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#$Date: 2021-07-06 12:14:15 +0300 (Tue, 06 Jul 2021) $
#$Revision: 267294 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/39/1563981.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_1563981
loop_
_publ_author_name
'Zhang, Nan'
'Zhu, Di'
'Herbert, David E.'
'van Leest, Nicolaas P.'
'de Bruin, Bas'
'Budzelaar, Peter H.M.'
_publ_section_title
;
 Reactivity of Rhodium(II) amido/Rhodium(I) aminyl complexes
;
_journal_name_full               'Inorganica Chimica Acta'
_journal_page_first              709
_journal_page_last               716
_journal_paper_doi               10.1016/j.ica.2018.06.015
_journal_volume                  482
_journal_year                    2018
_chemical_formula_moiety         'C33 H43 N3 Rh'
_chemical_formula_sum            'C33 H43 N3 Rh'
_chemical_formula_weight         584.61
_chemical_properties_physical    'air-sensitive, moisture-sensitive'
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_atom_sites_solution_hydrogens   mixed
_cell_angle_alpha                90
_cell_angle_beta                 106.011(4)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.1673(10)
_cell_length_b                   7.9539(5)
_cell_length_c                   25.0698(16)
_cell_measurement_reflns_used    9559
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      30.1765
_cell_measurement_theta_min      2.4725
_cell_volume                     2907.1(3)
_computing_structure_refinement  'SHELXL-2017/1 (Sheldrick, 2017)'
_computing_structure_solution    'SHELXS-2017/1 (Sheldrick, 2017)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker D8 QUEST ECO CMOS'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0610
_diffrn_reflns_av_unetI/netI     0.0262
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       9
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            88558
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.493
_diffrn_reflns_theta_min         2.472
_diffrn_source                   'fine-focus tube'
_exptl_absorpt_coefficient_mu    0.613
_exptl_absorpt_correction_T_max  0.7461
_exptl_absorpt_correction_T_min  0.7167
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS V2014/5 (Bruker AXS Inc.)'
_exptl_crystal_colour            blue
_exptl_crystal_density_diffrn    1.336
_exptl_crystal_description       block
_exptl_crystal_F_000             1228
_exptl_crystal_recrystallization_method Hexane
_exptl_crystal_size_max          0.130
_exptl_crystal_size_mid          0.110
_exptl_crystal_size_min          0.050
_refine_diff_density_max         1.737
_refine_diff_density_min         -0.644
_refine_diff_density_rms         0.075
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.057
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     352
_refine_ls_number_reflns         5408
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.057
_refine_ls_R_factor_all          0.0486
_refine_ls_R_factor_gt           0.0355
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0294P)²+5.8597P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0752
_refine_ls_wR_factor_ref         0.0807
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                4537
_reflns_number_total             5408
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ICA-2018-482-709.cif
_cod_data_source_block           complex_3a
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               1563981
_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.
;
_shelx_estimated_absorpt_t_min   0.925
_shelx_estimated_absorpt_t_max   0.970
_exptl_absorpt_special_details   'SADABS V2014/5 (Bruker AXS Inc.)'
loop_
_space_group_symop_operation_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_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
Rh1 Rh 0.26068(2) 0.32501(3) 0.37163(2) 0.01803(8) Uani 1 1 d . . . . .
N1 N 0.34139(16) 0.1454(3) 0.35455(9) 0.0181(5) Uani 1 1 d . . . . .
N2 N 0.28301(16) 0.2369(3) 0.44924(10) 0.0203(5) Uani 1 1 d . . . . .
N3 N 0.23402(18) 0.4251(3) 0.29847(11) 0.0233(6) Uani 1 1 d . . . . .
C11 C 0.4333(2) -0.1116(4) 0.36560(13) 0.0288(7) Uani 1 1 d . . . . .
H111 H 0.391865 -0.164527 0.332889 0.043 Uiso 1 1 calc R U . . .
H112 H 0.456466 -0.196914 0.394246 0.043 Uiso 1 1 calc R U . . .
H113 H 0.484921 -0.059996 0.355244 0.043 Uiso 1 1 calc R U . . .
C12 C 0.38210(19) 0.0217(4) 0.38776(12) 0.0200(6) Uani 1 1 d . . . . .
C13 C 0.3800(2) 0.0043(4) 0.44301(12) 0.0230(7) Uani 1 1 d . . . . .
