc R U . . .
H23C H 0.345549 0.058997 0.654064 0.103 Uiso 1 1 calc R U . . .
C3 C 0.2473(3) -0.1560(3) 0.5573(2) 0.0412(10) Uani 1 1 d . U . . .
C13 C 0.0579(4) 0.2010(4) 0.2882(2) 0.0538(12) Uani 1 1 d . U . . .
C7 C 0.2570(4) -0.1323(4) 0.4451(2) 0.0695(17) Uani 1 1 d . U . . .
H7A H 0.199709 -0.145315 0.441196 0.104 Uiso 1 1 calc R U . . .
H7B H 0.288040 -0.186309 0.434526 0.104 Uiso 1 1 calc R U . . .
H7C H 0.271541 -0.081802 0.419577 0.104 Uiso 1 1 calc R U . . .
C15 C 0.1207(5) -0.0452(4) 0.3115(3) 0.090(2) Uani 1 1 d . U . . .
H15A H 0.165484 -0.060803 0.337060 0.135 Uiso 1 1 calc R U . . .
H15B H 0.131064 -0.069033 0.272698 0.135 Uiso 1 1 calc R U . . .
H15C H 0.071190 -0.071983 0.326705 0.135 Uiso 1 1 calc R U . . .
C11 C 0.1949(3) -0.2404(4) 0.5563(3) 0.0666(17) Uani 1 1 d . U . . .
H11A H 0.162526 -0.242676 0.591661 0.100 Uiso 1 1 calc R U . . .
H11B H 0.228830 -0.294638 0.554179 0.100 Uiso 1 1 calc R U . . .
H11C H 0.159458 -0.238367 0.522566 0.100 Uiso 1 1 calc R U . . .
C17 C -0.0374(3) 0.0600(5) 0.2699(3) 0.083(2) Uani 1 1 d . U . . .
H17A H -0.046646 0.005233 0.293031 0.124 Uiso 1 1 calc R U . . .
H17B H -0.033414 0.043393 0.228953 0.124 Uiso 1 1 calc R U . . .
H17C H -0.082116 0.102327 0.275275 0.124 Uiso 1 1 calc R U . . .
C9 C 0.2688(4) -0.1414(4) 0.6703(2) 0.0727(18) Uani 1 1 d . U . . .
H9A H 0.265443 -0.088277 0.695704 0.109 Uiso 1 1 calc R U . . .
H9B H 0.314434 -0.179179 0.681849 0.109 Uiso 1 1 calc R U . . .
H9C H 0.219299 -0.176868 0.673324 0.109 Uiso 1 1 calc R U . . .
C19 C 0.2619(3) 0.1016(6) 0.3317(3) 0.109(3) Uani 1 1 d . U . . .
H19A H 0.288260 0.155344 0.347955 0.164 Uiso 1 1 calc R U . . .
H19B H 0.290469 0.082158 0.296810 0.164 Uiso 1 1 calc R U . . .
H19C H 0.262577 0.052371 0.360233 0.164 Uiso 1 1 calc R U . . .
C5 C 0.1874(6) 0.3028(6) 0.3035(3) 0.131(3) Uani 1 1 d . U . . .
H5A H 0.150619 0.351820 0.314262 0.196 Uiso 1 1 calc R U . . .
H5B H 0.208028 0.313746 0.264422 0.196 Uiso 1 1 calc R U . . .
H5C H 0.232151 0.300897 0.330882 0.196 Uiso 1 1 calc R U . . .
C21 C 0.0024(5) 0.2777(5) 0.2705(3) 0.117(3) Uani 1 1 d . U . . .
H21A H -0.052982 0.255651 0.269855 0.175 Uiso 1 1 calc R U . . .
H21B H 0.017310 0.299265 0.231850 0.175 Uiso 1 1 calc R U . . .
H21C H 0.007089 0.327742 0.298213 0.175 Uiso 1 1 calc R U . . .
O11 O 0.4103(4) 0.2460(5) 0.3846(3) 0.150(3) Uani 1 1 d . U . . .
O1 O 0.5166(5) 0.1757(5) 0.3779(4) 0.176(3) Uani 1 1 d . U . . .
C2 C 0.5156(5) 0.3040(6) 0.4347(3) 0.118(3) Uani 1 1 d . U . . .
H2A H 0.478850 0.355286 0.439900 0.177 Uiso 1 1 calc R U . . .
H2B H 0.565368 0.325481 0.416874 0.177 Uiso 1 1 calc R U . . .
H2C H 0.527632 0.276895 0.472459 0.177 Uiso 1 1 calc R U . . .
N2 N 0.4783(4) 0.2358(5) 0.3974(3) 0.0847(16) 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 Cl2 2.4284(14) . ?
Rh1 N1 2.074(4) 5_556 ?
Rh1 N3 2.134(4) . ?
Rh1 C10 2.142(5) . ?
Rh1 C14 2.134(4) . ?
Rh1 C20 2.180(4) . ?
Rh1 C22 2.177(5) . ?
Rh1 C3 2.158(5) . ?
Rh2 Cl1 2.4064(14) . ?
Rh2 C1 2.038(4) . ?
Rh2 C4 2.000(4) . ?
Rh2 C6 2.193(5) . ?
Rh2 C8 2.142(5) . ?
Rh2 C16 2.188(5) . ?
Rh2 C18 2.201(5) . ?
Rh2 C13 2.190(5) . ?
C1 N3 1.115(5) . ?
N1 C4 1.130(5) . ?
C6 C8 1.414(7) . ?
C6 C18 1.380(8) . ?
C6 C19 1.508(8) . ?
C8 C16 1.412(6) . ?
C8 C15 1.507(7) . ?
C10 C22 1.445(7) . ?
C10 C3 1.420(7) . ?
C10 C7 1.476(7) . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C12 C22 1.501(7) . ?
C14 C20 1.434(7) . ?
C14 C3 1.434(7) . ?
C14 C9 1.489(7) . ?
C16 C13 1.406(7) . ?
C16 C17 1.501(7) . ?
C18 C13 1.445(8) . ?
C18 C5 1.501(8) . ?
C20 C22 1.408(7) . ?
C20 C23 1.499(7) . ?
C23 H23A 0.9600 . ?
C23 H23B 0.9600 . ?
C23 H23C 0.9600 . ?
C3 C11 1.488(7) . ?
C13 C21 1.486(7) . ?
C7 H7A 0.9600 . ?
C7 H7B 0.9600 . ?
C7 H7C 0.9600 . ?
C15 H15A 0.9600 . ?
C15 H15B 0.9600 . ?
C15 H15C 0.9600 . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C9 H9A 0.9600 . ?
C9 H9B 0.9600 . ?
C9 H9C 0.9600 . ?
C19 H19A 0.9600 . ?
C19 H19B 0.9600 . ?
C19 H19C 0.9600 . ?
C5 H5A 0.9600 . ?
C5 H5B 0.9600 . ?
C5 H5C 0.9600 . ?
C21 H21A 0.9600 . ?
C21 H21B 0.9600 . ?
C21 H21C 0.9600 . ?
O11 N2 1.158(7) . ?
O1 N2 1.157(8) . ?
C2 H2A 0.9600 . ?
C2 H2B 0.9600 . ?
C2 H2C 0.9600 . ?
C2 N2 1.434(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
N1 Rh1 Cl2 87.08(11) 5_556 . ?
N1 Rh1 N3 88.65(14) 5_556 . ?
N1 Rh1 C10 113.29(18) 5_556 . ?
N1 Rh1 C14 105.91(18) 5_556 . ?
N1 Rh1 C20 144.08(17) 5_556 . ?
N1 Rh1 C22 152.29(18) 5_556 . ?
N1 Rh1 C3 91.12(17) 5_556 . ?
N3 Rh1 Cl2 95.12(11) . . ?
N3 Rh1 C10 97.42(16) . . ?
N3 Rh1 C14 160.38(16) . . ?
N3 Rh1 C20 127.15(17) . . ?
N3 Rh1 C22 96.49(16) . . ?
N3 Rh1 C3 130.03(16) . . ?
C10 Rh1 Cl2 156.22(13) . . ?
C10 Rh1 C20 64.50(18) . . ?
C10 Rh1 C22 39.10(18) . . ?
C10 Rh1 C3 38.55(18) . . ?
C14 Rh1 Cl2 98.64(14) . . ?
C14 Rh1 C10 65.00(18) . . ?
C14 Rh1 C20 38.81(18) . . ?
C14 Rh1 C22 64.53(18) . . ?
C14 Rh1 C3 39.02(18) . . ?
C20 Rh1 Cl2 91.86(14) . . ?
C22 Rh1 Cl2 119.35(14) . . ?
C22 Rh1 C20 37.72(18) . . ?
C3 Rh1 Cl2 134.78(14) . . ?
C3 Rh1 C20 64.80(18) . . ?
C3 Rh1 C22 64.82(18) . . ?
C1 Rh2 Cl1 92.65(13) . . ?
C1 Rh2 C6 96.18(18) . . ?
C1 Rh2 C8 105.76(18) . . ?
C1 Rh2 C16 141.74(18) . . ?
C1 Rh2 C18 119.7(2) . . ?
C1 Rh2 C13 157.66(19) . . ?
C4 Rh2 Cl1 89.96(13) . . ?
C4 Rh2 C1 87.12(16) . . ?
C4 Rh2 C6 142.4(2) . . ?
C4 Rh2 C8 105.04(19) . . ?
C4 Rh2 C16 91.78(18) . . ?
C4 Rh2 C18 152.23(19) . . ?
C4 Rh2 C13 114.1(2) . . ?
C6 Rh2 Cl1 127.09(17) . . ?
C6 Rh2 C18 36.6(2) . . ?
C8 Rh2 Cl1 156.57(14) . . ?
C8 Rh2 C6 38.07(19) . . ?
C8 Rh2 C16 38.06(17) . . ?
C8 Rh2 C18 62.9(2) . . ?
C8 Rh2 C13 63.48(19) . . ?
C16 Rh2 Cl1 125.60(14) . . ?
C16 Rh2 C6 63.04(18) . . ?
C16 Rh2 C18 63.01(18) . . ?
C16 Rh2 C13 37.46(19) . . ?
C18 Rh2 Cl1 95.54(16) . . ?
C13 Rh2 Cl1 94.13(14) . . ?
C13 Rh2 C6 63.0(2) . . ?
C13 Rh2 C18 38.4(2) . . ?
N3 C1 Rh2 172.8(4) . . ?
C4 N1 Rh1 169.2(4) . 5_556 ?
C1 N3 Rh1 166.8(4) . . ?
N1 C4 Rh2 172.5(4) . . ?
C8 C6 Rh2 69.0(3) . . ?
C8 C6 C19 124.4(6) . . ?
C18 C6 Rh2 72.0(3) . . ?
C18 C6 C8 108.4(5) . . ?
C18 C6 C19 127.1(6) . . ?
C19 C6 Rh2 126.5(4) . . ?
C6 C8 Rh2 72.9(3) . . ?
C6 C8 C15 126.6(5) . . ?
C16 C8 Rh2 72.7(3) . . ?
C16 C8 C6 108.2(5) . . ?
C16 C8 C15 124.6(5) . . ?
C15 C8 Rh2 127.1(4) . . ?
C22 C10 Rh1 71.8(3) . . ?
C22 C10 C7 126.5(5) . . ?
C3 C10 Rh1 71.4(3) . . ?
C3 C10 C22 108.4(4) . . ?
C3 C10 C7 124.9(5) . . ?
C7 C10 Rh1 126.1(3) . . ?
H12A C12 H12B 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C22 C12 H12A 109.5 . . ?
C22 C12 H12B 109.5 . . ?
C22 C12 H12C 109.5 . . ?
C20 C14 Rh1 72.3(3) . . ?
C20 C14 C9 126.3(5) . . ?
C3 C14 Rh1 71.4(3) . . ?
C3 C14 C20 108.3(4) . . ?
C3 C14 C9 125.1(5) . . ?
C9 C14 Rh1 126.8(4) . . ?
C8 C16 Rh2 69.2(3) . . ?
C8 C16 C17 125.6(5) . . ?
C13 C16 Rh2 71.3(3) . . ?
C13 C16 C8 107.9(4) . . ?
C13 C16 C17 126.4(5) . . ?
C17 C16 Rh2 127.6(4) . . ?
C6 C18 Rh2 71.4(3) . . ?
C6 C18 C13 108.2(5) . . ?
C6 C18 C5 127.7(7) . . ?
C13 C18 Rh2 70.3(3) . . ?
C13 C18 C5 123.8(7) . . ?
C5 C18 Rh2 128.3(4) . . ?
C14 C20 Rh1 68.9(2) . . ?
C14 C20 C23 124.9(5) . . ?
C22 C20 Rh1 71.0(3) . . ?
C22 C20 C14 108.2(4) . . ?
C22 C20 C23 127.0(5) . . ?
C23 C20 Rh1 127.0(4) . . ?
C10 C22 Rh1 69.1(3) . . ?
C10 C22 C12 125.3(5) . . ?
C12 C22 Rh1 127.9(3) . . ?
C20 C22 Rh1 71.2(3) . . ?
C20 C22 C10 107.8(4) . . ?
C20 C22 C12 126.8(5) . . ?
C20 C23 H23A 109.5 . . ?
C20 C23 H23B 109.5 . . ?
C20 C23 H23C 109.5 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C10 C3 Rh1 70.1(3) . . ?
C10 C3 C14 107.3(4) . . ?
C10 C3 C11 125.6(5) . . ?
C14 C3 Rh1 69.6(3) . . ?
C14 C3 C11 127.1(5) . . ?
C11 C3 Rh1 126.3(3) . . ?
C16 C13 Rh2 71.2(3) . . ?
C16 C13 C18 107.1(5) . . ?
C16 C13 C21 127.7(6) . . ?
C18 C13 Rh2 71.2(3) . . ?
C18 C13 C21 125.1(6) . . ?
C21 C13 Rh2 125.4(4) . . ?
C10 C7 H7A 109.5 . . ?
C10 C7 H7B 109.5 . . ?
C10 C7 H7C 109.5 . . ?
H7A C7 H7B 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C8 C15 H15A 109.5 . . ?
C8 C15 H15B 109.5 . . ?
C8 C15 H15C 109.5 . . ?
H15A C15 H15B 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C3 C11 H11A 109.5 . . ?
C3 C11 H11B 109.5 . . ?
C3 C11 H11C 109.5 . . ?
H11A C11 H11B 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17B 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C14 C9 H9A 109.5 . . ?
C14 C9 H9B 109.5 . . ?
C14 C9 H9C 109.5 . . ?
H9A C9 H9B 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C6 C19 H19A 109.5 . . ?
C6 C19 H19B 109.5 . . ?
C6 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C18 C5 H5A 109.5 . . ?
C18 C5 H5B 109.5 . . ?
C18 C5 H5C 109.5 . . ?
H5A C5 H5B 109.5 . . ?
H5A C5 H5C 109.5 . . ?
H5B C5 H5C 109.5 . . ?
C13 C21 H21A 109.5 . . ?
C13 C21 H21B 109.5 . . ?
C13 C21 H21C 109.5 . . ?
H21A C21 H21B 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
H2A C2 H2B 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
N2 C2 H2A 109.5 . . ?
N2 C2 H2B 109.5 . . ?
N2 C2 H2C 109.5 . . ?
O11 N2 C2 118.0(7) . . ?
O1 N2 O11 121.3(8) . . ?
O1 N2 C2 120.5(8) . . ?

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
Rh1 C10 C22 C12 -122.4(5) . . . . ?
Rh1 C10 C22 C20 61.1(3) . . . . ?
Rh1 C10 C3 C14 -59.9(3) . . . . ?
Rh1 C10 C3 C11 121.0(5) . . . . ?
Rh1 C14 C20 C22 -60.4(3) . . . . ?
Rh1 C14 C20 C23 121.1(5) . . . . ?
Rh1 C14 C3 C10 60.3(3) . . . . ?
Rh1 C14 C3 C11 -120.7(5) . . . . ?
Rh1 C20 C22 C10 -59.7(3) . . . . ?
Rh1 C20 C22 C12 123.8(5) . . . . ?
Rh2 C6 C8 C16 64.7(3) . . . . ?
Rh2 C6 C8 C15 -123.9(5) . . . . ?
Rh2 C6 C18 C13 -61.0(3) . . . . ?
Rh2 C6 C18 C5 124.5(6) . . . . ?
Rh2 C8 C16 C13 61.2(3) . . . . ?
Rh2 C8 C16 C17 -122.0(5) . . . . ?
Rh2 C16 C13 C18 62.6(3) . . . . ?
Rh2 C16 C13 C21 -120.7(6) . . . . ?
Rh2 C18 C13 C16 -62.5(3) . . . . ?
Rh2 C18 C13 C21 120.6(5) . . . . ?
C6 C8 C16 Rh2 -64.8(3) . . . . ?
C6 C8 C16 C13 -3.6(5) . . . . ?
C6 C8 C16 C17 173.2(5) . . . . ?
C6 C18 C13 Rh2 61.7(4) . . . . ?
C6 C18 C13 C16 -0.9(6) . . . . ?
C6 C18 C13 C21 -177.7(5) . . . . ?
C8 C6 C18 Rh2 59.7(3) . . . . ?
C8 C6 C18 C13 -1.4(6) . . . . ?
C8 C6 C18 C5 -175.9(5) . . . . ?
C8 C16 C13 Rh2 -59.8(3) . . . . ?
C8 C16 C13 C18 2.8(5) . . . . ?
C8 C16 C13 C21 179.5(5) . . . . ?
C14 C20 C22 Rh1 59.1(3) . . . . ?
C14 C20 C22 C10 -0.6(5) . . . . ?
