#------------------------------------------------------------------------------
#$Date: 2016-03-25 15:20:24 +0100 (Fri 25 de Mar de 2016) $
#$Revision: 179964 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/58/7025816.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7025816
loop_
_publ_author_name
'López-Valbuena, Josep M'
'Escudero-Adan, Eduardo C'
'Benet-Buchholz, Jordi'
'Freixa, Zoraida'
'van Leeuwen, Piet W. N. M.'
_publ_section_title
;
 An approach to bimetallic catalysts by ligand design.
;
_journal_issue                   36
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              8560
_journal_page_last               8574
_journal_paper_doi               10.1039/c0dt00011f
_journal_volume                  39
_journal_year                    2010
_chemical_formula_sum            'C88 H76 Cl10 O6 P4 Rh2'
_chemical_formula_weight         1913.69
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 105.1580(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   12.7468(5)
_cell_length_b                   18.3066(7)
_cell_length_c                   19.1337(8)
_cell_measurement_reflns_used    8038
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      39.41
_cell_measurement_theta_min      3.28
_cell_volume                     4309.5(3)
_computing_cell_refinement       'Bruker APEX2 v2009.1-0'
_computing_data_collection       'Bruker APEX2 v2009.1-0'
_computing_data_reduction        'Bruker SAINT V7.60A'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 512
_diffrn_detector_type            '4K CCD area detector APEX II'
_diffrn_measured_fraction_theta_full 0.957
_diffrn_measured_fraction_theta_max 0.957
_diffrn_measurement_device_type  'Kappa 4-axis goniometer bruker-nonius'
_diffrn_measurement_method
;
Fullsphere data collection, phi and omega scans
;
_diffrn_measurement_specimen_support
'magnetic support whith 10 micron nylon fiber cryoloop'
_diffrn_radiation_monochromator  'Multilayer Montel 200 mirrors'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0224
_diffrn_reflns_av_sigmaI/netI    0.0246
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       31
_diffrn_reflns_limit_k_min       -31
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_number            65761
_diffrn_reflns_theta_full        37.50
_diffrn_reflns_theta_max         37.50
_diffrn_reflns_theta_min         3.28
_diffrn_source                   'rotating anode X-ray tube'
_diffrn_source_current           70
_diffrn_source_power             50
_diffrn_source_size              '3 mm x 0.3 mm fine focus'
_diffrn_source_type              'Bruker-Nonius FR 591'
_exptl_absorpt_coefficient_mu    0.819
_exptl_absorpt_correction_T_max  1.0
_exptl_absorpt_correction_T_min  0.89
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details
;
SADABS Version 2008/1 Bruker-Nonius
Blessing, Acta Cryst. (1995) A51 33-38
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.475
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1944
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.854
_refine_diff_density_min         -2.240
_refine_diff_density_rms         0.112
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.075
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     538
_refine_ls_number_reflns         21725
_refine_ls_number_restraints     57
_refine_ls_restrained_S_all      1.089
_refine_ls_R_factor_all          0.0558
_refine_ls_R_factor_gt           0.0456
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0654P)²+5.9236P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1284
_refine_ls_wR_factor_ref         0.1385
_reflns_number_gt                18426
_reflns_number_total             21725
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c0dt00011f.txt
_cod_data_source_block           jm147_0m_20
_cod_depositor_comments
;
The following automatic conversions were performed:
'_diffrn_measurement_specimen_suppport' tag replaced with
'_diffrn_measurement_specimen_support'.

Automatic conversion script
Id: cif_correct_tags 1440 2010-10-19 06:21:57Z saulius 

The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 
;
_cod_original_sg_symbol_H-M      P2(1)/c
_cod_database_code               7025816
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Rh1 Rh 0.165828(8) 0.435370(6) 0.180232(6) 0.01451(2) Uani 1 1 d . . .
Cl1 Cl 0.21405(4) 0.53280(2) 0.26589(2) 0.02645(8) Uani 1 1 d . . .
P1 P 0.03545(3) 0.40578(2) 0.24076(2) 0.01497(6) Uani 1 1 d . . .
O1 O 0.11671(14) 0.30457(8) 0.08688(9) 0.0335(3) Uani 1 1 d . . .
C1 C 0.13475(14) 0.35601(9) 0.12184(9) 0.0220(3) Uani 1 1 d . . .
