#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/70/7027080.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the Crystal Eye server at
# http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
# Peter Murray-Rust laboratory.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_7027080
loop_
_publ_author_name
'García, María P.'
'Jiménez, M. Victoria'
'Lahoz, Fernando J.'
'López, José A.'
'Oro, Luis A.'
_publ_section_title
;
 Synthesis of the homoleptic rhodium(III) complex [Rh(C6Cl5)3]. Molecular
 structures of [Rh(C6Cl5)3] and [Rh(C6Cl4--C6Cl4)(C6Cl5)(SC4H8)2]
;
_journal_issue                   24
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              4211
_journal_paper_doi               10.1039/a806538a
_journal_year                    1998
_chemical_formula_moiety         '(C18 Cl15 Rh), 0.5(C H2 Cl2)'
_chemical_formula_sum            'C18.5 H Cl16 Rh'
_chemical_formula_weight         893.30
_chemical_name_systematic
;
 tris(pentachlorophenyl)-rhodium(III) dichloromethane solvate
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   none
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                108.608(5)
_cell_angle_beta                 102.214(4)
_cell_angle_gamma                106.976(6)
_cell_formula_units_Z            2
_cell_length_a                   10.8207(11)
_cell_length_b                   10.8539(15)
_cell_length_c                   14.0152(15)
_cell_measurement_reflns_used    58
_cell_measurement_temperature    233(2)
_cell_measurement_theta_max      20
_cell_measurement_theta_min      10
_cell_volume                     1405.2(3)
_computing_cell_refinement       'DIF4 (Stoe)'
_computing_data_collection       'DIF4 (Stoe)'
_computing_data_reduction        'REDU4 (Stoe)'
_computing_molecular_graphics    'XP, SHELXTL v.5 (Siemens)'
_computing_publication_material  'CIFTAB (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SIR92 (Giacovazzo, 1994)'
_diffrn_ambient_temperature      233(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Siemens-Stoe AED2'
_diffrn_measurement_method       'ω-2θ scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'normal focus Mo sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0200
_diffrn_reflns_av_sigmaI/netI    0.0371
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            4173
_diffrn_reflns_theta_full        23.02
_diffrn_reflns_theta_max         23.02
_diffrn_reflns_theta_min         1.63
_diffrn_standards_decay_%        'no decay'
_diffrn_standards_interval_time  55
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    2.142
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.8146
_exptl_absorpt_correction_type   psi-scans
_exptl_absorpt_process_details
;
 Azimuthal psi-scans of 7 reflections at 10° intervals.
 Data corrected with the program: XPREP, SHELXTL v. 5 (Siemens)
;
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    2.111
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'prismatic block'
_exptl_crystal_F_000             858
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.14
_refine_diff_density_max         1.743
_refine_diff_density_min         -0.992
_refine_diff_density_rms         0.135
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.043
_refine_ls_hydrogen_treatment    none
_refine_ls_matrix_type           full
_refine_ls_number_parameters     329
_refine_ls_number_reflns         3925
_refine_ls_number_restraints     7
_refine_ls_restrained_S_all      1.044
_refine_ls_R_factor_all          0.0602
_refine_ls_R_factor_gt           0.0472
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0787P)²+3.6004P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1215
_refine_ls_wR_factor_ref         0.1306
_reflns_number_gt                3261
_reflns_number_total             3925
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            806538Asup1.cif
_cod_data_source_block           compound1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_formula_sum        'C18.50 H Cl16 Rh'
_cod_database_code               7027080
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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_group
Rh Rh 0.22619(5) 0.07425(5) 0.20962(4) 0.02667(19) Uani 1 1 d . .
Cl2 Cl 0.16479(18) 0.13324(18) 0.04302(12) 0.0354(4) Uani 1 1 d . .
Cl3 Cl 0.0864(3) 0.3850(2) 0.01718(15) 0.0661(7) Uani 1 1 d . .
Cl4 Cl 0.0914(3) 0.6188(2) 0.22064(17) 0.0608(6) Uani 1 1 d . .
