#------------------------------------------------------------------------------
#$Date: 2016-03-25 09:33:25 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179729 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/25/7002534.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_7002534
loop_
_publ_author_name
'Rubio, Miguel'
'Jellema, Erica'
'Siegler, Maxime A.'
'Spek, Anthony L.'
'Reek, Joost N. H.'
'de Bruin, Bas'
_publ_section_title
;
 Supramolecular NHC ligands: on the influence of ZnII-templates on the
 activity of RhI(cod) complexes in ‘carbene
 polymerization’
;
_journal_issue                   41
_journal_name_full               'Dalton Transactions'
_journal_page_first              8970
_journal_page_last               8976
_journal_paper_doi               10.1039/b911339h
_journal_year                    2009
_chemical_formula_moiety         'C25 H29 Cl N3 Rh'
_chemical_formula_sum            'C25 H29 Cl N3 Rh'
_chemical_formula_weight         509.87
_chemical_name_systematic
;
?
;
_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   difmap
_atom_sites_solution_primary     heavy
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                93.230(2)
_cell_angle_beta                 104.119(2)
_cell_angle_gamma                93.696(2)
_cell_formula_units_Z            2
_cell_length_a                   7.4144(3)
_cell_length_b                   11.7114(4)
_cell_length_c                   13.4408(6)
_cell_measurement_reflns_used    23176
_cell_measurement_temperature    110(2)
_cell_measurement_theta_max      27.49
_cell_measurement_theta_min      1.57
_cell_volume                     1126.36(8)
_computing_cell_refinement       'PEAKREF (Schreurs, 2005)'
_computing_data_collection       'COLLECT (Nonius, 1999)'
_computing_data_reduction        'EVALCCD (Duisenberg et al., 2003)'
_computing_molecular_graphics    'PLATON (Spek, 2003)'
_computing_publication_material  'PLATON (Spek, 2003)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'DIRDIF08 (Beurskens et al., 2008)'
_diffrn_ambient_temperature      110(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Nonius KappaCCD diffractometer'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0245
_diffrn_reflns_av_sigmaI/netI    0.0177
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            31397
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.75
_exptl_absorpt_coefficient_mu    0.894
_exptl_absorpt_correction_T_max  0.932
_exptl_absorpt_correction_T_min  0.856
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 2008)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.503
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'irregular block'
_exptl_crystal_F_000             524
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.14
_refine_diff_density_max         0.535
_refine_diff_density_min         -0.500
_refine_diff_density_rms         0.064
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     285
_refine_ls_number_reflns         5180
_refine_ls_number_restraints     4
_refine_ls_restrained_S_all      1.062
_refine_ls_R_factor_all          0.0252
_refine_ls_R_factor_gt           0.0203
_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)+(0.0195P)²+0.8550P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0459
_refine_ls_wR_factor_ref         0.0479
_reflns_number_gt                4756
_reflns_number_total             5180
_reflns_threshold_expression     I>2/s(I)
_cod_data_source_file            b911339h.txt
_cod_data_source_block           4a
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7002534
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_assembly
_atom_site_disorder_group
Rh1 Rh 0.223363(17) 0.226385(10) 0.312228(9) 0.01219(4) Uani 1 1 d . . .
Cl1 Cl -0.00029(5) 0.07640(3) 0.22780(3) 0.01904(8) Uani 1 1 d . . .
C1 C 0.4865(2) 0.30450(15) 0.39098(12) 0.0175(3) Uani 1 1 d D . .
H1 H 0.566(2) 0.3104(17) 0.3453(12) 0.021 Uiso 1 1 d D . .
C2 C 0.5711(2) 0.23852(17) 0.48253(14) 0.0249(4) Uani 1 1 d . . .
H2A H 0.6677 0.2896 0.5320 0.030 Uiso 1 1 calc R . .
H2B H 0.6332 0.1736 0.4589 0.030 Uiso 1 1 calc R . .
C3 C 0.4268(3) 0.19187(18) 0.53780(14) 0.0301(4) Uani 1 1 d . . .
H3A H 0.4730 0.1242 0.5740 0.036 Uiso 1 1 calc R . .
H3B H 0.4122 0.2512 0.5901 0.036 Uiso 1 1 calc R . .
C4 C 0.2382(3) 0.15789(16) 0.46427(13) 0.0235(4) Uani 1 1 d D . .