C14 C20 C22 C12 -177.1(4) . . . . ?
C18 C6 C8 Rh2 -61.6(4) . . . . ?
C18 C6 C8 C16 3.1(6) . . . . ?
C18 C6 C8 C15 174.5(5) . . . . ?
C20 C14 C3 Rh1 -63.3(3) . . . . ?
C20 C14 C3 C10 -3.1(5) . . . . ?
C20 C14 C3 C11 176.0(4) . . . . ?
C22 C10 C3 Rh1 62.6(3) . . . . ?
C22 C10 C3 C14 2.7(5) . . . . ?
C22 C10 C3 C11 -176.4(4) . . . . ?
C23 C20 C22 Rh1 -122.5(5) . . . . ?
C23 C20 C22 C10 177.8(5) . . . . ?
C23 C20 C22 C12 1.3(8) . . . . ?
C3 C10 C22 Rh1 -62.3(3) . . . . ?
C3 C10 C22 C12 175.3(4) . . . . ?
C3 C10 C22 C20 -1.3(5) . . . . ?
C3 C14 C20 Rh1 62.7(3) . . . . ?
C3 C14 C20 C22 2.3(5) . . . . ?
C3 C14 C20 C23 -176.2(5) . . . . ?
C7 C10 C22 Rh1 121.9(5) . . . . ?
C7 C10 C22 C12 -0.4(8) . . . . ?
C7 C10 C22 C20 -177.0(5) . . . . ?
C7 C10 C3 Rh1 -121.6(5) . . . . ?
C7 C10 C3 C14 178.5(5) . . . . ?
C7 C10 C3 C11 -0.6(8) . . . . ?
C15 C8 C16 Rh2 123.6(5) . . . . ?
C15 C8 C16 C13 -175.2(5) . . . . ?
C15 C8 C16 C17 1.6(8) . . . . ?
C17 C16 C13 Rh2 123.4(5) . . . . ?
C17 C16 C13 C18 -174.0(5) . . . . ?
C17 C16 C13 C21 2.7(9) . . . . ?
C9 C14 C20 Rh1 -123.1(5) . . . . ?
C9 C14 C20 C22 176.5(5) . . . . ?
C9 C14 C20 C23 -2.0(8) . . . . ?
C9 C14 C3 Rh1 122.4(5) . . . . ?
C9 C14 C3 C10 -177.3(5) . . . . ?
C9 C14 C3 C11 1.7(8) . . . . ?
C19 C6 C8 Rh2 120.6(5) . . . . ?
C19 C6 C8 C16 -174.7(5) . . . . ?
C19 C6 C8 C15 -3.4(8) . . . . ?
C19 C6 C18 Rh2 -122.6(6) . . . . ?
C19 C6 C18 C13 176.4(5) . . . . ?
C19 C6 C18 C5 1.9(9) . . . . ?
C5 C18 C13 Rh2 -123.6(5) . . . . ?
C5 C18 C13 C16 173.9(5) . . . . ?
C5 C18 C13 C21 -3.0(8) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# 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_20231106564_4_0m_a_tw
_database_code_depnum_ccdc_archive 'CCDC 2308648'
loop_
_audit_author_name
_audit_author_address
'Weibin Yu'
;Anhui University of Technology
China
;
_audit_update_record             
;
2024-02-01 deposited with the CCDC.	2024-03-25 downloaded from the CCDC.
;
_audit_creation_date             2023-12-29
_audit_creation_method           
; 
Olex2 1.5 
(compiled 2023.08.24 svn.re1ec1418 for OlexSys, GUI svn.r6817) 
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C69 H90 N9 Rh6, 2(C F3 O3 S), 11[CH3OH]'
_chemical_formula_sum            'C82 H134 F6 N9 O17 Rh6 S2'
_chemical_formula_weight         2313.55
_chemical_melting_point          ?
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'
F F 0.0171 0.0103 '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'
Rh Rh -1.1178 0.9187 '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'

_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. 
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
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                   23.390(5)
_cell_length_b                   14.727(3)
_cell_length_c                   28.728(7)
_cell_angle_alpha                90
_cell_angle_beta                 96.413(3)
_cell_angle_gamma                90
_cell_volume                     9834(4)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9898
_cell_measurement_temperature    296.15
_cell_measurement_theta_max      24.70
_cell_measurement_theta_min      2.23
_shelx_estimated_absorpt_T_max   0.844
_shelx_estimated_absorpt_T_min   0.810
_exptl_absorpt_coefficient_mu    1.101
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            orange
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    1.563
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             4724
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.16
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  ?
_diffrn_reflns_av_unetI/netI     0.0900
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_limit_h_max       30
_diffrn_reflns_limit_h_min       -30
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_limit_l_min       -7
_diffrn_reflns_number            22626
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.583
_diffrn_reflns_theta_min         2.106
_diffrn_ambient_temperature      296.15
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                13561
_reflns_number_total             22626
_reflns_special_details          
; 
 Structure factors included contributions from the .fab file. 
  
 _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. Completness statistics refer to single and 
 composite reflections containing twin component 1 only. 
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick 2008)'
_refine_diff_density_max         3.592
_refine_diff_density_min         -2.929
_refine_diff_density_rms         0.299
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.037
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     875
_refine_ls_number_reflns         22626
_refine_ls_number_restraints     1053
_refine_ls_R_factor_all          0.1813
_refine_ls_R_factor_gt           0.1313
_refine_ls_restrained_S_all      1.037
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0100P)²+400.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2772
_refine_ls_wR_factor_ref         0.3047
_refine_special_details          
; 
 Refined as a 2-component twin. 
;
_olex2_refinement_description    
; 
1. Twinned data refinement 
 Scales: 0.712(3) 
 0.288(3) 
2. Fixed Uiso 
 At 1.5 times of: 
  All C(H,H,H) groups 
3. Restrained distances 
 C70-F5 = C70-F4 = C70-F6 
 1.33 with sigma of 0.02 
 C20-C15 = C16-C11 = C17-C12 = C18-C13 = C19-C14 
 1.53 with sigma of 0.01 
 C19-C13 
 2.65 with sigma of 0.02 
 C18-C12 
 2.65 with sigma of 0.02 
 C19-C15 
 2.65 with sigma of 0.02 
 C3-C25 
 1.53 with sigma of 0.01 
 C70-S2 
 1.82 with sigma of 0.02 
 C18-C14 
 2.65 with sigma of 0.02 
 S2-O5 = S2-O4 = S2-O6 
 1.44 with sigma of 0.02 
 C20-C14 
 2.65 with sigma of 0.02 
 C20-C11 
 2.65 with sigma of 0.02 
 C16-C15 
 2.65 with sigma of 0.02 
 C16-C12 
 2.65 with sigma of 0.02 
 C17-C11 
 2.65 with sigma of 0.02 
 C17-C13 
 2.65 with sigma of 0.02 
 C8-C33 = C37-C32 = C41-C36 = C40-C35 = C39-C34 
 1.53 with sigma of 0.01 
 C8-C32 
 2.65 with sigma of 0.01 
 C8-C34 
 2.65 with sigma of 0.01 
 C39-C33 
 2.65 with sigma of 0.01 
 C39-C35 
 2.65 with sigma of 0.01 
 C40-C34 
 2.65 with sigma of 0.01 
 C40-C36 
 2.65 with sigma of 0.01 
 C41-C35 
 2.65 with sigma of 0.01 
 C41-C32 
 2.65 with sigma of 0.01 
 C37-C36 
 2.65 with sigma of 0.01 
 C37-C33 
 2.65 with sigma of 0.01 
 C51-C46 = C47-C42 = C48-C43 = C49-C44 = C50-C45 
 1.53 with sigma of 0.01 
 C51-C45 
 2.65 with sigma of 0.01 
 C51-C42 
 2.65 with sigma of 0.01 
 C47-C46 
 2.65 with sigma of 0.01 
 C47-C43 
 2.65 with sigma of 0.01 
 C48-C42 
 2.65 with sigma of 0.01 
 C48-C44 
 2.65 with sigma of 0.01 
 C49-C43 
 2.65 with sigma of 0.01 
 C49-C45 
 2.65 with sigma of 0.01 
 C50-C44 
 2.65 with sigma of 0.01 
 C50-C46 
 2.65 with sigma of 0.01 
 C69-C1 = C7-C2 = C3-C25 = C38-C4 = C5-C10 
 1.53 with sigma of 0.01 
 C69-C5 
 2.65 with sigma of 0.01 
 C69-C2 
 2.65 with sigma of 0.01 
 C7-C1 
 2.65 with sigma of 0.01 
 C7-C3 
 2.65 with sigma of 0.01 
 C25-C2 
 2.65 with sigma of 0.01 
 C25-C4 
 2.65 with sigma of 0.01 
 C38-C3 
 2.65 with sigma of 0.01 
 C38-C5 
 2.65 with sigma of 0.01 
 C10-C4 
 2.65 with sigma of 0.01 
 C10-C1 
 2.65 with sigma of 0.01 
 C70-O5 
 2.58 with sigma of 0.04 
 C70-O4 
 2.56 with sigma of 0.04 
 C70-O6 
 2.57 with sigma of 0.04 
 C70-F5 \\sim C70-F4 \\sim C70-F6 
 with sigma of 0.02 
 F5-F4 \\sim F4-F6 \\sim F6-F5 
 with sigma of 0.04 
 S2-F5 \\sim S2-F4 \\sim S2-F6 
 with sigma of 0.04 
 S2-O5 \\sim S2-O4 \\sim S2-O6 
 with sigma of 0.02 
 O5-O4 \\sim O4-O6 \\sim O5-O6 
 with sigma of 0.04 
 C70-O5 \\sim C70-O4 \\sim C70-O6 
 with sigma of 0.04 
4. Rigid bond restraints 
 All non-hydrogen atoms 
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01 
5. Uiso/Uaniso restraints and constraints 
All non-hydrogen atoms have similar U: within 2A with sigma of 0.01 and sigma 
for terminal atoms of 0.02 within 2A 
S2 \\sim F4 \\sim F5 \\sim F6 \\sim O4 \\sim O5 \\sim O6 \\sim C70: within 2A 
with sigma of 0.04 and sigma for terminal atoms of 0.08 within 2A 
6. Rigid body (RIGU) restrains 
 S2, F4, F5, F6, O4, O5, O6, C70 
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004 
7.a Me refined with riding coordinates: 
 C18(H18A,H18B,H18C), C19(H19A,H19B,H19C), C25(H25A,H25B,H25C) 
7.b Fitted pentagon refined as free rotating group: 
 C3(C4,C5,C1,C2), C12(C11,C15,C14,C13), C23(C24,C26,C21,C22), C33(C34,C35,C36, 
 C32), C42(C43,C44,C45,C46), C53(C52,C56,C55,C54) 
7.c Idealised Me refined as rotating group: 
 C69(H69A,H69B,H69C), C7(H7A,H7B,H7C), C38(H38A,H38B,H38C), C10(H10A,H10B, 
 H10C), C16(H16A,H16B,H16C), C17(H17A,H17B,H17C), C20(H20A,H20B,H20C), C27(H27A, 
 H27B,H27C), C28(H28A,H28B,H28C), C29(H29A,H29B,H29C), C30(H30A,H30B,H30C), 
 C31(H31A,H31B,H31C), C37(H37A,H37B,H37C), C39(H39A,H39B,H39C), C40(H40A,H40B, 
 H40C), C41(H41A,H41B,H41C), C47(H47A,H47B,H47C), C48(H48A,H48B,H48C), C49(H49A, 
 H49B,H49C), C50(H50A,H50B,H50C), C51(H51A,H51B,H51C), C57(H57A,H57B,H57C), 
 C58(H58A,H58B,H58C), C59(H59A,H59B,H59C), C60(H60A,H60B,H60C), C61(H61A,H61B, 
 H61C), C8(H8A,H8B,H8C) 
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
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 0.15471(5) 0.55598(8) 0.61493(4) 0.0318(3) Uani 1 1 d . U . . .
Rh2 Rh 0.16034(5) 0.90833(8) 0.63612(4) 0.0326(3) Uani 1 1 d . U . . .
Rh3 Rh 0.24178(6) 0.94513(9) 0.47927(4) 0.0381(3) Uani 1 1 d . U . . .
Rh4 Rh 0.23777(6) 0.59255(9) 0.45786(4) 0.0381(3) Uani 1 1 d . U . . .
Rh5 Rh 0.37906(5) 0.90641(9) 0.63045(5) 0.0349(3) Uani 1 1 d . U . . .
Rh6 Rh 0.37322(5) 0.55420(8) 0.61036(4) 0.0335(3) Uani 1 1 d . U . . .
N1 N 0.1754(6) 0.9168(9) 0.5690(5) 0.042(3) Uani 1 1 d . U . . .
N2 N 0.3090(6) 0.9265(9) 0.5302(5) 0.043(3) Uani 1 1 d . U . . .
N3 N 0.2406(6) 0.8066(10) 0.4679(4) 0.041(3) Uani 1 1 d . U . . .
N4 N 0.1540(6) 0.6946(9) 0.6257(5) 0.041(3) Uani 1 1 d . U . . .
N5 N 0.1699(6) 0.5766(10) 0.5457(5) 0.043(3) Uani 1 1 d . U . . .
C6 C 0.2931(6) 0.5550(9) 0.6244(5) 0.033(2) Uani 1 1 d . U . . .
N7 N 0.3044(6) 0.5851(10) 0.5109(5) 0.042(2) Uani 1 1 d . U . . .
N8 N 0.3791(5) 0.6927(9) 0.6187(5) 0.037(2) Uani 1 1 d . U . . .
C9 C 0.2971(6) 0.8990(10) 0.6452(5) 0.032(2) Uani 1 1 d . U . . .
C3 C 0.1816(4) 0.5082(9) 0.4119(5) 0.077(3) Uani 1 1 d DG U . . .
C4 C 0.2336(5) 0.4606(7) 0.4254(5) 0.074(3) Uani 1 1 d DG U . . .
C5 C 0.2792(4) 0.5098(8) 0.4083(5) 0.073(3) Uani 1 1 d DG U . . .
C1 C 0.2554(5) 0.5876(8) 0.3843(4) 0.074(3) Uani 1 1 d DG U . . .
C2 C 0.1950(5) 0.5867(8) 0.3866(5) 0.076(3) Uani 1 1 d DG U . . .
C69 C 0.2894(8) 0.6603(13) 0.3603(7) 0.103(6) Uani 1 1 d D U . . .
H69A H 0.263098 0.699945 0.342071 0.155 Uiso 1 1 calc R U . . .
H69B H 0.313957 0.631213 0.340137 0.155 Uiso 1 1 calc R U . . .
H69C H 0.312463 0.695037 0.383657 0.155 Uiso 1 1 calc R U . . .
C7 C 0.1514(8) 0.6551(13) 0.3621(8) 0.108(7) Uani 1 1 d D U . . .
H7A H 0.138754 0.634141 0.330997 0.162 Uiso 1 1 calc R U . . .
H7B H 0.169457 0.713344 0.360475 0.162 Uiso 1 1 calc R U . . .
H7C H 0.118934 0.660161 0.379620 0.162 Uiso 1 1 calc R U . . .
C38 C 0.2394(9) 0.3704(10) 0.4527(8) 0.105(6) Uani 1 1 d D U . . .
H38A H 0.264525 0.378846 0.481174 0.157 Uiso 1 1 calc R U . . .
H38B H 0.255078 0.324834 0.433918 0.157 Uiso 1 1 calc R U . . .
H38C H 0.202191 0.351484 0.460095 0.157 Uiso 1 1 calc R U . . .
N009 N 0.2438(5) 0.9025(8) 0.6432(4) 0.031(2) Uani 1 1 d . U . . .
C10 C 0.3428(6) 0.4802(15) 0.4117(8) 0.104(7) Uani 1 1 d D U . . .
H10A H 0.367080 0.532953 0.414109 0.155 Uiso 1 1 calc R U . . .
H10B H 0.349282 0.446371 0.384198 0.155 Uiso 1 1 calc R U . . .
H10C H 0.351756 0.442772 0.438924 0.155 Uiso 1 1 calc R U . . .
C12 C 0.1855(6) 1.0532(10) 0.4470(5) 0.093(4) Uani 1 1 d DG U . . .
C11 C 0.2370(7) 1.0936(9) 0.4685(5) 0.096(4) Uani 1 1 d DG U . . .
C15 C 0.2837(6) 1.0568(10) 0.4471(5) 0.094(4) Uani 1 1 d DG U . . .
C14 C 0.2612(6) 0.9937(10) 0.4124(5) 0.090(4) Uani 1 1 d DG U . . .
C13 C 0.2005(6) 0.9915(10) 0.4124(5) 0.091(4) Uani 1 1 d DG U . . .
C16 C 0.2428(13) 1.1541(17) 0.5124(8) 0.137(8) Uani 1 1 d D U . . .
H16A H 0.205949 1.179124 0.516833 0.205 Uiso 1 1 calc R U . . .
H16B H 0.269391 1.202454 0.508460 0.205 Uiso 1 1 calc R U . . .
H16C H 0.256813 1.118431 0.539238 0.205 Uiso 1 1 calc R U . . .
C17 C 0.1246(7) 1.068(2) 0.4608(9) 0.133(7) Uani 1 1 d D U . . .
H17A H 0.121970 1.041504 0.491123 0.200 Uiso 1 1 calc R U . . .
H17B H 0.097175 1.038726 0.438140 0.200 Uiso 1 1 calc R U . . .
H17C H 0.116487 1.131396 0.461734 0.200 Uiso 1 1 calc R U . . .
C18 C 0.1571(10) 0.9377(17) 0.3793(8) 0.135(8) Uani 1 1 d D U . . .