Cl5 Cl 0.14123(19) 0.58325(19) 0.43518(14) 0.0429(5) Uani 1 1 d . .
Cl6 Cl 0.2187(2) 0.3396(2) 0.45573(14) 0.0545(6) Uani 1 1 d . .
Cl8 Cl 0.30340(18) -0.12925(18) 0.13115(14) 0.0385(4) Uani 1 1 d . .
Cl9 Cl 0.5783(2) -0.1268(2) 0.08259(17) 0.0572(6) Uani 1 1 d . .
Cl10 Cl 0.8188(2) 0.1652(2) 0.15576(18) 0.0583(6) Uani 1 1 d . .
Cl11 Cl 0.7792(2) 0.4412(2) 0.2657(2) 0.0647(6) Uani 1 1 d . .
Cl12 Cl 0.5059(2) 0.4321(2) 0.30594(18) 0.0551(5) Uani 1 1 d . .
Cl14 Cl -0.00204(17) -0.07871(18) 0.21947(13) 0.0367(4) Uani 1 1 d . .
Cl15 Cl -0.0615(2) -0.1965(2) 0.39282(16) 0.0478(5) Uani 1 1 d . .
Cl16 Cl 0.1795(3) -0.0888(2) 0.60836(16) 0.0585(6) Uani 1 1 d . .
Cl17 Cl 0.4669(3) 0.1275(3) 0.64421(16) 0.0656(6) Uani 1 1 d . .
Cl18 Cl 0.5190(2) 0.2245(2) 0.46689(16) 0.0555(5) Uani 1 1 d . .
C1 C 0.1906(6) 0.2501(7) 0.2451(5) 0.0280(14) Uani 1 1 d . .
C2 C 0.1595(6) 0.2673(6) 0.1517(5) 0.0279(15) Uani 1 1 d . .
C3 C 0.1259(7) 0.3755(7) 0.1385(5) 0.0366(17) Uani 1 1 d . .
C4 C 0.1267(7) 0.4767(7) 0.2301(5) 0.0356(16) Uani 1 1 d . .
C5 C 0.1518(7) 0.4619(7) 0.3255(5) 0.0303(15) Uani 1 1 d . .
C6 C 0.1859(6) 0.3507(7) 0.3335(5) 0.0285(15) Uani 1 1 d . .
C7 C 0.4202(7) 0.1477(7) 0.2148(5) 0.0318(15) Uani 1 1 d . .
C8 C 0.4433(7) 0.0292(7) 0.1671(5) 0.0318(15) Uani 1 1 d . .
C9 C 0.5616(7) 0.0275(7) 0.1449(5) 0.0342(16) Uani 1 1 d . .
C10 C 0.6654(7) 0.1568(8) 0.1767(5) 0.0381(17) Uani 1 1 d . .
C11 C 0.6468(7) 0.2817(8) 0.2264(5) 0.0385(17) Uani 1 1 d . .
C12 C 0.5234(7) 0.2763(7) 0.2445(5) 0.0341(16) Uani 1 1 d . .
C13 C 0.2515(7) 0.0546(7) 0.3484(5) 0.0290(15) Uani 1 1 d . .
C14 C 0.1275(7) -0.0314(7) 0.3402(5) 0.0296(15) Uani 1 1 d . .
C15 C 0.1002(7) -0.0810(7) 0.4151(5) 0.0343(16) Uani 1 1 d . .
C16 C 0.2078(8) -0.0339(7) 0.5094(5) 0.0392(18) Uani 1 1 d . .
C17 C 0.3348(8) 0.0599(8) 0.5236(5) 0.0388(18) Uani 1 1 d . .
C18 C 0.3596(8) 0.1053(8) 0.4432(5) 0.0395(17) Uani 1 1 d . .