H4 H 0.209(3) 0.0781(9) 0.4466(16) 0.028 Uiso 1 1 d D . .
C5 C 0.0945(3) 0.22781(16) 0.44147(13) 0.0227(4) Uani 1 1 d D . .
H5 H -0.0261(17) 0.1911(16) 0.4103(15) 0.027 Uiso 1 1 d D . .
C6 C 0.0947(3) 0.35259(17) 0.47792(14) 0.0271(4) Uani 1 1 d . . .
H6A H 0.0757 0.3570 0.5484 0.033 Uiso 1 1 calc R . .
H6B H -0.0110 0.3867 0.4325 0.033 Uiso 1 1 calc R . .
C7 C 0.2761(3) 0.42257(16) 0.47827(14) 0.0241(4) Uani 1 1 d . . .
H7A H 0.2528 0.5048 0.4754 0.029 Uiso 1 1 calc R . .
H7B H 0.3697 0.4138 0.5433 0.029 Uiso 1 1 calc R . .
C8 C 0.3544(2) 0.38527(14) 0.38794(12) 0.0175(3) Uani 1 1 d D . .
H8 H 0.350(3) 0.4403(14) 0.3384(12) 0.021 Uiso 1 1 d D . .
C9 C 0.3493(2) 0.08716(13) 0.11070(12) 0.0145(3) Uani 1 1 d . . .
C10 C 0.4917(2) 0.07263(14) 0.19598(13) 0.0164(3) Uani 1 1 d . . .
H10 H 0.5443 0.1349 0.2450 0.020 Uiso 1 1 calc R . .
C11 C 0.5553(2) -0.03591(14) 0.20767(13) 0.0190(3) Uani 1 1 d . . .
H11 H 0.6526 -0.0461 0.2664 0.023 Uiso 1 1 calc R . .
C12 C 0.3519(3) -0.10898(15) 0.05912(15) 0.0248(4) Uani 1 1 d . . .
H12 H 0.3031 -0.1724 0.0106 0.030 Uiso 1 1 calc R . .
C13 C 0.2777(2) -0.00466(15) 0.03991(13) 0.0201(3) Uani 1 1 d . . .
H13 H 0.1811 0.0035 -0.0198 0.024 Uiso 1 1 calc R . .
C14 C 0.2383(2) 0.26790(13) 0.16932(11) 0.0126(3) Uani 1 1 d . . .
C15 C 0.2348(2) 0.24276(15) -0.00099(13) 0.0214(4) Uani 1 1 d . . .
H15 H 0.2495 0.2087 -0.0641 0.026 Uiso 1 1 calc R . .
C16 C 0.1676(2) 0.34395(16) 0.01357(13) 0.0216(4) Uani 1 1 d . . .
H16 H 0.1254 0.3957 -0.0375 0.026 Uiso 1 1 calc R . .
C17 C 0.1170(2) 0.46258(13) 0.16202(12) 0.0139(3) Uani 1 1 d . . .
C18 C 0.2333(2) 0.56314(14) 0.16931(13) 0.0181(3) Uani 1 1 d . . .
C19 C 0.1833(2) 0.66313(14) 0.21259(13) 0.0192(3) Uani 1 1 d . . .
H19 H 0.2614 0.7319 0.2183 0.023 Uiso 1 1 calc R . .
C20 C 0.0219(2) 0.66523(14) 0.24778(12) 0.0174(3) Uani 1 1 d . . .
C21 C -0.0898(2) 0.56358(14) 0.23890(12) 0.0157(3) Uani 1 1 d . . .
H21 H -0.1992 0.5638 0.2638 0.019 Uiso 1 1 calc R . .
C22 C -0.0477(2) 0.46080(13) 0.19469(12) 0.0143(3) Uani 1 1 d . . .
C23 C 0.4086(3) 0.56537(17) 0.13112(18) 0.0316(4) Uani 1 1 d . . .
H23A H 0.3752 0.5569 0.0558 0.047 Uiso 1 1 calc R . .
H23B H 0.4818 0.5021 0.1581 0.047 Uiso 1 1 calc R . .
H23C H 0.4826 0.6386 0.1547 0.047 Uiso 1 1 calc R . .
C24 C -0.0321(3) 0.77620(15) 0.29054(14) 0.0252(4) Uani 1 1 d . . .
