#------------------------------------------------------------------------------
#$Date: 2016-03-25 16:57:53 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179997 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/91/7029122.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_7029122
loop_
_publ_author_name
'Coetzee, Jacorien'
'Eastham, Graham R.'
'Slawin, Alexandra M. Z.'
'Cole-Hamilton, David J'
_publ_section_title
;
 Mixed anhydride complexes of rhodium(i) and ruthenium(ii) - their
 synthesis and ligand rearrangements.
;
_journal_issue                   9
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              3479
_journal_page_last               3491
_journal_paper_doi               10.1039/c3dt52552j
_journal_volume                  43
_journal_year                    2014
_chemical_formula_moiety         'C54 H52 Cl2 O6 P4 Rh2, C7 H8'
_chemical_formula_sum            'C61 H60 Cl2 O6 P4 Rh2'
_chemical_formula_weight         1289.69
_chemical_name_common
;
μ-dichlorobis{(hydrogenbis(diphenylphosphinito-K1P)(ethanoyl-K1C)rhodium(III)}
;
_chemical_name_systematic
;
μ-dichlorobis{(hydrogenbis(diphenylphosphinito-K1P)(ethanoyl-K1C)rhodium(III)}
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/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                 101.120(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   20.089(7)
_cell_length_b                   12.811(5)
_cell_length_c                   22.725(8)
_cell_measurement_reflns_used    7249
_cell_measurement_temperature    93(2)
_cell_measurement_theta_max      27.5963
_cell_measurement_theta_min      1.8957
_cell_volume                     5739(4)
_computing_cell_refinement       'CrystalClear (Rigaku Corp., 2004)'
_computing_data_collection       'CrystalClear (Rigaku Corp., 2004)'
_computing_data_reduction        'CrystalClear (Rigaku Corp., 2004)'
_computing_molecular_graphics
'X-seed (Barbour 2001; Atwood and Barbour 2003)'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      93(2)
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.985
_diffrn_measured_fraction_theta_max 0.985
_diffrn_measurement_device_type  'Rigaku Saturn70 (4x4 bin mode)'
_diffrn_measurement_method       'profile from ω and φ scans'
_diffrn_radiation_monochromator  confocal
_diffrn_radiation_source         'rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0522
_diffrn_reflns_av_sigmaI/netI    0.0313
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            26636
_diffrn_reflns_theta_full        25.35
_diffrn_reflns_theta_max         25.35
_diffrn_reflns_theta_min         2.48
_exptl_absorpt_coefficient_mu    0.830
_exptl_absorpt_correction_T_max  0.9216
_exptl_absorpt_correction_T_min  0.9216
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.493
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             2632
_exptl_crystal_size_max          0.10
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.758
_refine_diff_density_min         -0.790
_refine_diff_density_rms         0.087
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.968
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     342
_refine_ls_number_reflns         5187
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.968
_refine_ls_R_factor_all          0.0336
_refine_ls_R_factor_gt           0.0318
_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)+(0.0499P)²+14.3290P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0814
_refine_ls_wR_factor_ref         0.0836
_reflns_number_gt                4881
_reflns_number_total             5187
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3dt52552j.txt
_cod_data_source_block           16
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/automatic-downloads/current/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               7029122
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -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
Rh1 Rh 0.698309(8) 0.170993(12) 0.042162(7) 0.01507(8) Uani 1 1 d .
Cl1 Cl 0.81468(3) 0.17284(4) 0.02387(3) 0.01924(13) Uani 1 1 d .
P2 P 0.72416(3) 0.05610(4) 0.11806(2) 0.01754(13) Uani 1 1 d .
P1 P 0.59638(3) 0.19269(5) 0.06781(3) 0.01997(14) Uani 1 1 d .
O3 O 0.66563(8) -0.00943(12) 0.13306(7) 0.0218(3) Uani 1 1 d .
H1 H 0.6350 0.0304 0.1404 0.026 Uiso 1 1 calc R
O2 O 0.56502(8) 0.09504(14) 0.09290(8) 0.0293(4) Uani 1 1 d .
O1 O 0.63469(11) -0.02020(15) -0.00195(8) 0.0417(5) Uani 1 1 d .
C19 C 0.88498(16) -0.1801(2) 0.08360(14) 0.0395(7) Uani 1 1 d .