C50 C 0.618(3) 0.524(10) 0.052(3) 0.108(16) Uiso 0.277(5) 1 d PD 1
Cl50 Cl 0.468(3) 0.485(4) 0.082(3) 0.169(5) Uiso 0.277(5) 1 d PD 1
Cl51 Cl 0.576(3) 0.506(3) -0.078(2) 0.169(5) Uiso 0.277(5) 1 d PD 1
C51 C 0.498(5) 0.496(9) 0.071(4) 0.108(16) Uiso 0.224(5) 1 d PD 2
Cl52 Cl 0.661(2) 0.623(3) 0.1309(18) 0.169(5) Uiso 0.224(5) 1 d PD 2
Cl53 Cl 0.414(3) 0.482(5) -0.0525(19) 0.169(5) Uiso 0.224(5) 1 d PD 2
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'
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 Rh C7 100.4(3) . .
C1 Rh C13 100.8(2) . .
C7 Rh C13 100.8(3) . .
C1 Rh Cl8 164.56(19) . .
C7 Rh Cl8 68.64(19) . .
C13 Rh Cl8 92.17(18) . .
C1 Rh Cl14 95.66(18) . .
C7 Rh Cl14 161.84(19) . .
C13 Rh Cl14 67.6(2) . .
Cl8 Rh Cl14 96.99(6) . .
C1 Rh Cl2 67.84(18) . .
C7 Rh Cl2 86.31(18) . .
C13 Rh Cl2 167.73(18) . .
Cl8 Rh Cl2 99.76(5) . .
Cl14 Rh Cl2 107.70(6) . .
C2 Cl2 Rh 73.2(2) . .
C8 Cl8 Rh 73.3(2) . .
C14 Cl14 Rh 73.4(2) . .
C2 C1 C6 116.1(6) . .
C2 C1 Rh 105.8(4) . .
C6 C1 Rh 138.0(5) . .
C1 C2 C3 126.0(6) . .
C1 C2 Cl2 113.1(5) . .
C3 C2 Cl2 120.9(5) . .
C2 C3 C4 116.1(6) . .
C2 C3 Cl3 121.9(5) . .
C4 C3 Cl3 122.1(5) . .
C5 C4 C3 120.6(6) . .
C5 C4 Cl4 120.7(5) . .
C3 C4 Cl4 118.7(5) . .
C4 C5 C6 120.4(6) . .
C4 C5 Cl5 119.3(5) . .
C6 C5 Cl5 120.4(5) . .
C1 C6 C5 120.8(6) . .
C1 C6 Cl6 121.0(5) . .
C5 C6 Cl6 118.1(5) . .
C8 C7 C12 117.7(6) . .
C8 C7 Rh 104.3(5) . .
C12 C7 Rh 137.9(5) . .
C7 C8 C9 125.5(7) . .
C7 C8 Cl8 113.7(5) . .
C9 C8 Cl8 120.8(5) . .
C10 C9 C8 116.5(6) . .
C10 C9 Cl9 121.9(5) . .
C8 C9 Cl9 121.7(6) . .
C9 C10 C11 120.1(6) . .
C9 C10 Cl10 119.8(5) . .
C11 C10 Cl10 120.1(6) . .
C12 C11 C10 120.6(7) . .
C12 C11 Cl11 120.6(6) . .
C10 C11 Cl11 118.7(6) . .
C7 C12 C11 119.6(6) . .
C7 C12 Cl12 121.6(5) . .
C11 C12 Cl12 118.8(5) . .
C14 C13 C18 118.0(6) . .
C14 C13 Rh 105.7(4) . .
C18 C13 Rh 136.3(5) . .
C13 C14 C15 125.4(6) . .
C13 C14 Cl14 113.1(5) . .
C15 C14 Cl14 121.5(5) . .
C14 C15 C16 117.4(7) . .
C14 C15 Cl15 121.0(5) . .
C16 C15 Cl15 121.6(5) . .
C17 C16 C15 119.2(6) . .
C17 C16 Cl16 121.0(5) . .
C15 C16 Cl16 119.8(6) . .
C16 C17 C18 121.6(6) . .
C16 C17 Cl17 119.6(5) . .
C18 C17 Cl17 118.8(6) . .
C13 C18 C17 118.3(7) . .
