# Electronic Supplementary Material (ESI) for Chemical Science.
# This journal is © The Royal Society of Chemistry 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 
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# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
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data_ms1442_1
_database_code_depnum_ccdc_archive 'CCDC 2351158'
loop_
_audit_author_name
_audit_author_address
'Thomas Shaw'
;Los Alamos National Laboratory
United States of America
;
_audit_update_record             
;
2024-04-25 deposited with the CCDC.	2024-06-18 downloaded from the CCDC.
;
_audit_creation_date             2024-03-25
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C104 H96 Cl2 P4 Rh2'
_chemical_formula_sum            'C104 H96 Cl2 P4 Rh2'
_chemical_formula_weight         1746.40
_chemical_absolute_configuration ad
_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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh -1.1178 0.9187 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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           19
_space_group_name_H-M_alt        'P 21 21 21'
_space_group_name_Hall           'P 2ac 2ab'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z'

_cell_length_a                   14.3389(8)
_cell_length_b                   23.8027(13)
_cell_length_c                   24.6313(13)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     8406.8(8)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9865
_cell_measurement_temperature    100.0
_cell_measurement_theta_max      23.40
_cell_measurement_theta_min      2.18
_shelx_estimated_absorpt_T_max   0.965
_shelx_estimated_absorpt_T_min   0.903
_exptl_absorpt_coefficient_mu    0.582
_exptl_absorpt_correction_T_max  0.8919
_exptl_absorpt_correction_T_min  0.8056
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1052 before and 0.0813 after correction.
The Ratio of minimum to maximum transmission is 0.9237.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear orangish red'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   orangish
_exptl_crystal_colour_primary    red
_exptl_crystal_density_diffrn    1.380
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             3616
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
-4.00 1.00 4.00 0.0370
-2.00 3.00 -4.00 0.0610
-1.00 -3.00 -2.00 0.0480
-1.00 4.00 -2.00 0.0820
-1.00 -1.00 -4.00 0.0300
-1.00 0.00 -3.00 0.0390
0.00 1.00 1.00 0.0730
0.00 -3.00 -4.00 0.0320
0.00 0.00 1.00 0.0240
1.00 3.00 2.00 0.0660
1.00 -4.00 2.00 0.0390
1.00 -2.00 2.00 0.0330
1.00 3.00 3.00 0.0600
1.00 2.00 3.00 0.0470
1.00 -4.00 -1.00 0.0380
1.00 1.00 4.00 0.0310
1.00 -2.00 -2.00 0.0200
2.00 -1.00 4.00 0.0220
2.00 -3.00 -1.00 0.0240
2.00 -2.00 -3.00 0.0100

_exptl_crystal_size_max          0.179
_exptl_crystal_size_mid          0.089
_exptl_crystal_size_min          0.062
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.1133
_diffrn_reflns_av_unetI/netI     0.0674
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       30
_diffrn_reflns_limit_k_min       -30
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_number            148406
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.515
_diffrn_reflns_theta_min         2.180
_diffrn_ambient_temperature      100.0
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_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           0.0
_diffrn_source_power             0.0
_diffrn_source_voltage           0.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.843
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.998
_reflns_number_gt                15629
_reflns_number_total             19287
_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. Completness statistics refer to single and
 composite reflections containing twin component 1 only.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT V8.40B (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_refine_diff_density_max         1.147
_refine_diff_density_min         -0.449
_refine_diff_density_rms         0.076
_refine_ls_abs_structure_details 
;
 Refined as an inversion twin.
;
_refine_ls_abs_structure_Flack   -0.03(3)
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.019
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1026
_refine_ls_number_reflns         19287
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0625
_refine_ls_R_factor_gt           0.0434
_refine_ls_restrained_S_all      1.019
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0452P)²+1.8324P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0945
_refine_ls_wR_factor_ref         0.1035
_refine_special_details          
;
 Refined as a 2-component inversion twin.
;
_olex2_refinement_description    
;
1. Twinned data refinement
 Scales: 1.03(3)
 -0.03(3)
2. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
3.a Aromatic/amide H refined with riding coordinates:
 C009(H009), C00A(H00A), C00C(H00C), C00D(H00D), C00E(H00E), C00H(H00H),
 C00I(H00I), C00J(H00J), C00N(H00N), C00O(H00O), C00U(H00U), C00V(H00V),
 C00W(H00W), C00X(H00X), C00Y(H00Y), C00Z(H00Z), C016(H016), C017(H017),
 C019(H019), C01D(H01G), C01F(H01H), C01H(H01I), C01K(H01K), C01L(H01L),
 C01M(H01M), C01N(H01N), C01R(H01R), C01V(H01V), C01W(H01W), C01X(H01X),
 C01Z(H01Z), C022(H022), C023(H023), C024(H024), C02A(H02G), C02B(H02H),
 C02C(H02I), C02D(H02J), C02G(H02N), C02I(H02O), C02K(H02P), C02M(H02T),
 C02P(H02X), C02Q(H02Y), C02R(H02Z), C02T(H1), C02Y(H4), C032(H032)
3.b Idealised Me refined as rotating group:
 C012(H01A,H01B,H01C), C018(H01D,H01E,H01F), C01O(H01J,H01O,H01P), C01Y(H01Q,
 H01S,H01T), C021(H02A,H02B,H02C), C026(H02D,H02E,H02F), C02E(H02K,H02L,H02M),
 C02L(H02Q,H02R,H02S), C02N(H02U,H02V,H02W), C02S(H02,H,HA), C02W(H2,HB,HC),
 C02X(H3,HD,HE), C02Z(H5,HF,HG), C031(H03A,H03B,H03C), C033(H03D,H03E,H03F),
 C034(H03G,H03H,H03I)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_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
Rh01 Rh 0.60231(3) 0.65888(2) 0.71030(2) 0.02555(10) Uani 1 1 d . . . . .
Rh02 Rh 0.45123(3) 0.59822(2) 0.60948(2) 0.02612(10) Uani 1 1 d . . . . .
P03 P 0.58537(10) 0.70074(6) 0.78837(6) 0.0245(3) Uani 1 1 d . . . . .
Cl04 Cl 0.60756(10) 0.63722(6) 0.61431(6) 0.0297(3) Uani 1 1 d . . . . .
Cl05 Cl 0.43564(10) 0.65165(6) 0.69280(6) 0.0347(3) Uani 1 1 d . . . . .
P06 P 0.30138(10) 0.57572(6) 0.61413(6) 0.0262(3) Uani 1 1 d . . . . .
P07 P 0.45729(11) 0.56388(6) 0.52698(6) 0.0254(3) Uani 1 1 d . . . . .
P08 P 0.75004(11) 0.64084(6) 0.72665(6) 0.0283(3) Uani 1 1 d . . . . .
C009 C 0.2254(4) 0.4685(2) 0.5905(2) 0.0272(12) Uani 1 1 d . . . . .
H009 H 0.226495 0.463698 0.628775 0.033 Uiso 1 1 calc R U . . .
C00A C 0.5542(4) 0.5971(3) 0.9444(2) 0.0361(13) Uani 1 1 d . . . . .
H00A H 0.549510 0.574765 0.976237 0.043 Uiso 1 1 calc R U . . .
C00B C 0.2504(4) 0.5212(2) 0.5687(2) 0.0255(12) Uani 1 1 d . . . . .
C00C C 0.5624(4) 0.6032(2) 0.8478(2) 0.0296(12) Uani 1 1 d . . . . .
H00C H 0.562233 0.585359 0.813249 0.036 Uiso 1 1 calc R U . . .
C00D C 0.1980(4) 0.4427(3) 0.3888(3) 0.0339(13) Uani 1 1 d . . . . .
H00D H 0.196678 0.446613 0.350444 0.041 Uiso 1 1 calc R U . . .
C00E C 0.1789(4) 0.5487(3) 0.7024(3) 0.0342(14) Uani 1 1 d . . . . .
H00E H 0.132571 0.571344 0.685639 0.041 Uiso 1 1 calc R U . . .
C00F C 0.5696(4) 0.6614(2) 0.8510(2) 0.0273(12) Uani 1 1 d . . . . .
C00G C 0.4835(4) 0.7470(2) 0.7849(2) 0.0266(12) Uani 1 1 d . . . . .
C00H C 0.1998(4) 0.4244(2) 0.5588(2) 0.0295(13) Uani 1 1 d . . . . .
H00H H 0.182382 0.389760 0.575001 0.035 Uiso 1 1 calc R U . . .
C00I C 0.8119(4) 0.5570(3) 0.8682(3) 0.0398(16) Uani 1 1 d . . . . .
H00I H 0.824584 0.519195 0.878210 0.048 Uiso 1 1 calc R U . . .
C00J C 0.4138(4) 0.7479(2) 0.8240(2) 0.0314(13) Uani 1 1 d . . . . .
H00J H 0.419315 0.724937 0.855424 0.038 Uiso 1 1 calc R U . . .
C00K C 0.5597(5) 0.6555(3) 0.9493(2) 0.0376(14) Uani 1 1 d . . . . .
C00L C 0.2679(4) 0.5474(2) 0.6804(2) 0.0297(13) Uani 1 1 d . . . . .
C00M C 0.8083(4) 0.5989(3) 0.9086(3) 0.0377(15) Uani 1 1 d . . . . .
C00N C 0.1783(4) 0.3905(3) 0.4123(3) 0.0372(15) Uani 1 1 d . . . . .
H00N H 0.164431 0.359215 0.389753 0.045 Uiso 1 1 calc R U . . .