H13 H 0.413602 -0.087441 0.463025 0.028 Uiso 1 1 calc R U . . .
C14 C 0.3344(2) 0.1061(4) 0.47189(12) 0.0216(6) Uani 1 1 d . . . . .
C15 C 0.3435(2) 0.0585(5) 0.53167(13) 0.0321(8) Uani 1 1 d . . . . .
H151 H 0.357142 0.159296 0.555001 0.048 Uiso 1 1 calc R U . . .
H152 H 0.393435 -0.022973 0.544166 0.048 Uiso 1 1 calc R U . . .
H153 H 0.285960 0.008556 0.534513 0.048 Uiso 1 1 calc R U . . .
C21 C 0.3599(2) 0.1537(4) 0.30124(11) 0.0182(6) Uani 1 1 d . . . . .
C22 C 0.2996(2) 0.0813(4) 0.25463(12) 0.0218(7) Uani 1 1 d . . . . .
C23 C 0.3210(2) 0.0964(4) 0.20392(13) 0.0286(7) Uani 1 1 d . . . . .
H23 H 0.281672 0.046511 0.171611 0.034 Uiso 1 1 calc R U . . .
C24 C 0.3980(2) 0.1820(4) 0.19995(14) 0.0334(8) Uani 1 1 d . . . . .
H24 H 0.410841 0.191388 0.165073 0.040 Uiso 1 1 calc R U . . .
C25 C 0.4563(2) 0.2542(4) 0.24640(14) 0.0308(8) Uani 1 1 d . . . . .
H25 H 0.509164 0.312882 0.243268 0.037 Uiso 1 1 calc R U . . .
C26 C 0.4386(2) 0.2420(4) 0.29769(13) 0.0238(7) Uani 1 1 d . . . . .
C27 C 0.2140(2) -0.0063(4) 0.25861(13) 0.0299(7) Uani 1 1 d . . . . .
H271 H 0.230320 -0.112574 0.278666 0.045 Uiso 1 1 calc R U . . .
H272 H 0.174484 -0.028963 0.221214 0.045 Uiso 1 1 calc R U . . .
H273 H 0.181186 0.065531 0.278555 0.045 Uiso 1 1 calc R U . . .
C28 C 0.5007(2) 0.3212(5) 0.34836(14) 0.0338(8) Uani 1 1 d . . . . .
H281 H 0.552437 0.374680 0.338745 0.051 Uiso 1 1 calc R U . . .
H282 H 0.523648 0.234641 0.376609 0.051 Uiso 1 1 calc R U . . .
H283 H 0.466574 0.406006 0.362924 0.051 Uiso 1 1 calc R U . . .
C31 C 0.2404(2) 0.3320(4) 0.48450(11) 0.0238(7) Uani 1 1 d . . . . .
C32 C 0.1535(2) 0.2853(5) 0.48863(13) 0.0315(8) Uani 1 1 d . . . . .
C33 C 0.1148(3) 0.3800(6) 0.52319(15) 0.0432(10) Uani 1 1 d . . . . .
H33 H 0.056156 0.349951 0.526846 0.052 Uiso 1 1 calc R U . . .
C34 C 0.1597(3) 0.5158(5) 0.55203(15) 0.0471(11) Uani 1 1 d . . . . .
H34 H 0.131977 0.578982 0.575223 0.056 Uiso 1 1 calc R U . . .
C35 C 0.2456(3) 0.5611(5) 0.54737(14) 0.0425(10) Uani 1 1 d . . . . .
H35 H 0.276054 0.655678 0.567316 0.051 Uiso 1 1 calc R U . . .
C36 C 0.2877(2) 0.4697(4) 0.51388(13) 0.0311(8) Uani 1 1 d . . . . .
C37 C 0.1050(2) 0.1353(5) 0.45758(15) 0.0436(10) Uani 1 1 d . . . . .
H371 H 0.042043 0.131253 0.460725 0.065 Uiso 1 1 calc R U . . .
H372 H 0.137528 0.032551 0.473359 0.065 Uiso 1 1 calc R U . . .
H373 H 0.103757 0.144246 0.418394 0.065 Uiso 1 1 calc R U . . .
C38 C 0.3816(2) 0.5143(5) 0.50929(15) 0.0409(9) Uani 1 1 d . . . . .