C13 C18 Cl18 122.4(6) . .
C17 C18 Cl18 119.3(5) . .
Cl51 C50 Cl50 107.8(11) . .
Cl51 C50 Cl50 15.8(19) . 2_665
Cl50 C50 Cl50 93(2) . 2_665
Cl51 C50 Cl51 102.0(17) . 2_665
Cl50 C50 Cl51 8.2(17) . 2_665
Cl50 C50 Cl51 87(2) 2_665 2_665
Cl51 Cl50 C50 143(7) 2_665 .
Cl51 Cl50 C50 65(6) 2_665 2_665
C50 Cl50 C50 87(2) . 2_665
Cl50 Cl51 C50 99(7) 2_665 .
Cl50 Cl51 C50 29(6) 2_665 2_665
C50 Cl51 C50 78.0(17) . 2_665
Cl53 C51 Cl52 44(3) 2_665 .
Cl53 C51 Cl53 87(4) 2_665 .
Cl52 C51 Cl53 113.9(14) . .
Cl53 Cl52 C51 36(3) 2_665 .
C51 Cl53 Cl52 101(5) 2_665 2_665
C51 Cl53 C51 93(4) 2_665 .
Cl52 Cl53 C51 129(4) 2_665 .
C51 Cl53 Cl53 62(2) 2_665 2_665
Cl52 Cl53 Cl53 130(5) 2_665 2_665
C51 Cl53 Cl53 32(2) . 2_665
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Rh C1 1.986(6) .
Rh C7 1.993(7) .
Rh C13 1.994(6) .
Rh Cl8 2.5889(17) .
Rh Cl14 2.6020(18) .
Rh Cl2 2.6171(16) .
Cl2 C2 1.764(6) .
Cl3 C3 1.707(7) .
Cl4 C4 1.731(6) .
Cl5 C5 1.727(6) .
Cl6 C6 1.725(6) .
Cl8 C8 1.763(7) .
Cl9 C9 1.706(7) .
Cl10 C10 1.727(7) .
Cl11 C11 1.721(7) .
Cl12 C12 1.721(7) .
Cl14 C14 1.764(6) .
Cl15 C15 1.723(7) .
Cl16 C16 1.724(7) .
Cl17 C17 1.735(7) .
Cl18 C18 1.714(8) .
C1 C2 1.366(9) .
C1 C6 1.388(9) .
C2 C3 1.380(9) .
C3 C4 1.394(9) .
C4 C5 1.377(9) .
C5 C6 1.390(9) .
C7 C8 1.368(9) .
C7 C12 1.374(10) .
C8 C9 1.384(10) .
C9 C10 1.379(10) .
C10 C11 1.407(10) .
C11 C12 1.399(10) .
C13 C14 1.349(9) .
C13 C18 1.392(9) .
C14 C15 1.370(9) .
C15 C16 1.391(10) .
C16 C17 1.380(11) .
C17 C18 1.411(10) .
C50 Cl51 1.718(10) .
C50 Cl50 1.725(10) .
C50 Cl50 1.87(5) 2_665
C50 Cl51 2.16(5) 2_665
Cl50 Cl51 0.51(5) 2_665
Cl50 C50 1.87(5) 2_665
Cl51 Cl50 0.51(5) 2_665
Cl51 C50 2.16(5) 2_665
C51 Cl53 1.02(7) 2_665
C51 Cl52 1.715(10) .
C51 Cl53 1.717(10) .
Cl52 Cl53 1.20(4) 2_665
Cl53 C51 1.02(7) 2_665
Cl53 Cl52 1.20(4) 2_665
Cl53 Cl53 1.95(5) 2_665
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 Rh Cl2 C2 -0.3(3) . .
C7 Rh Cl2 C2 -103.1(3) . .
C13 Rh Cl2 C2 23.0(10) . .
Cl8 Rh Cl2 C2 -170.7(2) . .
Cl14 Rh Cl2 C2 88.7(2) . .
C1 Rh Cl8 C8 44.7(7) . .