H1A H 0.9175 -0.2291 0.0754 0.047 Uiso 1 1 calc R
C4 C 0.60596(12) 0.2940(2) 0.12579(11) 0.0278(5) Uani 1 1 d .
C7 C 0.62507(17) 0.4398(3) 0.21735(15) 0.0536(9) Uani 1 1 d .
H10 H 0.6310 0.4905 0.2485 0.064 Uiso 1 1 calc R
C5 C 0.57521(15) 0.2788(3) 0.17481(12) 0.0425(7) Uani 1 1 d .
H11 H 0.5478 0.2191 0.1771 0.051 Uiso 1 1 calc R
C11 C 0.48239(13) 0.16982(17) -0.02082(12) 0.0247(5) Uani 1 1 d .
H12 H 0.4853 0.0983 -0.0096 0.030 Uiso 1 1 calc R
C8 C 0.65589(16) 0.4532(3) 0.16939(13) 0.0455(8) Uani 1 1 d .
H13 H 0.6837 0.5126 0.1674 0.055 Uiso 1 1 calc R
C6 C 0.58545(19) 0.3535(4) 0.22092(14) 0.0591(10) Uani 1 1 d .
H14 H 0.5648 0.3443 0.2548 0.071 Uiso 1 1 calc R
C9 C 0.64666(14) 0.3800(2) 0.12352(12) 0.0339(6) Uani 1 1 d .
H15 H 0.6685 0.3892 0.0903 0.041 Uiso 1 1 calc R
C20 C 0.81659(16) -0.2020(2) 0.06708(13) 0.0383(6) Uani 1 1 d .
H16 H 0.8021 -0.2660 0.0477 0.046 Uiso 1 1 calc R
C26 C 0.74085(14) 0.2029(2) 0.27891(11) 0.0335(6) Uani 1 1 d .
H17 H 0.7180 0.2001 0.3118 0.040 Uiso 1 1 calc R
C23 C 0.80711(12) 0.21232(19) 0.18272(11) 0.0254(5) Uani 1 1 d .
H18 H 0.8298 0.2163 0.1498 0.031 Uiso 1 1 calc R
C16 C 0.78951(12) -0.03577(18) 0.10699(10) 0.0216(5) Uani 1 1 d .
C27 C 0.72352(13) 0.1330(2) 0.23157(11) 0.0267(5) Uani 1 1 d .
H20 H 0.6892 0.0822 0.2324 0.032 Uiso 1 1 calc R
C10 C 0.53025(11) 0.24006(18) 0.00779(10) 0.0207(5) Uani 1 1 d .
C1 C 0.65986(11) 0.05832(18) -0.01465(10) 0.0217(5) Uani 1 1 d .
C24 C 0.82431(13) 0.2809(2) 0.23053(12) 0.0314(6) Uani 1 1 d .
H23 H 0.8591 0.3311 0.2304 0.038 Uiso 1 1 calc R
C12 C 0.43015(13) 0.2038(2) -0.06598(12) 0.0306(5) Uani 1 1 d .
H24 H 0.3976 0.1552 -0.0857 0.037 Uiso 1 1 calc R
C25 C 0.79104(14) 0.2764(2) 0.27848(11) 0.0332(6) Uani 1 1 d .
H25 H 0.8027 0.3237 0.3110 0.040 Uiso 1 1 calc R
C21 C 0.76881(14) -0.1301(2) 0.07881(11) 0.0300(5) Uani 1 1 d .
H26 H 0.7218 -0.1455 0.0675 0.036 Uiso 1 1 calc R
C14 C 0.47331(13) 0.37832(19) -0.05414(12) 0.0295(5) Uani 1 1 d .
H27 H 0.4704 0.4497 -0.0657 0.035 Uiso 1 1 calc R
C15 C 0.52584(12) 0.34469(18) -0.00903(11) 0.0248(5) Uani 1 1 d .
H30 H 0.5587 0.3931 0.0103 0.030 Uiso 1 1 calc R
C31 C 0.5000 -0.2245(6) 0.2500 0.0757(18) Uani 1 2 d S
C17 C 0.85875(12) -0.0153(2) 0.12315(11) 0.0268(5) Uani 1 1 d .
H32 H 0.8736 0.0489 0.1421 0.032 Uiso 1 1 calc R
C22 C 0.75648(12) 0.13747(18) 0.18296(10) 0.0207(5) Uani 1 1 d .