H18A H 0.118950 0.948854 0.387178 0.202 Uiso 1 1 calc R U . . .
H18B H 0.159674 0.956574 0.347563 0.202 Uiso 1 1 calc R U . . .
H18C H 0.165608 0.874093 0.382263 0.202 Uiso 1 1 calc R U . . .
C19 C 0.2959(11) 0.9422(18) 0.3786(8) 0.128(7) Uani 1 1 d D U . . .
H19A H 0.270562 0.903856 0.358712 0.193 Uiso 1 1 calc R U . . .
H19B H 0.314131 0.984917 0.359779 0.193 Uiso 1 1 calc R U . . .
H19C H 0.324665 0.905739 0.396201 0.193 Uiso 1 1 calc R U . . .
C20 C 0.3470(7) 1.0844(19) 0.4582(9) 0.139(8) Uani 1 1 d D U . . .
H20A H 0.349275 1.147266 0.467032 0.209 Uiso 1 1 calc R U . . .
H20B H 0.366720 1.075284 0.430975 0.209 Uiso 1 1 calc R U . . .
H20C H 0.364717 1.047900 0.483501 0.209 Uiso 1 1 calc R U . . .
C23 C 0.0985(6) 1.0187(9) 0.6304(4) 0.052(3) Uani 1 1 d G U . . .
C24 C 0.1472(5) 1.0440(7) 0.6617(5) 0.052(3) Uani 1 1 d G U . . .
C26 C 0.1514(5) 0.9831(9) 0.7003(4) 0.052(3) Uani 1 1 d G U . . .
C21 C 0.1053(6) 0.9201(8) 0.6928(4) 0.052(3) Uani 1 1 d G U . . .
C22 C 0.0726(5) 0.9422(9) 0.6496(5) 0.054(3) Uani 1 1 d G U . . .
C27 C 0.0955(11) 0.8444(17) 0.7260(8) 0.081(5) Uani 1 1 d . U . . .
H27A H 0.093469 0.787708 0.709370 0.121 Uiso 1 1 calc R U . . .
H27B H 0.060012 0.854533 0.739061 0.121 Uiso 1 1 calc R U . . .
H27C H 0.126675 0.842537 0.750678 0.121 Uiso 1 1 calc R U . . .
C28 C 0.0184(7) 0.9029(12) 0.6280(6) 0.046(4) Uani 1 1 d . U . . .
H28A H 0.017687 0.904463 0.594487 0.068 Uiso 1 1 calc R U . . .
H28B H -0.013315 0.937427 0.637090 0.068 Uiso 1 1 calc R U . . .
H28C H 0.015420 0.841172 0.638119 0.068 Uiso 1 1 calc R U . . .
C29 C 0.0776(10) 1.0681(16) 0.5880(8) 0.079(5) Uani 1 1 d . U . . .
H29A H 0.109174 1.098105 0.575886 0.118 Uiso 1 1 calc R U . . .
H29B H 0.049739 1.112402 0.595212 0.118 Uiso 1 1 calc R U . . .
H29C H 0.059958 1.026376 0.565082 0.118 Uiso 1 1 calc R U . . .
C30 C 0.1877(10) 1.1221(12) 0.6581(9) 0.070(5) Uani 1 1 d . U . . .
H30A H 0.172234 1.175593 0.671082 0.106 Uiso 1 1 calc R U . . .
H30B H 0.192480 1.132595 0.625768 0.106 Uiso 1 1 calc R U . . .
H30C H 0.224339 1.108018 0.675084 0.106 Uiso 1 1 calc R U . . .
C31 C 0.1944(10) 0.9844(17) 0.7445(8) 0.079(5) Uani 1 1 d . U . . .
H31A H 0.194017 0.926701 0.760005 0.118 Uiso 1 1 calc R U . . .
H31B H 0.183900 1.031265 0.765211 0.118 Uiso 1 1 calc R U . . .
H31C H 0.232305 0.996212 0.736131 0.118 Uiso 1 1 calc R U . . .
C33 C 0.0772(4) 0.4751(7) 0.5990(3) 0.048(3) Uani 1 1 d DG U . . .
C34 C 0.0710(4) 0.5293(7) 0.6391(3) 0.050(3) Uani 1 1 d DG U . . .
C35 C 0.1148(4) 0.5038(7) 0.6749(3) 0.050(3) Uani 1 1 d DG U . . .
C36 C 0.1480(4) 0.4339(7) 0.6571(3) 0.049(3) Uani 1 1 d DG U . . .
C32 C 0.1247(4) 0.4161(7) 0.6102(3) 0.050(3) Uani 1 1 d DG U . . .
C37 C 0.1457(8) 0.3439(12) 0.5770(5) 0.074(5) Uani 1 1 d D U . . .
H37A H 0.141165 0.366564 0.545517 0.111 Uiso 1 1 calc R U . . .
H37B H 0.123332 0.289475 0.578650 0.111 Uiso 1 1 calc R U . . .
H37C H 0.185492 0.330596 0.586311 0.111 Uiso 1 1 calc R U . . .
C39 C 0.0218(7) 0.5966(13) 0.6441(6) 0.076(5) Uani 1 1 d D U . . .
H39A H 0.030147 0.630626 0.672601 0.114 Uiso 1 1 calc R U . . .
H39B H -0.013537 0.563795 0.645072 0.114 Uiso 1 1 calc R U . . .
H39C H 0.018001 0.637466 0.617933 0.114 Uiso 1 1 calc R U . . .
C40 C 0.1226(8) 0.5424(13) 0.7252(4) 0.072(5) Uani 1 1 d D U . . .
H40A H 0.159150 0.523519 0.740748 0.107 Uiso 1 1 calc R U . . .
H40B H 0.092387 0.520234 0.742231 0.107 Uiso 1 1 calc R U . . .
H40C H 0.121130 0.607544 0.724019 0.107 Uiso 1 1 calc R U . . .
C41 C 0.1981(7) 0.3825(11) 0.6851(5) 0.073(5) Uani 1 1 d D U . . .
H41A H 0.229887 0.378560 0.666763 0.109 Uiso 1 1 calc R U . . .
H41B H 0.185682 0.322433 0.692252 0.109 Uiso 1 1 calc R U . . .
H41C H 0.209839 0.414466 0.713683 0.109 Uiso 1 1 calc R U . . .
C42 C 0.3978(5) 0.4139(8) 0.6062(3) 0.061(3) Uani 1 1 d DG U . . .
C43 C 0.3944(5) 0.4359(8) 0.6539(3) 0.058(3) Uani 1 1 d DG U . . .
C44 C 0.4354(5) 0.5051(8) 0.6669(3) 0.059(3) Uani 1 1 d DG U . . .
C45 C 0.4641(5) 0.5258(8) 0.6272(4) 0.059(3) Uani 1 1 d DG U . . .
C46 C 0.4409(5) 0.4694(8) 0.5897(3) 0.061(3) Uani 1 1 d DG U . . .
C47 C 0.3639(8) 0.3386(11) 0.5780(6) 0.088(6) Uani 1 1 d D U . . .
H47A H 0.353020 0.359250 0.546534 0.131 Uiso 1 1 calc R U . . .
H47B H 0.329911 0.324240 0.592454 0.131 Uiso 1 1 calc R U . . .
H47C H 0.387474 0.285412 0.577379 0.131 Uiso 1 1 calc R U . . .
C48 C 0.3555(8) 0.3895(13) 0.6867(6) 0.086(6) Uani 1 1 d D U . . .
H48A H 0.358250 0.421289 0.716028 0.129 Uiso 1 1 calc R U . . .
H48B H 0.367571 0.327718 0.691974 0.129 Uiso 1 1 calc R U . . .
H48C H 0.316327 0.390581 0.672473 0.129 Uiso 1 1 calc R U . . .
C49 C 0.4483(9) 0.5470(14) 0.7162(4) 0.091(6) Uani 1 1 d D U . . .
H49A H 0.477663 0.592401 0.715785 0.137 Uiso 1 1 calc R U . . .
H49B H 0.461194 0.500346 0.738231 0.137 Uiso 1 1 calc R U . . .
H49C H 0.413925 0.574363 0.725248 0.137 Uiso 1 1 calc R U . . .
C50 C 0.5161(6) 0.5895(13) 0.6258(6) 0.087(6) Uani 1 1 d D U . . .
H50A H 0.522073 0.601244 0.593842 0.130 Uiso 1 1 calc R U . . .
H50B H 0.549821 0.561360 0.641706 0.130 Uiso 1 1 calc R U . . .
H50C H 0.508847 0.645699 0.641054 0.130 Uiso 1 1 calc R U . . .
C51 C 0.4660(9) 0.4578(17) 0.5425(5) 0.096(6) Uani 1 1 d D U . . .
H51A H 0.435405 0.460517 0.517259 0.144 Uiso 1 1 calc R U . . .
H51B H 0.485024 0.400146 0.541977 0.144 Uiso 1 1 calc R U . . .
H51C H 0.493058 0.505573 0.538884 0.144 Uiso 1 1 calc R U . . .
C53 C 0.4118(6) 0.9774(10) 0.6939(4) 0.057(3) Uani 1 1 d G U . . .
C52 C 0.4538(6) 0.9151(8) 0.6813(5) 0.061(3) Uani 1 1 d G U . . .
C56 C 0.4694(5) 0.9411(9) 0.6369(5) 0.061(3) Uani 1 1 d G U . . .
C55 C 0.4370(6) 1.0195(9) 0.6220(4) 0.059(3) Uani 1 1 d G U . . .
C54 C 0.4014(5) 1.0419(8) 0.6572(5) 0.057(3) Uani 1 1 d G U . . .
C57 C 0.4800(10) 0.8400(16) 0.7071(9) 0.081(6) Uani 1 1 d . U . . .
H57A H 0.458881 0.826540 0.733063 0.122 Uiso 1 1 calc R U . . .
H57B H 0.518970 0.855158 0.718554 0.122 Uiso 1 1 calc R U . . .
H57C H 0.479773 0.787889 0.687010 0.122 Uiso 1 1 calc R U . . .
C58 C 0.3910(10) 0.9770(18) 0.7396(7) 0.079(5) Uani 1 1 d . U . . .
H58A H 0.354665 0.945955 0.737668 0.119 Uiso 1 1 calc R U . . .
H58B H 0.386179 1.038329 0.749768 0.119 Uiso 1 1 calc R U . . .
H58C H 0.418244 0.946331 0.761659 0.119 Uiso 1 1 calc R U . . .
C59 C 0.3660(10) 1.1178(13) 0.6573(9) 0.079(5) Uani 1 1 d . U . . .
H59A H 0.329684 1.105015 0.639465 0.119 Uiso 1 1 calc R U . . .
H59B H 0.383952 1.168195 0.643438 0.119 Uiso 1 1 calc R U . . .
H59C H 0.359975 1.132581 0.688883 0.119 Uiso 1 1 calc R U . . .
C60 C 0.4387(11) 1.0749(17) 0.5783(9) 0.085(6) Uani 1 1 d . U . . .
H60A H 0.461292 1.043885 0.557364 0.128 Uiso 1 1 calc R U . . .
H60B H 0.455609 1.133004 0.586334 0.128 Uiso 1 1 calc R U . . .
H60C H 0.400270 1.083248 0.563344 0.128 Uiso 1 1 calc R U . . .
C61 C 0.5138(8) 0.8999(16) 0.6177(10) 0.080(5) Uani 1 1 d . U . . .
H61A H 0.527428 0.849125 0.636761 0.120 Uiso 1 1 calc R U . . .
H61B H 0.544551 0.942573 0.616158 0.120 Uiso 1 1 calc R U . . .
H61C H 0.500544 0.879039 0.586676 0.120 Uiso 1 1 calc R U . . .
C62 C 0.3797(6) 0.7687(10) 0.6235(5) 0.031(3) Uani 1 1 d . U . . .
C63 C 0.3346(7) 0.5747(10) 0.5443(6) 0.038(3) Uani 1 1 d . U . . .
C64 C 0.2386(7) 0.7315(11) 0.4646(5) 0.038(3) Uani 1 1 d . U . . .
C65 C 0.1562(7) 0.7705(10) 0.6302(6) 0.034(3) Uani 1 1 d . U . . .
C66 C 0.3389(6) 0.9195(10) 0.5629(5) 0.034(3) Uani 1 1 d . U . . .
C67 C 0.1884(7) 0.5840(11) 0.5106(6) 0.041(3) Uani 1 1 d . U . . .
C68 C 0.1902(7) 0.9262(10) 0.5324(5) 0.036(3) Uani 1 1 d . U . . .
N69 N 0.2417(5) 0.5578(8) 0.6240(5) 0.031(2) Uani 1 1 d . U . . .
S1 S -0.0174(3) 0.7189(4) 0.3344(3) 0.0749(16) Uani 1 1 d . U . . .
F1 F 0.0018(8) 0.8212(13) 0.2646(6) 0.126(5) Uani 1 1 d . U . . .
F2 F 0.0097(8) 0.8896(11) 0.3279(7) 0.121(5) Uani 1 1 d . U . . .
F3 F 0.0736(6) 0.8006(11) 0.3085(6) 0.102(4) Uani 1 1 d . U . . .
O1 O -0.0763(7) 0.7500(13) 0.3275(7) 0.098(5) Uani 1 1 d . U . . .
O2 O -0.0030(9) 0.6447(12) 0.3072(8) 0.107(5) Uani 1 1 d . U . . .
O3 O 0.0018(10) 0.7232(16) 0.3806(7) 0.120(5) Uani 1 1 d . U . . .
C71 C 0.0193(12) 0.8117(19) 0.3119(11) 0.085(3) Uani 1 1 d . U . . .
S2 S 0.4729(3) 0.7869(5) 0.8518(3) 0.091(2) Uani 1 1 d D U . . .
F4 F 0.3773(8) 0.6956(15) 0.8512(8) 0.175(6) Uani 1 1 d D U . . .
F5 F 0.4052(9) 0.7042(14) 0.7866(6) 0.163(6) Uani 1 1 d D U . . .
F6 F 0.4467(9) 0.6169(10) 0.8371(8) 0.161(6) Uani 1 1 d D U . . .
O4 O 0.4433(9) 0.8678(9) 0.8389(8) 0.131(6) Uani 1 1 d D U . . .
O5 O 0.5212(7) 0.7719(16) 0.8256(7) 0.140(6) Uani 1 1 d D U . . .
O6 O 0.4893(10) 0.7694(14) 0.8997(5) 0.133(6) Uani 1 1 d D U . . .
C70 C 0.4250(7) 0.6978(11) 0.8311(6) 0.118(4) Uani 1 1 d D U . . .
C25 C 0.1208(6) 0.4749(16) 0.4193(9) 0.117(7) Uani 1 1 d D U . . .
H25A H 0.092948 0.519191 0.407165 0.176 Uiso 1 1 calc R U . . .
H25B H 0.113242 0.418327 0.403121 0.176 Uiso 1 1 calc R U . . .
H25C H 0.118407 0.466304 0.452124 0.176 Uiso 1 1 calc R U . . .
C8 C 0.0355(8) 0.4731(15) 0.5535(5) 0.084(6) Uani 1 1 d D U . . .
H8A H 0.057107 0.471654 0.527008 0.126 Uiso 1 1 calc R U . . .
H8B H 0.011742 0.526486 0.551873 0.126 Uiso 1 1 calc R U . . .
H8C H 0.011595 0.420071 0.553243 0.126 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 N4 2.065(14) . ?
Rh1 N5 2.081(13) . ?
Rh1 C33 2.176(11) . ?
Rh1 C34 2.184(11) . ?
Rh1 C35 2.189(11) . ?
Rh1 C36 2.184(11) . ?
Rh1 C32 2.176(11) . ?
Rh1 N69 2.022(11) . ?
Rh2 N1 2.001(14) . ?
Rh2 N009 1.941(12) . ?
Rh2 C23 2.170(12) . ?
Rh2 C24 2.163(12) . ?
Rh2 C26 2.177(12) . ?
Rh2 C21 2.193(11) . ?
Rh2 C22 2.188(12) . ?
Rh2 C65 2.038(15) . ?
Rh3 N2 2.043(14) . ?
Rh3 N3 2.066(14) . ?
Rh3 C12 2.202(14) . ?
Rh3 C11 2.209(14) . ?
Rh3 C15 2.174(14) . ?
Rh3 C14 2.145(13) . ?
Rh3 C13 2.163(14) . ?
Rh3 C68 2.069(16) . ?
Rh4 N7 2.057(15) . ?
Rh4 C3 2.151(13) . ?
Rh4 C4 2.153(13) . ?
Rh4 C5 2.182(13) . ?
Rh4 C1 2.197(12) . ?
Rh4 C2 2.179(13) . ?
Rh4 C64 2.056(17) . ?
Rh4 C67 2.008(16) . ?
Rh5 C9 2.013(14) . ?
Rh5 C53 2.166(12) . ?
Rh5 C52 2.153(12) . ?
Rh5 C56 2.161(12) . ?
Rh5 C55 2.178(12) . ?
Rh5 C54 2.181(12) . ?
Rh5 C62 2.038(15) . ?
Rh5 C66 2.070(16) . ?
Rh6 C6 1.960(15) . ?
Rh6 N8 2.056(13) . ?
Rh6 C42 2.151(12) . ?
Rh6 C43 2.169(12) . ?
Rh6 C44 2.179(12) . ?
Rh6 C45 2.168(12) . ?
Rh6 C46 2.151(12) . ?
Rh6 C63 2.030(16) . ?
N1 C68 1.151(19) . ?
N2 C66 1.110(19) . ?
N3 C64 1.11(2) . ?
N4 C65 1.126(19) . ?
N5 C67 1.15(2) . ?