H381 H 0.400277 0.623139 0.527152 0.061 Uiso 1 1 calc R U . . .
H382 H 0.380381 0.521067 0.470051 0.061 Uiso 1 1 calc R U . . .
H383 H 0.425524 0.427680 0.527663 0.061 Uiso 1 1 calc R U . . .
C41 C 0.16305(19) 0.5304(4) 0.27182(12) 0.0195(6) Uani 1 1 d . . . . .
C42 C 0.1080(2) 0.6048(4) 0.30255(12) 0.0220(6) Uani 1 1 d . . . . .
C43 C 0.0317(2) 0.6984(4) 0.27507(13) 0.0275(7) Uani 1 1 d . . . . .
H43 H -0.005610 0.748200 0.295579 0.033 Uiso 1 1 calc R U . . .
C44 C 0.0094(2) 0.7199(4) 0.21811(14) 0.0297(8) Uani 1 1 d . . . . .
H44 H -0.044151 0.780699 0.199500 0.036 Uiso 1 1 calc R U . . .
C45 C 0.0655(2) 0.6527(4) 0.18838(13) 0.0259(7) Uani 1 1 d . . . . .
H45 H 0.050469 0.670675 0.149439 0.031 Uiso 1 1 calc R U . . .
C46 C 0.1429(2) 0.5599(4) 0.21386(12) 0.0213(6) Uani 1 1 d . . . . .
C47 C 0.1362(2) 0.5880(4) 0.36489(13) 0.0268(7) Uani 1 1 d . . . . .
C48 C 0.2121(3) 0.7150(5) 0.39055(15) 0.0411(9) Uani 1 1 d . . . . .
H481 H 0.264544 0.696194 0.375589 0.062 Uiso 1 1 calc R U . . .
H482 H 0.231516 0.700664 0.430938 0.062 Uiso 1 1 calc R U . . .
H483 H 0.188763 0.829449 0.381527 0.062 Uiso 1 1 calc R U . . .
C49 C 0.0579(3) 0.6072(5) 0.39164(16) 0.0447(10) Uani 1 1 d . . . . .
H491 H 0.035553 0.723377 0.387279 0.067 Uiso 1 1 calc R U . . .
H492 H 0.079990 0.579847 0.431210 0.067 Uiso 1 1 calc R U . . .
H493 H 0.007891 0.530760 0.373633 0.067 Uiso 1 1 calc R U . . .
C50 C 0.2050(2) 0.4929(4) 0.18028(13) 0.0272(7) Uani 1 1 d . . . . .
H50 H 0.225819 0.378425 0.195022 0.033 Uiso 1 1 calc R U . . .
C51 C 0.2905(2) 0.6016(5) 0.18909(16) 0.0413(9) Uani 1 1 d . . . . .
H511 H 0.273044 0.713971 0.173807 0.062 Uiso 1 1 calc R U . . .
H512 H 0.332480 0.550235 0.170250 0.062 Uiso 1 1 calc R U . . .
H513 H 0.321098 0.610470 0.228897 0.062 Uiso 1 1 calc R U . . .
C52 C 0.1585(3) 0.4735(6) 0.11859(14) 0.0462(10) Uani 1 1 d . . . . .
H521 H 0.099806 0.415069 0.113397 0.069 Uiso 1 1 calc R U . . .
H522 H 0.198007 0.408058 0.101346 0.069 Uiso 1 1 calc R U . . .
H523 H 0.147558 0.584805 0.101273 0.069 Uiso 1 1 calc R U . . .
H47 H 0.158(2) 0.470(4) 0.3760(12) 0.021(8) Uiso 1 1 d . . . . .
H3 H 0.265(2) 0.393(5) 0.2750(15) 0.039(10) Uiso 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'
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
N3 Rh1 N1 94.08(10) . .
N3 Rh1 N2 175.39(11) . .
N1 Rh1 N2 90.49(10) . .
N3 Rh1 H47 81.4(9) . .
N1 Rh1 H47 166.1(9) . .
N2 Rh1 H47 94.3(9) . .
C12 N1 C21 116.1(2) . .
C12 N1 Rh1 126.96(19) . .
C21 N1 Rh1 116.90(18) . .
C14 N2 C31 117.2(2) . .
C14 N2 Rh1 127.5(2) . .
C31 N2 Rh1 115.23(19) . .