H24A H -0.1653 0.7689 0.2888 0.038 Uiso 1 1 calc R . .
H24B H -0.0071 0.8386 0.2489 0.038 Uiso 1 1 calc R . .
H24C H 0.0410 0.7932 0.3617 0.038 Uiso 1 1 calc R . .
C25 C -0.1806(2) 0.35524(14) 0.18078(14) 0.0203(3) Uani 1 1 d . . .
H25A H -0.2869 0.3723 0.2089 0.030 Uiso 0.50 1 calc PR . .
H25B H -0.1162 0.2934 0.2170 0.030 Uiso 0.50 1 calc PR . .
H25C H -0.2253 0.3312 0.1074 0.030 Uiso 0.50 1 calc PR . .
H25D H -0.1321 0.2923 0.1466 0.030 Uiso 0.50 1 calc PR . .
H25E H -0.3027 0.3712 0.1385 0.030 Uiso 0.50 1 calc PR . .
H25F H -0.1936 0.3334 0.2482 0.030 Uiso 0.50 1 calc PR . .
N1 N 0.4882(2) -0.12657(12) 0.14163(12) 0.0229(3) Uani 1 1 d . . .
N2 N 0.27901(18) 0.19718(12) 0.09462(10) 0.0148(3) Uani 1 1 d . . .
N3 N 0.17110(18) 0.35918(11) 0.11751(10) 0.0147(3) Uani 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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
_geom_angle_publ_flag
C14 Rh1 C1 96.50(6) . . ?
C14 Rh1 C8 95.11(6) . . ?
C1 Rh1 C8 38.69(7) . . ?
C14 Rh1 C5 152.95(7) . . ?
C1 Rh1 C5 97.87(7) . . ?
C8 Rh1 C5 82.21(7) . . ?
C14 Rh1 C4 170.25(7) . . ?
C1 Rh1 C4 81.61(7) . . ?
C8 Rh1 C4 89.38(7) . . ?
C5 Rh1 C4 36.36(7) . . ?
C14 Rh1 Cl1 86.42(4) . . ?
C1 Rh1 Cl1 157.39(5) . . ?
C8 Rh1 Cl1 163.61(5) . . ?
C5 Rh1 Cl1 89.01(5) . . ?
C4 Rh1 Cl1 91.72(5) . . ?
C8 C1 C2 126.07(15) . . ?
C8 C1 Rh1 71.53(9) . . ?
C2 C1 Rh1 110.48(11) . . ?
C8 C1 H1 118.0(12) . . ?
C2 C1 H1 111.4(12) . . ?
Rh1 C1 H1 110.1(12) . . ?
C1 C2 C3 113.07(15) . . ?
C1 C2 H2A 109.0 . . ?
C3 C2 H2A 109.0 . . ?
C1 C2 H2B 109.0 . . ?
C3 C2 H2B 109.0 . . ?
H2A C2 H2B 107.8 . . ?
C4 C3 C2 112.35(15) . . ?
C4 C3 H3A 109.1 . . ?
C2 C3 H3A 109.1 . . ?
C4 C3 H3B 109.1 . . ?
C2 C3 H3B 109.1 . . ?
H3A C3 H3B 107.9 . . ?
C5 C4 C3 124.92(18) . . ?
C5 C4 Rh1 70.20(10) . . ?
C3 C4 Rh1 110.89(12) . . ?
C5 C4 H4 117.3(13) . . ?
C3 C4 H4 115.9(13) . . ?
Rh1 C4 H4 102.2(13) . . ?
C4 C5 C6 127.86(17) . . ?
C4 C5 Rh1 73.44(10) . . ?
C6 C5 Rh1 106.45(11) . . ?
C4 C5 H5 116.5(13) . . ?
C6 C5 H5 114.4(13) . . ?
Rh1 C5 H5 101.6(13) . . ?
C5 C6 C7 112.67(15) . . ?
C5 C6 H6A 109.1 . . ?
C7 C6 H6A 109.1 . . ?
C5 C6 H6B 109.1 . . ?
C7 C6 H6B 109.1 . . ?
H6A C6 H6B 107.8 . . ?
C8 C7 C6 112.16(14) . . ?
C8 C7 H7A 109.2 . . ?
C6 C7 H7A 109.2 . . ?
C8 C7 H7B 109.2 . . ?