C30 C 0.4986(2) -0.1691(5) 0.19795(18) 0.0735(14) Uani 1 1 d .
H34 H 0.4967 -0.2058 0.1613 0.088 Uiso 1 1 calc R
C18 C 0.90622(14) -0.0875(2) 0.11195(12) 0.0349(6) Uani 1 1 d .
H36 H 0.9533 -0.0732 0.1238 0.042 Uiso 1 1 calc R
C13 C 0.42519(13) 0.3078(2) -0.08234(12) 0.0309(6) Uani 1 1 d .
H37 H 0.3889 0.3309 -0.1128 0.037 Uiso 1 1 calc R
C29 C 0.4998(3) -0.0631(6) 0.1978(3) 0.112(2) Uani 1 1 d .
H44 H 0.5006 -0.0271 0.1614 0.134 Uiso 1 1 calc R
C28 C 0.5000 -0.0063(8) 0.2500 0.111(3) Uani 1 2 d S
H28 H 0.5000 0.0679 0.2500 0.133 Uiso 1 2 calc SR
C32 C 0.5000 -0.3369(6) 0.2500 0.121(4) Uani 1 2 d S
H32A H 0.5010 -0.3624 0.2908 0.182 Uiso 0.25 1 calc PR
H32B H 0.5401 -0.3624 0.2357 0.182 Uiso 0.25 1 calc PR
H32C H 0.4589 -0.3624 0.2234 0.182 Uiso 0.25 1 calc PR
H32D H 0.4990 -0.3624 0.2092 0.182 Uiso 0.25 1 calc PR
H32E H 0.4599 -0.3624 0.2643 0.182 Uiso 0.25 1 calc PR
H32F H 0.5411 -0.3624 0.2766 0.182 Uiso 0.25 1 calc PR
C2 C 0.66595(16) 0.0837(2) -0.07886(11) 0.0351(6) Uani 1 1 d .
H2A H 0.6270 0.1276 -0.0976 0.042 Uiso 1 1 calc R
H2B H 0.7080 0.1242 -0.0785 0.042 Uiso 1 1 calc R
C3 C 0.6674(3) -0.0138(3) -0.11589(15) 0.0670(12) Uani 1 1 d .
H3A H 0.7069 -0.0563 -0.0983 0.100 Uiso 1 1 calc R
H3B H 0.6706 0.0055 -0.1570 0.100 Uiso 1 1 calc R
H3C H 0.6258 -0.0541 -0.1164 0.100 Uiso 1 1 calc R
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'
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'
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 P2 91.50(7) . .
C1 Rh1 P1 89.94(7) . .
P2 Rh1 P1 88.24(3) . .
C1 Rh1 Cl1 99.23(7) . .
P2 Rh1 Cl1 92.85(2) . .
P1 Rh1 Cl1 170.73(2) . .
C1 Rh1 Cl1 102.11(7) . 7_655
P2 Rh1 Cl1 166.27(2) . 7_655
P1 Rh1 Cl1 93.56(2) . 7_655
Cl1 Rh1 Cl1 83.24(2) . 7_655
Rh1 Cl1 Rh1 96.76(2) . 7_655
O3 P2 C16 106.33(10) . .
O3 P2 C22 107.58(10) . .
C16 P2 C22 109.20(11) . .
O3 P2 Rh1 117.02(7) . .
C16 P2 Rh1 112.56(8) . .
C22 P2 Rh1 103.88(8) . .
O2 P1 C10 104.75(10) . .
O2 P1 C4 107.42(12) . .
C10 P1 C4 105.29(11) . .
O2 P1 Rh1 116.60(7) . .
C10 P1 Rh1 114.65(8) . .
C4 P1 Rh1 107.39(8) . .
P2 O3 H1 109.5 . .
C20 C19 C18 120.2(3) . .
C20 C19 H1A 119.9 . .
C18 C19 H1A 119.9 . .
C9 C4 C5 120.0(3) . .
C9 C4 P1 121.32(19) . .
C5 C4 P1 118.5(2) . .
C8 C7 C6 120.4(3) . .
C8 C7 H10 119.8 . .
C6 C7 H10 119.8 . .
C4 C5 C6 118.7(3) . .
C4 C5 H11 120.7 . .
C6 C5 H11 120.7 . .
C10 C11 C12 120.1(2) . .
C10 C11 H12 120.0 . .
C12 C11 H12 120.0 . .
C7 C8 C9 120.0(3) . .