C00O C 0.1087(4) 0.6050(2) 0.4614(2) 0.0301(12) Uani 1 1 d . . . . .
H00O H 0.089351 0.569123 0.473958 0.036 Uiso 1 1 calc R U . . .
C00P C 0.0729(4) 0.6764(3) 0.5801(2) 0.0365(15) Uani 1 1 d . . . . .
C00Q C 0.2463(4) 0.5292(2) 0.5134(2) 0.0241(12) Uani 1 1 d . . . . .
C00R C 0.8459(4) 0.7661(3) 0.8279(2) 0.0299(13) Uani 1 1 d . . . . .
C00S C 0.2292(4) 0.6758(2) 0.4487(2) 0.0305(13) Uani 1 1 d . . . . .
C00T C 0.6409(4) 0.5870(2) 0.3992(2) 0.0322(13) Uani 1 1 d . . . . .
C00U C 0.2665(4) 0.6875(3) 0.5915(2) 0.0339(14) Uani 1 1 d . . . . .
H00U H 0.331955 0.691513 0.596224 0.041 Uiso 1 1 calc R U . . .
C00V C 0.5604(4) 0.5864(2) 0.4301(2) 0.0285(12) Uani 1 1 d . . . . .
H00V H 0.502401 0.594017 0.412975 0.034 Uiso 1 1 calc R U . . .
C00W C 0.8016(4) 0.4718(3) 0.6406(3) 0.0354(14) Uani 1 1 d . . . . .
H00W H 0.809114 0.436772 0.622551 0.043 Uiso 1 1 calc R U . . .
C00X C 0.1280(4) 0.6307(3) 0.5943(2) 0.0319(13) Uani 1 1 d . . . . .
H00X H 0.099338 0.595094 0.599487 0.038 Uiso 1 1 calc R U . . .
C00Y C 0.0449(5) 0.6406(3) 0.4393(2) 0.0349(13) Uani 1 1 d . . . . .
H00Y H -0.017949 0.628481 0.435453 0.042 Uiso 1 1 calc R U . . .
C00Z C 0.4747(4) 0.7817(2) 0.7393(2) 0.0310(13) Uani 1 1 d . . . . .
H00Z H 0.521380 0.780459 0.711904 0.037 Uiso 1 1 calc R U . . .
C010 C 0.6824(4) 0.7494(2) 0.8046(2) 0.0247(12) Uani 1 1 d . . . . .
C011 C 0.2132(5) 0.7336(3) 0.5748(3) 0.0361(15) Uani 1 1 d . . . . .
C012 C 0.8206(4) 0.5521(3) 0.5093(3) 0.0408(16) Uani 1 1 d . . . . .
H01A H 0.830918 0.511419 0.509946 0.061 Uiso 1 1 calc R U . . .
H01B H 0.817374 0.566303 0.546637 0.061 Uiso 1 1 calc R U . . .
H01C H 0.872173 0.570446 0.490178 0.061 Uiso 1 1 calc R U . . .
C013 C 0.5554(4) 0.5711(2) 0.8944(3) 0.0332(13) Uani 1 1 d . . . . .
C014 C 0.3355(4) 0.7823(3) 0.8177(3) 0.0373(15) Uani 1 1 d . . . . .
C015 C 0.8422(4) 0.6914(2) 0.7101(3) 0.0300(12) Uani 1 1 d . . . . .
C016 C 0.2193(4) 0.4882(2) 0.4208(2) 0.0293(13) Uani 1 1 d . . . . .
H016 H 0.233553 0.523308 0.404349 0.035 Uiso 1 1 calc R U . . .
C017 C 0.3376(4) 0.5153(2) 0.7070(3) 0.0330(13) Uani 1 1 d . . . . .
H017 H 0.399409 0.514860 0.693087 0.040 Uiso 1 1 calc R U . . .
C018 C 0.4341(5) 0.3892(3) 0.3914(3) 0.0478(17) Uani 1 1 d . . . . .
H01D H 0.384441 0.408456 0.371329 0.072 Uiso 1 1 calc R U . . .
H01E H 0.421689 0.348768 0.391923 0.072 Uiso 1 1 calc R U . . .
H01F H 0.494131 0.396268 0.373597 0.072 Uiso 1 1 calc R U . . .
C019 C 0.6477(4) 0.5636(2) 0.5103(3) 0.0306(13) Uani 1 1 d . . . . .
H019 H 0.649418 0.555091 0.548005 0.037 Uiso 1 1 calc R U . . .
C01A C 0.2246(4) 0.6357(2) 0.6012(2) 0.0275(12) Uani 1 1 d . . . . .
C01B C 0.2040(4) 0.6208(2) 0.4660(2) 0.0274(12) Uani 1 1 d . . . . .
C01C C 0.2200(4) 0.4832(2) 0.4787(2) 0.0268(12) Uani 1 1 d . . . . .
C01D C 0.9349(4) 0.6808(3) 0.7233(2) 0.0340(14) Uani 1 1 d . . . . .
H01G H 0.951800 0.645268 0.737762 0.041 Uiso 1 1 calc R U . . .
C01E C 0.7789(4) 0.5743(2) 0.6924(2) 0.0303(13) Uani 1 1 d . . . . .
C01F C 0.0698(4) 0.6949(3) 0.4219(3) 0.0370(15) Uani 1 1 d . . . . .
H01H H 0.024476 0.719192 0.406540 0.044 Uiso 1 1 calc R U . . .
C01G C 0.2738(4) 0.5846(2) 0.4887(2) 0.0251(12) Uani 1 1 d . . . . .
C01H C 0.3304(5) 0.8167(3) 0.7726(3) 0.0417(16) Uani 1 1 d . . . . .
H01I H 0.277661 0.840441 0.768422 0.050 Uiso 1 1 calc R U . . .
C01I C 0.3998(5) 0.8176(3) 0.7331(2) 0.0372(14) Uani 1 1 d . . . . .
C01J C 0.3652(4) 0.6020(2) 0.4906(2) 0.0266(12) Uani 1 1 d . . . . .
C01K C 0.7974(4) 0.5699(3) 0.8152(3) 0.0379(15) Uani 1 1 d . . . . .
H01K H 0.798364 0.540697 0.788922 0.045 Uiso 1 1 calc R U . . .
C01L C 0.9342(4) 0.7472(3) 0.8451(3) 0.0370(14) Uani 1 1 d . . . . .
H01L H 0.942857 0.708431 0.852881 0.044 Uiso 1 1 calc R U . . .
C01M C 0.3888(4) 0.6584(2) 0.4744(2) 0.0291(12) Uani 1 1 d . . . . .
H01M H 0.451312 0.671186 0.477654 0.035 Uiso 1 1 calc R U . . .
C01N C 0.6736(4) 0.8074(2) 0.7937(2) 0.0301(12) Uani 1 1 d . . . . .
H01N H 0.615132 0.821845 0.782040 0.036 Uiso 1 1 calc R U . . .
C01O C -0.0300(4) 0.6710(3) 0.5729(3) 0.0388(15) Uani 1 1 d . . . . .
H01J H -0.047516 0.631203 0.574518 0.058 Uiso 1 1 calc R U . . .
H01O H -0.048097 0.686569 0.537659 0.058 Uiso 1 1 calc R U . . .
H01P H -0.061972 0.691525 0.601948 0.058 Uiso 1 1 calc R U . . .
C01P C 0.7933(4) 0.6554(3) 0.8933(3) 0.0345(13) Uani 1 1 d . . . . .
C01Q C 0.7802(4) 0.6683(3) 0.8370(2) 0.0296(13) Uani 1 1 d . . . . .
C01R C 0.8636(4) 0.5602(3) 0.6685(3) 0.0330(14) Uani 1 1 d . . . . .
H01R H 0.913877 0.586137 0.670040 0.040 Uiso 1 1 calc R U . . .
C01S C 0.1561(5) 0.5179(3) 0.7480(3) 0.0375(15) Uani 1 1 d . . . . .
C01T C 0.4373(4) 0.4106(3) 0.4473(3) 0.0368(14) Uani 1 1 d . . . . .
C01U C 0.7666(4) 0.7290(2) 0.8222(2) 0.0283(12) Uani 1 1 d . . . . .
C01V C 1.0067(5) 0.7828(3) 0.8508(3) 0.0448(17) Uani 1 1 d . . . . .
H01V H 1.064968 0.769067 0.863460 0.054 Uiso 1 1 calc R U . . .
C01W C 0.8168(4) 0.7437(3) 0.6906(2) 0.0333(14) Uani 1 1 d . . . . .
H01W H 0.753843 0.750520 0.680688 0.040 Uiso 1 1 calc R U . . .
C01X C 0.7264(4) 0.5765(2) 0.4255(3) 0.0329(14) Uani 1 1 d . . . . .
H01X H 0.782513 0.577545 0.405107 0.039 Uiso 1 1 calc R U . . .
C01Y C 0.5516(5) 0.5069(2) 0.8906(3) 0.0431(15) Uani 1 1 d . . . . .
H01Q H 0.594539 0.490549 0.917205 0.065 Uiso 1 1 calc R U . . .
H01S H 0.569801 0.495045 0.853998 0.065 Uiso 1 1 calc R U . . .
H01T H 0.487981 0.494027 0.898176 0.065 Uiso 1 1 calc R U . . .
C01Z C 0.1176(5) 0.7276(3) 0.5701(3) 0.0408(16) Uani 1 1 d . . . . .
H01Z H 0.081139 0.759140 0.559812 0.049 Uiso 1 1 calc R U . . .