C6 C7 H7B 109.2 . . ?
H7A C7 H7B 107.9 . . ?
C1 C8 C7 124.77(15) . . ?
C1 C8 Rh1 69.78(9) . . ?
C7 C8 Rh1 112.37(11) . . ?
C1 C8 H8 116.1(12) . . ?
C7 C8 H8 114.5(12) . . ?
Rh1 C8 H8 108.9(12) . . ?
C13 C9 C10 119.72(15) . . ?
C13 C9 N2 120.05(14) . . ?
C10 C9 N2 120.22(14) . . ?
C9 C10 C11 117.87(15) . . ?
C9 C10 H10 121.1 . . ?
C11 C10 H10 121.1 . . ?
N1 C11 C10 124.03(16) . . ?
N1 C11 H11 118.0 . . ?
C10 C11 H11 118.0 . . ?
N1 C12 C13 124.37(16) . . ?
N1 C12 H12 117.8 . . ?
C13 C12 H12 117.8 . . ?
C9 C13 C12 117.53(16) . . ?
C9 C13 H13 121.2 . . ?
C12 C13 H13 121.2 . . ?
N3 C14 N2 103.23(12) . . ?
N3 C14 Rh1 128.57(11) . . ?
N2 C14 Rh1 126.66(11) . . ?
C16 C15 N2 106.41(14) . . ?
C16 C15 H15 126.8 . . ?
N2 C15 H15 126.8 . . ?
C15 C16 N3 107.15(14) . . ?
C15 C16 H16 126.4 . . ?
N3 C16 H16 126.4 . . ?
C22 C17 C18 121.97(15) . . ?
C22 C17 N3 120.25(14) . . ?
C18 C17 N3 117.77(14) . . ?
C19 C18 C17 118.31(15) . . ?
C19 C18 C23 119.90(16) . . ?
C17 C18 C23 121.79(15) . . ?
C18 C19 C20 121.81(15) . . ?
C18 C19 H19 119.1 . . ?
C20 C19 H19 119.1 . . ?
C21 C20 C19 118.05(15) . . ?
C21 C20 C24 121.48(16) . . ?
C19 C20 C24 120.44(16) . . ?
C20 C21 C22 122.59(15) . . ?
C20 C21 H21 118.7 . . ?
C22 C21 H21 118.7 . . ?
C17 C22 C21 117.23(15) . . ?
C17 C22 C25 122.56(14) . . ?
C21 C22 C25 120.18(14) . . ?
C18 C23 H23A 109.5 . . ?
C18 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C18 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C20 C24 H24A 109.5 . . ?
C20 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C20 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C22 C25 H25A 109.5 . . ?
C22 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
C22 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C22 C25 H25D 109.5 . . ?
H25A C25 H25D 141.1 . . ?
H25B C25 H25D 56.3 . . ?
H25C C25 H25D 56.3 . . ?
C22 C25 H25E 109.5 . . ?
H25A C25 H25E 56.3 . . ?
H25B C25 H25E 141.1 . . ?
H25C C25 H25E 56.3 . . ?
H25D C25 H25E 109.5 . . ?
C22 C25 H25F 109.5 . . ?
H25A C25 H25F 56.3 . . ?
H25B C25 H25F 56.3 . . ?
H25C C25 H25F 141.1 . . ?
H25D C25 H25F 109.5 . . ?
H25E C25 H25F 109.5 . . ?
C11 N1 C12 116.48(15) . . ?
C14 N2 C15 111.76(13) . . ?
C14 N2 C9 124.58(13) . . ?
C15 N2 C9 123.59(13) . . ?
C14 N3 C16 111.44(13) . . ?
C14 N3 C17 126.13(13) . . ?
C16 N3 C17 122.37(13) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Rh1 C14 2.0349(15) . ?
Rh1 C1 2.1018(16) . ?
Rh1 C8 2.1244(16) . ?
Rh1 C5 2.1770(16) . ?
Rh1 C4 2.2177(16) . ?
Rh1 Cl1 2.3674(4) . ?
C1 C8 1.400(2) . ?
C1 C2 1.516(2) . ?
C1 H1 0.951(9) . ?
C2 C3 1.534(3) . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C3 C4 1.516(3) . ?
C3 H3A 0.9900 . ?
C3 H3B 0.9900 . ?
C4 C5 1.372(3) . ?