C41 N3 Rh1 129.7(2) . .
C41 N3 H3 110(2) . .
Rh1 N3 H3 120(2) . .
C12 C11 H111 109.5 . .
C12 C11 H112 109.5 . .
H111 C11 H112 109.5 . .
C12 C11 H113 109.5 . .
H111 C11 H113 109.5 . .
H112 C11 H113 109.5 . .
N1 C12 C13 124.1(3) . .
N1 C12 C11 119.2(3) . .
C13 C12 C11 116.7(3) . .
C14 C13 C12 127.4(3) . .
C14 C13 H13 116.3 . .
C12 C13 H13 116.3 . .
N2 C14 C13 123.4(3) . .
N2 C14 C15 120.0(3) . .
C13 C14 C15 116.6(3) . .
C14 C15 H151 109.5 . .
C14 C15 H152 109.5 . .
H151 C15 H152 109.5 . .
C14 C15 H153 109.5 . .
H151 C15 H153 109.5 . .
H152 C15 H153 109.5 . .
C22 C21 C26 121.7(3) . .
C22 C21 N1 120.4(3) . .
C26 C21 N1 117.8(3) . .
C21 C22 C23 117.5(3) . .
C21 C22 C27 121.1(3) . .
C23 C22 C27 121.4(3) . .
C24 C23 C22 121.4(3) . .
C24 C23 H23 119.3 . .
C22 C23 H23 119.3 . .
C25 C24 C23 120.2(3) . .
C25 C24 H24 119.9 . .
C23 C24 H24 119.9 . .
C24 C25 C26 120.7(3) . .
C24 C25 H25 119.6 . .
C26 C25 H25 119.6 . .
C25 C26 C21 118.5(3) . .
C25 C26 C28 121.4(3) . .
C21 C26 C28 120.1(3) . .
C22 C27 H271 109.5 . .
C22 C27 H272 109.5 . .
H271 C27 H272 109.5 . .
C22 C27 H273 109.5 . .
H271 C27 H273 109.5 . .
H272 C27 H273 109.5 . .
C26 C28 H281 109.5 . .
C26 C28 H282 109.5 . .
H281 C28 H282 109.5 . .
C26 C28 H283 109.5 . .
H281 C28 H283 109.5 . .
H282 C28 H283 109.5 . .
C32 C31 C36 121.6(3) . .
C32 C31 N2 119.7(3) . .
C36 C31 N2 118.7(3) . .
C33 C32 C31 117.9(3) . .
C33 C32 C37 121.5(3) . .
C31 C32 C37 120.6(3) . .
C34 C33 C32 121.4(4) . .
C34 C33 H33 119.3 . .
C32 C33 H33 119.3 . .
C33 C34 C35 120.1(3) . .
C33 C34 H34 120.0 . .
C35 C34 H34 120.0 . .
C34 C35 C36 120.9(4) . .
C34 C35 H35 119.5 . .
C36 C35 H35 119.5 . .
C35 C36 C31 118.1(3) . .
C35 C36 C38 121.7(3) . .
C31 C36 C38 120.2(3) . .
C32 C37 H371 109.5 . .
C32 C37 H372 109.5 . .
H371 C37 H372 109.5 . .
C32 C37 H373 109.5 . .
H371 C37 H373 109.5 . .
H372 C37 H373 109.5 . .
C36 C38 H381 109.5 . .
C36 C38 H382 109.5 . .
H381 C38 H382 109.5 . .
C36 C38 H383 109.5 . .
H381 C38 H383 109.5 . .
H382 C38 H383 109.5 . .
N3 C41 C42 119.3(3) . .
N3 C41 C46 120.9(3) . .
C42 C41 C46 119.8(3) . .
C43 C42 C41 119.4(3) . .
C43 C42 C47 121.4(3) . .
C41 C42 C47 119.1(3) . .
C44 C43 C42 120.7(3) . .
C44 C43 H43 119.6 . .
C42 C43 H43 119.6 . .
C45 C44 C43 119.8(3) . .
C45 C44 H44 120.1 . .
C43 C44 H44 120.1 . .
C44 C45 C46 121.8(3) . .
C44 C45 H45 119.1 . .
C46 C45 H45 119.1 . .
C45 C46 C41 118.4(3) . .
C45 C46 C50 120.5(3) . .
C41 C46 C50 121.1(3) . .