C7 C8 H13 120.0 . .
C9 C8 H13 120.0 . .
C7 C6 C5 120.5(3) . .
C7 C6 H14 119.8 . .
C5 C6 H14 119.8 . .
C4 C9 C8 120.4(3) . .
C4 C9 H15 119.8 . .
C8 C9 H15 119.8 . .
C19 C20 C21 120.0(3) . .
C19 C20 H16 120.0 . .
C21 C20 H16 120.0 . .
C25 C26 C27 120.5(2) . .
C25 C26 H17 119.8 . .
C27 C26 H17 119.8 . .
C24 C23 C22 120.1(2) . .
C24 C23 H18 119.9 . .
C22 C23 H18 119.9 . .
C17 C16 C21 118.6(2) . .
C17 C16 P2 123.59(19) . .
C21 C16 P2 117.78(19) . .
C26 C27 C22 120.0(2) . .
C26 C27 H20 120.0 . .
C22 C27 H20 120.0 . .
C11 C10 C15 119.7(2) . .
C11 C10 P1 118.49(18) . .
C15 C10 P1 121.80(18) . .
O1 C1 C2 122.1(2) . .
O1 C1 Rh1 125.98(19) . .
C2 C1 Rh1 111.95(16) . .
C25 C24 C23 120.3(2) . .
C25 C24 H23 119.9 . .
C23 C24 H23 119.9 . .
C13 C12 C11 120.4(2) . .
C13 C12 H24 119.8 . .
C11 C12 H24 119.8 . .
C26 C25 C24 119.9(2) . .
C26 C25 H25 120.1 . .
C24 C25 H25 120.1 . .
C20 C21 C16 120.4(3) . .
C20 C21 H26 119.8 . .
C16 C21 H26 119.8 . .
C13 C14 C15 120.1(2) . .
C13 C14 H27 120.0 . .
C15 C14 H27 120.0 . .
C14 C15 C10 120.0(2) . .
C14 C15 H30 120.0 . .
C10 C15 H30 120.0 . .
C30 C31 C30 117.9(7) . 2_655
C30 C31 C32 121.1(3) . .
C30 C31 C32 121.1(3) 2_655 .
C18 C17 C16 120.9(2) . .
C18 C17 H32 119.6 . .
C16 C17 H32 119.6 . .
C27 C22 C23 119.2(2) . .
C27 C22 P2 117.94(18) . .
C23 C22 P2 122.37(18) . .
C29 C30 C31 121.4(5) . .
C29 C30 H34 119.3 . .
C31 C30 H34 119.3 . .
C19 C18 C17 119.9(3) . .
C19 C18 H36 120.1 . .
C17 C18 H36 120.1 . .
C12 C13 C14 119.8(2) . .
C12 C13 H37 120.1 . .
C14 C13 H37 120.1 . .
C30 C29 C28 121.1(6) . .
C30 C29 H44 119.4 . .
C28 C29 H44 119.4 . .
C29 C28 C29 117.0(9) . 2_655
C29 C28 H28 121.5 . .
C29 C28 H28 121.5 2_655 .
C31 C32 H32A 109.5 . .
C31 C32 H32B 109.5 . .
H32A C32 H32B 109.5 . .
C31 C32 H32C 109.5 . .
H32A C32 H32C 109.5 . .
H32B C32 H32C 109.5 . .
C31 C32 H32D 109.5 . .
H32A C32 H32D 141.1 . .
H32B C32 H32D 56.3 . .
H32C C32 H32D 56.3 . .
C31 C32 H32E 109.5 . .
H32A C32 H32E 56.3 . .
H32B C32 H32E 141.1 . .
H32C C32 H32E 56.3 . .
H32D C32 H32E 109.5 . .
C31 C32 H32F 109.5 . .
H32A C32 H32F 56.3 . .
H32B C32 H32F 56.3 . .
H32C C32 H32F 141.1 . .
H32D C32 H32F 109.5 . .
H32E C32 H32F 109.5 . .
C3 C2 C1 111.8(2) . .
C3 C2 H2A 109.3 . .
C1 C2 H2A 109.3 . .
C3 C2 H2B 109.3 . .
C1 C2 H2B 109.3 . .
H2A C2 H2B 107.9 . .
C2 C3 H3A 109.5 . .
C2 C3 H3B 109.5 . .
H3A C3 H3B 109.5 . .