C020 C 0.1991(4) 0.4300(2) 0.5020(2) 0.0293(13) Uani 1 1 d . . . . .
C021 C 0.9676(4) 0.4943(3) 0.6151(3) 0.0393(15) Uani 1 1 d . . . . .
H02A H 0.982153 0.522696 0.587624 0.059 Uiso 1 1 calc R U . . .
H02B H 0.962534 0.457344 0.597749 0.059 Uiso 1 1 calc R U . . .
H02C H 1.017334 0.493364 0.642382 0.059 Uiso 1 1 calc R U . . .
C022 C 0.5687(4) 0.6870(3) 0.9022(2) 0.0339(14) Uani 1 1 d . . . . .
H022 H 0.574327 0.726688 0.904734 0.041 Uiso 1 1 calc R U . . .
C023 C 0.1788(4) 0.3840(2) 0.4676(3) 0.0364(15) Uani 1 1 d . . . . .
H023 H 0.165394 0.348262 0.483037 0.044 Uiso 1 1 calc R U . . .
C024 C 0.4410(4) 0.4682(2) 0.4585(2) 0.0306(13) Uani 1 1 d . . . . .
H024 H 0.441605 0.494143 0.429109 0.037 Uiso 1 1 calc R U . . .
C025 C 0.7809(4) 0.6261(2) 0.7982(2) 0.0303(13) Uani 1 1 d . . . . .
C026 C 0.2606(6) 0.7878(3) 0.5597(3) 0.0508(19) Uani 1 1 d . . . . .
H02D H 0.234131 0.801989 0.525706 0.076 Uiso 1 1 calc R U . . .
H02E H 0.327523 0.781101 0.554998 0.076 Uiso 1 1 calc R U . . .
H02F H 0.250905 0.815458 0.588607 0.076 Uiso 1 1 calc R U . . .
C027 C 0.7304(4) 0.5646(2) 0.4805(3) 0.0309(13) Uani 1 1 d . . . . .
C028 C 0.5619(4) 0.5750(2) 0.4852(2) 0.0279(12) Uani 1 1 d . . . . .
C029 C 1.0035(5) 0.7216(3) 0.7154(3) 0.0424(16) Uani 1 1 d . . . . .
C02A C 0.3230(4) 0.6932(2) 0.4545(3) 0.0325(13) Uani 1 1 d . . . . .
H02G H 0.339969 0.730284 0.444270 0.039 Uiso 1 1 calc R U . . .
C02B C 0.7062(4) 0.5354(2) 0.6899(3) 0.0340(14) Uani 1 1 d . . . . .
H02H H 0.647983 0.544189 0.706276 0.041 Uiso 1 1 calc R U . . .
C02C C 0.2255(5) 0.4863(3) 0.7729(2) 0.0371(15) Uani 1 1 d . . . . .
H02I H 0.210437 0.465159 0.804423 0.045 Uiso 1 1 calc R U . . .
C02D C 0.8187(5) 0.6275(4) 1.0029(3) 0.052(2) Uani 1 1 d . . . . .
H02J H 0.825437 0.618248 1.040197 0.062 Uiso 1 1 calc R U . . .
C02E C 0.3944(5) 0.8568(3) 0.6849(3) 0.0521(19) Uani 1 1 d . . . . .
H02K H 0.355418 0.839803 0.656648 0.078 Uiso 1 1 calc R U . . .
H02L H 0.457219 0.863283 0.670591 0.078 Uiso 1 1 calc R U . . .
H02M H 0.367012 0.892620 0.696280 0.078 Uiso 1 1 calc R U . . .
C02F C 0.8349(4) 0.8238(2) 0.8160(2) 0.0316(13) Uani 1 1 d . . . . .
C02G C 0.4387(4) 0.3745(2) 0.4917(3) 0.0386(15) Uani 1 1 d . . . . .
H02N H 0.436448 0.335233 0.485120 0.046 Uiso 1 1 calc R U . . .
C02H C 0.3161(5) 0.4846(3) 0.7532(3) 0.0383(15) Uani 1 1 d . . . . .
C02I C 0.8053(5) 0.6835(3) 0.9874(3) 0.0464(17) Uani 1 1 d . . . . .
H02O H 0.806039 0.712195 1.014210 0.056 Uiso 1 1 calc R U . . .
C02J C 0.8765(4) 0.5087(2) 0.6422(2) 0.0325(14) Uani 1 1 d . . . . .
C02K C 0.8221(5) 0.5868(3) 0.9650(3) 0.0464(18) Uani 1 1 d . . . . .
H02P H 0.833942 0.549228 0.975862 0.056 Uiso 1 1 calc R U . . .
C02L C 0.0562(5) 0.5169(3) 0.7692(3) 0.0508(18) Uani 1 1 d . . . . .
H02Q H 0.016579 0.496069 0.743771 0.076 Uiso 1 1 calc R U . . .
H02R H 0.033067 0.555472 0.772646 0.076 Uiso 1 1 calc R U . . .
H02S H 0.054706 0.498515 0.804788 0.076 Uiso 1 1 calc R U . . .
C02M C 0.1595(4) 0.7120(3) 0.4275(3) 0.0355(14) Uani 1 1 d . . . . .
H02T H 0.175987 0.749025 0.416908 0.043 Uiso 1 1 calc R U . . .
C02N C 1.1049(5) 0.7101(3) 0.7288(3) 0.0535(19) Uani 1 1 d . . . . .
H02U H 1.108793 0.679035 0.754824 0.080 Uiso 1 1 calc R U . . .
H02V H 1.133103 0.743807 0.744665 0.080 Uiso 1 1 calc R U . . .
H02W H 1.138427 0.699935 0.695530 0.080 Uiso 1 1 calc R U . . .
C02O C 0.7172(4) 0.4837(3) 0.6639(3) 0.0359(14) Uani 1 1 d . . . . .
C02P C 0.7478(4) 0.8435(3) 0.7995(2) 0.0326(13) Uani 1 1 d . . . . .
H02X H 0.739655 0.882407 0.792270 0.039 Uiso 1 1 calc R U . . .
C02Q C 0.4452(4) 0.4506(2) 0.5543(2) 0.0309(12) Uani 1 1 d . . . . .
H02Y H 0.447496 0.464117 0.590582 0.037 Uiso 1 1 calc R U . . .
C02R C 0.9134(5) 0.8603(3) 0.8216(3) 0.0387(15) Uani 1 1 d . . . . .
H02Z H 0.906984 0.899183 0.813679 0.046 Uiso 1 1 calc R U . . .
C02S C 0.6391(5) 0.5990(3) 0.3396(3) 0.0435(16) Uani 1 1 d . . . . .
H02 H 0.575235 0.594902 0.325973 0.065 Uiso 1 1 calc R U . . .
H H 0.680091 0.572535 0.320672 0.065 Uiso 1 1 calc R U . . .
HA H 0.660727 0.637490 0.333090 0.065 Uiso 1 1 calc R U . . .
C02T C 0.7914(4) 0.6973(3) 0.9348(3) 0.0384(15) Uani 1 1 d . . . . .
H1 H 0.780305 0.735430 0.925312 0.046 Uiso 1 1 calc R U . . .
C02U C 0.8829(5) 0.7866(3) 0.6854(3) 0.0400(15) Uani 1 1 d . . . . .
C02V C 0.4433(5) 0.3928(2) 0.5447(3) 0.0390(15) Uani 1 1 d . . . . .
C02W C 0.3900(5) 0.4498(3) 0.7811(3) 0.0527(19) Uani 1 1 d . . . . .
H2 H 0.421859 0.426280 0.754205 0.079 Uiso 1 1 calc R U . . .
HB H 0.360778 0.425859 0.808581 0.079 Uiso 1 1 calc R U . . .
HC H 0.435410 0.474755 0.798530 0.079 Uiso 1 1 calc R U . . .
C02X C 0.5567(6) 0.6835(3) 1.0040(3) 0.0509(18) Uani 1 1 d . . . . .
H3 H 0.609796 0.670727 1.025873 0.076 Uiso 1 1 calc R U . . .
HD H 0.498437 0.673527 1.022482 0.076 Uiso 1 1 calc R U . . .
HE H 0.559956 0.724298 0.999426 0.076 Uiso 1 1 calc R U . . .
C02Y C 0.9971(5) 0.8398(3) 0.8382(3) 0.0461(17) Uani 1 1 d . . . . .
H4 H 1.049180 0.864299 0.841210 0.055 Uiso 1 1 calc R U . . .
C02Z C 0.6332(5) 0.4456(3) 0.6589(3) 0.0490(18) Uani 1 1 d . . . . .
H5 H 0.591223 0.451968 0.689703 0.073 Uiso 1 1 calc R U . . .
HF H 0.653734 0.406314 0.658870 0.073 Uiso 1 1 calc R U . . .
HG H 0.600277 0.453775 0.624969 0.073 Uiso 1 1 calc R U . . .
C030 C 0.4438(4) 0.4886(2) 0.5115(2) 0.0287(12) Uani 1 1 d . . . . .
C031 C 0.8550(6) 0.8454(3) 0.6728(3) 0.054(2) Uani 1 1 d . . . . .
H03A H 0.788204 0.846510 0.664360 0.081 Uiso 1 1 calc R U . . .
H03B H 0.890566 0.858890 0.641396 0.081 Uiso 1 1 calc R U . . .
H03C H 0.867783 0.869400 0.704183 0.081 Uiso 1 1 calc R U . . .
C032 C 0.9743(5) 0.7742(3) 0.6970(3) 0.0433(17) Uani 1 1 d . . . . .