C42 C47 C49 114.5(3) . .
C42 C47 C48 110.0(3) . .
C49 C47 C48 109.6(3) . .
C42 C47 H47 110.2(17) . .
C49 C47 H47 101.8(17) . .
C48 C47 H47 110.5(18) . .
C47 C48 H481 109.5 . .
C47 C48 H482 109.5 . .
H481 C48 H482 109.5 . .
C47 C48 H483 109.5 . .
H481 C48 H483 109.5 . .
H482 C48 H483 109.5 . .
C47 C49 H491 109.5 . .
C47 C49 H492 109.5 . .
H491 C49 H492 109.5 . .
C47 C49 H493 109.5 . .
H491 C49 H493 109.5 . .
H492 C49 H493 109.5 . .
C52 C50 C46 114.4(3) . .
C52 C50 C51 110.1(3) . .
C46 C50 C51 110.7(3) . .
C52 C50 H50 107.1 . .
C46 C50 H50 107.1 . .
C51 C50 H50 107.1 . .
C50 C51 H511 109.5 . .
C50 C51 H512 109.5 . .
H511 C51 H512 109.5 . .
C50 C51 H513 109.5 . .
H511 C51 H513 109.5 . .
H512 C51 H513 109.5 . .
C50 C52 H521 109.5 . .
C50 C52 H522 109.5 . .
H521 C52 H522 109.5 . .
C50 C52 H523 109.5 . .
H521 C52 H523 109.5 . .
H522 C52 H523 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Rh1 N3 1.937(3) .
Rh1 N1 2.003(2) .
Rh1 N2 2.007(2) .
Rh1 H47 1.97(3) .
N1 C12 1.326(4) .
N1 C21 1.441(3) .
N2 C14 1.330(4) .
N2 C31 1.444(4) .
N3 C41 1.382(4) .
N3 H3 0.89(4) .
C11 C12 1.508(4) .
C11 H111 0.9800 .
C11 H112 0.9800 .
C11 H113 0.9800 .
C12 C13 1.401(4) .
C13 C14 1.391(4) .
C13 H13 0.9500 .
C14 C15 1.514(4) .
C15 H151 0.9800 .
C15 H152 0.9800 .
C15 H153 0.9800 .
C21 C22 1.395(4) .
C21 C26 1.408(4) .
C22 C23 1.401(4) .
C22 C27 1.501(4) .
C23 C24 1.379(5) .
C23 H23 0.9500 .
C24 C25 1.378(5) .
C24 H24 0.9500 .
C25 C26 1.387(4) .
C25 H25 0.9500 .
C26 C28 1.495(4) .
C27 H271 0.9800 .
C27 H272 0.9800 .
C27 H273 0.9800 .
C28 H281 0.9800 .
C28 H282 0.9800 .
C28 H283 0.9800 .
C31 C32 1.401(4) .
C31 C36 1.402(5) .
C32 C33 1.394(5) .
C32 C37 1.501(5) .
C33 C34 1.372(6) .
C33 H33 0.9500 .
C34 C35 1.386(6) .
C34 H34 0.9500 .
C35 C36 1.392(5) .
C35 H35 0.9500 .
C36 C38 1.503(5) .
C37 H371 0.9800 .
C37 H372 0.9800 .
C37 H373 0.9800 .
C38 H381 0.9800 .
C38 H382 0.9800 .
C38 H383 0.9800 .
C41 C42 1.413(4) .
C41 C46 1.419(4) .
C42 C43 1.389(4) .
C42 C47 1.508(4) .
C43 C44 1.384(4) .
C43 H43 0.9500 .
C44 C45 1.383(4) .
C44 H44 0.9500 .
C45 C46 1.385(4) .
C45 H45 0.9500 .
C46 C50 1.522(4) .
C47 C49 1.524(5) .
C47 C48 1.534(5) .
C47 H47 1.01(3) .
C48 H481 0.9800 .
C48 H482 0.9800 .
C48 H483 0.9800 .
C49 H491 0.9800 .
C49 H492 0.9800 .
C49 H493 0.9800 .
C50 C52 1.520(5) .
C50 C51 1.523(5) .
C50 H50 1.0000 .
C51 H511 0.9800 .
C51 H512 0.9800 .
C51 H513 0.9800 .
C52 H521 0.9800 .
C52 H522 0.9800 .