C6 N69 1.203(17) . ?
N7 C63 1.14(2) . ?
N8 C62 1.128(18) . ?
C9 N009 1.242(18) . ?
C3 C4 1.4200 . ?
C3 C2 1.4200 . ?
C3 C25 1.541(5) . ?
C4 C5 1.4200 . ?
C4 C38 1.542(6) . ?
C5 C1 1.4200 . ?
C5 C10 1.543(6) . ?
C1 C2 1.4200 . ?
C1 C69 1.543(6) . ?
C2 C7 1.545(6) . ?
C69 H69A 0.9600 . ?
C69 H69B 0.9600 . ?
C69 H69C 0.9600 . ?
C7 H7A 0.9600 . ?
C7 H7B 0.9600 . ?
C7 H7C 0.9600 . ?
C38 H38A 0.9600 . ?
C38 H38B 0.9600 . ?
C38 H38C 0.9600 . ?
C10 H10A 0.9600 . ?
C10 H10B 0.9600 . ?
C10 H10C 0.9600 . ?
C12 C11 1.4200 . ?
C12 C13 1.4200 . ?
C12 C17 1.536(8) . ?
C11 C15 1.4200 . ?
C11 C16 1.537(8) . ?
C15 C14 1.4200 . ?
C15 C20 1.534(8) . ?
C14 C13 1.4200 . ?
C14 C19 1.534(8) . ?
C13 C18 1.531(8) . ?
C16 H16A 0.9600 . ?
C16 H16B 0.9600 . ?
C16 H16C 0.9600 . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C18 H18A 0.9600 . ?
C18 H18B 0.9600 . ?
C18 H18C 0.9600 . ?
C19 H19A 0.9600 . ?
C19 H19B 0.9600 . ?
C19 H19C 0.9600 . ?
C20 H20A 0.9600 . ?
C20 H20B 0.9600 . ?
C20 H20C 0.9600 . ?
C23 C24 1.4200 . ?
C23 C22 1.4200 . ?
C23 C29 1.46(2) . ?
C24 C26 1.4200 . ?
C24 C30 1.50(2) . ?
C26 C21 1.4200 . ?
C26 C31 1.53(2) . ?
C21 C22 1.4200 . ?
C21 C27 1.50(2) . ?
C22 C28 1.467(19) . ?
C27 H27A 0.9600 . ?
C27 H27B 0.9600 . ?
C27 H27C 0.9600 . ?
C28 H28A 0.9600 . ?
C28 H28B 0.9600 . ?
C28 H28C 0.9600 . ?
C29 H29A 0.9600 . ?
C29 H29B 0.9600 . ?
C29 H29C 0.9600 . ?
C30 H30A 0.9600 . ?
C30 H30B 0.9600 . ?
C30 H30C 0.9600 . ?
C31 H31A 0.9600 . ?
C31 H31B 0.9600 . ?
C31 H31C 0.9600 . ?
C33 C34 1.4200 . ?
C33 C32 1.4200 . ?
C33 C8 1.543(6) . ?
C34 C35 1.4200 . ?
C34 C39 1.539(6) . ?
C35 C36 1.4200 . ?
C35 C40 1.545(6) . ?
C36 C32 1.4200 . ?
C36 C41 1.543(6) . ?
C32 C37 1.544(6) . ?
C37 H37A 0.9600 . ?
C37 H37B 0.9600 . ?
C37 H37C 0.9600 . ?
C39 H39A 0.9600 . ?
C39 H39B 0.9600 . ?
C39 H39C 0.9600 . ?
C40 H40A 0.9600 . ?
C40 H40B 0.9600 . ?
C40 H40C 0.9600 . ?
C41 H41A 0.9600 . ?
C41 H41B 0.9600 . ?
C41 H41C 0.9600 . ?
C42 C43 1.4200 . ?
C42 C46 1.4200 . ?
C42 C47 1.540(6) . ?
C43 C44 1.4200 . ?
C43 C48 1.541(6) . ?
C44 C45 1.4200 . ?
C44 C49 1.544(6) . ?
C45 C46 1.4200 . ?
C45 C50 1.540(6) . ?
C46 C51 1.545(6) . ?
C47 H47A 0.9600 . ?
C47 H47B 0.9600 . ?
C47 H47C 0.9600 . ?
C48 H48A 0.9600 . ?
C48 H48B 0.9600 . ?
C48 H48C 0.9600 . ?
C49 H49A 0.9600 . ?
C49 H49B 0.9600 . ?
C49 H49C 0.9600 . ?
C50 H50A 0.9600 . ?
C50 H50B 0.9600 . ?
C50 H50C 0.9600 . ?
C51 H51A 0.9600 . ?
C51 H51B 0.9600 . ?
C51 H51C 0.9600 . ?
C53 C52 1.4200 . ?
C53 C54 1.4200 . ?
C53 C58 1.45(2) . ?
C52 C56 1.4200 . ?
C52 C57 1.43(2) . ?
C56 C55 1.4200 . ?
C56 C61 1.37(2) . ?
C55 C54 1.4200 . ?
C55 C60 1.50(2) . ?
C54 C59 1.39(2) . ?
C57 H57A 0.9600 . ?
C57 H57B 0.9600 . ?
C57 H57C 0.9600 . ?
C58 H58A 0.9600 . ?
C58 H58B 0.9600 . ?
C58 H58C 0.9600 . ?
C59 H59A 0.9600 . ?
C59 H59B 0.9600 . ?
C59 H59C 0.9600 . ?
C60 H60A 0.9600 . ?
C60 H60B 0.9600 . ?
C60 H60C 0.9600 . ?
C61 H61A 0.9600 . ?
C61 H61B 0.9600 . ?
C61 H61C 0.9600 . ?
S1 O1 1.443(18) . ?
S1 O2 1.406(19) . ?
S1 O3 1.36(2) . ?
S1 C71 1.77(3) . ?
F1 C71 1.38(3) . ?
F2 C71 1.26(3) . ?
F3 C71 1.30(3) . ?
S2 O4 1.406(12) . ?
S2 O5 1.443(12) . ?
S2 O6 1.411(12) . ?
S2 C70 1.784(15) . ?
F4 C70 1.312(13) . ?
F5 C70 1.314(13) . ?
F6 C70 1.299(12) . ?
C25 H25A 0.9600 . ?
C25 H25B 0.9600 . ?
C25 H25C 0.9600 . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?

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
N4 Rh1 N5 90.2(6) . . ?
N4 Rh1 C33 123.5(5) . . ?
N4 Rh1 C34 96.2(4) . . ?
N4 Rh1 C35 102.6(5) . . ?
N4 Rh1 C36 136.8(5) . . ?
N4 Rh1 C32 159.7(4) . . ?
N5 Rh1 C33 96.1(5) . . ?
N5 Rh1 C34 125.7(5) . . ?
N5 Rh1 C35 159.5(5) . . ?
N5 Rh1 C36 132.9(5) . . ?
N5 Rh1 C32 99.6(5) . . ?
C33 Rh1 C34 38.02(17) . . ?
C33 Rh1 C35 63.5(2) . . ?
C33 Rh1 C36 63.6(2) . . ?
C34 Rh1 C35 37.89(17) . . ?
C36 Rh1 C34 63.5(2) . . ?
C36 Rh1 C35 37.89(17) . . ?
C32 Rh1 C33 38.09(17) . . ?
C32 Rh1 C34 63.6(2) . . ?
C32 Rh1 C35 63.5(2) . . ?
C32 Rh1 C36 38.02(17) . . ?
N69 Rh1 N4 89.6(5) . . ?
N69 Rh1 N5 81.1(5) . . ?
N69 Rh1 C33 146.9(4) . . ?
N69 Rh1 C34 152.4(4) . . ?
N69 Rh1 C35 114.5(4) . . ?
N69 Rh1 C36 94.2(4) . . ?
N69 Rh1 C32 109.5(4) . . ?
N1 Rh2 C23 93.9(5) . . ?
N1 Rh2 C24 108.5(5) . . ?
N1 Rh2 C26 145.9(5) . . ?
N1 Rh2 C21 153.0(5) . . ?
N1 Rh2 C22 115.2(5) . . ?
N1 Rh2 C65 89.6(6) . . ?
N009 Rh2 N1 79.7(5) . . ?
N009 Rh2 C23 134.0(5) . . ?
N009 Rh2 C24 100.6(5) . . ?
N009 Rh2 C26 97.1(5) . . ?
N009 Rh2 C21 126.3(5) . . ?
N009 Rh2 C22 160.6(5) . . ?
N009 Rh2 C65 90.1(6) . . ?
C23 Rh2 C26 63.8(2) . . ?
C23 Rh2 C21 63.6(2) . . ?
C23 Rh2 C22 38.03(19) . . ?
C24 Rh2 C23 38.27(19) . . ?
C24 Rh2 C26 38.20(18) . . ?
C24 Rh2 C21 63.7(2) . . ?
C24 Rh2 C22 63.8(2) . . ?
C26 Rh2 C21 37.93(18) . . ?
C26 Rh2 C22 63.5(2) . . ?
C22 Rh2 C21 37.83(18) . . ?
C65 Rh2 C23 135.6(6) . . ?
C65 Rh2 C24 160.2(5) . . ?
C65 Rh2 C26 124.5(6) . . ?
C65 Rh2 C21 96.6(5) . . ?
C65 Rh2 C22 101.8(5) . . ?
N2 Rh3 N3 88.6(5) . . ?
N2 Rh3 C12 140.7(6) . . ?
N2 Rh3 C11 104.9(6) . . ?
N2 Rh3 C15 93.4(5) . . ?
N2 Rh3 C14 117.6(6) . . ?
N2 Rh3 C13 155.6(6) . . ?
N2 Rh3 C68 85.3(6) . . ?
N3 Rh3 C12 130.6(6) . . ?
N3 Rh3 C11 162.9(5) . . ?
N3 Rh3 C15 132.7(6) . . ?
N3 Rh3 C14 100.9(5) . . ?
N3 Rh3 C13 100.1(5) . . ?
N3 Rh3 C68 89.1(6) . . ?
C12 Rh3 C11 37.6(2) . . ?
C15 Rh3 C12 63.3(3) . . ?
C15 Rh3 C11 37.8(2) . . ?
C14 Rh3 C12 63.8(3) . . ?
C14 Rh3 C11 63.7(3) . . ?
C14 Rh3 C15 38.4(2) . . ?
C14 Rh3 C13 38.5(2) . . ?
C13 Rh3 C12 38.0(2) . . ?
C13 Rh3 C11 63.4(3) . . ?
C13 Rh3 C15 64.0(2) . . ?
C68 Rh3 C12 92.1(5) . . ?
C68 Rh3 C11 102.3(6) . . ?
C68 Rh3 C15 138.1(6) . . ?
C68 Rh3 C14 154.9(6) . . ?
C68 Rh3 C13 117.3(6) . . ?
N7 Rh4 C3 141.6(5) . . ?
N7 Rh4 C4 105.5(5) . . ?
N7 Rh4 C5 95.7(5) . . ?
N7 Rh4 C1 120.2(5) . . ?
N7 Rh4 C2 157.6(5) . . ?
C3 Rh4 C4 38.5(2) . . ?
C3 Rh4 C5 64.1(3) . . ?
C3 Rh4 C1 63.8(2) . . ?
C3 Rh4 C2 38.3(2) . . ?
C4 Rh4 C5 38.2(2) . . ?
C4 Rh4 C1 63.8(2) . . ?
C4 Rh4 C2 64.1(3) . . ?
C5 Rh4 C1 37.84(19) . . ?
C2 Rh4 C5 63.6(2) . . ?
C2 Rh4 C1 37.87(19) . . ?
C64 Rh4 N7 89.1(6) . . ?
C64 Rh4 C3 129.2(5) . . ?
C64 Rh4 C4 159.8(5) . . ?
C64 Rh4 C5 128.2(5) . . ?
C64 Rh4 C1 97.0(5) . . ?
C64 Rh4 C2 97.3(5) . . ?
C67 Rh4 N7 83.6(6) . . ?
C67 Rh4 C3 93.6(6) . . ?
C67 Rh4 C4 105.6(6) . . ?
C67 Rh4 C5 142.3(6) . . ?
C67 Rh4 C1 155.2(6) . . ?
C67 Rh4 C2 117.7(6) . . ?
C67 Rh4 C64 89.5(7) . . ?
C9 Rh5 C53 96.0(5) . . ?
C9 Rh5 C52 125.5(6) . . ?
C9 Rh5 C56 160.1(5) . . ?
C9 Rh5 C55 133.2(6) . . ?
C9 Rh5 C54 99.9(5) . . ?
C9 Rh5 C62 89.1(6) . . ?
C9 Rh5 C66 81.9(6) . . ?
C53 Rh5 C55 63.9(2) . . ?
C53 Rh5 C54 38.13(19) . . ?
C52 Rh5 C53 38.39(19) . . ?
C52 Rh5 C56 38.43(19) . . ?
C52 Rh5 C55 64.1(2) . . ?
C52 Rh5 C54 64.0(2) . . ?
C56 Rh5 C53 64.2(2) . . ?
C56 Rh5 C55 38.21(19) . . ?
C56 Rh5 C54 63.9(2) . . ?
C55 Rh5 C54 38.03(19) . . ?
C62 Rh5 C53 123.9(6) . . ?
C62 Rh5 C52 96.4(5) . . ?
C62 Rh5 C56 103.1(5) . . ?
C62 Rh5 C55 137.6(6) . . ?
C62 Rh5 C54 160.2(5) . . ?
C62 Rh5 C66 90.4(6) . . ?
C66 Rh5 C53 145.7(6) . . ?
C66 Rh5 C52 151.7(6) . . ?
C66 Rh5 C56 113.3(6) . . ?
C66 Rh5 C55 92.7(5) . . ?
C66 Rh5 C54 108.2(5) . . ?
C6 Rh6 N8 91.3(6) . . ?
C6 Rh6 C42 106.5(5) . . ?
C6 Rh6 C43 92.8(5) . . ?
C6 Rh6 C44 115.0(5) . . ?
C6 Rh6 C45 153.1(5) . . ?
C6 Rh6 C46 144.1(5) . . ?
C6 Rh6 C63 81.7(6) . . ?
N8 Rh6 C42 160.8(5) . . ?
N8 Rh6 C43 136.2(5) . . ?
N8 Rh6 C44 102.2(4) . . ?
N8 Rh6 C45 96.6(5) . . ?
N8 Rh6 C46 124.5(5) . . ?
C42 Rh6 C43 38.37(19) . . ?
C42 Rh6 C44 64.1(2) . . ?
C42 Rh6 C45 64.3(2) . . ?
C43 Rh6 C44 38.12(19) . . ?
C45 Rh6 C43 64.0(2) . . ?
C45 Rh6 C44 38.13(19) . . ?
C46 Rh6 C42 38.5(2) . . ?
C46 Rh6 C43 64.3(2) . . ?
C46 Rh6 C44 64.1(2) . . ?
C46 Rh6 C45 38.39(19) . . ?
C63 Rh6 N8 88.8(6) . . ?
C63 Rh6 C42 100.6(5) . . ?
C63 Rh6 C43 135.0(5) . . ?
C63 Rh6 C44 159.4(5) . . ?
C63 Rh6 C45 124.0(5) . . ?
C63 Rh6 C46 95.3(5) . . ?
C68 N1 Rh2 171.9(14) . . ?
C66 N2 Rh3 168.2(14) . . ?
C64 N3 Rh3 175.3(14) . . ?
C65 N4 Rh1 176.1(14) . . ?
C67 N5 Rh1 167.4(14) . . ?
N69 C6 Rh6 167.6(14) . . ?
C63 N7 Rh4 168.7(14) . . ?
C62 N8 Rh6 176.9(13) . . ?
N009 C9 Rh5 164.3(13) . . ?
C4 C3 Rh4 70.8(5) . . ?
C4 C3 C2 108.0 . . ?
C4 C3 C25 125.6(6) . . ?
C2 C3 Rh4 71.9(5) . . ?
C2 C3 C25 126.2(6) . . ?
C25 C3 Rh4 127.6(14) . . ?
C3 C4 Rh4 70.7(5) . . ?
C3 C4 C5 108.0 . . ?
C3 C4 C38 126.0(6) . . ?
C5 C4 Rh4 72.0(5) . . ?
C5 C4 C38 126.0(6) . . ?
C38 C4 Rh4 124.0(12) . . ?
C4 C5 Rh4 69.8(5) . . ?
C4 C5 C10 126.2(6) . . ?
C1 C5 Rh4 71.7(5) . . ?
C1 C5 C4 108.0 . . ?
C1 C5 C10 125.6(6) . . ?
C10 C5 Rh4 127.8(12) . . ?
C5 C1 Rh4 70.5(5) . . ?
C5 C1 C2 108.0 . . ?
C5 C1 C69 125.7(6) . . ?
C2 C1 Rh4 70.3(5) . . ?
C2 C1 C69 126.3(6) . . ?
C69 C1 Rh4 124.7(12) . . ?
C3 C2 Rh4 69.8(5) . . ?
C3 C2 C7 126.2(6) . . ?
C1 C2 Rh4 71.8(5) . . ?
C1 C2 C3 108.0 . . ?
C1 C2 C7 125.6(6) . . ?
C7 C2 Rh4 127.7(12) . . ?
C1 C69 H69A 109.5 . . ?
C1 C69 H69B 109.5 . . ?
C1 C69 H69C 109.5 . . ?
H69A C69 H69B 109.5 . . ?
H69A C69 H69C 109.5 . . ?
H69B C69 H69C 109.5 . . ?
C2 C7 H7A 109.5 . . ?
C2 C7 H7B 109.5 . . ?
C2 C7 H7C 109.5 . . ?