O2 O -0.04899(10) 0.50973(6) 0.12632(6) 0.01849(19) Uani 1 1 d . . .
P2 P 0.29189(3) 0.48076(2) 0.12234(2) 0.01611(6) Uani 1 1 d . . .
C2 C -0.07269(12) 0.33935(8) 0.20644(8) 0.0172(2) Uani 1 1 d . . .
O3 O -0.12049(8) 0.55474(6) 0.01070(6) 0.01684(18) Uani 1 1 d . . .
C3 C -0.18274(13) 0.35688(10) 0.19400(10) 0.0236(3) Uani 1 1 d . . .
H3 H -0.2039 0.4061 0.1985 0.028 Uiso 1 1 calc R . .
C4 C -0.26142(15) 0.30247(12) 0.17508(12) 0.0308(4) Uani 1 1 d . . .
H4 H -0.3361 0.3147 0.1669 0.037 Uiso 1 1 calc R . .
C5 C -0.23168(16) 0.23055(11) 0.16812(13) 0.0317(4) Uani 1 1 d . . .
H5 H -0.2857 0.1936 0.1554 0.038 Uiso 1 1 calc R . .
C6 C -0.12183(16) 0.21262(10) 0.17988(12) 0.0291(4) Uani 1 1 d . . .
H6 H -0.1009 0.1634 0.1753 0.035 Uiso 1 1 calc R . .
C7 C -0.04356(14) 0.26689(9) 0.19825(10) 0.0227(3) Uani 1 1 d . . .
H7 H 0.0309 0.2546 0.2054 0.027 Uiso 1 1 calc R . .
C8 C 0.09288(12) 0.37192(8) 0.33242(8) 0.0178(2) Uani 1 1 d . . .
C9 C 0.02719(14) 0.34516(9) 0.37530(9) 0.0208(3) Uani 1 1 d . . .
H9 H -0.0497 0.3452 0.3571 0.025 Uiso 1 1 calc R . .
C10 C 0.07491(16) 0.31851(9) 0.44448(9) 0.0239(3) Uani 1 1 d . . .
H10 H 0.0305 0.3017 0.4740 0.029 Uiso 1 1 calc R . .
C11 C 0.18717(17) 0.31641(10) 0.47038(9) 0.0264(3) Uani 1 1 d . . .
H11 H 0.2193 0.2972 0.5172 0.032 Uiso 1 1 calc R . .
C12 C 0.25264(15) 0.34218(10) 0.42832(9) 0.0257(3) Uani 1 1 d . . .
H12 H 0.3295 0.3408 0.4464 0.031 Uiso 1 1 calc R . .
C13 C 0.20578(13) 0.37012(9) 0.35946(9) 0.0218(3) Uani 1 1 d . . .
H13 H 0.2508 0.3880 0.3308 0.026 Uiso 1 1 calc R . .
C14 C -0.03875(12) 0.48862(8) 0.25022(8) 0.0166(2) Uani 1 1 d . . .
C15 C -0.06287(13) 0.51119(9) 0.31400(8) 0.0197(2) Uani 1 1 d . . .
H15 H -0.0438 0.4806 0.3555 0.024 Uiso 1 1 calc R . .
C16 C -0.11453(14) 0.57794(9) 0.31791(9) 0.0212(3) Uani 1 1 d . . .
C17 C -0.13745(12) 0.62368(8) 0.25768(8) 0.0189(2) Uani 1 1 d . . .
H17 H -0.1709 0.6696 0.2602 0.023 Uiso 1 1 calc R . .
C18 C -0.11238(11) 0.60355(8) 0.19390(8) 0.0166(2) Uani 1 1 d . . .
C19 C -0.06754(11) 0.53478(8) 0.18978(8) 0.0162(2) Uani 1 1 d . . .
C20 C -0.12405(11) 0.65256(8) 0.12909(8) 0.0174(2) Uani 1 1 d . . .
H20 H -0.1269 0.7048 0.1436 0.021 Uiso 1 1 calc R . .
C21 C -0.02271(12) 0.63900(9) 0.10189(9) 0.0192(2) Uani 1 1 d . . .
H21A H -0.0200 0.6738 0.0628 0.023 Uiso 1 1 calc R . .
H21B H 0.0441 0.6449 0.1418 0.023 Uiso 1 1 calc R . .