C2 C3 H3C 109.5 . .
H3A C3 H3C 109.5 . .
H3B C3 H3C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Rh1 C1 1.991(2) .
Rh1 P2 2.2508(8) .
Rh1 P1 2.2517(9) .
Rh1 Cl1 2.4522(10) .
Rh1 Cl1 2.4843(8) 7_655
Cl1 Rh1 2.4843(8) 7_655
P2 O3 1.5354(17) .
P2 C16 1.816(2) .
P2 C22 1.821(2) .
P1 O2 1.5574(18) .
P1 C10 1.815(2) .
P1 C4 1.833(3) .
O3 H1 0.8400 .
O1 C1 1.186(3) .
C19 C20 1.381(5) .
C19 C18 1.378(4) .
C19 H1A 0.9500 .
C4 C9 1.379(4) .
C4 C5 1.388(4) .
C7 C8 1.364(5) .
C7 C6 1.374(6) .
C7 H10 0.9500 .
C5 C6 1.405(5) .
C5 H11 0.9500 .
C11 C10 1.384(3) .
C11 C12 1.389(4) .
C11 H12 0.9500 .
C8 C9 1.387(4) .
C8 H13 0.9500 .
C6 H14 0.9500 .
C9 H15 0.9500 .
C20 C21 1.392(4) .
C20 H16 0.9500 .
C26 C25 1.380(4) .
C26 C27 1.392(4) .
C26 H17 0.9500 .
C23 C24 1.388(4) .
C23 C22 1.399(3) .
C23 H18 0.9500 .
C16 C17 1.393(3) .
C16 C21 1.393(3) .
C27 C22 1.394(3) .
C27 H20 0.9500 .
C10 C15 1.392(3) .
C1 C2 1.523(3) .
C24 C25 1.385(4) .
C24 H23 0.9500 .
C12 C13 1.382(4) .
C12 H24 0.9500 .
C25 H25 0.9500 .
C21 H26 0.9500 .
C14 C13 1.386(4) .
C14 C15 1.390(4) .
C14 H27 0.9500 .
C15 H30 0.9500 .
C31 C30 1.375(6) .
C31 C30 1.375(6) 2_655
C31 C32 1.440(10) .
C17 C18 1.387(4) .
C17 H32 0.9500 .
C30 C29 1.359(8) .
C30 H34 0.9500 .
C18 H36 0.9500 .
C13 H37 0.9500 .
C29 C28 1.392(9) .
C29 H44 0.9500 .
C28 C29 1.392(9) 2_655
C28 H28 0.9500 .
C32 H32A 0.9800 .
C32 H32B 0.9800 .
C32 H32C 0.9800 .
C32 H32D 0.9800 .
C32 H32E 0.9800 .
C32 H32F 0.9800 .
C2 C3 1.510(4) .
C2 H2A 0.9900 .
C2 H2B 0.9900 .
C3 H3A 0.9800 .
C3 H3B 0.9800 .
C3 H3C 0.9800 .
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 Cl1 Rh1 101.23(7) . 7_655
P2 Rh1 Cl1 Rh1 -166.79(2) . 7_655
P1 Rh1 Cl1 Rh1 -70.27(13) . 7_655
Cl1 Rh1 Cl1 Rh1 0.0 7_655 7_655
C1 Rh1 P2 O3 -57.20(10) . .
P1 Rh1 P2 O3 32.69(8) . .
Cl1 Rh1 P2 O3 -156.52(8) . .
Cl1 Rh1 P2 O3 130.50(10) 7_655 .
C1 Rh1 P2 C16 66.42(11) . .
P1 Rh1 P2 C16 156.31(9) . .
Cl1 Rh1 P2 C16 -32.90(9) . .
Cl1 Rh1 P2 C16 -105.88(12) 7_655 .
C1 Rh1 P2 C22 -175.58(10) . .
P1 Rh1 P2 C22 -85.69(8) . .
Cl1 Rh1 P2 C22 85.10(8) . .
Cl1 Rh1 P2 C22 12.12(13) 7_655 .
C1 Rh1 P1 O2 57.66(11) . .
P2 Rh1 P1 O2 -33.84(8) . .
Cl1 Rh1 P1 O2 -130.73(14) . .
Cl1 Rh1 P1 O2 159.79(8) 7_655 .
C1 Rh1 P1 C10 -65.24(11) . .