H7A C7 H7B 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C4 C38 H38A 109.5 . . ?
C4 C38 H38B 109.5 . . ?
C4 C38 H38C 109.5 . . ?
H38A C38 H38B 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
C9 N009 Rh2 176.7(12) . . ?
C5 C10 H10A 109.5 . . ?
C5 C10 H10B 109.5 . . ?
C5 C10 H10C 109.5 . . ?
H10A C10 H10B 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C11 C12 Rh3 71.5(5) . . ?
C11 C12 C13 108.0 . . ?
C11 C12 C17 126.7(10) . . ?
C13 C12 Rh3 69.5(5) . . ?
C13 C12 C17 125.2(10) . . ?
C17 C12 Rh3 121.3(14) . . ?
C12 C11 Rh3 71.0(5) . . ?
C12 C11 C15 108.0 . . ?
C12 C11 C16 126.3(10) . . ?
C15 C11 Rh3 69.8(5) . . ?
C15 C11 C16 125.0(10) . . ?
C16 C11 Rh3 117.4(14) . . ?
C11 C15 Rh3 72.4(5) . . ?
C11 C15 C20 125.5(10) . . ?
C14 C15 Rh3 69.7(5) . . ?
C14 C15 C11 108.0 . . ?
C14 C15 C20 126.4(10) . . ?
C20 C15 Rh3 125.7(13) . . ?
C15 C14 Rh3 71.9(6) . . ?
C15 C14 C13 108.0 . . ?
C15 C14 C19 125.9(10) . . ?
C13 C14 Rh3 71.4(6) . . ?
C13 C14 C19 126.0(10) . . ?
C19 C14 Rh3 125.6(13) . . ?
C12 C13 Rh3 72.5(5) . . ?
C12 C13 C18 124.7(10) . . ?
C14 C13 Rh3 70.1(6) . . ?
C14 C13 C12 108.0 . . ?
C14 C13 C18 127.2(10) . . ?
C18 C13 Rh3 126.0(13) . . ?
C11 C16 H16A 109.5 . . ?
C11 C16 H16B 109.5 . . ?
C11 C16 H16C 109.5 . . ?
H16A C16 H16B 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C12 C17 H17A 109.5 . . ?
C12 C17 H17B 109.5 . . ?
C12 C17 H17C 109.5 . . ?
H17A C17 H17B 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C13 C18 H18A 109.5 . . ?
C13 C18 H18B 109.5 . . ?
C13 C18 H18C 109.5 . . ?
H18A C18 H18B 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C14 C19 H19A 109.5 . . ?
C14 C19 H19B 109.5 . . ?
C14 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C15 C20 H20A 109.5 . . ?
C15 C20 H20B 109.5 . . ?
C15 C20 H20C 109.5 . . ?
H20A C20 H20B 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C24 C23 Rh2 70.6(5) . . ?
C24 C23 C29 124.8(15) . . ?
C22 C23 Rh2 71.7(5) . . ?
C22 C23 C24 108.0 . . ?
C22 C23 C29 127.1(15) . . ?
C29 C23 Rh2 126.7(11) . . ?
C23 C24 Rh2 71.1(5) . . ?
C23 C24 C26 108.0 . . ?
C23 C24 C30 128.6(14) . . ?
C26 C24 Rh2 71.4(5) . . ?
C26 C24 C30 123.3(14) . . ?
C30 C24 Rh2 124.7(10) . . ?
C24 C26 Rh2 70.4(4) . . ?
C24 C26 C31 128.4(14) . . ?
C21 C26 Rh2 71.6(5) . . ?
C21 C26 C24 108.0 . . ?
C21 C26 C31 123.5(14) . . ?
C31 C26 Rh2 126.4(11) . . ?
C26 C21 Rh2 70.4(5) . . ?
C26 C21 C22 108.0 . . ?
C26 C21 C27 123.8(14) . . ?
C22 C21 Rh2 70.9(5) . . ?
C22 C21 C27 128.2(14) . . ?
C27 C21 Rh2 123.8(11) . . ?
C23 C22 Rh2 70.3(4) . . ?
C23 C22 C21 108.0 . . ?
C23 C22 C28 122.3(12) . . ?
C21 C22 Rh2 71.3(5) . . ?
C21 C22 C28 129.5(12) . . ?
C28 C22 Rh2 128.2(9) . . ?
C21 C27 H27A 109.5 . . ?
C21 C27 H27B 109.5 . . ?
C21 C27 H27C 109.5 . . ?
H27A C27 H27B 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
C22 C28 H28A 109.5 . . ?
C22 C28 H28B 109.5 . . ?
C22 C28 H28C 109.5 . . ?
H28A C28 H28B 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
C23 C29 H29A 109.5 . . ?
C23 C29 H29B 109.5 . . ?
C23 C29 H29C 109.5 . . ?
H29A C29 H29B 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
C24 C30 H30A 109.5 . . ?
C24 C30 H30B 109.5 . . ?
C24 C30 H30C 109.5 . . ?
H30A C30 H30B 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
C26 C31 H31A 109.5 . . ?
C26 C31 H31B 109.5 . . ?
C26 C31 H31C 109.5 . . ?
H31A C31 H31B 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
C34 C33 Rh1 71.3(4) . . ?
C34 C33 C32 108.0 . . ?
C34 C33 C8 125.8(6) . . ?
C32 C33 Rh1 71.0(4) . . ?
C32 C33 C8 125.9(6) . . ?
C8 C33 Rh1 128.4(12) . . ?
C33 C34 Rh1 70.7(4) . . ?
C33 C34 C35 108.0 . . ?
C33 C34 C39 125.7(5) . . ?
C35 C34 Rh1 71.3(4) . . ?
C35 C34 C39 126.0(5) . . ?
C39 C34 Rh1 128.4(11) . . ?
C34 C35 Rh1 70.9(4) . . ?
C34 C35 C36 108.0 . . ?
C34 C35 C40 125.6(5) . . ?
C36 C35 Rh1 70.9(4) . . ?
C36 C35 C40 126.3(5) . . ?
C40 C35 Rh1 126.2(10) . . ?
C35 C36 Rh1 71.3(4) . . ?
C35 C36 C41 125.6(5) . . ?
C32 C36 Rh1 70.7(4) . . ?
C32 C36 C35 108.0 . . ?
C32 C36 C41 126.3(5) . . ?
C41 C36 Rh1 126.6(10) . . ?
C33 C32 Rh1 71.0(4) . . ?
C33 C32 C37 125.2(5) . . ?
C36 C32 Rh1 71.3(4) . . ?
C36 C32 C33 108.0 . . ?
C36 C32 C37 126.8(5) . . ?
C37 C32 Rh1 124.7(11) . . ?
C32 C37 H37A 109.5 . . ?
C32 C37 H37B 109.5 . . ?
C32 C37 H37C 109.5 . . ?
H37A C37 H37B 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
C34 C39 H39A 109.5 . . ?
C34 C39 H39B 109.5 . . ?
C34 C39 H39C 109.5 . . ?
H39A C39 H39B 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
C35 C40 H40A 109.5 . . ?
C35 C40 H40B 109.5 . . ?
C35 C40 H40C 109.5 . . ?
H40A C40 H40B 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
C36 C41 H41A 109.5 . . ?
C36 C41 H41B 109.5 . . ?
C36 C41 H41C 109.5 . . ?
H41A C41 H41B 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
C43 C42 Rh6 71.5(5) . . ?
C43 C42 C47 126.3(6) . . ?
C46 C42 Rh6 70.7(5) . . ?
C46 C42 C43 108.0 . . ?
C46 C42 C47 125.6(6) . . ?
C47 C42 Rh6 126.6(11) . . ?
C42 C43 Rh6 70.1(5) . . ?
C42 C43 C48 126.1(6) . . ?
C44 C43 Rh6 71.3(5) . . ?
C44 C43 C42 108.0 . . ?
C44 C43 C48 125.9(6) . . ?
C48 C43 Rh6 126.6(11) . . ?
C43 C44 Rh6 70.6(5) . . ?
C43 C44 C45 108.0 . . ?
C43 C44 C49 125.8(6) . . ?
C45 C44 Rh6 70.5(4) . . ?
C45 C44 C49 126.2(6) . . ?
C49 C44 Rh6 126.6(12) . . ?
C44 C45 Rh6 71.4(5) . . ?
C44 C45 C50 126.6(6) . . ?
C46 C45 Rh6 70.1(5) . . ?
C46 C45 C44 108.0 . . ?
C46 C45 C50 125.0(6) . . ?
C50 C45 Rh6 129.3(10) . . ?
C42 C46 Rh6 70.8(5) . . ?
C42 C46 C51 125.7(6) . . ?
C45 C46 Rh6 71.5(5) . . ?
C45 C46 C42 108.0 . . ?
C45 C46 C51 125.4(6) . . ?
C51 C46 Rh6 132.1(13) . . ?
C42 C47 H47A 109.5 . . ?
C42 C47 H47B 109.5 . . ?
C42 C47 H47C 109.5 . . ?
H47A C47 H47B 109.5 . . ?
H47A C47 H47C 109.5 . . ?
H47B C47 H47C 109.5 . . ?
C43 C48 H48A 109.5 . . ?
C43 C48 H48B 109.5 . . ?
C43 C48 H48C 109.5 . . ?
H48A C48 H48B 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
C44 C49 H49A 109.5 . . ?
C44 C49 H49B 109.5 . . ?
C44 C49 H49C 109.5 . . ?
H49A C49 H49B 109.5 . . ?
H49A C49 H49C 109.5 . . ?
H49B C49 H49C 109.5 . . ?
C45 C50 H50A 109.5 . . ?
C45 C50 H50B 109.5 . . ?
C45 C50 H50C 109.5 . . ?
H50A C50 H50B 109.5 . . ?
H50A C50 H50C 109.5 . . ?
H50B C50 H50C 109.5 . . ?
C46 C51 H51A 109.5 . . ?
C46 C51 H51B 109.5 . . ?
C46 C51 H51C 109.5 . . ?
H51A C51 H51B 109.5 . . ?
H51A C51 H51C 109.5 . . ?
H51B C51 H51C 109.5 . . ?
C52 C53 Rh5 70.3(5) . . ?
C52 C53 C54 108.0 . . ?
C52 C53 C58 122.6(15) . . ?
C54 C53 Rh5 71.5(5) . . ?
C54 C53 C58 128.9(15) . . ?
C58 C53 Rh5 129.6(12) . . ?
C53 C52 Rh5 71.3(5) . . ?
C53 C52 C57 129.5(16) . . ?
C56 C52 Rh5 71.1(5) . . ?
C56 C52 C53 108.0 . . ?
C56 C52 C57 122.4(16) . . ?
C57 C52 Rh5 125.0(12) . . ?
C52 C56 Rh5 70.5(5) . . ?
C55 C56 Rh5 71.5(5) . . ?
C55 C56 C52 108.0 . . ?
C61 C56 Rh5 129.7(12) . . ?
C61 C56 C52 121.6(16) . . ?
C61 C56 C55 129.9(16) . . ?
C56 C55 Rh5 70.2(5) . . ?
C56 C55 C60 129.1(16) . . ?
C54 C55 Rh5 71.1(5) . . ?
C54 C55 C56 108.0 . . ?
C54 C55 C60 122.8(15) . . ?
C60 C55 Rh5 125.8(12) . . ?
C53 C54 Rh5 70.4(5) . . ?
C55 C54 Rh5 70.9(5) . . ?
C55 C54 C53 108.0 . . ?
C59 C54 Rh5 128.1(12) . . ?
C59 C54 C53 126.1(16) . . ?
C59 C54 C55 125.7(16) . . ?
C52 C57 H57A 109.5 . . ?
C52 C57 H57B 109.5 . . ?
C52 C57 H57C 109.5 . . ?
H57A C57 H57B 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
C53 C58 H58A 109.5 . . ?
C53 C58 H58B 109.5 . . ?
C53 C58 H58C 109.5 . . ?
H58A C58 H58B 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
C54 C59 H59A 109.5 . . ?
C54 C59 H59B 109.5 . . ?
C54 C59 H59C 109.5 . . ?
H59A C59 H59B 109.5 . . ?
H59A C59 H59C 109.5 . . ?
H59B C59 H59C 109.5 . . ?
C55 C60 H60A 109.5 . . ?
C55 C60 H60B 109.5 . . ?
C55 C60 H60C 109.5 . . ?
H60A C60 H60B 109.5 . . ?
H60A C60 H60C 109.5 . . ?
H60B C60 H60C 109.5 . . ?
C56 C61 H61A 109.5 . . ?
C56 C61 H61B 109.5 . . ?
C56 C61 H61C 109.5 . . ?
H61A C61 H61B 109.5 . . ?
H61A C61 H61C 109.5 . . ?
H61B C61 H61C 109.5 . . ?
N8 C62 Rh5 178.3(14) . . ?
N7 C63 Rh6 168.0(15) . . ?
N3 C64 Rh4 178.0(17) . . ?
N4 C65 Rh2 178.2(15) . . ?
N2 C66 Rh5 168.1(14) . . ?
N5 C67 Rh4 167.2(15) . . ?
N1 C68 Rh3 161.8(14) . . ?
C6 N69 Rh1 172.6(13) . . ?
O1 S1 C71 101.4(12) . . ?
O2 S1 O1 117.1(14) . . ?
O2 S1 C71 104.0(12) . . ?
O3 S1 O1 109.0(14) . . ?
O3 S1 O2 120.5(15) . . ?
O3 S1 C71 101.5(15) . . ?
F1 C71 S1 109(2) . . ?
F2 C71 S1 117.1(19) . . ?
F2 C71 F1 103(2) . . ?
F2 C71 F3 111(2) . . ?
F3 C71 S1 117(2) . . ?
F3 C71 F1 97(2) . . ?
O4 S2 O5 112.5(13) . . ?
O4 S2 O6 118.9(13) . . ?
O4 S2 C70 105.3(10) . . ?
O5 S2 C70 102.3(10) . . ?
O6 S2 O5 109.7(13) . . ?
O6 S2 C70 106.5(10) . . ?
F4 C70 S2 113.9(14) . . ?
F4 C70 F5 101.9(16) . . ?
F5 C70 S2 114.2(13) . . ?
F6 C70 S2 114.1(13) . . ?
F6 C70 F4 105.0(17) . . ?
F6 C70 F5 106.5(16) . . ?
C3 C25 H25A 109.5 . . ?
C3 C25 H25B 109.5 . . ?
C3 C25 H25C 109.5 . . ?
H25A C25 H25B 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C33 C8 H8A 109.5 . . ?
C33 C8 H8B 109.5 . . ?
C33 C8 H8C 109.5 . . ?
H8A C8 H8B 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?

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
Rh1 N5 C67 Rh4 -7(13) . . . . ?
Rh1 C33 C34 C35 -61.8(4) . . . . ?
Rh1 C33 C34 C39 123.9(14) . . . . ?
Rh1 C33 C32 C36 62.1(4) . . . . ?
Rh1 C33 C32 C37 -119.5(14) . . . . ?
Rh1 C34 C35 C36 -61.5(4) . . . . ?
Rh1 C34 C35 C40 121.4(13) . . . . ?
Rh1 C35 C36 C32 -61.5(4) . . . . ?
Rh1 C35 C36 C41 122.0(13) . . . . ?
Rh1 C36 C32 C33 -61.8(4) . . . . ?
Rh1 C36 C32 C37 119.8(14) . . . . ?
Rh2 C23 C24 C26 -62.3(4) . . . . ?
Rh2 C23 C24 C30 119.8(14) . . . . ?
Rh2 C23 C22 C21 61.6(5) . . . . ?
Rh2 C23 C22 C28 -123.4(12) . . . . ?
Rh2 C24 C26 C21 -62.1(5) . . . . ?
Rh2 C24 C26 C31 121.4(15) . . . . ?
Rh2 C26 C21 C22 -61.3(5) . . . . ?
Rh2 C26 C21 C27 118.2(14) . . . . ?
Rh2 C21 C22 C23 -61.0(4) . . . . ?
Rh2 C21 C22 C28 124.5(13) . . . . ?
Rh3 N2 C66 Rh5 13(13) . . . . ?
Rh3 C12 C11 C15 60.2(5) . . . . ?
Rh3 C12 C11 C16 -110.5(18) . . . . ?
Rh3 C12 C13 C14 -61.5(5) . . . . ?
Rh3 C12 C13 C18 122.1(16) . . . . ?
Rh3 C11 C15 C14 61.0(5) . . . . ?
Rh3 C11 C15 C20 -121.7(17) . . . . ?
Rh3 C15 C14 C13 62.7(5) . . . . ?
Rh3 C15 C14 C19 -121.3(17) . . . . ?
Rh3 C14 C13 C12 63.0(5) . . . . ?
Rh3 C14 C13 C18 -120.7(17) . . . . ?
Rh4 N7 C63 Rh6 -19(13) . . . . ?
Rh4 C3 C4 C5 -62.7(5) . . . . ?
Rh4 C3 C4 C38 118.5(15) . . . . ?
Rh4 C3 C2 C1 62.0(5) . . . . ?
Rh4 C3 C2 C7 -122.6(15) . . . . ?
Rh4 C4 C5 C1 -61.8(5) . . . . ?
Rh4 C4 C5 C10 122.6(16) . . . . ?
Rh4 C5 C1 C2 -60.6(5) . . . . ?
Rh4 C5 C1 C69 119.3(15) . . . . ?
Rh4 C1 C2 C3 -60.7(5) . . . . ?
Rh4 C1 C2 C7 123.8(16) . . . . ?
Rh5 C53 C52 C56 61.9(5) . . . . ?
Rh5 C53 C52 C57 -120.4(16) . . . . ?