H032 H 1.019837 0.802715 0.692153 0.052 Uiso 1 1 calc R U . . .
C033 C 0.4459(6) 0.3520(3) 0.5915(3) 0.0540(19) Uani 1 1 d . . . . .
H03D H 0.386029 0.332270 0.594000 0.081 Uiso 1 1 calc R U . . .
H03E H 0.457384 0.372503 0.625372 0.081 Uiso 1 1 calc R U . . .
H03F H 0.495988 0.324616 0.585688 0.081 Uiso 1 1 calc R U . . .
C034 C 0.2613(5) 0.7831(4) 0.8603(3) 0.065(2) Uani 1 1 d . . . . .
H03G H 0.246953 0.744545 0.871365 0.097 Uiso 1 1 calc R U . . .
H03H H 0.205056 0.800868 0.845596 0.097 Uiso 1 1 calc R U . . .
H03I H 0.283377 0.804494 0.891750 0.097 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
Rh01 P03 2.1794(15) . ?
Rh01 Cl04 2.4210(14) . ?
Rh01 Cl05 2.4345(15) . ?
Rh01 P08 2.1986(16) . ?
Rh02 Cl04 2.4292(14) . ?
Rh02 Cl05 2.4247(15) . ?
Rh02 P06 2.2173(15) . ?
Rh02 P07 2.1920(16) . ?
P03 C00F 1.819(6) . ?
P03 C00G 1.831(6) . ?
P03 C010 1.854(6) . ?
P06 C00B 1.862(6) . ?
P06 C00L 1.831(6) . ?
P06 C01A 1.831(6) . ?
P07 C01J 1.836(6) . ?
P07 C028 1.838(6) . ?
P07 C030 1.842(6) . ?
P08 C015 1.833(6) . ?
P08 C01E 1.841(6) . ?
P08 C025 1.851(6) . ?
C009 H009 0.9500 . ?
C009 C00B 1.411(8) . ?
C009 C00H 1.360(8) . ?
C00A H00A 0.9500 . ?
C00A C00K 1.398(9) . ?
C00A C013 1.379(9) . ?
C00B C00Q 1.376(8) . ?
C00C H00C 0.9500 . ?
C00C C00F 1.392(8) . ?
C00C C013 1.383(8) . ?
C00D H00D 0.9500 . ?
C00D C00N 1.400(9) . ?
C00D C016 1.375(8) . ?
C00E H00E 0.9500 . ?
C00E C00L 1.386(9) . ?
C00E C01S 1.382(9) . ?
C00F C022 1.401(8) . ?
C00G C00J 1.389(8) . ?
C00G C00Z 1.400(8) . ?
C00H H00H 0.9500 . ?
C00H C020 1.406(8) . ?
C00I H00I 0.9500 . ?
C00I C00M 1.411(10) . ?
C00I C01K 1.356(9) . ?
C00J H00J 0.9500 . ?
C00J C014 1.398(8) . ?
C00K C022 1.386(8) . ?
C00K C02X 1.505(9) . ?
C00L C017 1.417(8) . ?
C00M C01P 1.413(9) . ?
C00M C02K 1.431(9) . ?
C00N H00N 0.9500 . ?
C00N C023 1.371(9) . ?
C00O H00O 0.9500 . ?
C00O C00Y 1.361(8) . ?
C00O C01B 1.422(8) . ?
C00P C00X 1.390(8) . ?
C00P C01O 1.491(9) . ?
C00P C01Z 1.397(9) . ?
C00Q C01C 1.439(8) . ?
C00Q C01G 1.506(7) . ?
C00R C01L 1.409(9) . ?
C00R C01U 1.448(8) . ?
C00R C02F 1.413(8) . ?
C00S C01B 1.423(8) . ?
C00S C02A 1.415(8) . ?
C00S C02M 1.419(8) . ?
C00T C00V 1.382(8) . ?
C00T C01X 1.409(9) . ?
C00T C02S 1.495(8) . ?
C00U H00U 0.9500 . ?
C00U C011 1.400(9) . ?
C00U C01A 1.392(8) . ?
C00V H00V 0.9500 . ?
C00V C028 1.386(8) . ?
C00W H00W 0.9500 . ?
C00W C02J 1.389(9) . ?
C00W C02O 1.369(9) . ?
C00X H00X 0.9500 . ?
C00X C01A 1.401(8) . ?
C00Y H00Y 0.9500 . ?
C00Y C01F 1.408(9) . ?
C00Z H00Z 0.9500 . ?
C00Z C01I 1.382(8) . ?
C010 C01N 1.414(8) . ?
C010 C01U 1.370(8) . ?
C011 C01Z 1.384(10) . ?
C011 C026 1.503(9) . ?
C012 H01A 0.9800 . ?
C012 H01B 0.9800 . ?
C012 H01C 0.9800 . ?
C012 C027 1.504(9) . ?
C013 C01Y 1.531(8) . ?
C014 C01H 1.381(9) . ?
C014 C034 1.494(9) . ?
C015 C01D 1.391(8) . ?
C015 C01W 1.382(8) . ?
C016 H016 0.9500 . ?
C016 C01C 1.431(8) . ?
C017 H017 0.9500 . ?
C017 C02H 1.387(9) . ?
C018 H01D 0.9800 . ?
C018 H01E 0.9800 . ?
C018 H01F 0.9800 . ?
C018 C01T 1.470(9) . ?
C019 H019 0.9500 . ?
C019 C027 1.396(8) . ?
C019 C028 1.403(8) . ?
C01B C01G 1.434(8) . ?
C01C C020 1.421(8) . ?
C01D H01G 0.9500 . ?
C01D C029 1.396(9) . ?
C01E C01R 1.392(8) . ?
C01E C02B 1.397(8) . ?
C01F H01H 0.9500 . ?
C01F C02M 1.355(9) . ?
C01G C01J 1.376(8) . ?
C01H H01I 0.9500 . ?
C01H C01I 1.392(9) . ?
C01I C02E 1.511(9) . ?
C01J C01M 1.441(8) . ?
C01K H01K 0.9500 . ?
C01K C025 1.422(8) . ?
C01L H01L 0.9500 . ?
C01L C01V 1.350(9) . ?
C01M H01M 0.9500 . ?
C01M C02A 1.347(8) . ?
C01N H01N 0.9500 . ?
C01N C02P 1.375(8) . ?
C01O H01J 0.9800 . ?
C01O H01O 0.9800 . ?
C01O H01P 0.9800 . ?
C01P C01Q 1.431(8) . ?
C01P C02T 1.429(9) . ?
C01Q C01U 1.504(8) . ?
C01Q C025 1.387(8) . ?
C01R H01R 0.9500 . ?
C01R C02J 1.400(8) . ?
C01S C02C 1.390(10) . ?
C01S C02L 1.525(9) . ?
C01T C024 1.399(8) . ?
C01T C02G 1.390(9) . ?
C01V H01V 0.9500 . ?
C01V C02Y 1.399(10) . ?
C01W H01W 0.9500 . ?
C01W C02U 1.400(9) . ?
C01X H01X 0.9500 . ?
C01X C027 1.385(9) . ?
C01Y H01Q 0.9800 . ?
C01Y H01S 0.9800 . ?
C01Y H01T 0.9800 . ?
C01Z H01Z 0.9500 . ?
C020 C023 1.415(8) . ?
C021 H02A 0.9800 . ?
C021 H02B 0.9800 . ?
C021 H02C 0.9800 . ?
C021 C02J 1.505(8) . ?
C022 H022 0.9500 . ?
C023 H023 0.9500 . ?
C024 H024 0.9500 . ?
C024 C030 1.395(8) . ?
C026 H02D 0.9800 . ?
C026 H02E 0.9800 . ?
C026 H02F 0.9800 . ?
C029 C02N 1.516(10) . ?
C029 C032 1.394(10) . ?
C02A H02G 0.9500 . ?
C02B H02H 0.9500 . ?
C02B C02O 1.395(9) . ?
C02C H02I 0.9500 . ?
C02C C02H 1.388(10) . ?
C02D H02J 0.9500 . ?
C02D C02I 1.399(11) . ?
C02D C02K 1.347(11) . ?
C02E H02K 0.9800 . ?
C02E H02L 0.9800 . ?
C02E H02M 0.9800 . ?
C02F C02P 1.394(9) . ?
C02F C02R 1.428(8) . ?
C02G H02N 0.9500 . ?
C02G C02V 1.377(9) . ?
C02H C02W 1.510(9) . ?
C02I H02O 0.9500 . ?
C02I C02T 1.351(9) . ?
C02K H02P 0.9500 . ?
C02L H02Q 0.9800 . ?
C02L H02R 0.9800 . ?
C02L H02S 0.9800 . ?
C02M H02T 0.9500 . ?
C02N H02U 0.9800 . ?
C02N H02V 0.9800 . ?
C02N H02W 0.9800 . ?
C02O C02Z 1.513(9) . ?
C02P H02X 0.9500 . ?
C02Q H02Y 0.9500 . ?
C02Q C02V 1.397(8) . ?
C02Q C030 1.389(8) . ?
C02R H02Z 0.9500 . ?
C02R C02Y 1.358(10) . ?
C02S H02 0.9800 . ?
C02S H 0.9800 . ?
C02S HA 0.9800 . ?
C02T H1 0.9500 . ?
C02U C031 1.488(10) . ?
C02U C032 1.373(10) . ?
C02V C033 1.509(9) . ?
C02W H2 0.9800 . ?
C02W HB 0.9800 . ?
C02W HC 0.9800 . ?
C02X H3 0.9800 . ?