C4 H4 0.949(9) . ?
C5 C6 1.515(3) . ?
C5 H5 0.953(9) . ?
C6 C7 1.528(3) . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C7 C8 1.523(2) . ?
C7 H7A 0.9900 . ?
C7 H7B 0.9900 . ?
C8 H8 0.949(9) . ?
C9 C13 1.381(2) . ?
C9 C10 1.383(2) . ?
C9 N2 1.429(2) . ?
C10 C11 1.388(2) . ?
C10 H10 0.9500 . ?
C11 N1 1.332(2) . ?
C11 H11 0.9500 . ?
C12 N1 1.341(2) . ?
C12 C13 1.384(3) . ?
C12 H12 0.9500 . ?
C13 H13 0.9500 . ?
C14 N3 1.3636(19) . ?
C14 N2 1.3679(19) . ?
C15 C16 1.337(2) . ?
C15 N2 1.392(2) . ?
C15 H15 0.9500 . ?
C16 N3 1.392(2) . ?
C16 H16 0.9500 . ?
C17 C22 1.395(2) . ?
C17 C18 1.398(2) . ?
C17 N3 1.443(2) . ?
C18 C19 1.390(2) . ?
C18 C23 1.509(2) . ?
C19 C20 1.390(2) . ?
C19 H19 0.9500 . ?
C20 C21 1.388(2) . ?
C20 C24 1.508(2) . ?
C21 C22 1.399(2) . ?
C21 H21 0.9500 . ?
C22 C25 1.504(2) . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C25 H25A 0.9800 . ?
C25 H25B 0.9800 . ?
C25 H25C 0.9800 . ?
C25 H25D 0.9800 . ?
C25 H25E 0.9800 . ?
C25 H25F 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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C14 Rh1 C1 C8 90.07(10) . . . . ?
C5 Rh1 C1 C8 -66.96(11) . . . . ?
C4 Rh1 C1 C8 -99.58(11) . . . . ?
Cl1 Rh1 C1 C8 -173.62(9) . . . . ?
C14 Rh1 C1 C2 -147.39(12) . . . . ?
C8 Rh1 C1 C2 122.54(16) . . . . ?
C5 Rh1 C1 C2 55.59(13) . . . . ?
C4 Rh1 C1 C2 22.96(12) . . . . ?
Cl1 Rh1 C1 C2 -51.08(19) . . . . ?
C8 C1 C2 C3 43.8(2) . . . . ?
Rh1 C1 C2 C3 -37.83(19) . . . . ?
C1 C2 C3 C4 33.8(2) . . . . ?
C2 C3 C4 C5 -93.4(2) . . . . ?
C2 C3 C4 Rh1 -13.6(2) . . . . ?
C1 Rh1 C4 C5 115.71(12) . . . . ?
C8 Rh1 C4 C5 77.65(12) . . . . ?
Cl1 Rh1 C4 C5 -85.99(11) . . . . ?
C1 Rh1 C4 C3 -5.21(14) . . . . ?
C8 Rh1 C4 C3 -43.26(14) . . . . ?
C5 Rh1 C4 C3 -120.92(19) . . . . ?
Cl1 Rh1 C4 C3 153.09(13) . . . . ?
C3 C4 C5 C6 4.0(3) . . . . ?
Rh1 C4 C5 C6 -98.22(17) . . . . ?
C3 C4 C5 Rh1 102.18(16) . . . . ?
C14 Rh1 C5 C4 174.40(13) . . . . ?
C1 Rh1 C5 C4 -64.14(12) . . . . ?
C8 Rh1 C5 C4 -99.63(12) . . . . ?
Cl1 Rh1 C5 C4 94.25(11) . . . . ?
C14 Rh1 C5 C6 -60.2(2) . . . . ?
C1 Rh1 C5 C6 61.30(13) . . . . ?
C8 Rh1 C5 C6 25.81(12) . . . . ?
C4 Rh1 C5 C6 125.44(18) . . . . ?
Cl1 Rh1 C5 C6 -140.32(12) . . . . ?
C4 C5 C6 C7 40.7(2) . . . . ?
Rh1 C5 C6 C7 -40.88(18) . . . . ?
C5 C6 C7 C8 36.8(2) . . . . ?
C2 C1 C8 C7 1.5(3) . . . . ?
Rh1 C1 C8 C7 103.77(16) . . . . ?