Rh5 C53 C54 C55 -61.2(5) . . . . ?
Rh5 C53 C54 C59 123.4(15) . . . . ?
Rh5 C52 C56 C55 62.1(5) . . . . ?
Rh5 C52 C56 C61 -125.3(15) . . . . ?
Rh5 C56 C55 C54 61.4(5) . . . . ?
Rh5 C56 C55 C60 -120.6(16) . . . . ?
Rh5 C55 C54 C53 60.9(5) . . . . ?
Rh5 C55 C54 C59 -123.6(15) . . . . ?
Rh6 C42 C43 C44 -61.6(5) . . . . ?
Rh6 C42 C43 C48 121.4(15) . . . . ?
Rh6 C42 C46 C45 62.1(5) . . . . ?
Rh6 C42 C46 C51 -128.5(16) . . . . ?
Rh6 C43 C44 C45 -60.9(4) . . . . ?
Rh6 C43 C44 C49 121.7(15) . . . . ?
Rh6 C44 C45 C46 -60.9(5) . . . . ?
Rh6 C44 C45 C50 125.7(14) . . . . ?
Rh6 C45 C46 C42 -61.7(4) . . . . ?
Rh6 C45 C46 C51 128.9(16) . . . . ?
C3 C4 C5 Rh4 61.8(5) . . . . ?
C3 C4 C5 C1 0.0 . . . . ?
C3 C4 C5 C10 -175.5(18) . . . . ?
C4 C3 C2 Rh4 -62.0(5) . . . . ?
C4 C3 C2 C1 0.0 . . . . ?
C4 C3 C2 C7 175.4(17) . . . . ?
C4 C5 C1 Rh4 60.6(5) . . . . ?
C4 C5 C1 C2 0.0 . . . . ?
C4 C5 C1 C69 179.9(17) . . . . ?
C5 C1 C2 Rh4 60.7(5) . . . . ?
C5 C1 C2 C3 0.0 . . . . ?
C5 C1 C2 C7 -175.5(17) . . . . ?
C2 C3 C4 Rh4 62.7(5) . . . . ?
C2 C3 C4 C5 0.0 . . . . ?
C2 C3 C4 C38 -178.8(17) . . . . ?
C69 C1 C2 Rh4 -119.2(15) . . . . ?
C69 C1 C2 C3 -179.9(17) . . . . ?
C69 C1 C2 C7 5(2) . . . . ?
C38 C4 C5 Rh4 -119.4(15) . . . . ?
C38 C4 C5 C1 178.8(17) . . . . ?
C38 C4 C5 C10 3(2) . . . . ?
C10 C5 C1 Rh4 -123.8(16) . . . . ?
C10 C5 C1 C2 175.6(18) . . . . ?
C10 C5 C1 C69 -5(2) . . . . ?
C12 C11 C15 Rh3 -61.0(5) . . . . ?
C12 C11 C15 C14 0.0 . . . . ?
C12 C11 C15 C20 177.3(19) . . . . ?
C11 C12 C13 Rh3 61.5(5) . . . . ?
C11 C12 C13 C14 0.0 . . . . ?
C11 C12 C13 C18 -176.4(18) . . . . ?
C11 C15 C14 Rh3 -62.7(5) . . . . ?
C11 C15 C14 C13 0.0 . . . . ?
C11 C15 C14 C19 176.0(19) . . . . ?
C15 C14 C13 Rh3 -63.0(5) . . . . ?
C15 C14 C13 C12 0.0 . . . . ?
C15 C14 C13 C18 176.3(19) . . . . ?
C13 C12 C11 Rh3 -60.2(5) . . . . ?
C13 C12 C11 C15 0.0 . . . . ?
C13 C12 C11 C16 -170.7(19) . . . . ?
C16 C11 C15 Rh3 109.9(17) . . . . ?
C16 C11 C15 C14 170.9(19) . . . . ?
C16 C11 C15 C20 -12(2) . . . . ?
C17 C12 C11 Rh3 115.7(18) . . . . ?
C17 C12 C11 C15 175.9(19) . . . . ?
C17 C12 C11 C16 5(2) . . . . ?
C17 C12 C13 Rh3 -114.5(17) . . . . ?
C17 C12 C13 C14 -176.0(19) . . . . ?
C17 C12 C13 C18 8(2) . . . . ?
C19 C14 C13 Rh3 120.9(17) . . . . ?
C19 C14 C13 C12 -176.0(19) . . . . ?
C19 C14 C13 C18 0(2) . . . . ?
C20 C15 C14 Rh3 120.0(17) . . . . ?
C20 C15 C14 C13 -177.3(19) . . . . ?
C20 C15 C14 C19 -1(2) . . . . ?
C23 C24 C26 Rh2 62.1(5) . . . . ?
C23 C24 C26 C21 0.0 . . . . ?
C23 C24 C26 C31 -176.5(16) . . . . ?
C24 C23 C22 Rh2 -61.6(5) . . . . ?
C24 C23 C22 C21 0.0 . . . . ?
C24 C23 C22 C28 175.0(13) . . . . ?
C24 C26 C21 Rh2 61.3(5) . . . . ?
C24 C26 C21 C22 0.0 . . . . ?
C24 C26 C21 C27 179.5(15) . . . . ?
C26 C21 C22 Rh2 61.0(4) . . . . ?
C26 C21 C22 C23 0.0 . . . . ?
C26 C21 C22 C28 -174.5(15) . . . . ?
C22 C23 C24 Rh2 62.3(4) . . . . ?
C22 C23 C24 C26 0.0 . . . . ?
C22 C23 C24 C30 -177.9(15) . . . . ?
C27 C21 C22 Rh2 -118.5(15) . . . . ?
C27 C21 C22 C23 -179.5(16) . . . . ?
C27 C21 C22 C28 6.0(19) . . . . ?
C29 C23 C24 Rh2 -121.7(14) . . . . ?
C29 C23 C24 C26 175.9(16) . . . . ?
C29 C23 C24 C30 -1.9(19) . . . . ?
C29 C23 C22 Rh2 122.6(15) . . . . ?
C29 C23 C22 C21 -175.8(16) . . . . ?
C29 C23 C22 C28 -0.8(18) . . . . ?
C30 C24 C26 Rh2 -119.9(13) . . . . ?
C30 C24 C26 C21 178.0(14) . . . . ?
C30 C24 C26 C31 1.5(19) . . . . ?
C31 C26 C21 Rh2 -122.0(14) . . . . ?
C31 C26 C21 C22 176.7(15) . . . . ?
C31 C26 C21 C27 -3.8(19) . . . . ?
C33 C34 C35 Rh1 61.5(4) . . . . ?
C33 C34 C35 C36 0.0 . . . . ?
C33 C34 C35 C40 -177.1(15) . . . . ?
C34 C33 C32 Rh1 -62.1(4) . . . . ?
C34 C33 C32 C36 0.0 . . . . ?
C34 C33 C32 C37 178.4(15) . . . . ?
C34 C35 C36 Rh1 61.5(4) . . . . ?
C34 C35 C36 C32 0.0 . . . . ?
C34 C35 C36 C41 -176.5(14) . . . . ?
C35 C36 C32 Rh1 61.8(4) . . . . ?
C35 C36 C32 C33 0.0 . . . . ?
C35 C36 C32 C37 -178.4(16) . . . . ?
C32 C33 C34 Rh1 61.8(4) . . . . ?
C32 C33 C34 C35 0.0 . . . . ?
C32 C33 C34 C39 -174.2(15) . . . . ?
C39 C34 C35 Rh1 -124.3(14) . . . . ?
C39 C34 C35 C36 174.2(15) . . . . ?
C39 C34 C35 C40 -2.9(19) . . . . ?
C40 C35 C36 Rh1 -121.4(13) . . . . ?
C40 C35 C36 C32 177.1(15) . . . . ?
C40 C35 C36 C41 0.6(18) . . . . ?
C41 C36 C32 Rh1 -121.7(13) . . . . ?
C41 C36 C32 C33 176.5(14) . . . . ?
C41 C36 C32 C37 -1.9(19) . . . . ?
C42 C43 C44 Rh6 60.9(4) . . . . ?
C42 C43 C44 C45 0.0 . . . . ?
C42 C43 C44 C49 -177.5(17) . . . . ?
C43 C42 C46 Rh6 -62.1(5) . . . . ?
C43 C42 C46 C45 0.0 . . . . ?
C43 C42 C46 C51 169.4(17) . . . . ?
C43 C44 C45 Rh6 60.9(5) . . . . ?
C43 C44 C45 C46 0.0 . . . . ?
C43 C44 C45 C50 -173.4(15) . . . . ?
C44 C45 C46 Rh6 61.7(4) . . . . ?
C44 C45 C46 C42 0.0 . . . . ?
C44 C45 C46 C51 -169.4(17) . . . . ?
C46 C42 C43 Rh6 61.6(5) . . . . ?
C46 C42 C43 C44 0.0 . . . . ?
C46 C42 C43 C48 -177.0(16) . . . . ?
C47 C42 C43 Rh6 -122.3(14) . . . . ?
C47 C42 C43 C44 176.1(16) . . . . ?
C47 C42 C43 C48 -1(2) . . . . ?
C47 C42 C46 Rh6 121.7(14) . . . . ?
C47 C42 C46 C45 -176.2(16) . . . . ?
C47 C42 C46 C51 -7(2) . . . . ?
C48 C43 C44 Rh6 -122.2(15) . . . . ?
C48 C43 C44 C45 177.0(16) . . . . ?
C48 C43 C44 C49 0(2) . . . . ?
C49 C44 C45 Rh6 -121.7(15) . . . . ?
C49 C44 C45 C46 177.4(17) . . . . ?
C49 C44 C45 C50 4(2) . . . . ?
C50 C45 C46 Rh6 -124.8(13) . . . . ?
C50 C45 C46 C42 173.6(15) . . . . ?
C50 C45 C46 C51 4(2) . . . . ?
C53 C52 C56 Rh5 -62.1(5) . . . . ?
C53 C52 C56 C55 0.0 . . . . ?
C53 C52 C56 C61 172.7(16) . . . . ?
C52 C53 C54 Rh5 61.2(5) . . . . ?
C52 C53 C54 C55 0.0 . . . . ?
C52 C53 C54 C59 -175.5(17) . . . . ?
C52 C56 C55 Rh5 -61.4(5) . . . . ?
C52 C56 C55 C54 0.0 . . . . ?
C52 C56 C55 C60 178.0(17) . . . . ?
C56 C55 C54 Rh5 -60.9(5) . . . . ?
C56 C55 C54 C53 0.0 . . . . ?
C56 C55 C54 C59 175.5(17) . . . . ?
C54 C53 C52 Rh5 -61.9(5) . . . . ?
C54 C53 C52 C56 0.0 . . . . ?
C54 C53 C52 C57 177.6(17) . . . . ?
C57 C52 C56 Rh5 120.1(14) . . . . ?
C57 C52 C56 C55 -177.8(16) . . . . ?
C57 C52 C56 C61 -5.2(19) . . . . ?
C58 C53 C52 Rh5 125.1(14) . . . . ?
C58 C53 C52 C56 -173.0(16) . . . . ?
C58 C53 C52 C57 5(2) . . . . ?
C58 C53 C54 Rh5 -126.4(16) . . . . ?
C58 C53 C54 C55 172.4(17) . . . . ?
C58 C53 C54 C59 -3(2) . . . . ?
C60 C55 C54 Rh5 121.0(14) . . . . ?
C60 C55 C54 C53 -178.2(15) . . . . ?
C60 C55 C54 C59 -3(2) . . . . ?
C61 C56 C55 Rh5 126.7(17) . . . . ?
C61 C56 C55 C54 -171.8(18) . . . . ?
C61 C56 C55 C60 6(2) . . . . ?
O1 S1 C71 F1 -64(2) . . . . ?
O1 S1 C71 F2 52(3) . . . . ?
O1 S1 C71 F3 -173(2) . . . . ?
O2 S1 C71 F1 58(2) . . . . ?
O2 S1 C71 F2 174(3) . . . . ?
O2 S1 C71 F3 -51(3) . . . . ?
O3 S1 C71 F1 -176(2) . . . . ?
O3 S1 C71 F2 -60(3) . . . . ?
O3 S1 C71 F3 75(3) . . . . ?
O4 S2 C70 F4 -64.0(18) . . . . ?
O4 S2 C70 F5 52.5(18) . . . . ?
O4 S2 C70 F6 175.5(17) . . . . ?
O5 S2 C70 F4 178.2(16) . . . . ?
O5 S2 C70 F5 -65.3(18) . . . . ?
O5 S2 C70 F6 57.7(18) . . . . ?
O6 S2 C70 F4 63.1(18) . . . . ?
O6 S2 C70 F5 179.6(17) . . . . ?
O6 S2 C70 F6 -57.4(19) . . . . ?
C25 C3 C4 Rh4 -123.0(18) . . . . ?
C25 C3 C4 C5 174.3(19) . . . . ?
C25 C3 C4 C38 -4(2) . . . . ?
C25 C3 C2 Rh4 123.8(18) . . . . ?
C25 C3 C2 C1 -174.3(19) . . . . ?
C25 C3 C2 C7 1(2) . . . . ?
C8 C33 C34 Rh1 -124.4(15) . . . . ?
C8 C33 C34 C35 173.8(16) . . . . ?
C8 C33 C34 C39 0(2) . . . . ?
C8 C33 C32 Rh1 124.2(15) . . . . ?
C8 C33 C32 C36 -173.8(16) . . . . ?
C8 C33 C32 C37 5(2) . . . . ?

_smtbx_masks_special_details     
; 
A solvent mask was calculated and 797 electrons were 
found in a volume of 2955Å³ in 2 voids per unit cell. 
This is consistent with the presence of 
11[CH3OH] per Asymmetric Unit 
which account for 792 electrons 
per unit cell. 
;
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 -0.565 -0.175 0.204 2902.7 797.0 '44 CH3OH'
2 0.257 0.743 0.570 12.9 0.0 ?
3 0.257 0.757 0.070 12.9 0.0 ?
4 0.743 0.243 0.930 12.9 0.0 ?
5 0.743 0.257 0.430 12.9 0.0 ?

_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
1 0.712(3)
2 0.288(3)

####################################################################### 
# 
# 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_20231204544_2_0ma_a
_database_code_depnum_ccdc_archive 'CCDC 2308647'
loop_
_audit_author_name
_audit_author_address
'Weibin Yu'
;Anhui University of Technology
China
;
_audit_update_record             
;
2024-02-01 deposited with the CCDC.	2024-03-25 downloaded from the CCDC.
;
_audit_creation_date             2023-12-29
_audit_creation_method           
; 
Olex2 1.5 
(compiled 2023.08.24 svn.re1ec1418 for OlexSys, GUI svn.r6817) 
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C67 H90 Cl4 N7 Rh6, 10[CH3OH]'
_chemical_formula_sum            'C77 H130 Cl4 N7 O10 Rh6'
_chemical_formula_weight         2073.13
_chemical_absolute_configuration ?
_chemical_melting_point          ?
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'
Cl Cl 0.1484 0.1585 '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'
Rh Rh -1.1178 0.9187 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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. 
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           34
_space_group_name_H-M_alt        'P n n 2'
_space_group_name_Hall           'P 2 -2n'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z'
'x+1/2, -y+1/2, z+1/2'
'-x+1/2, y+1/2, z+1/2'

_cell_length_a                   14.946(2)
_cell_length_b                   26.441(4)
_cell_length_c                   11.9783(19)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     4733.6(13)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    2952
_cell_measurement_temperature    296.15
_cell_measurement_theta_max      17.46
_cell_measurement_theta_min      2.18
_shelx_estimated_absorpt_T_max   0.842
_shelx_estimated_absorpt_T_min   0.806
_exptl_absorpt_coefficient_mu    1.186
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.6712
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
; 
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction. 
wR2(int) was 0.1019 before and 0.0647 after correction. 
The Ratio of minimum to maximum transmission is 0.9002. 
The λ/2 correction factor is 0.00150. 
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.454
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             2118
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.15
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.1037
_diffrn_reflns_av_unetI/netI     0.0917
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       31
_diffrn_reflns_limit_k_min       -31
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            35499
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_theta_full        25.023
_diffrn_reflns_theta_max         25.023
_diffrn_reflns_theta_min         2.057
_diffrn_ambient_temperature      296.15
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           30.0
_diffrn_source_power             1.5
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.895
_reflns_Friedel_fraction_full    0.992
_reflns_Friedel_fraction_max     0.992
_reflns_number_gt                5165
_reflns_number_total             8334
_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 Structure factors included contributions from the .fab file. 
  
 _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. 
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT v8.34A (Bruker, 2013)'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'SAINT v8.34A (Bruker, 2013)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2014/4 (Sheldrick, 2014)'
_refine_diff_density_max         0.525
_refine_diff_density_min         -0.741
_refine_diff_density_rms         0.110
_refine_ls_abs_structure_details 
; 
 Flack x determined using 1782 quotients [(I+)-(I-)]/[(I+)+(I-)] 
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259). 
;
_refine_ls_abs_structure_Flack   0.00(3)
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.962
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     376
_refine_ls_number_reflns         8334
_refine_ls_number_restraints     392
_refine_ls_R_factor_all          0.1017
_refine_ls_R_factor_gt           0.0563
_refine_ls_restrained_S_all      0.973
_refine_ls_shift/su_max          0.008
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0782P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1314
_refine_ls_wR_factor_ref         0.1537
_refine_special_details          ?