C7 Rh Cl8 C8 -1.9(3) . .
C13 Rh Cl8 C8 -102.7(3) . .
Cl14 Rh Cl8 C8 -170.4(2) . .
Cl2 Rh Cl8 C8 80.2(2) . .
C1 Rh Cl14 C14 -101.4(3) . .
C7 Rh Cl14 C14 50.9(6) . .
C13 Rh Cl14 C14 -2.0(3) . .
Cl8 Rh Cl14 C14 87.4(2) . .
Cl2 Rh Cl14 C14 -169.9(2) . .
C7 Rh C1 C2 82.0(5) . .
C13 Rh C1 C2 -174.8(4) . .
Cl8 Rh C1 C2 38.5(10) . .
Cl14 Rh C1 C2 -106.5(4) . .
Cl2 Rh C1 C2 0.3(4) . .
C7 Rh C1 C6 -100.2(7) . .
C13 Rh C1 C6 3.1(8) . .
Cl8 Rh C1 C6 -143.7(6) . .
Cl14 Rh C1 C6 71.3(7) . .
Cl2 Rh C1 C6 178.2(8) . .
C6 C1 C2 C3 0.9(10) . .
Rh C1 C2 C3 179.2(6) . .
C6 C1 C2 Cl2 -178.9(5) . .
Rh C1 C2 Cl2 -0.5(6) . .
Rh Cl2 C2 C1 0.4(4) . .
Rh Cl2 C2 C3 -179.4(6) . .
C1 C2 C3 C4 1.1(11) . .
Cl2 C2 C3 C4 -179.2(5) . .
C1 C2 C3 Cl3 -179.1(5) . .
Cl2 C2 C3 Cl3 0.6(9) . .
C2 C3 C4 C5 -3.7(11) . .
Cl3 C3 C4 C5 176.5(5) . .
C2 C3 C4 Cl4 177.8(5) . .
Cl3 C3 C4 Cl4 -2.0(9) . .
C3 C4 C5 C6 4.3(11) . .
Cl4 C4 C5 C6 -177.2(5) . .
C3 C4 C5 Cl5 -176.0(6) . .
Cl4 C4 C5 Cl5 2.5(8) . .
C2 C1 C6 C5 -0.3(9) . .
Rh C1 C6 C5 -178.0(5) . .
C2 C1 C6 Cl6 178.4(5) . .
Rh C1 C6 Cl6 0.7(10) . .
C4 C5 C6 C1 -2.3(10) . .
Cl5 C5 C6 C1 178.0(5) . .
C4 C5 C6 Cl6 179.0(5) . .
Cl5 C5 C6 Cl6 -0.7(8) . .
C1 Rh C7 C8 -166.2(4) . .
C13 Rh C7 C8 90.5(4) . .
Cl8 Rh C7 C8 2.4(4) . .
Cl14 Rh C7 C8 41.8(9) . .
Cl2 Rh C7 C8 -99.6(4) . .
C1 Rh C7 C12 8.1(8) . .
C13 Rh C7 C12 -95.2(7) . .
Cl8 Rh C7 C12 176.7(8) . .
Cl14 Rh C7 C12 -143.9(6) . .
Cl2 Rh C7 C12 74.7(7) . .
C12 C7 C8 C9 -0.9(10) . .
Rh C7 C8 C9 174.8(5) . .
C12 C7 C8 Cl8 -179.3(5) . .
Rh C7 C8 Cl8 -3.6(5) . .
Rh Cl8 C8 C7 2.8(4) . .
Rh Cl8 C8 C9 -175.7(6) . .
C7 C8 C9 C10 2.0(10) . .
Cl8 C8 C9 C10 -179.7(5) . .
C7 C8 C9 Cl9 -178.7(5) . .
Cl8 C8 C9 Cl9 -0.4(8) . .
C8 C9 C10 C11 -1.7(10) . .
Cl9 C9 C10 C11 179.0(5) . .
C8 C9 C10 Cl10 178.2(5) . .