C52 H523 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
C21 N1 C12 C13 172.9(3) . . . .
Rh1 N1 C12 C13 -4.9(4) . . . .
C21 N1 C12 C11 -7.9(4) . . . .
Rh1 N1 C12 C11 174.3(2) . . . .
N1 C12 C13 C14 2.1(5) . . . .
C11 C12 C13 C14 -177.1(3) . . . .
C31 N2 C14 C13 -179.5(3) . . . .
Rh1 N2 C14 C13 -1.9(4) . . . .
C31 N2 C14 C15 2.2(4) . . . .
Rh1 N2 C14 C15 179.7(2) . . . .
C12 C13 C14 N2 1.5(5) . . . .
C12 C13 C14 C15 179.9(3) . . . .
C12 N1 C21 C22 96.0(3) . . . .
Rh1 N1 C21 C22 -85.9(3) . . . .
C12 N1 C21 C26 -86.2(3) . . . .
Rh1 N1 C21 C26 91.8(3) . . . .
C26 C21 C22 C23 1.3(4) . . . .
N1 C21 C22 C23 179.0(3) . . . .
C26 C21 C22 C27 -177.5(3) . . . .
N1 C21 C22 C27 0.2(4) . . . .
C21 C22 C23 C24 -1.1(5) . . . .
C27 C22 C23 C24 177.7(3) . . . .
C22 C23 C24 C25 0.5(5) . . . .
C23 C24 C25 C26 0.0(5) . . . .
C24 C25 C26 C21 0.2(5) . . . .
C24 C25 C26 C28 -179.3(3) . . . .
C22 C21 C26 C25 -0.9(5) . . . .
N1 C21 C26 C25 -178.6(3) . . . .
C22 C21 C26 C28 178.7(3) . . . .
N1 C21 C26 C28 0.9(4) . . . .
C14 N2 C31 C32 -89.1(3) . . . .
Rh1 N2 C31 C32 93.1(3) . . . .
C14 N2 C31 C36 90.9(3) . . . .
Rh1 N2 C31 C36 -86.9(3) . . . .
C36 C31 C32 C33 -0.1(5) . . . .
N2 C31 C32 C33 179.9(3) . . . .
C36 C31 C32 C37 -178.8(3) . . . .
N2 C31 C32 C37 1.2(4) . . . .
C31 C32 C33 C34 0.5(5) . . . .
C37 C32 C33 C34 179.2(3) . . . .
C32 C33 C34 C35 -0.3(6) . . . .
C33 C34 C35 C36 -0.4(6) . . . .
C34 C35 C36 C31 0.8(5) . . . .
C34 C35 C36 C38 -178.6(3) . . . .
C32 C31 C36 C35 -0.5(5) . . . .
N2 C31 C36 C35 179.5(3) . . . .
C32 C31 C36 C38 178.8(3) . . . .
N2 C31 C36 C38 -1.1(4) . . . .
Rh1 N3 C41 C42 12.4(4) . . . .
Rh1 N3 C41 C46 -165.3(2) . . . .
N3 C41 C42 C43 -174.3(3) . . . .
C46 C41 C42 C43 3.6(4) . . . .
N3 C41 C42 C47 8.8(4) . . . .
C46 C41 C42 C47 -173.4(3) . . . .
C41 C42 C43 C44 -0.3(5) . . . .
C47 C42 C43 C44 176.6(3) . . . .
C42 C43 C44 C45 -2.3(5) . . . .
C43 C44 C45 C46 1.6(5) . . . .
C44 C45 C46 C41 1.7(5) . . . .
C44 C45 C46 C50 -177.8(3) . . . .
N3 C41 C46 C45 173.6(3) . . . .
C42 C41 C46 C45 -4.2(4) . . . .
N3 C41 C46 C50 -7.0(4) . . . .
C42 C41 C46 C50 175.3(3) . . . .
C43 C42 C47 C49 26.5(4) . . . .
C41 C42 C47 C49 -156.6(3) . . . .
C43 C42 C47 C48 -97.4(4) . . . .
C41 C42 C47 C48 79.5(4) . . . .
C45 C46 C50 C52 -23.2(4) . . . .
C41 C46 C50 C52 157.3(3) . . . .
C45 C46 C50 C51 101.8(3) . . . .
C41 C46 C50 C51 -77.7(4) . . . .