C22 C -0.03239(11) 0.56172(8) 0.07379(8) 0.0169(2) Uani 1 1 d . . .
H22 H 0.0363 0.5488 0.0608 0.020 Uiso 1 1 calc R . .
C23 C -0.1437(2) 0.60113(12) 0.38614(11) 0.0329(4) Uani 1 1 d . . .
H23A H -0.1261 0.6529 0.3955 0.049 Uiso 1 1 calc R . .
H23B H -0.1022 0.5719 0.4270 0.049 Uiso 1 1 calc R . .
H23C H -0.2216 0.5936 0.3803 0.049 Uiso 1 1 calc R . .
C24 C 0.30816(11) 0.42892(8) 0.04395(8) 0.0167(2) Uani 1 1 d . . .
C25 C 0.21701(11) 0.41313(8) -0.01364(8) 0.0161(2) Uani 1 1 d . . .
C26 C 0.22453(11) 0.36644(8) -0.06961(8) 0.0167(2) Uani 1 1 d . . .
C27 C 0.32547(12) 0.33663(8) -0.06899(9) 0.0190(2) Uani 1 1 d . . .
H27 H 0.3313 0.3057 -0.1077 0.023 Uiso 1 1 calc R . .
C28 C 0.41803(12) 0.35091(9) -0.01311(9) 0.0208(3) Uani 1 1 d . . .
C29 C 0.40763(12) 0.39687(9) 0.04291(9) 0.0194(2) Uani 1 1 d . . .
H29 H 0.4699 0.4067 0.0815 0.023 Uiso 1 1 calc R . .
C30 C 0.52508(14) 0.31571(12) -0.01219(11) 0.0292(4) Uani 1 1 d . . .
H30A H 0.5846 0.3487 0.0110 0.044 Uiso 1 1 calc R . .
H30B H 0.5280 0.3058 -0.0620 0.044 Uiso 1 1 calc R . .
H30C H 0.5323 0.2698 0.0150 0.044 Uiso 1 1 calc R . .
C31 C 0.42901(12) 0.48075(9) 0.18226(9) 0.0203(3) Uani 1 1 d . . .
C32 C 0.51307(14) 0.52189(11) 0.16782(11) 0.0275(3) Uani 1 1 d . . .
H32 H 0.4988 0.5538 0.1272 0.033 Uiso 1 1 calc R . .
C33 C 0.61803(15) 0.51621(13) 0.21298(14) 0.0350(4) Uani 1 1 d . . .
H33 H 0.6753 0.5439 0.2027 0.042 Uiso 1 1 calc R . .
C34 C 0.63936(16) 0.47059(15) 0.27259(13) 0.0369(5) Uani 1 1 d . . .
H34 H 0.7108 0.4676 0.3036 0.044 Uiso 1 1 calc R . .
C35 C 0.55657(17) 0.42929(16) 0.28711(13) 0.0396(5) Uani 1 1 d . . .
H35 H 0.5713 0.3974 0.3277 0.048 Uiso 1 1 calc R . .
C36 C 0.45149(15) 0.43458(12) 0.24208(11) 0.0302(4) Uani 1 1 d . . .
H36 H 0.3947 0.4064 0.2523 0.036 Uiso 1 1 calc R . .
C37 C 0.26906(12) 0.57638(8) 0.09323(9) 0.0200(3) Uani 1 1 d . . .
C38 C 0.22044(13) 0.59660(9) 0.02149(10) 0.0232(3) Uani 1 1 d . . .
H38 H 0.2038 0.5604 -0.0153 0.028 Uiso 1 1 calc R . .
C39 C 0.19627(14) 0.66967(10) 0.00384(12) 0.0278(3) Uani 1 1 d . . .
H39 H 0.1623 0.6828 -0.0449 0.033 Uiso 1 1 calc R . .
C40 C 0.22146(16) 0.72343(10) 0.05697(13) 0.0313(4) Uani 1 1 d . . .
H40 H 0.2047 0.7731 0.0447 0.038 Uiso 1 1 calc R . .
C41 C 0.27108(18) 0.70407(10) 0.12784(13) 0.0320(4) Uani 1 1 d . . .
H41 H 0.2891 0.7407 0.1642 0.038 Uiso 1 1 calc R . .
C42 C 0.29476(16) 0.63106(10) 0.14631(11) 0.0266(3) Uani 1 1 d . . .