Cl9 C9 C10 Cl10 -1.1(8) . .
C9 C10 C11 C12 0.3(10) . .
Cl10 C10 C11 C12 -179.5(5) . .
C9 C10 C11 Cl11 179.6(5) . .
Cl10 C10 C11 Cl11 -0.2(8) . .
C8 C7 C12 C11 -0.6(10) . .
Rh C7 C12 C11 -174.4(5) . .
C8 C7 C12 Cl12 -179.5(5) . .
Rh C7 C12 Cl12 6.7(10) . .
C10 C11 C12 C7 0.9(10) . .
Cl11 C11 C12 C7 -178.4(5) . .
C10 C11 C12 Cl12 179.8(5) . .
Cl11 C11 C12 Cl12 0.5(8) . .
C1 Rh C13 C14 94.4(5) . .
C7 Rh C13 C14 -162.7(4) . .
Cl8 Rh C13 C14 -94.0(4) . .
Cl14 Rh C13 C14 2.7(4) . .
Cl2 Rh C13 C14 72.6(11) . .
C1 Rh C13 C18 -85.9(7) . .
C7 Rh C13 C18 17.0(7) . .
Cl8 Rh C13 C18 85.7(7) . .
Cl14 Rh C13 C18 -177.7(7) . .
Cl2 Rh C13 C18 -107.8(10) . .
C18 C13 C14 C15 -4.4(10) . .
Rh C13 C14 C15 175.3(5) . .
C18 C13 C14 Cl14 176.3(5) . .
Rh C13 C14 Cl14 -4.0(5) . .
Rh Cl14 C14 C13 3.0(4) . .
Rh Cl14 C14 C15 -176.2(6) . .
C13 C14 C15 C16 3.1(10) . .
Cl14 C14 C15 C16 -177.7(5) . .
C13 C14 C15 Cl15 -177.2(5) . .
Cl14 C14 C15 Cl15 1.9(8) . .
C14 C15 C16 C17 0.4(9) . .
Cl15 C15 C16 C17 -179.3(5) . .
C14 C15 C16 Cl16 178.4(5) . .
Cl15 C15 C16 Cl16 -1.2(7) . .
C15 C16 C17 C18 -2.3(10) . .
Cl16 C16 C17 C18 179.7(5) . .
C15 C16 C17 Cl17 176.1(5) . .
Cl16 C16 C17 Cl17 -1.9(8) . .
C14 C13 C18 C17 2.3(9) . .
Rh C13 C18 C17 -177.4(5) . .
C14 C13 C18 Cl18 -175.5(5) . .
Rh C13 C18 Cl18 4.9(10) . .
C16 C17 C18 C13 0.9(10) . .
Cl17 C17 C18 C13 -177.5(5) . .
C16 C17 C18 Cl18 178.8(5) . .
Cl17 C17 C18 Cl18 0.3(8) . .
Cl51 C50 Cl50 Cl51 -46(16) . 2_665
Cl50 C50 Cl50 Cl51 -39(14) 2_665 2_665
Cl51 C50 Cl50 C50 -7(3) . 2_665
Cl50 C50 Cl50 C50 0.000(3) 2_665 2_665
Cl51 C50 Cl50 C50 39(14) 2_665 2_665
Cl50 C50 Cl51 Cl50 26(10) . 2_665
Cl51 C50 Cl51 Cl50 20(8) 2_665 2_665
Cl50 C50 Cl51 C50 6(3) . 2_665
Cl50 C50 Cl51 C50 -20(8) 2_665 2_665
Cl51 C50 Cl51 C50 0.000(3) 2_665 2_665
Cl53 C51 Cl52 Cl53 -57(6) . 2_665
Cl53 C51 Cl53 C51 0.000(5) 2_665 2_665
Cl52 C51 Cl53 C51 35(4) . 2_665
Cl53 C51 Cl53 Cl52 106(6) 2_665 2_665
Cl52 C51 Cl53 Cl52 141(4) . 2_665
Cl52 C51 Cl53 Cl53 35(4) . 2_665