C2 C1 C8 Rh1 -102.30(16) . . . . ?
C6 C7 C8 C1 -93.4(2) . . . . ?
C6 C7 C8 Rh1 -13.14(19) . . . . ?
C14 Rh1 C8 C1 -94.02(10) . . . . ?
C5 Rh1 C8 C1 113.07(11) . . . . ?
C4 Rh1 C8 C1 77.31(10) . . . . ?
Cl1 Rh1 C8 C1 171.29(13) . . . . ?
C14 Rh1 C8 C7 145.60(12) . . . . ?
C1 Rh1 C8 C7 -120.38(16) . . . . ?
C5 Rh1 C8 C7 -7.31(12) . . . . ?
C4 Rh1 C8 C7 -43.07(13) . . . . ?
Cl1 Rh1 C8 C7 50.9(2) . . . . ?
C13 C9 C10 C11 -1.1(2) . . . . ?
N2 C9 C10 C11 -179.74(14) . . . . ?
C9 C10 C11 N1 0.3(2) . . . . ?
C10 C9 C13 C12 0.9(2) . . . . ?
N2 C9 C13 C12 179.60(15) . . . . ?
N1 C12 C13 C9 0.0(3) . . . . ?
C1 Rh1 C14 N3 -95.22(14) . . . . ?
C8 Rh1 C14 N3 -56.34(14) . . . . ?
C5 Rh1 C14 N3 26.5(2) . . . . ?
Cl1 Rh1 C14 N3 107.30(14) . . . . ?
C1 Rh1 C14 N2 101.33(14) . . . . ?
C8 Rh1 C14 N2 140.20(14) . . . . ?
C5 Rh1 C14 N2 -136.93(15) . . . . ?
Cl1 Rh1 C14 N2 -56.16(13) . . . . ?
N2 C15 C16 N3 -0.1(2) . . . . ?
C22 C17 C18 C19 1.4(2) . . . . ?
N3 C17 C18 C19 -179.63(14) . . . . ?
C22 C17 C18 C23 -178.24(16) . . . . ?
N3 C17 C18 C23 0.7(2) . . . . ?
C17 C18 C19 C20 -0.3(2) . . . . ?
C23 C18 C19 C20 179.32(16) . . . . ?
C18 C19 C20 C21 0.2(2) . . . . ?
C18 C19 C20 C24 -177.59(15) . . . . ?
C19 C20 C21 C22 -1.1(2) . . . . ?
C24 C20 C21 C22 176.65(15) . . . . ?
C18 C17 C22 C21 -2.2(2) . . . . ?
N3 C17 C22 C21 178.82(13) . . . . ?
C18 C17 C22 C25 175.74(15) . . . . ?
N3 C17 C22 C25 -3.2(2) . . . . ?
C20 C21 C22 C17 2.1(2) . . . . ?
C20 C21 C22 C25 -175.93(15) . . . . ?
C10 C11 N1 C12 0.5(2) . . . . ?
C13 C12 N1 C11 -0.7(3) . . . . ?
N3 C14 N2 C15 -1.06(17) . . . . ?
Rh1 C14 N2 C15 165.72(12) . . . . ?
N3 C14 N2 C9 -178.05(14) . . . . ?
Rh1 C14 N2 C9 -11.3(2) . . . . ?
C16 C15 N2 C14 0.7(2) . . . . ?
C16 C15 N2 C9 177.76(15) . . . . ?
C13 C9 N2 C14 136.46(16) . . . . ?
C10 C9 N2 C14 -44.9(2) . . . . ?
C13 C9 N2 C15 -40.2(2) . . . . ?
C10 C9 N2 C15 138.50(17) . . . . ?
N2 C14 N3 C16 1.01(18) . . . . ?
Rh1 C14 N3 C16 -165.42(12) . . . . ?
N2 C14 N3 C17 -176.21(14) . . . . ?
Rh1 C14 N3 C17 17.4(2) . . . . ?
C15 C16 N3 C14 -0.6(2) . . . . ?
C15 C16 N3 C17 176.74(15) . . . . ?
C22 C17 N3 C14 -73.3(2) . . . . ?
C18 C17 N3 C14 107.72(18) . . . . ?
C22 C17 N3 C16 109.78(18) . . . . ?
C18 C17 N3 C16 -69.2(2) . . . . ?