P2 Rh1 P1 C10 -156.74(9) . .
Cl1 Rh1 P1 C10 106.37(14) . .
Cl1 Rh1 P1 C10 36.89(9) 7_655 .
C1 Rh1 P1 C4 178.16(11) . .
P2 Rh1 P1 C4 86.66(9) . .
Cl1 Rh1 P1 C4 -10.23(16) . .
Cl1 Rh1 P1 C4 -79.71(9) 7_655 .
O2 P1 C4 C9 164.3(2) . .
C10 P1 C4 C9 -84.5(2) . .
Rh1 P1 C4 C9 38.1(2) . .
O2 P1 C4 C5 -11.1(2) . .
C10 P1 C4 C5 100.2(2) . .
Rh1 P1 C4 C5 -137.23(19) . .
C9 C4 C5 C6 1.2(4) . .
P1 C4 C5 C6 176.6(2) . .
C6 C7 C8 C9 0.8(5) . .
C8 C7 C6 C5 -1.1(5) . .
C4 C5 C6 C7 0.1(5) . .
C5 C4 C9 C8 -1.5(4) . .
P1 C4 C9 C8 -176.8(2) . .
C7 C8 C9 C4 0.5(4) . .
C18 C19 C20 C21 0.3(4) . .
O3 P2 C16 C17 -145.26(19) . .
C22 P2 C16 C17 -29.5(2) . .
Rh1 P2 C16 C17 85.4(2) . .
O3 P2 C16 C21 37.1(2) . .
C22 P2 C16 C21 152.95(18) . .
Rh1 P2 C16 C21 -92.23(19) . .
C25 C26 C27 C22 -0.6(4) . .
C12 C11 C10 C15 -0.2(4) . .
C12 C11 C10 P1 178.5(2) . .
O2 P1 C10 C11 -25.8(2) . .
C4 P1 C10 C11 -139.0(2) . .
Rh1 P1 C10 C11 103.25(19) . .
O2 P1 C10 C15 152.82(19) . .
C4 P1 C10 C15 39.7(2) . .
Rh1 P1 C10 C15 -78.1(2) . .
P2 Rh1 C1 O1 28.6(2) . .
P1 Rh1 C1 O1 -59.6(2) . .
Cl1 Rh1 C1 O1 121.7(2) . .
Cl1 Rh1 C1 O1 -153.3(2) 7_655 .
P2 Rh1 C1 C2 -151.52(17) . .
P1 Rh1 C1 C2 120.24(17) . .
Cl1 Rh1 C1 C2 -58.39(18) . .
Cl1 Rh1 C1 C2 26.62(18) 7_655 .
C22 C23 C24 C25 -0.7(4) . .
C10 C11 C12 C13 -0.5(4) . .
C27 C26 C25 C24 0.2(4) . .
C23 C24 C25 C26 0.4(4) . .
C19 C20 C21 C16 0.2(4) . .
C17 C16 C21 C20 -0.1(4) . .
P2 C16 C21 C20 177.6(2) . .
C13 C14 C15 C10 0.1(4) . .
C11 C10 C15 C14 0.4(4) . .
P1 C10 C15 C14 -178.24(19) . .
C21 C16 C17 C18 -0.5(4) . .
P2 C16 C17 C18 -178.13(19) . .
C26 C27 C22 C23 0.4(4) . .
C26 C27 C22 P2 -171.96(19) . .
C24 C23 C22 C27 0.3(4) . .
C24 C23 C22 P2 172.25(19) . .
O3 P2 C22 C27 -3.3(2) . .
C16 P2 C22 C27 -118.28(19) . .
Rh1 P2 C22 C27 121.42(18) . .
O3 P2 C22 C23 -175.38(19) . .
C16 P2 C22 C23 69.6(2) . .
Rh1 P2 C22 C23 -50.7(2) . .
C30 C31 C30 C29 1.2(3) 2_655 .
C32 C31 C30 C29 -178.8(3) . .
C20 C19 C18 C17 -0.9(4) . .
C16 C17 C18 C19 1.1(4) . .
C11 C12 C13 C14 1.0(4) . .
C15 C14 C13 C12 -0.8(4) . .
C31 C30 C29 C28 -2.5(7) . .
C30 C29 C28 C29 1.2(3) . 2_655
O1 C1 C2 C3 -25.9(4) . .
Rh1 C1 C2 C3 154.3(3) . .