C02X HD 0.9800 . ?
C02X HE 0.9800 . ?
C02Y H4 0.9500 . ?
C02Z H5 0.9800 . ?
C02Z HF 0.9800 . ?
C02Z HG 0.9800 . ?
C031 H03A 0.9800 . ?
C031 H03B 0.9800 . ?
C031 H03C 0.9800 . ?
C032 H032 0.9500 . ?
C033 H03D 0.9800 . ?
C033 H03E 0.9800 . ?
C033 H03F 0.9800 . ?
C034 H03G 0.9800 . ?
C034 H03H 0.9800 . ?
C034 H03I 0.9800 . ?

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
P03 Rh01 Cl04 164.26(5) . . ?
P03 Rh01 Cl05 94.54(5) . . ?
P03 Rh01 P08 92.01(6) . . ?
Cl04 Rh01 Cl05 80.95(5) . . ?
P08 Rh01 Cl04 96.16(5) . . ?
P08 Rh01 Cl05 164.68(6) . . ?
Cl05 Rh02 Cl04 80.98(5) . . ?
P06 Rh02 Cl04 169.73(5) . . ?
P06 Rh02 Cl05 89.64(5) . . ?
P07 Rh02 Cl04 98.70(5) . . ?
P07 Rh02 Cl05 169.70(6) . . ?
P07 Rh02 P06 89.79(6) . . ?
C00F P03 Rh01 121.80(19) . . ?
C00F P03 C00G 104.5(3) . . ?
C00F P03 C010 103.4(2) . . ?
C00G P03 Rh01 108.8(2) . . ?
C00G P03 C010 103.5(2) . . ?
C010 P03 Rh01 113.11(18) . . ?
Rh01 Cl04 Rh02 95.77(5) . . ?
Rh02 Cl05 Rh01 95.53(5) . . ?
C00B P06 Rh02 121.15(19) . . ?
C00L P06 Rh02 112.9(2) . . ?
C00L P06 C00B 100.1(3) . . ?
C00L P06 C01A 106.6(3) . . ?
C01A P06 Rh02 112.68(19) . . ?
C01A P06 C00B 101.7(3) . . ?
C01J P07 Rh02 103.86(18) . . ?
C01J P07 C028 104.0(3) . . ?
C01J P07 C030 107.7(3) . . ?
C028 P07 Rh02 119.8(2) . . ?
C028 P07 C030 96.3(3) . . ?
C030 P07 Rh02 123.4(2) . . ?
C015 P08 Rh01 121.7(2) . . ?
C015 P08 C01E 107.5(3) . . ?
C015 P08 C025 99.4(3) . . ?
C01E P08 Rh01 107.5(2) . . ?
C01E P08 C025 102.7(3) . . ?
C025 P08 Rh01 116.22(19) . . ?
C00B C009 H009 118.8 . . ?
C00H C009 H009 118.8 . . ?
C00H C009 C00B 122.5(6) . . ?
C00K C00A H00A 119.2 . . ?
C013 C00A H00A 119.2 . . ?
C013 C00A C00K 121.5(6) . . ?
C009 C00B P06 119.4(4) . . ?
C00Q C00B P06 121.1(4) . . ?
C00Q C00B C009 119.2(5) . . ?
C00F C00C H00C 119.7 . . ?
C013 C00C H00C 119.7 . . ?
C013 C00C C00F 120.5(5) . . ?
C00N C00D H00D 119.7 . . ?
C016 C00D H00D 119.7 . . ?
C016 C00D C00N 120.5(6) . . ?
C00L C00E H00E 119.2 . . ?
C01S C00E H00E 119.2 . . ?
C01S C00E C00L 121.6(6) . . ?
C00C C00F P03 118.2(4) . . ?
C00C C00F C022 119.0(5) . . ?
C022 C00F P03 122.7(4) . . ?
C00J C00G P03 123.4(5) . . ?
C00J C00G C00Z 118.9(5) . . ?
C00Z C00G P03 117.6(4) . . ?
C009 C00H H00H 120.0 . . ?
C009 C00H C020 120.0(5) . . ?
C020 C00H H00H 120.0 . . ?
C00M C00I H00I 119.6 . . ?
C01K C00I H00I 119.6 . . ?
C01K C00I C00M 120.9(6) . . ?
C00G C00J H00J 119.7 . . ?
C00G C00J C014 120.6(6) . . ?
C014 C00J H00J 119.7 . . ?
C00A C00K C02X 121.0(6) . . ?
C022 C00K C00A 118.1(6) . . ?
C022 C00K C02X 120.9(6) . . ?
C00E C00L P06 125.5(5) . . ?
C00E C00L C017 118.8(6) . . ?
C017 C00L P06 115.2(5) . . ?
C00I C00M C01P 119.3(6) . . ?
C00I C00M C02K 122.5(6) . . ?
C01P C00M C02K 118.1(7) . . ?
C00D C00N H00N 119.6 . . ?
C023 C00N C00D 120.7(6) . . ?
C023 C00N H00N 119.6 . . ?
C00Y C00O H00O 119.5 . . ?
C00Y C00O C01B 120.9(5) . . ?
C01B C00O H00O 119.5 . . ?
C00X C00P C01O 121.5(6) . . ?
C00X C00P C01Z 117.8(6) . . ?
C01Z C00P C01O 120.6(6) . . ?
C00B C00Q C01C 119.7(5) . . ?
C00B C00Q C01G 120.6(5) . . ?
C01C C00Q C01G 119.6(5) . . ?
C01L C00R C01U 122.7(6) . . ?
C01L C00R C02F 118.3(6) . . ?
C02F C00R C01U 119.0(5) . . ?
C02A C00S C01B 118.7(5) . . ?
C02A C00S C02M 122.0(5) . . ?
C02M C00S C01B 119.3(6) . . ?
C00V C00T C01X 118.0(6) . . ?
C00V C00T C02S 121.8(6) . . ?
C01X C00T C02S 120.1(6) . . ?
C011 C00U H00U 119.7 . . ?
C01A C00U H00U 119.7 . . ?
C01A C00U C011 120.6(6) . . ?
C00T C00V H00V 119.0 . . ?
C00T C00V C028 121.9(6) . . ?
C028 C00V H00V 119.0 . . ?
C02J C00W H00W 118.6 . . ?
C02O C00W H00W 118.6 . . ?
C02O C00W C02J 122.7(6) . . ?
C00P C00X H00X 119.1 . . ?
C00P C00X C01A 121.7(6) . . ?
C01A C00X H00X 119.1 . . ?
C00O C00Y H00Y 119.3 . . ?
C00O C00Y C01F 121.4(6) . . ?
C01F C00Y H00Y 119.3 . . ?
C00G C00Z H00Z 119.2 . . ?
C01I C00Z C00G 121.5(6) . . ?
C01I C00Z H00Z 119.2 . . ?
C01N C010 P03 120.1(4) . . ?
C01U C010 P03 120.5(4) . . ?
C01U C010 C01N 119.0(5) . . ?
C00U C011 C026 119.9(6) . . ?
C01Z C011 C00U 118.9(6) . . ?
C01Z C011 C026 121.1(6) . . ?
H01A C012 H01B 109.5 . . ?
H01A C012 H01C 109.5 . . ?
H01B C012 H01C 109.5 . . ?
C027 C012 H01A 109.5 . . ?
C027 C012 H01B 109.5 . . ?
C027 C012 H01C 109.5 . . ?
C00A C013 C00C 119.6(5) . . ?
C00A C013 C01Y 120.1(6) . . ?
C00C C013 C01Y 120.3(6) . . ?
C00J C014 C034 120.0(6) . . ?
C01H C014 C00J 118.7(6) . . ?
C01H C014 C034 121.2(6) . . ?
C01D C015 P08 121.2(4) . . ?
C01W C015 P08 118.6(5) . . ?
C01W C015 C01D 119.7(6) . . ?
C00D C016 H016 119.8 . . ?
C00D C016 C01C 120.4(6) . . ?
C01C C016 H016 119.8 . . ?
C00L C017 H017 119.8 . . ?
C02H C017 C00L 120.4(6) . . ?
C02H C017 H017 119.8 . . ?
H01D C018 H01E 109.5 . . ?
H01D C018 H01F 109.5 . . ?
H01E C018 H01F 109.5 . . ?
C01T C018 H01D 109.5 . . ?
C01T C018 H01E 109.5 . . ?
C01T C018 H01F 109.5 . . ?
C027 C019 H019 119.7 . . ?
C027 C019 C028 120.7(6) . . ?
C028 C019 H019 119.7 . . ?
C00U C01A P06 117.4(4) . . ?
C00U C01A C00X 118.8(5) . . ?
C00X C01A P06 123.3(4) . . ?
C00O C01B C00S 117.6(5) . . ?
C00O C01B C01G 122.9(5) . . ?
C00S C01B C01G 119.5(5) . . ?
C016 C01C C00Q 122.1(5) . . ?
C020 C01C C00Q 119.5(5) . . ?
C020 C01C C016 118.4(5) . . ?
C015 C01D H01G 119.5 . . ?
C015 C01D C029 121.0(6) . . ?
C029 C01D H01G 119.5 . . ?
C01R C01E P08 126.7(5) . . ?
C01R C01E C02B 118.2(5) . . ?
C02B C01E P08 115.1(4) . . ?
C00Y C01F H01H 120.4 . . ?
C02M C01F C00Y 119.1(6) . . ?
C02M C01F H01H 120.4 . . ?
C01B C01G C00Q 120.1(5) . . ?
C01J C01G C00Q 120.0(5) . . ?