H42 H 0.3285 0.6183 0.1951 0.032 Uiso 1 1 calc R . .
C1V C 0.4043(7) 0.2497(3) 0.6781(2) 0.082(2) Uani 0.606(2) 1 d PDU A 1
H1VA H 0.3262 0.2439 0.6533 0.098 Uiso 0.606(2) 1 calc PR A 1
H1VB H 0.4409 0.2029 0.6738 0.098 Uiso 0.606(2) 1 calc PR A 1
Cl1V Cl 0.41766(17) 0.26788(11) 0.76853(9) 0.0770(5) Uani 0.606(2) 1 d PDU A 1
Cl2V Cl 0.4584(2) 0.31745(17) 0.63435(16) 0.0988(7) Uani 0.606(2) 1 d PDU A 1
C1V' C 0.4780(13) 0.3518(5) 0.6653(5) 0.161(4) Uani 0.394(2) 1 d PDU A 2
H1V1 H 0.4225 0.3794 0.6821 0.193 Uiso 0.394(2) 1 calc PR A 2
H1V2 H 0.5450 0.3470 0.7053 0.193 Uiso 0.394(2) 1 calc PR A 2
Cl1' Cl 0.4294(5) 0.2669(4) 0.6278(3) 0.1403(19) Uani 0.394(2) 1 d PDU A 2
Cl2' Cl 0.5031(7) 0.3896(5) 0.5875(5) 0.258(4) Uani 0.394(2) 1 d PDU A 2
Cl1W Cl 0.13851(13) 0.57372(6) 0.49708(7) 0.0888(4) Uani 1 1 d D . .
C1W C 0.2212(5) 0.5243(6) 0.4574(3) 0.0775(16) Uani 0.394(2) 1 d PDU A 2
H1WA H 0.2335 0.5509 0.4152 0.093 Uiso 0.394(2) 1 calc PR A 2
H1WB H 0.1879 0.4764 0.4407 0.093 Uiso 0.394(2) 1 calc PR A 2
Cl2W Cl 0.3432(2) 0.51227(19) 0.52282(16) 0.0813(9) Uani 0.394(2) 1 d PD A 2
C1W' C 0.2505(3) 0.5486(3) 0.4649(4) 0.0775(16) Uani 0.606(2) 1 d PDU A 1
H1WC H 0.2264 0.5488 0.4114 0.093 Uiso 0.606(2) 1 calc PR A 1
H1WD H 0.2692 0.4975 0.4801 0.093 Uiso 0.606(2) 1 calc PR A 1
Cl3W Cl 0.3710(3) 0.60040(18) 0.49078(14) 0.1169(10) Uani 0.606(2) 1 d PD A 1
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'
O O 0.0106 0.0060 '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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
C1 Rh1 P1 92.91(5) . .
C1 Rh1 P2 93.42(5) . .
P1 Rh1 P2 172.581(14) . .
C1 Rh1 Cl1 174.89(6) . .
P1 Rh1 Cl1 85.496(15) . .
P2 Rh1 Cl1 88.521(15) . .
C14 P1 C8 106.01(7) . .
C14 P1 C2 103.14(7) . .
C8 P1 C2 101.24(7) . .
C14 P1 Rh1 108.24(5) . .
C8 P1 Rh1 113.51(5) . .
C2 P1 Rh1 123.14(5) . .
O1 C1 Rh1 177.80(17) . .
C19 O2 C22 119.12(12) . .
C31 P2 C24 102.69(7) . .
C31 P2 C37 103.93(7) . .
C24 P2 C37 106.75(7) . .
C31 P2 Rh1 111.59(6) . .
C24 P2 Rh1 116.37(5) . .
C37 P2 Rh1 114.19(5) . .
C7 C2 C3 118.91(14) . .
C7 C2 P1 118.33(11) . .
C3 C2 P1 122.53(12) . .
C25 O3 C22 116.23(12) 3_565 .
C4 C3 C2 120.17(16) . .
C5 C4 C3 120.53(17) . .
C4 C5 C6 119.68(17) . .
C7 C6 C5 119.78(17) . .
C6 C7 C2 120.92(16) . .
C13 C8 C9 119.29(14) . .
C13 C8 P1 118.68(12) . .
C9 C8 P1 121.98(12) . .
C10 C9 C8 119.89(16) . .
C11 C10 C9 120.19(17) . .