_olex2_refinement_description    
; 
1. Fixed Uiso 
 At 1.5 times of: 
  All C(H,H,H) groups 
2. Restrained distances 
 Rh1-N11 
 2 with sigma of 0.02 
 C33-C28 
 1.53 with sigma of 0.01 
 C29-C24 = C33-C28 = C32-C27 = C31-C26 = C30-C25 = C5-C10 = C6-C11 = C7-C2 = 
 C8-C3 = C9-C4 = C19-C14 = C20-C15 = C21-C16 = C22-C17 = C23-C18 
 1.53 with sigma of 0.01 
3. Rigid bond restraints 
 All non-hydrogen atoms 
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01 
4. Uiso/Uaniso restraints and constraints 
All non-hydrogen atoms have similar U: within 2A with sigma of 0.01 and sigma 
for terminal atoms of 0.02 within 2A 
5. Others 
 Fixed Sof: C1(0.5) N11(0.5) 
6.a Fitted pentagon refined as free rotating group: 
 C4(C5,C11,C2,C3), C18(C17,C16,C15,C14), C27(C26,C25,C24,C28) 
6.b Idealised Me refined as rotating group: 
 C6(H6A,H6B,H6C), C7(H7A,H7B,H7C), C8(H8A,H8B,H8C), C9(H9A,H9B,H9C), C10(H10A, 
 H10B,H10C), C19(H19A,H19B,H19C), C20(H20A,H20B,H20C), C21(H21A,H21B,H21C), 
 C22(H22A,H22B,H22C), C23(H23A,H23B,H23C), C29(H29A,H29B,H29C), C30(H30A,H30B, 
 H30C), C31(H31A,H31B,H31C), C32(H32A,H32B,H32C), C33(H33A,H33B,H33C) 
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
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 0.66679(7) 0.53022(4) 0.58873(9) 0.0424(3) Uani 1 1 d D U . . .
Rh2 Rh 0.75499(7) 0.37952(4) 0.33253(11) 0.0517(3) Uani 1 1 d . U . . .
Rh3 Rh 0.58135(8) 0.67703(4) 0.32145(11) 0.0525(3) Uani 1 1 d . U . . .
Cl1 Cl 0.7895(3) 0.3401(2) 0.5078(4) 0.0790(13) Uani 1 1 d . U . . .
Cl2 Cl 0.5770(3) 0.71957(18) 0.4992(4) 0.0818(14) Uani 1 1 d . U . . .
N2 N 0.6062(9) 0.6134(5) 0.4083(11) 0.058(3) Uani 1 1 d . U . . .
N3 N 0.6884(8) 0.4738(5) 0.4720(11) 0.052(3) Uani 1 1 d . U . . .
N4 N 0.5551(8) 0.3420(4) 0.3316(12) 0.058(3) Uani 1 1 d . U . . .
C00A C 0.6289(10) 0.3540(5) 0.3356(15) 0.052(3) Uani 1 1 d . U . . .
C4 C 0.7706(8) 0.5805(4) 0.6457(10) 0.078(3) Uani 1 1 d DG U . . .
C5 C 0.6974(8) 0.5813(4) 0.7213(10) 0.065(3) Uani 1 1 d DG U . . .
C11 C 0.6866(7) 0.5318(5) 0.7649(9) 0.069(3) Uani 1 1 d DG U . . .
C2 C 0.7531(8) 0.5004(4) 0.7164(11) 0.071(3) Uani 1 1 d DG U . . .
C3 C 0.8050(7) 0.5305(5) 0.6427(10) 0.082(4) Uani 1 1 d DG U . . .
C6 C 0.6263(12) 0.5135(7) 0.8594(13) 0.085(5) Uani 1 1 d D U . . .
H6A H 0.566819 0.526189 0.848269 0.128 Uiso 1 1 calc R U . . .
H6B H 0.649107 0.525633 0.929416 0.128 Uiso 1 1 calc R U . . .
H6C H 0.625174 0.477211 0.860044 0.128 Uiso 1 1 calc R U . . .
C7 C 0.7829(15) 0.4463(6) 0.740(2) 0.116(7) Uani 1 1 d D U . . .
H7A H 0.741449 0.430662 0.790858 0.174 Uiso 1 1 calc R U . . .
H7B H 0.841441 0.446732 0.773425 0.174 Uiso 1 1 calc R U . . .
H7C H 0.784740 0.427473 0.671857 0.174 Uiso 1 1 calc R U . . .
C8 C 0.8865(12) 0.5178(10) 0.572(2) 0.154(8) Uani 1 1 d D U . . .
H8A H 0.877591 0.485789 0.536044 0.231 Uiso 1 1 calc R U . . .
H8B H 0.938498 0.516115 0.618940 0.231 Uiso 1 1 calc R U . . .
H8C H 0.894859 0.543599 0.516553 0.231 Uiso 1 1 calc R U . . .
C9 C 0.8031(12) 0.6281(6) 0.5880(18) 0.101(6) Uani 1 1 d D U . . .
H9A H 0.835570 0.619089 0.521704 0.152 Uiso 1 1 calc R U . . .
H9B H 0.841714 0.646586 0.637401 0.152 Uiso 1 1 calc R U . . .
H9C H 0.752775 0.648779 0.568191 0.152 Uiso 1 1 calc R U . . .
C10 C 0.6445(12) 0.6278(6) 0.7570(17) 0.088(5) Uani 1 1 d D U . . .
H10A H 0.622667 0.645131 0.691988 0.131 Uiso 1 1 calc R U . . .
H10B H 0.682643 0.650098 0.798796 0.131 Uiso 1 1 calc R U . . .
H10C H 0.594932 0.617631 0.802651 0.131 Uiso 1 1 calc R U . . .
C12 C 0.7099(10) 0.4402(7) 0.4217(13) 0.052(3) Uani 1 1 d . U . . .
C13 C 0.6272(9) 0.5810(6) 0.4697(12) 0.043(3) Uani 1 1 d . U . . .
C18 C 0.8396(10) 0.4242(4) 0.2261(12) 0.083(4) Uani 1 1 d DG U . . .
C17 C 0.7770(8) 0.3982(6) 0.1577(10) 0.084(4) Uani 1 1 d DG U . . .
C16 C 0.7913(8) 0.3455(5) 0.1715(11) 0.079(4) Uani 1 1 d DG U . . .
C15 C 0.8626(9) 0.3389(4) 0.2484(11) 0.081(4) Uani 1 1 d DG U . . .
C14 C 0.8925(7) 0.3875(6) 0.2821(10) 0.083(3) Uani 1 1 d DG U . . .
C19 C 0.9719(11) 0.4020(10) 0.3556(17) 0.120(7) Uani 1 1 d D U . . .
H19A H 0.994016 0.434547 0.333385 0.179 Uiso 1 1 calc R U . . .
H19B H 1.018445 0.377236 0.347355 0.179 Uiso 1 1 calc R U . . .
H19C H 0.953177 0.403258 0.432188 0.179 Uiso 1 1 calc R U . . .
C20 C 0.9056(14) 0.2893(6) 0.2829(16) 0.102(6) Uani 1 1 d D U . . .
H20A H 0.939129 0.294215 0.350389 0.153 Uiso 1 1 calc R U . . .
H20B H 0.944932 0.277872 0.224792 0.153 Uiso 1 1 calc R U . . .
H20C H 0.859889 0.264409 0.295398 0.153 Uiso 1 1 calc R U . . .
C21 C 0.7408(14) 0.3027(8) 0.1105(19) 0.119(7) Uani 1 1 d D U . . .
H21A H 0.722911 0.277409 0.163498 0.179 Uiso 1 1 calc R U . . .
H21B H 0.779384 0.287726 0.055587 0.179 Uiso 1 1 calc R U . . .
H21C H 0.688770 0.316339 0.074452 0.179 Uiso 1 1 calc R U . . .
C22 C 0.7104(12) 0.4243(9) 0.0798(17) 0.120(7) Uani 1 1 d D U . . .
H22A H 0.675208 0.399296 0.041957 0.180 Uiso 1 1 calc R U . . .
H22B H 0.742433 0.444226 0.025944 0.180 Uiso 1 1 calc R U . . .
H22C H 0.671838 0.445931 0.122667 0.180 Uiso 1 1 calc R U . . .
C23 C 0.8512(16) 0.4805(6) 0.236(2) 0.126(7) Uani 1 1 d D U . . .
H23A H 0.797064 0.495318 0.263986 0.189 Uiso 1 1 calc R U . . .
H23B H 0.864121 0.494418 0.163368 0.189 Uiso 1 1 calc R U . . .
H23C H 0.899659 0.487845 0.285646 0.189 Uiso 1 1 calc R U . . .
C27 C 0.5802(8) 0.7266(5) 0.1741(12) 0.083(4) Uani 1 1 d DG U . . .
C26 C 0.5991(9) 0.6762(5) 0.1404(10) 0.087(4) Uani 1 1 d DG U . . .
C25 C 0.6792(10) 0.6607(4) 0.1943(12) 0.083(4) Uani 1 1 d DG U . . .
C24 C 0.7097(7) 0.7015(6) 0.2613(10) 0.076(3) Uani 1 1 d DG U . . .
C28 C 0.6486(10) 0.7422(4) 0.2489(11) 0.082(4) Uani 1 1 d DG U . . .
C29 C 0.7998(9) 0.7012(8) 0.3199(19) 0.106(6) Uani 1 1 d D U . . .
H29A H 0.794983 0.718809 0.389674 0.160 Uiso 1 1 calc R U . . .
H29B H 0.843446 0.717569 0.273637 0.160 Uiso 1 1 calc R U . . .
H29C H 0.817823 0.666855 0.333423 0.160 Uiso 1 1 calc R U . . .
C30 C 0.7272(15) 0.6088(6) 0.183(2) 0.132(8) Uani 1 1 d D U . . .
H30A H 0.763164 0.602856 0.248554 0.198 Uiso 1 1 calc R U . . .
H30B H 0.764780 0.608949 0.118386 0.198 Uiso 1 1 calc R U . . .
H30C H 0.683404 0.582395 0.176552 0.198 Uiso 1 1 calc R U . . .
C31 C 0.5382(16) 0.6472(9) 0.0604(17) 0.132(7) Uani 1 1 d D U . . .
H31A H 0.530482 0.613208 0.087060 0.198 Uiso 1 1 calc R U . . .
H31B H 0.564898 0.646428 -0.012475 0.198 Uiso 1 1 calc R U . . .
H31C H 0.481063 0.663627 0.056408 0.198 Uiso 1 1 calc R U . . .
C32 C 0.5054(12) 0.7599(8) 0.1333(17) 0.115(7) Uani 1 1 d D U . . .
H32A H 0.464044 0.740103 0.090243 0.173 Uiso 1 1 calc R U . . .
H32B H 0.529498 0.786417 0.087569 0.173 Uiso 1 1 calc R U . . .
H32C H 0.474807 0.774448 0.196076 0.173 Uiso 1 1 calc R U . . .
C33 C 0.6620(17) 0.7892(7) 0.324(2) 0.157(8) Uani 1 1 d D U . . .
H33A H 0.604882 0.803744 0.341238 0.236 Uiso 1 1 calc R U . . .
H33B H 0.697816 0.813699 0.284678 0.236 Uiso 1 1 calc R U . . .
H33C H 0.691771 0.779473 0.391280 0.236 Uiso 1 1 calc R U . . .
C1 C 0.464(4) 0.490(4) 0.595(8) 0.036(11) Uani 0.5 1 d . U P A -1
N11 N 0.543(3) 0.502(4) 0.602(6) 0.042(10) Uani 0.5 1 d D U P A -1


_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 N3 2.070(14) . ?
Rh1 C4 2.155(11) . ?
Rh1 C5 2.135(11) . ?
Rh1 C11 2.132(11) . ?
Rh1 C2 2.150(11) . ?
Rh1 C3 2.164(12) . ?
Rh1 C13 2.046(16) . ?
Rh1 N11 2.01(3) . ?
Rh2 Cl1 2.400(5) . ?
Rh2 C00A 2.002(16) . ?
Rh2 C12 2.041(17) . ?
Rh2 C18 2.149(13) . ?
Rh2 C17 2.176(12) . ?
Rh2 C16 2.196(12) . ?
Rh2 C15 2.182(12) . ?
Rh2 C14 2.152(13) . ?
Rh3 Cl2 2.409(5) . ?
Rh3 N2 2.012(15) . ?
Rh3 N4 2.104(13) 2_665 ?
Rh3 C27 2.198(12) . ?
Rh3 C26 2.185(12) . ?
Rh3 C25 2.154(13) . ?
Rh3 C24 2.149(12) . ?
Rh3 C28 2.176(12) . ?
N2 C13 1.173(17) . ?
N3 C12 1.122(17) . ?
N4 C00A 1.149(16) . ?
C4 C5 1.4200 . ?
C4 C3 1.4200 . ?
C4 C9 1.516(12) . ?
C5 C11 1.4200 . ?
C5 C10 1.523(12) . ?
C11 C2 1.4200 . ?
C11 C6 1.524(11) . ?
C2 C3 1.4200 . ?
C2 C7 1.525(12) . ?
C3 C8 1.520(12) . ?
C6 H6A 0.9600 . ?
C6 H6B 0.9600 . ?
C6 H6C 0.9600 . ?
C7 H7A 0.9600 . ?
C7 H7B 0.9600 . ?
C7 H7C 0.9600 . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
C9 H9A 0.9600 . ?
C9 H9B 0.9600 . ?
C9 H9C 0.9600 . ?
C10 H10A 0.9600 . ?
C10 H10B 0.9600 . ?
C10 H10C 0.9600 . ?
C18 C17 1.4200 . ?
C18 C14 1.4200 . ?
C18 C23 1.505(12) . ?
C17 C16 1.4200 . ?
C17 C22 1.530(12) . ?
C16 C15 1.4200 . ?
C16 C21 1.544(12) . ?
C15 C14 1.4200 . ?
C15 C20 1.517(12) . ?
C14 C19 1.526(12) . ?
C19 H19A 0.9600 . ?
C19 H19B 0.9600 . ?
C19 H19C 0.9600 . ?
C20 H20A 0.9600 . ?
C20 H20B 0.9600 . ?
C20 H20C 0.9600 . ?
C21 H21A 0.9600 . ?
C21 H21B 0.9600 . ?
C21 H21C 0.9600 . ?
C22 H22A 0.9600 . ?
C22 H22B 0.9600 . ?
C22 H22C 0.9600 . ?
C23 H23A 0.9600 . ?
C23 H23B 0.9600 . ?
C23 H23C 0.9600 . ?
C27 C26 1.4200 . ?
C27 C28 1.4200 . ?
C27 C32 1.506(12) . ?
C26 C25 1.4200 . ?
C26 C31 1.529(12) . ?
C25 C24 1.4200 . ?
C25 C30 1.556(12) . ?
C24 C28 1.4200 . ?
C24 C29 1.517(12) . ?
C28 C33 1.545(9) . ?
C29 H29A 0.9600 . ?
C29 H29B 0.9600 . ?
C29 H29C 0.9600 . ?
C30 H30A 0.9600 . ?
C30 H30B 0.9600 . ?
C30 H30C 0.9600 . ?
C31 H31A 0.9600 . ?
C31 H31B 0.9600 . ?
C31 H31C 0.9600 . ?
C32 H32A 0.9600 . ?
C32 H32B 0.9600 . ?
C32 H32C 0.9600 . ?
C33 H33A 0.9600 . ?
C33 H33B 0.9600 . ?
C33 H33C 0.9600 . ?
C1 N11 1.22(3) . ?

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
N3 Rh1 C4 123.1(5) . . ?
N3 Rh1 C5 157.7(4) . . ?
N3 Rh1 C11 131.4(5) . . ?
N3 Rh1 C2 97.0(5) . . ?
N3 Rh1 C3 93.2(4) . . ?
C4 Rh1 C3 38.38(18) . . ?
C5 Rh1 C4 38.66(18) . . ?
C5 Rh1 C2 64.9(2) . . ?
C5 Rh1 C3 64.6(2) . . ?
C11 Rh1 C4 64.8(2) . . ?
C11 Rh1 C5 38.88(18) . . ?
C11 Rh1 C2 38.73(18) . . ?
C11 Rh1 C3 64.7(2) . . ?
C2 Rh1 C4 64.5(2) . . ?
C2 Rh1 C3 38.43(18) . . ?
C13 Rh1 N3 92.7(5) . . ?
C13 Rh1 C4 91.4(5) . . ?
C13 Rh1 C5 99.5(5) . . ?
C13 Rh1 C11 135.9(5) . . ?
C13 Rh1 C2 155.5(5) . . ?
C13 Rh1 C3 118.8(5) . . ?
N11 Rh1 N3 86(3) . . ?
N11 Rh1 C4 151(3) . . ?
N11 Rh1 C5 112(3) . . ?
N11 Rh1 C11 93(2) . . ?
N11 Rh1 C2 111(2) . . ?
N11 Rh1 C3 149(2) . . ?
N11 Rh1 C13 92(2) . . ?
C00A Rh2 Cl1 92.3(5) . . ?
C00A Rh2 C12 86.8(6) . . ?
C00A Rh2 C18 138.6(6) . . ?
C00A Rh2 C17 103.7(6) . . ?
C00A Rh2 C16 96.3(6) . . ?
C00A Rh2 C15 122.4(6) . . ?
C00A Rh2 C14 159.5(6) . . ?
C12 Rh2 Cl1 87.3(5) . . ?
C12 Rh2 C18 94.2(5) . . ?
C12 Rh2 C17 112.0(6) . . ?
C12 Rh2 C16 149.7(6) . . ?
C12 Rh2 C15 150.7(6) . . ?
C12 Rh2 C14 112.6(6) . . ?
C18 Rh2 Cl1 129.1(4) . . ?
C18 Rh2 C17 38.3(2) . . ?
C18 Rh2 C16 63.8(2) . . ?