C01J C01G C01B 119.8(5) . . ?
C014 C01H H01I 118.9 . . ?
C014 C01H C01I 122.2(6) . . ?
C01I C01H H01I 118.9 . . ?
C00Z C01I C01H 117.9(6) . . ?
C00Z C01I C02E 120.5(6) . . ?
C01H C01I C02E 121.5(6) . . ?
C01G C01J P07 123.6(4) . . ?
C01G C01J C01M 119.6(5) . . ?
C01M C01J P07 115.3(4) . . ?
C00I C01K H01K 119.3 . . ?
C00I C01K C025 121.5(6) . . ?
C025 C01K H01K 119.3 . . ?
C00R C01L H01L 119.3 . . ?
C01V C01L C00R 121.5(6) . . ?
C01V C01L H01L 119.3 . . ?
C01J C01M H01M 119.7 . . ?
C02A C01M C01J 120.6(5) . . ?
C02A C01M H01M 119.7 . . ?
C010 C01N H01N 119.3 . . ?
C02P C01N C010 121.4(6) . . ?
C02P C01N H01N 119.3 . . ?
C00P C01O H01J 109.5 . . ?
C00P C01O H01O 109.5 . . ?
C00P C01O H01P 109.5 . . ?
H01J C01O H01O 109.5 . . ?
H01J C01O H01P 109.5 . . ?
H01O C01O H01P 109.5 . . ?
C00M C01P C01Q 118.8(6) . . ?
C00M C01P C02T 118.4(6) . . ?
C02T C01P C01Q 122.8(6) . . ?
C01P C01Q C01U 117.3(5) . . ?
C025 C01Q C01P 120.8(6) . . ?
C025 C01Q C01U 121.9(5) . . ?
C01E C01R H01R 119.2 . . ?
C01E C01R C02J 121.6(6) . . ?
C02J C01R H01R 119.2 . . ?
C00E C01S C02C 118.4(6) . . ?
C00E C01S C02L 120.6(6) . . ?
C02C C01S C02L 120.9(6) . . ?
C024 C01T C018 121.6(6) . . ?
C02G C01T C018 121.6(6) . . ?
C02G C01T C024 116.8(6) . . ?
C00R C01U C01Q 117.5(5) . . ?
C010 C01U C00R 120.4(5) . . ?
C010 C01U C01Q 122.1(5) . . ?
C01L C01V H01V 119.6 . . ?
C01L C01V C02Y 120.7(6) . . ?
C02Y C01V H01V 119.6 . . ?
C015 C01W H01W 119.6 . . ?
C015 C01W C02U 120.8(6) . . ?
C02U C01W H01W 119.6 . . ?
C00T C01X H01X 119.2 . . ?
C027 C01X C00T 121.6(6) . . ?
C027 C01X H01X 119.2 . . ?
C013 C01Y H01Q 109.5 . . ?
C013 C01Y H01S 109.5 . . ?
C013 C01Y H01T 109.5 . . ?
H01Q C01Y H01S 109.5 . . ?
H01Q C01Y H01T 109.5 . . ?
H01S C01Y H01T 109.5 . . ?
C00P C01Z H01Z 119.0 . . ?
C011 C01Z C00P 122.1(6) . . ?
C011 C01Z H01Z 119.0 . . ?
C00H C020 C01C 119.0(5) . . ?
C00H C020 C023 121.5(6) . . ?
C023 C020 C01C 119.5(6) . . ?
H02A C021 H02B 109.5 . . ?
H02A C021 H02C 109.5 . . ?
H02B C021 H02C 109.5 . . ?
C02J C021 H02A 109.5 . . ?
C02J C021 H02B 109.5 . . ?
C02J C021 H02C 109.5 . . ?
C00F C022 H022 119.4 . . ?
C00K C022 C00F 121.2(6) . . ?
C00K C022 H022 119.4 . . ?
C00N C023 C020 120.5(6) . . ?
C00N C023 H023 119.8 . . ?
C020 C023 H023 119.8 . . ?
C01T C024 H024 119.2 . . ?
C030 C024 C01T 121.7(6) . . ?
C030 C024 H024 119.2 . . ?
C01K C025 P08 120.0(5) . . ?
C01Q C025 P08 121.2(4) . . ?
C01Q C025 C01K 118.6(6) . . ?
C011 C026 H02D 109.5 . . ?
C011 C026 H02E 109.5 . . ?
C011 C026 H02F 109.5 . . ?
H02D C026 H02E 109.5 . . ?
H02D C026 H02F 109.5 . . ?
H02E C026 H02F 109.5 . . ?
C019 C027 C012 118.6(6) . . ?
C01X C027 C012 122.5(6) . . ?
C01X C027 C019 118.8(6) . . ?
C00V C028 P07 124.3(5) . . ?
C00V C028 C019 118.9(5) . . ?
C019 C028 P07 116.2(4) . . ?
C01D C029 C02N 121.3(7) . . ?
C032 C029 C01D 117.2(6) . . ?
C032 C029 C02N 121.5(6) . . ?
C00S C02A H02G 119.2 . . ?
C01M C02A C00S 121.5(5) . . ?
C01M C02A H02G 119.2 . . ?
C01E C02B H02H 119.3 . . ?
C02O C02B C01E 121.3(6) . . ?
C02O C02B H02H 119.3 . . ?
C01S C02C H02I 118.9 . . ?
C02H C02C C01S 122.1(6) . . ?
C02H C02C H02I 118.9 . . ?
C02I C02D H02J 120.0 . . ?
C02K C02D H02J 120.0 . . ?
C02K C02D C02I 120.0(7) . . ?
C01I C02E H02K 109.5 . . ?
C01I C02E H02L 109.5 . . ?
C01I C02E H02M 109.5 . . ?
H02K C02E H02L 109.5 . . ?
H02K C02E H02M 109.5 . . ?
H02L C02E H02M 109.5 . . ?
C00R C02F C02R 118.9(6) . . ?
C02P C02F C00R 119.1(5) . . ?
C02P C02F C02R 122.0(6) . . ?
C01T C02G H02N 118.3 . . ?
C02V C02G C01T 123.4(6) . . ?
C02V C02G H02N 118.3 . . ?
C017 C02H C02C 118.7(6) . . ?
C017 C02H C02W 120.4(6) . . ?
C02C C02H C02W 120.9(6) . . ?
C02D C02I H02O 119.5 . . ?
C02T C02I C02D 120.9(7) . . ?
C02T C02I H02O 119.5 . . ?
C00W C02J C01R 117.7(6) . . ?
C00W C02J C021 121.0(5) . . ?
C01R C02J C021 121.3(6) . . ?
C00M C02K H02P 119.2 . . ?
C02D C02K C00M 121.5(7) . . ?
C02D C02K H02P 119.2 . . ?
C01S C02L H02Q 109.5 . . ?
C01S C02L H02R 109.5 . . ?
C01S C02L H02S 109.5 . . ?
H02Q C02L H02R 109.5 . . ?
H02Q C02L H02S 109.5 . . ?
H02R C02L H02S 109.5 . . ?
C00S C02M H02T 119.2 . . ?
C01F C02M C00S 121.6(6) . . ?
C01F C02M H02T 119.2 . . ?
C029 C02N H02U 109.5 . . ?
C029 C02N H02V 109.5 . . ?
C029 C02N H02W 109.5 . . ?
H02U C02N H02V 109.5 . . ?
H02U C02N H02W 109.5 . . ?
H02V C02N H02W 109.5 . . ?
C00W C02O C02B 118.5(6) . . ?
C00W C02O C02Z 123.0(6) . . ?
C02B C02O C02Z 118.4(6) . . ?
C01N C02P C02F 120.9(6) . . ?
C01N C02P H02X 119.5 . . ?
C02F C02P H02X 119.5 . . ?
C02V C02Q H02Y 119.6 . . ?
C030 C02Q H02Y 119.6 . . ?
C030 C02Q C02V 120.8(6) . . ?
C02F C02R H02Z 119.8 . . ?
C02Y C02R C02F 120.5(6) . . ?
C02Y C02R H02Z 119.8 . . ?
C00T C02S H02 109.5 . . ?
C00T C02S H 109.5 . . ?
C00T C02S HA 109.5 . . ?
H02 C02S H 109.5 . . ?
H02 C02S HA 109.5 . . ?
H C02S HA 109.5 . . ?
C01P C02T H1 119.6 . . ?
C02I C02T C01P 120.9(7) . . ?
C02I C02T H1 119.6 . . ?
C01W C02U C031 121.6(7) . . ?
C032 C02U C01W 118.0(6) . . ?
C032 C02U C031 120.2(6) . . ?
C02G C02V C02Q 118.2(6) . . ?
C02G C02V C033 121.5(6) . . ?
C02Q C02V C033 120.3(6) . . ?
C02H C02W H2 109.5 . . ?
C02H C02W HB 109.5 . . ?
C02H C02W HC 109.5 . . ?
H2 C02W HB 109.5 . . ?
H2 C02W HC 109.5 . . ?
HB C02W HC 109.5 . . ?
C00K C02X H3 109.5 . . ?
C00K C02X HD 109.5 . . ?
C00K C02X HE 109.5 . . ?
H3 C02X HD 109.5 . . ?
H3 C02X HE 109.5 . . ?
HD C02X HE 109.5 . . ?
C01V C02Y H4 119.9 . . ?
C02R C02Y C01V 120.1(6) . . ?
C02R C02Y H4 119.9 . . ?
C02O C02Z H5 109.5 . . ?
C02O C02Z HF 109.5 . . ?