C12 C11 C10 120.33(16) . .
C11 C12 C13 120.00(17) . .
C12 C13 C8 120.28(16) . .
C15 C14 C19 118.20(13) . .
C15 C14 P1 124.88(11) . .
C19 C14 P1 116.80(11) . .
C14 C15 C16 121.28(14) . .
C17 C16 C15 118.73(15) . .
C17 C16 C23 120.08(15) . .
C15 C16 C23 121.18(16) . .
C18 C17 C16 121.39(14) . .
C17 C18 C19 118.76(14) . .
C17 C18 C20 124.70(13) . .
C19 C18 C20 116.45(13) . .
O2 C19 C18 121.27(13) . .
O2 C19 C14 117.33(12) . .
C18 C19 C14 121.40(13) . .
C18 C20 C26 111.35(12) . 3_565
C18 C20 C21 105.81(12) . .
C26 C20 C21 109.24(12) 3_565 .
C22 C21 C20 105.98(12) . .
O3 C22 O2 107.77(11) . .
O3 C22 C21 111.09(12) . .
O2 C22 C21 112.64(12) . .
C29 C24 C25 117.89(14) . .
C29 C24 P2 121.66(11) . .
C25 C24 P2 120.05(11) . .
O3 C25 C26 122.34(12) 3_565 .
O3 C25 C24 116.34(13) 3_565 .
C26 C25 C24 121.31(13) . .
C25 C26 C27 118.84(13) . .
C25 C26 C20 120.26(12) . 3_565
C27 C26 C20 120.89(13) . 3_565
C28 C27 C26 121.79(14) . .
C27 C28 C29 118.08(14) . .
C27 C28 C30 120.76(15) . .
C29 C28 C30 121.13(15) . .
C28 C29 C24 122.07(14) . .
C36 C31 C32 119.16(15) . .
C36 C31 P2 118.37(13) . .
C32 C31 P2 122.36(13) . .
C33 C32 C31 119.96(19) . .
C34 C33 C32 120.43(19) . .
C33 C34 C35 120.00(18) . .
C34 C35 C36 119.9(2) . .
C31 C36 C35 120.59(19) . .
C38 C37 C42 118.75(15) . .
C38 C37 P2 122.93(13) . .
C42 C37 P2 118.17(13) . .
C39 C38 C37 120.29(17) . .
C40 C39 C38 120.50(18) . .
C41 C40 C39 119.60(17) . .
C40 C41 C42 120.44(19) . .
C41 C42 C37 120.41(18) . .
Cl1V C1V Cl2V 113.4(3) . .
Cl2' C1V' Cl1' 97.2(6) . .
C1W Cl1W C1W' 19.0(4) . .
Cl1W C1W Cl2W 106.6(3) . .
Cl1W C1W' Cl3W 119.3(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Rh1 C1 1.8123(17) .
Rh1 P1 2.3245(4) .
Rh1 P2 2.3304(4) .
Rh1 Cl1 2.3914(4) .
P1 C14 1.8211(15) .
P1 C8 1.8234(15) .
P1 C2 1.8268(15) .
O1 C1 1.143(2) .
O2 C19 1.3751(18) .
O2 C22 1.4395(19) .
P2 C31 1.8225(15) .
P2 C24 1.8320(16) .
P2 C37 1.8368(16) .
C2 C7 1.397(2) .
C2 C3 1.397(2) .
O3 C25 1.3780(17) 3_565
O3 C22 1.4233(18) .
C3 C4 1.393(3) .
C4 C5 1.386(3) .
C5 C6 1.398(3) .
C6 C7 1.387(2) .
C8 C13 1.397(2) .
C8 C9 1.405(2) .
C9 C10 1.392(2) .
C10 C11 1.387(3) .
C11 C12 1.385(3) .
C12 C13 1.394(2) .
C14 C15 1.397(2) .
C14 C19 1.401(2) .
C15 C16 1.399(2) .
C16 C17 1.392(2) .
C16 C23 1.508(2) .
C17 C18 1.390(2) .
C18 C19 1.393(2) .
C18 C20 1.506(2) .
C20 C26 1.515(2) 3_565
C20 C21 1.534(2) .
C21 C22 1.507(2) .
C24 C29 1.402(2) .
C24 C25 1.406(2) .
C25 O3 1.3780(17) 3_565
C25 C26 1.393(2) .