C18 Rh2 C15 64.1(2) . . ?
C18 Rh2 C14 38.6(2) . . ?
C17 Rh2 Cl1 155.2(3) . . ?
C17 Rh2 C16 37.90(19) . . ?
C17 Rh2 C15 63.6(2) . . ?
C16 Rh2 Cl1 122.5(4) . . ?
C15 Rh2 Cl1 91.8(3) . . ?
C15 Rh2 C16 37.85(19) . . ?
C14 Rh2 Cl1 94.7(4) . . ?
C14 Rh2 C17 64.1(2) . . ?
C14 Rh2 C16 63.8(2) . . ?
C14 Rh2 C15 38.2(2) . . ?
N2 Rh3 Cl2 86.5(4) . . ?
N2 Rh3 N4 87.1(5) . 2_665 ?
N2 Rh3 C27 156.2(5) . . ?
N2 Rh3 C26 118.8(5) . . ?
N2 Rh3 C25 94.2(5) . . ?
N2 Rh3 C24 105.1(5) . . ?
N2 Rh3 C28 141.6(6) . . ?
N4 Rh3 Cl2 92.0(4) 2_665 . ?
N4 Rh3 C27 100.4(5) 2_665 . ?
N4 Rh3 C26 99.9(5) 2_665 . ?
N4 Rh3 C25 130.6(6) 2_665 . ?
N4 Rh3 C24 163.1(5) 2_665 . ?
N4 Rh3 C28 131.3(5) 2_665 . ?
C27 Rh3 Cl2 115.5(4) . . ?
C26 Rh3 Cl2 152.3(4) . . ?
C26 Rh3 C27 37.81(19) . . ?
C25 Rh3 Cl2 137.4(4) . . ?
C25 Rh3 C27 63.7(2) . . ?
C25 Rh3 C26 38.2(2) . . ?
C25 Rh3 C28 64.1(2) . . ?
C24 Rh3 Cl2 100.4(4) . . ?
C24 Rh3 C27 63.8(2) . . ?
C24 Rh3 C26 64.0(2) . . ?
C24 Rh3 C25 38.5(2) . . ?
C24 Rh3 C28 38.32(19) . . ?
C28 Rh3 Cl2 89.8(3) . . ?
C28 Rh3 C27 37.88(19) . . ?
C28 Rh3 C26 63.6(2) . . ?
C13 N2 Rh3 170.1(12) . . ?
C12 N3 Rh1 168.3(13) . . ?
C00A N4 Rh3 177.7(12) . 2_665 ?
N4 C00A Rh2 174.9(15) . . ?
C5 C4 Rh1 69.9(4) . . ?
C5 C4 C3 108.0 . . ?
C5 C4 C9 121.7(13) . . ?
C3 C4 Rh1 71.2(4) . . ?
C3 C4 C9 130.2(13) . . ?
C9 C4 Rh1 126.8(10) . . ?
C4 C5 Rh1 71.4(4) . . ?
C4 C5 C10 126.2(13) . . ?
C11 C5 Rh1 70.4(4) . . ?
C11 C5 C4 108.0 . . ?
C11 C5 C10 125.6(13) . . ?
C10 C5 Rh1 127.5(10) . . ?
C5 C11 Rh1 70.7(4) . . ?
C5 C11 C2 108.0 . . ?
C5 C11 C6 129.3(12) . . ?
C2 C11 Rh1 71.3(4) . . ?
C2 C11 C6 122.1(12) . . ?
C6 C11 Rh1 130.3(10) . . ?
C11 C2 Rh1 69.9(4) . . ?
C11 C2 C3 108.0 . . ?
C11 C2 C7 132.5(14) . . ?
C3 C2 Rh1 71.3(4) . . ?
C3 C2 C7 118.9(14) . . ?
C7 C2 Rh1 130.8(12) . . ?
C4 C3 Rh1 70.4(4) . . ?
C4 C3 C2 108.0 . . ?
C4 C3 C8 120.6(15) . . ?
C2 C3 Rh1 70.2(4) . . ?
C2 C3 C8 131.3(15) . . ?
C8 C3 Rh1 126.7(13) . . ?
C11 C6 H6A 109.5 . . ?
C11 C6 H6B 109.5 . . ?
C11 C6 H6C 109.5 . . ?
H6A C6 H6B 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C2 C7 H7A 109.5 . . ?
C2 C7 H7B 109.5 . . ?
C2 C7 H7C 109.5 . . ?
H7A C7 H7B 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C3 C8 H8A 109.5 . . ?
C3 C8 H8B 109.5 . . ?
C3 C8 H8C 109.5 . . ?
H8A C8 H8B 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C4 C9 H9A 109.5 . . ?
C4 C9 H9B 109.5 . . ?
C4 C9 H9C 109.5 . . ?
H9A C9 H9B 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C5 C10 H10A 109.5 . . ?
C5 C10 H10B 109.5 . . ?
C5 C10 H10C 109.5 . . ?
H10A C10 H10B 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
N3 C12 Rh2 177.4(14) . . ?
N2 C13 Rh1 174.0(13) . . ?
C17 C18 Rh2 71.9(5) . . ?
C17 C18 C14 108.0 . . ?
C17 C18 C23 126.7(15) . . ?
C14 C18 Rh2 70.9(5) . . ?
C14 C18 C23 125.2(15) . . ?
C23 C18 Rh2 124.5(12) . . ?
C18 C17 Rh2 69.8(5) . . ?
C18 C17 C22 124.2(14) . . ?
C16 C17 Rh2 71.8(5) . . ?
C16 C17 C18 108.0 . . ?
C16 C17 C22 127.7(14) . . ?
C22 C17 Rh2 126.2(11) . . ?
C17 C16 Rh2 70.3(5) . . ?
C17 C16 C15 108.0 . . ?
C17 C16 C21 126.3(14) . . ?
C15 C16 Rh2 70.5(5) . . ?
C15 C16 C21 125.7(14) . . ?
C21 C16 Rh2 126.6(11) . . ?
C16 C15 Rh2 71.6(5) . . ?
C16 C15 C20 127.0(13) . . ?
C14 C15 Rh2 69.8(5) . . ?
C14 C15 C16 108.0 . . ?
C14 C15 C20 124.9(13) . . ?
C20 C15 Rh2 127.7(11) . . ?
C18 C14 Rh2 70.6(5) . . ?
C18 C14 C19 122.3(14) . . ?
C15 C14 Rh2 72.0(5) . . ?
C15 C14 C18 108.0 . . ?
C15 C14 C19 129.5(14) . . ?
C19 C14 Rh2 127.3(11) . . ?
C14 C19 H19A 109.5 . . ?
C14 C19 H19B 109.5 . . ?
C14 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C15 C20 H20A 109.5 . . ?
C15 C20 H20B 109.5 . . ?
C15 C20 H20C 109.5 . . ?
H20A C20 H20B 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C16 C21 H21A 109.5 . . ?
C16 C21 H21B 109.5 . . ?
C16 C21 H21C 109.5 . . ?
H21A C21 H21B 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C17 C22 H22A 109.5 . . ?
C17 C22 H22B 109.5 . . ?
C17 C22 H22C 109.5 . . ?
H22A C22 H22B 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C18 C23 H23A 109.5 . . ?
C18 C23 H23B 109.5 . . ?
C18 C23 H23C 109.5 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C26 C27 Rh3 70.6(5) . . ?
C26 C27 C32 127.2(15) . . ?
C28 C27 Rh3 70.2(5) . . ?
C28 C27 C26 108.0 . . ?
C28 C27 C32 124.7(15) . . ?
C32 C27 Rh3 128.0(10) . . ?
C27 C26 Rh3 71.6(5) . . ?
C27 C26 C31 122.1(15) . . ?
C25 C26 Rh3 69.8(5) . . ?
C25 C26 C27 108.0 . . ?
C25 C26 C31 129.9(15) . . ?
C31 C26 Rh3 123.7(12) . . ?
C26 C25 Rh3 72.0(5) . . ?
C26 C25 C24 108.0 . . ?
C26 C25 C30 127.3(15) . . ?
C24 C25 Rh3 70.5(5) . . ?
C24 C25 C30 124.7(15) . . ?
C30 C25 Rh3 123.3(12) . . ?
C25 C24 Rh3 70.9(5) . . ?
C25 C24 C28 108.0 . . ?
C25 C24 C29 122.8(14) . . ?
C28 C24 Rh3 71.9(5) . . ?
C28 C24 C29 128.6(14) . . ?
C29 C24 Rh3 129.4(11) . . ?
C27 C28 Rh3 71.9(5) . . ?
C27 C28 C24 108.0 . . ?
C27 C28 C33 133.9(15) . . ?
C24 C28 Rh3 69.8(5) . . ?
C24 C28 C33 117.7(16) . . ?
C33 C28 Rh3 117.8(12) . . ?
C24 C29 H29A 109.5 . . ?
C24 C29 H29B 109.5 . . ?
C24 C29 H29C 109.5 . . ?
H29A C29 H29B 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
C25 C30 H30A 109.5 . . ?
C25 C30 H30B 109.5 . . ?
C25 C30 H30C 109.5 . . ?
H30A C30 H30B 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
C26 C31 H31A 109.5 . . ?
C26 C31 H31B 109.5 . . ?
C26 C31 H31C 109.5 . . ?
H31A C31 H31B 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
C27 C32 H32A 109.5 . . ?
C27 C32 H32B 109.5 . . ?
C27 C32 H32C 109.5 . . ?
H32A C32 H32B 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C28 C33 H33A 109.5 . . ?
C28 C33 H33B 109.5 . . ?
C28 C33 H33C 109.5 . . ?
H33A C33 H33B 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C1 N11 Rh1 169(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
Rh1 C4 C5 C11 61.3(4) . . . . ?
Rh1 C4 C5 C10 -123.4(13) . . . . ?
Rh1 C4 C3 C2 -60.5(4) . . . . ?
Rh1 C4 C3 C8 121.8(15) . . . . ?
Rh1 C5 C11 C2 61.9(4) . . . . ?
Rh1 C5 C11 C6 -126.8(14) . . . . ?
Rh1 C11 C2 C3 61.5(4) . . . . ?
Rh1 C11 C2 C7 -127.5(16) . . . . ?
Rh1 C2 C3 C4 60.6(4) . . . . ?
Rh1 C2 C3 C8 -122.0(18) . . . . ?
Rh2 C18 C17 C16 -62.0(5) . . . . ?
Rh2 C18 C17 C22 120.8(14) . . . . ?
Rh2 C18 C14 C15 62.7(5) . . . . ?
Rh2 C18 C14 C19 -122.5(14) . . . . ?
Rh2 C17 C16 C15 -60.7(5) . . . . ?
Rh2 C17 C16 C21 121.5(15) . . . . ?
Rh2 C16 C15 C14 -60.6(5) . . . . ?
Rh2 C16 C15 C20 123.9(15) . . . . ?
Rh2 C15 C14 C18 -61.8(5) . . . . ?
Rh2 C15 C14 C19 123.8(16) . . . . ?
Rh3 C27 C26 C25 -60.6(5) . . . . ?
Rh3 C27 C26 C31 118.8(14) . . . . ?
Rh3 C27 C28 C24 60.8(5) . . . . ?
Rh3 C27 C28 C33 -111.4(17) . . . . ?
Rh3 C26 C25 C24 -61.7(5) . . . . ?
Rh3 C26 C25 C30 118.6(16) . . . . ?
Rh3 C25 C24 C28 -62.7(5) . . . . ?
Rh3 C25 C24 C29 125.2(13) . . . . ?
Rh3 C24 C28 C27 -62.1(5) . . . . ?
Rh3 C24 C28 C33 111.6(14) . . . . ?
C4 C5 C11 Rh1 -61.9(4) . . . . ?
C4 C5 C11 C2 0.0 . . . . ?
C4 C5 C11 C6 171.3(15) . . . . ?
C5 C4 C3 Rh1 60.5(4) . . . . ?
C5 C4 C3 C2 0.0 . . . . ?
C5 C4 C3 C8 -177.7(17) . . . . ?
C5 C11 C2 Rh1 -61.5(4) . . . . ?
C5 C11 C2 C3 0.0 . . . . ?
C5 C11 C2 C7 170.9(17) . . . . ?
C11 C2 C3 Rh1 -60.6(4) . . . . ?
C11 C2 C3 C4 0.0 . . . . ?
C11 C2 C3 C8 177.4(19) . . . . ?
C3 C4 C5 Rh1 -61.3(4) . . . . ?
C3 C4 C5 C11 0.0 . . . . ?
C3 C4 C5 C10 175.3(14) . . . . ?
C6 C11 C2 Rh1 126.5(12) . . . . ?
C6 C11 C2 C3 -172.0(14) . . . . ?
C6 C11 C2 C7 -1(2) . . . . ?
C7 C2 C3 Rh1 127.0(14) . . . . ?
C7 C2 C3 C4 -172.4(15) . . . . ?
C7 C2 C3 C8 5(2) . . . . ?
C9 C4 C5 Rh1 121.6(13) . . . . ?
C9 C4 C5 C11 -177.2(14) . . . . ?
C9 C4 C5 C10 -1.8(18) . . . . ?
C9 C4 C3 Rh1 -122.7(15) . . . . ?
C9 C4 C3 C2 176.8(16) . . . . ?
C9 C4 C3 C8 -1(2) . . . . ?
C10 C5 C11 Rh1 122.7(13) . . . . ?
C10 C5 C11 C2 -175.4(14) . . . . ?
C10 C5 C11 C6 -4.1(18) . . . . ?
C18 C17 C16 Rh2 60.7(5) . . . . ?
C18 C17 C16 C15 0.0 . . . . ?
C18 C17 C16 C21 -177.8(16) . . . . ?
C17 C18 C14 Rh2 -62.7(5) . . . . ?
C17 C18 C14 C15 0.0 . . . . ?
C17 C18 C14 C19 174.9(16) . . . . ?
C17 C16 C15 Rh2 60.6(5) . . . . ?
C17 C16 C15 C14 0.0 . . . . ?
C17 C16 C15 C20 -175.5(16) . . . . ?
C16 C15 C14 Rh2 61.8(5) . . . . ?
C16 C15 C14 C18 0.0 . . . . ?
C16 C15 C14 C19 -174.4(17) . . . . ?
C14 C18 C17 Rh2 62.0(5) . . . . ?
C14 C18 C17 C16 0.0 . . . . ?
C14 C18 C17 C22 -177.2(16) . . . . ?
C20 C15 C14 Rh2 -122.6(14) . . . . ?
C20 C15 C14 C18 175.7(16) . . . . ?
C20 C15 C14 C19 1(2) . . . . ?
C21 C16 C15 Rh2 -121.6(14) . . . . ?
C21 C16 C15 C14 177.8(16) . . . . ?
C21 C16 C15 C20 2(2) . . . . ?
C22 C17 C16 Rh2 -122.2(15) . . . . ?
C22 C17 C16 C15 177.1(16) . . . . ?
C22 C17 C16 C21 -1(2) . . . . ?
C23 C18 C17 Rh2 -120.0(16) . . . . ?
C23 C18 C17 C16 178.0(18) . . . . ?
C23 C18 C17 C22 1(2) . . . . ?
C23 C18 C14 Rh2 119.3(16) . . . . ?
C23 C18 C14 C15 -178.0(17) . . . . ?
C23 C18 C14 C19 -3(2) . . . . ?
C27 C26 C25 Rh3 61.7(5) . . . . ?
C27 C26 C25 C24 0.0 . . . . ?
C27 C26 C25 C30 -179.6(18) . . . . ?
C26 C27 C28 Rh3 -60.8(5) . . . . ?
C26 C27 C28 C24 0.0 . . . . ?
C26 C27 C28 C33 -172.2(19) . . . . ?
C26 C25 C24 Rh3 62.7(5) . . . . ?
C26 C25 C24 C28 0.0 . . . . ?
C26 C25 C24 C29 -172.1(15) . . . . ?
C25 C24 C28 Rh3 62.1(5) . . . . ?
C25 C24 C28 C27 0.0 . . . . ?
C25 C24 C28 C33 173.7(15) . . . . ?
C28 C27 C26 Rh3 60.6(5) . . . . ?
C28 C27 C26 C25 0.0 . . . . ?
C28 C27 C26 C31 179.4(16) . . . . ?
C29 C24 C28 Rh3 -126.4(15) . . . . ?
C29 C24 C28 C27 171.5(16) . . . . ?
C29 C24 C28 C33 -15(2) . . . . ?
C30 C25 C24 Rh3 -117.6(15) . . . . ?
C30 C25 C24 C28 179.6(17) . . . . ?
C30 C25 C24 C29 8(2) . . . . ?
C31 C26 C25 Rh3 -117.6(16) . . . . ?
C31 C26 C25 C24 -179.3(17) . . . . ?
C31 C26 C25 C30 1(2) . . . . ?
C32 C27 C26 Rh3 -123.5(14) . . . . ?
C32 C27 C26 C25 176.0(16) . . . . ?
C32 C27 C26 C31 -5(2) . . . . ?
C32 C27 C28 Rh3 123.1(13) . . . . ?
C32 C27 C28 C24 -176.1(15) . . . . ?
C32 C27 C28 C33 12(2) . . . . ?

_smtbx_masks_special_details     
; 
A solvent mask was calculated and 392 electrons were 
found in a volume of 1750Å³ in 1 void per unit cell. 
This is consistent with the presence of 
10[CH3OH] per Asymmetric Unit 
which account for 360 electrons 
per unit cell. 
;
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 0.000 -0.635 0.105 874.6 196.2 '10 CH3OH'
2 0.500 0.342 0.605 874.6 196.2 '10 CH3OH'

_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_submission_special_instructions 'No special instructions were received'