C02O C02Z HG 109.5 . . ?
H5 C02Z HF 109.5 . . ?
H5 C02Z HG 109.5 . . ?
HF C02Z HG 109.5 . . ?
C024 C030 P07 122.3(4) . . ?
C02Q C030 P07 118.4(4) . . ?
C02Q C030 C024 119.0(5) . . ?
C02U C031 H03A 109.5 . . ?
C02U C031 H03B 109.5 . . ?
C02U C031 H03C 109.5 . . ?
H03A C031 H03B 109.5 . . ?
H03A C031 H03C 109.5 . . ?
H03B C031 H03C 109.5 . . ?
C029 C032 H032 118.4 . . ?
C02U C032 C029 123.2(6) . . ?
C02U C032 H032 118.4 . . ?
C02V C033 H03D 109.5 . . ?
C02V C033 H03E 109.5 . . ?
C02V C033 H03F 109.5 . . ?
H03D C033 H03E 109.5 . . ?
H03D C033 H03F 109.5 . . ?
H03E C033 H03F 109.5 . . ?
C014 C034 H03G 109.5 . . ?
C014 C034 H03H 109.5 . . ?
C014 C034 H03I 109.5 . . ?
H03G C034 H03H 109.5 . . ?
H03G C034 H03I 109.5 . . ?
H03H C034 H03I 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
Rh01 P03 C00F C00C -4.1(5) . . . . ?
Rh01 P03 C00F C022 172.9(4) . . . . ?
Rh01 P03 C00G C00J 131.3(5) . . . . ?
Rh01 P03 C00G C00Z -46.3(5) . . . . ?
Rh01 P03 C010 C01N 96.6(4) . . . . ?
Rh01 P03 C010 C01U -76.8(5) . . . . ?
Rh01 P08 C015 C01D 176.6(4) . . . . ?
Rh01 P08 C015 C01W 4.8(6) . . . . ?
Rh01 P08 C01E C01R 145.7(5) . . . . ?
Rh01 P08 C01E C02B -33.0(5) . . . . ?
Rh01 P08 C025 C01K 103.2(5) . . . . ?
Rh01 P08 C025 C01Q -70.9(5) . . . . ?
Rh02 P06 C00B C009 107.7(4) . . . . ?
Rh02 P06 C00B C00Q -65.0(5) . . . . ?
Rh02 P06 C00L C00E 155.2(5) . . . . ?
Rh02 P06 C00L C017 -33.5(5) . . . . ?
Rh02 P06 C01A C00U -1.5(5) . . . . ?
Rh02 P06 C01A C00X 170.7(4) . . . . ?
Rh02 P07 C01J C01G -88.1(5) . . . . ?
Rh02 P07 C01J C01M 78.0(4) . . . . ?
Rh02 P07 C028 C00V -140.7(4) . . . . ?
Rh02 P07 C028 C019 48.0(5) . . . . ?
Rh02 P07 C030 C024 175.1(4) . . . . ?
Rh02 P07 C030 C02Q -10.9(6) . . . . ?
P03 C00F C022 C00K -177.8(5) . . . . ?
P03 C00G C00J C014 -176.8(5) . . . . ?
P03 C00G C00Z C01I 179.5(5) . . . . ?
P03 C010 C01N C02P -172.6(4) . . . . ?
P03 C010 C01U C00R 171.7(4) . . . . ?
P03 C010 C01U C01Q -9.4(8) . . . . ?
P06 C00B C00Q C01C 170.5(4) . . . . ?
P06 C00B C00Q C01G -6.3(7) . . . . ?
P06 C00L C017 C02H -170.1(5) . . . . ?
P07 C01J C01M C02A -170.3(5) . . . . ?
P08 C015 C01D C029 -173.7(5) . . . . ?
P08 C015 C01W C02U 170.1(5) . . . . ?
P08 C01E C01R C02J -178.2(5) . . . . ?
P08 C01E C02B C02O 178.3(5) . . . . ?
C009 C00B C00Q C01C -2.3(8) . . . . ?
C009 C00B C00Q C01G -179.1(5) . . . . ?
C009 C00H C020 C01C -3.7(9) . . . . ?
C009 C00H C020 C023 175.8(5) . . . . ?
C00A C00K C022 C00F 1.8(9) . . . . ?
C00B P06 C00L C00E -74.6(6) . . . . ?
C00B P06 C00L C017 96.7(5) . . . . ?
C00B P06 C01A C00U -132.7(5) . . . . ?
C00B P06 C01A C00X 39.5(6) . . . . ?
C00B C009 C00H C020 1.1(9) . . . . ?
C00B C00Q C01C C016 -176.7(5) . . . . ?
C00B C00Q C01C C020 -0.3(8) . . . . ?
C00B C00Q C01G C01B -109.1(6) . . . . ?
C00B C00Q C01G C01J 67.3(7) . . . . ?
C00C C00F C022 C00K -0.7(9) . . . . ?
C00D C00N C023 C020 0.1(10) . . . . ?
C00D C016 C01C C00Q 176.9(5) . . . . ?
C00D C016 C01C C020 0.5(9) . . . . ?
C00E C00L C017 C02H 1.9(9) . . . . ?
C00E C01S C02C C02H -0.4(10) . . . . ?
C00F P03 C00G C00J -0.2(5) . . . . ?
C00F P03 C00G C00Z -177.9(4) . . . . ?
C00F P03 C010 C01N -129.7(5) . . . . ?
C00F P03 C010 C01U 56.9(5) . . . . ?
C00F C00C C013 C00A 1.0(9) . . . . ?
C00F C00C C013 C01Y -177.4(5) . . . . ?
C00G P03 C00F C00C 119.4(5) . . . . ?
C00G P03 C00F C022 -63.6(5) . . . . ?
C00G P03 C010 C01N -21.0(5) . . . . ?
C00G P03 C010 C01U 165.6(5) . . . . ?
C00G C00J C014 C01H -2.1(9) . . . . ?
C00G C00J C014 C034 -179.5(6) . . . . ?
C00G C00Z C01I C01H -2.9(9) . . . . ?
C00G C00Z C01I C02E 176.8(6) . . . . ?
C00H C009 C00B P06 -170.9(5) . . . . ?
C00H C009 C00B C00Q 2.0(9) . . . . ?
C00H C020 C023 C00N 179.9(6) . . . . ?
C00I C00M C01P C01Q 1.2(9) . . . . ?
C00I C00M C01P C02T -179.0(6) . . . . ?
C00I C00M C02K C02D 179.8(7) . . . . ?
C00I C01K C025 P08 -174.0(5) . . . . ?
C00I C01K C025 C01Q 0.3(9) . . . . ?
C00J C00G C00Z C01I 1.8(9) . . . . ?
C00J C014 C01H C01I 0.9(10) . . . . ?
C00K C00A C013 C00C 0.1(9) . . . . ?
C00K C00A C013 C01Y 178.5(6) . . . . ?
C00L P06 C00B C009 -17.0(5) . . . . ?
C00L P06 C00B C00Q 170.2(5) . . . . ?
C00L P06 C01A C00U 122.8(5) . . . . ?
C00L P06 C01A C00X -64.9(6) . . . . ?
C00L C00E C01S C02C 1.9(9) . . . . ?
C00L C00E C01S C02L -175.9(6) . . . . ?
C00L C017 C02H C02C -0.4(9) . . . . ?
C00L C017 C02H C02W 179.1(6) . . . . ?
C00M C00I C01K C025 1.8(10) . . . . ?
C00M C01P C01Q C01U -178.6(5) . . . . ?
C00M C01P C01Q C025 0.9(8) . . . . ?
C00M C01P C02T C02I 1.1(9) . . . . ?
C00N C00D C016 C01C -1.1(9) . . . . ?
C00O C00Y C01F C02M 0.0(9) . . . . ?
C00O C01B C01G C00Q -5.3(8) . . . . ?
C00O C01B C01G C01J 178.3(5) . . . . ?
C00P C00X C01A P06 -174.6(5) . . . . ?
C00P C00X C01A C00U -2.4(9) . . . . ?
C00Q C01C C020 C00H 3.3(8) . . . . ?
C00Q C01C C020 C023 -176.2(5) . . . . ?
C00Q C01G C01J P07 -5.2(7) . . . . ?
C00Q C01G C01J C01M -170.7(5) . . . . ?
C00R C01L C01V C02Y -1.8(11) . . . . ?
C00R C02F C02P C01N -1.4(9) . . . . ?
C00R C02F C02R C02Y -0.1(9) . . . . ?
C00S C01B C01G C00Q 172.5(5) . . . . ?
C00S C01B C01G C01J -3.8(8) . . . . ?
C00T C00V C028 P07 -171.3(4) . . . . ?
C00T C00V C028 C019 -0.2(8) . . . . ?
C00T C01X C027 C012 178.7(6) . . . . ?
C00T C01X C027 C019 -0.5(9) . . . . ?
C00U C011 C01Z C00P -1.8(10) . . . . ?
C00V C00T C01X C027 1.3(9) . . . . ?
C00X C00P C01Z C011 -0.9(10) . . . . ?
C00Y C00O C01B C00S 2.5(9) . . . . ?
C00Y C00O C01B C01G -179.6(5) . . . . ?
C00Y C01F C02M C00S 2.1(10) . . . . ?
C00Z C00G C00J C014 0.8(8) . . . . ?
C010 P03 C00F C00C -132.6(4) . . . . ?
C010 P03 C00F C022 44.4(5) . . . . ?
C010 P03 C00G C00J -108.2(5) . . . . ?