C26 C27 1.395(2) .
C26 C20 1.515(2) 3_565
C27 C28 1.394(2) .
C28 C29 1.396(2) .
C28 C30 1.505(2) .
C31 C36 1.391(3) .
C31 C32 1.395(2) .
C32 C33 1.394(3) .
C33 C34 1.382(4) .
C34 C35 1.384(4) .
C35 C36 1.394(3) .
C37 C38 1.400(2) .
C37 C42 1.403(2) .
C38 C39 1.394(2) .
C39 C40 1.391(3) .
C40 C41 1.384(3) .
C41 C42 1.395(3) .
C1V Cl1V 1.727(4) .
C1V Cl2V 1.736(4) .
C1V' Cl2' 1.746(5) .
C1V' Cl1' 1.755(5) .
Cl1W C1W 1.711(5) .
Cl1W C1W' 1.757(4) .
C1W Cl2W 1.736(4) .
C1W' Cl3W 1.762(4) .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
C1 Rh1 P1 C14 -135.57(7) . .
P2 Rh1 P1 C14 12.95(12) . .
Cl1 Rh1 P1 C14 49.30(5) . .
C1 Rh1 P1 C8 107.03(8) . .
P2 Rh1 P1 C8 -104.45(12) . .
Cl1 Rh1 P1 C8 -68.10(6) . .
C1 Rh1 P1 C2 -15.50(8) . .
P2 Rh1 P1 C2 133.02(11) . .
Cl1 Rh1 P1 C2 169.36(6) . .
P1 Rh1 C1 O1 -72(4) . .
P2 Rh1 C1 O1 112(4) . .
Cl1 Rh1 C1 O1 -1(5) . .
C1 Rh1 P2 C31 -114.50(8) . .
P1 Rh1 P2 C31 97.00(12) . .
Cl1 Rh1 P2 C31 60.77(6) . .
C1 Rh1 P2 C24 2.89(8) . .
P1 Rh1 P2 C24 -145.62(11) . .
Cl1 Rh1 P2 C24 178.15(5) . .
C1 Rh1 P2 C37 128.02(8) . .
P1 Rh1 P2 C37 -20.49(13) . .
Cl1 Rh1 P2 C37 -56.72(6) . .
C14 P1 C2 C7 -175.01(13) . .
C8 P1 C2 C7 -65.43(14) . .
Rh1 P1 C2 C7 62.56(14) . .
C14 P1 C2 C3 -0.55(15) . .
C8 P1 C2 C3 109.04(14) . .
Rh1 P1 C2 C3 -122.98(13) . .
C7 C2 C3 C4 1.2(3) . .
P1 C2 C3 C4 -173.27(15) . .
C2 C3 C4 C5 -0.2(3) . .
C3 C4 C5 C6 -0.3(3) . .
C4 C5 C6 C7 -0.1(3) . .
C5 C6 C7 C2 1.1(3) . .
C3 C2 C7 C6 -1.6(3) . .
P1 C2 C7 C6 173.07(15) . .
C14 P1 C8 C13 -115.43(13) . .
C2 P1 C8 C13 137.22(13) . .
Rh1 P1 C8 C13 3.25(14) . .
C14 P1 C8 C9 67.04(14) . .
C2 P1 C8 C9 -40.31(14) . .
Rh1 P1 C8 C9 -174.27(11) . .
C13 C8 C9 C10 1.2(2) . .
P1 C8 C9 C10 178.72(12) . .
C8 C9 C10 C11 -1.8(2) . .
C9 C10 C11 C12 1.4(3) . .
C10 C11 C12 C13 -0.3(3) . .
C11 C12 C13 C8 -0.3(3) . .
C9 C8 C13 C12 -0.1(2) . .
P1 C8 C13 C12 -177.72(13) . .
C8 P1 C14 C15 -11.43(15) . .
C2 P1 C14 C15 94.55(14) . .
Rh1 P1 C14 C15 -133.54(12) . .
C8 P1 C14 C19 164.54(11) . .
C2 P1 C14 C19 -89.48(12) . .
Rh1 P1 C14 C19 42.43(12) . .
C19 C14 C15 C16 0.1(2) . .
P1 C14 C15 C16 176.03(12) . .
C14 C15 C16 C17 -2.9(2) . .
C14 C15 C16 C23 178.06(17) . .
C15 C16 C17 C18 1.5(2) . .