C010 P03 C00G C00Z 74.2(5) . . . . ?
C010 C01N C02P C02F 0.7(9) . . . . ?
C011 C00U C01A P06 172.2(5) . . . . ?
C011 C00U C01A C00X -0.4(9) . . . . ?
C013 C00A C00K C022 -1.5(10) . . . . ?
C013 C00A C00K C02X 179.0(6) . . . . ?
C013 C00C C00F P03 176.5(4) . . . . ?
C013 C00C C00F C022 -0.7(8) . . . . ?
C014 C01H C01I C00Z 1.6(10) . . . . ?
C014 C01H C01I C02E -178.1(6) . . . . ?
C015 P08 C01E C01R 13.1(7) . . . . ?
C015 P08 C01E C02B -165.7(5) . . . . ?
C015 P08 C025 C01K -124.3(5) . . . . ?
C015 P08 C025 C01Q 61.6(5) . . . . ?
C015 C01D C029 C02N -179.0(6) . . . . ?
C015 C01D C029 C032 3.6(9) . . . . ?
C015 C01W C02U C031 -170.4(6) . . . . ?
C015 C01W C02U C032 3.9(9) . . . . ?
C016 C00D C00N C023 0.7(10) . . . . ?
C016 C01C C020 C00H 179.8(5) . . . . ?
C016 C01C C020 C023 0.3(8) . . . . ?
C018 C01T C024 C030 179.9(6) . . . . ?
C018 C01T C02G C02V 178.8(6) . . . . ?
C01A P06 C00B C009 -126.5(5) . . . . ?
C01A P06 C00B C00Q 60.8(5) . . . . ?
C01A P06 C00L C00E 30.9(6) . . . . ?
C01A P06 C00L C017 -157.7(4) . . . . ?
C01A C00U C011 C01Z 2.4(9) . . . . ?
C01A C00U C011 C026 -174.5(6) . . . . ?
C01B C00O C00Y C01F -2.3(9) . . . . ?
C01B C00S C02A C01M 2.2(9) . . . . ?
C01B C00S C02M C01F -1.8(9) . . . . ?
C01B C01G C01J P07 171.2(4) . . . . ?
C01B C01G C01J C01M 5.7(8) . . . . ?
C01C C00Q C01G C01B 74.1(7) . . . . ?
C01C C00Q C01G C01J -109.5(6) . . . . ?
C01C C020 C023 C00N -0.7(9) . . . . ?
C01D C015 C01W C02U -1.8(9) . . . . ?
C01D C029 C032 C02U -1.4(10) . . . . ?
C01E P08 C015 C01D -59.0(6) . . . . ?
C01E P08 C015 C01W 129.2(5) . . . . ?
C01E P08 C025 C01K -13.8(6) . . . . ?
C01E P08 C025 C01Q 172.1(5) . . . . ?
C01E C01R C02J C00W 0.0(9) . . . . ?
C01E C01R C02J C021 178.4(6) . . . . ?
C01E C02B C02O C00W 0.0(9) . . . . ?
C01E C02B C02O C02Z -175.2(6) . . . . ?
C01G C00Q C01C C016 0.2(8) . . . . ?
C01G C00Q C01C C020 176.5(5) . . . . ?
C01G C01J C01M C02A -3.7(8) . . . . ?
C01J P07 C028 C00V -25.4(5) . . . . ?
C01J P07 C028 C019 163.3(4) . . . . ?
C01J P07 C030 C024 54.3(6) . . . . ?
C01J P07 C030 C02Q -131.7(5) . . . . ?
C01J C01M C02A C00S -0.4(9) . . . . ?
C01K C00I C00M C01P -2.6(9) . . . . ?
C01K C00I C00M C02K 179.2(6) . . . . ?
C01L C00R C01U C010 -179.2(6) . . . . ?
C01L C00R C01U C01Q 1.8(9) . . . . ?
C01L C00R C02F C02P -179.2(6) . . . . ?
C01L C00R C02F C02R 0.3(9) . . . . ?
C01L C01V C02Y C02R 2.0(11) . . . . ?
C01N C010 C01U C00R -1.7(8) . . . . ?
C01N C010 C01U C01Q 177.2(5) . . . . ?
C01O C00P C00X C01A -179.8(5) . . . . ?
C01O C00P C01Z C011 -178.1(6) . . . . ?
C01P C00M C02K C02D 1.6(10) . . . . ?
C01P C01Q C01U C00R 69.3(7) . . . . ?
C01P C01Q C01U C010 -109.6(6) . . . . ?
C01P C01Q C025 P08 172.6(4) . . . . ?
C01P C01Q C025 C01K -1.7(8) . . . . ?
C01Q C01P C02T C02I -179.1(6) . . . . ?
C01R C01E C02B C02O -0.5(9) . . . . ?
C01S C00E C00L P06 168.4(5) . . . . ?
C01S C00E C00L C017 -2.7(9) . . . . ?
C01S C02C C02H C017 -0.3(10) . . . . ?
C01S C02C C02H C02W -179.9(6) . . . . ?
C01T C024 C030 P07 175.5(5) . . . . ?
C01T C024 C030 C02Q 1.6(9) . . . . ?
C01T C02G C02V C02Q 0.9(10) . . . . ?
C01T C02G C02V C033 -179.2(6) . . . . ?
C01U C00R C01L C01V -179.1(6) . . . . ?
C01U C00R C02F C02P 0.6(8) . . . . ?
C01U C00R C02F C02R -179.9(5) . . . . ?
C01U C010 C01N C02P 0.9(9) . . . . ?
C01U C01Q C025 P08 -8.0(8) . . . . ?
C01U C01Q C025 C01K 177.8(5) . . . . ?
C01W C015 C01D C029 -2.0(9) . . . . ?
C01W C02U C032 C029 -2.3(10) . . . . ?
C01X C00T C00V C028 -1.0(8) . . . . ?
C01Z C00P C00X C01A 3.1(9) . . . . ?
C024 C01T C02G C02V 0.2(10) . . . . ?
C025 P08 C015 C01D 47.6(6) . . . . ?
C025 P08 C015 C01W -124.2(5) . . . . ?
C025 P08 C01E C01R -91.2(6) . . . . ?
C025 P08 C01E C02B 90.0(5) . . . . ?
C025 C01Q C01U C00R -110.2(6) . . . . ?
C025 C01Q C01U C010 70.9(8) . . . . ?
C026 C011 C01Z C00P 175.2(6) . . . . ?
C027 C019 C028 P07 172.9(4) . . . . ?
C027 C019 C028 C00V 1.1(8) . . . . ?
C028 P07 C01J C01G 145.7(5) . . . . ?
C028 P07 C01J C01M -48.2(5) . . . . ?
C028 P07 C030 C024 -52.7(6) . . . . ?
C028 P07 C030 C02Q 121.3(5) . . . . ?
C028 C019 C027 C012 -180.0(5) . . . . ?
C028 C019 C027 C01X -0.7(9) . . . . ?
C02A C00S C01B C00O 177.8(5) . . . . ?
C02A C00S C01B C01G -0.1(8) . . . . ?
C02A C00S C02M C01F 179.9(6) . . . . ?
C02B C01E C01R C02J 0.5(9) . . . . ?
C02D C02I C02T C01P -2.2(11) . . . . ?
C02F C00R C01L C01V 0.7(10) . . . . ?
C02F C00R C01U C010 1.0(8) . . . . ?
C02F C00R C01U C01Q -178.0(5) . . . . ?
C02F C02R C02Y C01V -1.1(10) . . . . ?
C02G C01T C024 C030 -1.5(9) . . . . ?
C02I C02D C02K C00M -2.7(11) . . . . ?
C02J C00W C02O C02B 0.5(10) . . . . ?
C02J C00W C02O C02Z 175.5(6) . . . . ?
C02K C00M C01P C01Q 179.5(5) . . . . ?
C02K C00M C01P C02T -0.8(9) . . . . ?
C02K C02D C02I C02T 3.0(12) . . . . ?
C02L C01S C02C C02H 177.4(6) . . . . ?
C02M C00S C01B C00O -0.5(8) . . . . ?
C02M C00S C01B C01G -178.4(5) . . . . ?
C02M C00S C02A C01M -179.5(6) . . . . ?
C02N C029 C032 C02U -178.8(6) . . . . ?
C02O C00W C02J C01R -0.6(9) . . . . ?
C02O C00W C02J C021 -178.9(6) . . . . ?
C02P C02F C02R C02Y 179.4(6) . . . . ?
C02R C02F C02P C01N 179.1(6) . . . . ?
C02S C00T C00V C028 179.6(6) . . . . ?
C02S C00T C01X C027 -179.3(6) . . . . ?
C02T C01P C01Q C01U 1.6(8) . . . . ?
C02T C01P C01Q C025 -178.9(6) . . . . ?
C02V C02Q C030 P07 -174.5(5) . . . . ?
C02V C02Q C030 C024 -0.4(9) . . . . ?
C02X C00K C022 C00F -178.7(6) . . . . ?
C030 P07 C01J C01G 44.3(5) . . . . ?
C030 P07 C01J C01M -149.7(4) . . . . ?
C030 P07 C028 C00V 84.7(5) . . . . ?
C030 P07 C028 C019 -86.6(5) . . . . ?
C030 C02Q C02V C02G -0.8(10) . . . . ?
C030 C02Q C02V C033 179.3(6) . . . . ?
C031 C02U C032 C029 172.1(6) . . . . ?
C034 C014 C01H C01I 178.3(7) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
1 1.03(3)
2 -0.03(3)