C23 C16 C17 C18 -179.47(17) . .
C16 C17 C18 C19 2.7(2) . .
C16 C17 C18 C20 -173.58(14) . .
C22 O2 C19 C18 25.6(2) . .
C22 O2 C19 C14 -153.88(13) . .
C17 C18 C19 O2 174.88(13) . .
C20 C18 C19 O2 -8.5(2) . .
C17 C18 C19 C14 -5.6(2) . .
C20 C18 C19 C14 170.95(13) . .
C15 C14 C19 O2 -176.25(13) . .
P1 C14 C19 O2 7.50(18) . .
C15 C14 C19 C18 4.2(2) . .
P1 C14 C19 C18 -172.01(11) . .
C17 C18 C20 C26 -102.84(16) . 3_565
C19 C18 C20 C26 80.80(16) . 3_565
C17 C18 C20 C21 138.58(15) . .
C19 C18 C20 C21 -37.77(16) . .
C18 C20 C21 C22 67.15(14) . .
C26 C20 C21 C22 -52.82(15) 3_565 .
C25 O3 C22 O2 78.04(15) 3_565 .
C25 O3 C22 C21 -45.79(17) 3_565 .
C19 O2 C22 O3 -114.93(13) . .
C19 O2 C22 C21 7.96(18) . .
C20 C21 C22 O3 67.41(15) . .
C20 C21 C22 O2 -53.60(15) . .
C31 P2 C24 C29 3.77(14) . .
C37 P2 C24 C29 112.76(13) . .
Rh1 P2 C24 C29 -118.42(12) . .
C31 P2 C24 C25 176.32(12) . .
C37 P2 C24 C25 -74.68(13) . .
Rh1 P2 C24 C25 54.14(13) . .
C29 C24 C25 O3 179.70(13) . 3_565
P2 C24 C25 O3 6.86(18) . 3_565
C29 C24 C25 C26 0.8(2) . .
P2 C24 C25 C26 -172.03(11) . .
O3 C25 C26 C27 179.42(14) 3_565 .
C24 C25 C26 C27 -1.8(2) . .
O3 C25 C26 C20 -1.8(2) 3_565 3_565
C24 C25 C26 C20 177.03(13) . 3_565
C25 C26 C27 C28 1.6(2) . .
C20 C26 C27 C28 -177.19(15) 3_565 .
C26 C27 C28 C29 -0.5(2) . .
C26 C27 C28 C30 177.56(16) . .
C27 C28 C29 C24 -0.5(2) . .
C30 C28 C29 C24 -178.55(16) . .
C25 C24 C29 C28 0.4(2) . .
P2 C24 C29 C28 173.07(13) . .
C24 P2 C31 C36 -104.26(16) . .
C37 P2 C31 C36 144.62(15) . .
Rh1 P2 C31 C36 21.10(17) . .
C24 P2 C31 C32 71.81(16) . .
C37 P2 C31 C32 -39.31(17) . .
Rh1 P2 C31 C32 -162.82(14) . .
C36 C31 C32 C33 0.2(3) . .
P2 C31 C32 C33 -175.82(16) . .
C31 C32 C33 C34 -0.7(3) . .
C32 C33 C34 C35 1.0(4) . .
C33 C34 C35 C36 -0.9(4) . .
C32 C31 C36 C35 -0.1(3) . .
P2 C31 C36 C35 176.14(19) . .
C34 C35 C36 C31 0.4(4) . .
C31 P2 C37 C38 136.59(14) . .
C24 P2 C37 C38 28.47(15) . .
Rh1 P2 C37 C38 -101.60(14) . .
C31 P2 C37 C42 -47.95(15) . .
C24 P2 C37 C42 -156.07(13) . .
Rh1 P2 C37 C42 73.85(14) . .
C42 C37 C38 C39 -1.3(2) . .
P2 C37 C38 C39 174.15(13) . .
C37 C38 C39 C40 0.9(3) . .
C38 C39 C40 C41 0.1(3) . .
C39 C40 C41 C42 -0.7(3) . .
C40 C41 C42 C37 0.3(3) . .
C38 C37 C42 C41 0.7(3) . .
P2 C37 C42 C41 -174.96(15) . .
C1W' Cl1W C1W Cl2W 57.8(9) . .
C1W Cl1W C1W' Cl3W -168.7(15) . .
