#------------------------------------------------------------------------------
#$Date: 2019-11-17 10:17:56 +0200 (Sun, 17 Nov 2019) $
#$Revision: 229305 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/04/72/7047280.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_7047280
loop_
_publ_author_name
'Yang, Wu'
'Chen, Chen'
'Chan, Kin Shing'
_publ_section_title
;
 Hydrodebromination of allylic and benzylic bromides with water catalyzed
 by a rhodium porphyrin complex.
;
_journal_issue                   37
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              12879
_journal_page_last               12883
_journal_paper_doi               10.1039/c8dt02168f
_journal_volume                  47
_journal_year                    2018
_chemical_formula_sum            'C58.5 H48.5 N4 Rh'
_chemical_formula_weight         910.42
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/6
_audit_update_record
;
2018-07-16 deposited with the CCDC.
2018-08-16 downloaded from the CCDC.
;
_cell_angle_alpha                112.876(4)
_cell_angle_beta                 91.885(4)
_cell_angle_gamma                112.174(4)
_cell_formula_units_Z            2
_cell_length_a                   12.498(2)
_cell_length_b                   14.419(2)
_cell_length_c                   15.675(2)
_cell_measurement_reflns_used    276
_cell_measurement_temperature    222(2)
_cell_measurement_theta_max      15
_cell_measurement_theta_min      15
_cell_volume                     2356.1(6)
_computing_cell_refinement       'BRUKER D8VENTURE DIFFRACTOMETER'
_computing_data_collection       'BRUKER D8VENTURE DIFFRACTOMETER'
_computing_data_reduction        'BRUKER D8VENTURE DIFFRACTOMETER'
_computing_molecular_graphics    'BRUKER SHELXTL'
_computing_publication_material  'BRUKER SHELXTL'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_diffrn_ambient_temperature      222(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'BRUKER D8VENTURE DIFFRACTOMETER'
_diffrn_measurement_method       'PHI & OMEGA SCAN'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_unetI/netI     0.1059
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -11
_diffrn_reflns_number            8476
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.302
_diffrn_reflns_theta_min         2.056
_exptl_absorpt_coefficient_mu    0.405
_exptl_absorpt_correction_T_max  0.7441
_exptl_absorpt_correction_T_min  0.5655
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.283
_exptl_crystal_description       block
_exptl_crystal_F_000             945
_exptl_crystal_size_max          0.500
_exptl_crystal_size_mid          0.400
_exptl_crystal_size_min          0.300
_refine_diff_density_max         3.817
_refine_diff_density_min         -2.051
_refine_diff_density_rms         0.169
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.995
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     587
_refine_ls_number_reflns         8476
_refine_ls_number_restraints     10
_refine_ls_restrained_S_all      0.998
_refine_ls_R_factor_all          0.1330
_refine_ls_R_factor_gt           0.0960
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1643P)²+9.5519P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2507
_refine_ls_wR_factor_ref         0.2743
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6046
_reflns_number_total             8476
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c8dt02168f2.cif
_cod_data_source_block           WY313(low)
_cod_depositor_comments
'Adding full bibliography for 7047279--7047280.cif.'
_cod_original_cell_volume        2356.3(6)
_cod_original_formula_sum        'C58.50 H48.50 N4 Rh'
_cod_database_code               7047280
_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   0.823
_shelx_estimated_absorpt_t_max   0.888
_shelxl_version_number           2014/6
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
Rh1 Rh 0.71203(6) -0.00605(5) 0.50484(5) 0.0246(3) Uani 1 1 d . . .
N1 N 0.7555(6) 0.0711(6) 0.6470(5) 0.0324(17) Uani 1 1 d . . .
N2 N 0.6373(6) 0.0960(6) 0.5053(5) 0.0294(15) Uani 1 1 d . . .
N3 N 0.6731(6) -0.0801(6) 0.3616(5) 0.0319(16) Uani 1 1 d . . .
N4 N 0.7671(6) -0.1204(6) 0.5052(5) 0.0288(15) Uani 1 1 d . . .
C1 C 0.8168(7) 0.0476(8) 0.7052(6) 0.032(2) Uani 1 1 d . . .
C2 C 0.8509(8) 0.1351(8) 0.7999(6) 0.037(2) Uani 1 1 d . . .
H2A H 0.8924 0.1393 0.8534 0.045 Uiso 1 1 calc R U .
C3 C 0.8127(8) 0.2087(9) 0.7974(6) 0.039(2) Uani 1 1 d . . .
H3A H 0.8241 0.2754 0.8491 0.047 Uiso 1 1 calc R U .
C4 C 0.7527(8) 0.1701(7) 0.7050(6) 0.033(2) Uani 1 1 d . . .
C5 C 0.6910(8) 0.2189(7) 0.6740(6) 0.034(2) Uani 1 1 d . . .
C6 C 0.6294(7) 0.1771(7) 0.5821(6) 0.0296(19) Uani 1 1 d . . .
C7 C 0.5549(9) 0.2196(9) 0.5532(7) 0.045(3) Uani 1 1 d . . .
H7A H 0.5315 0.2733 0.5930 0.055 Uiso 1 1 calc R U .
C8 C 0.5256(8) 0.1677(8) 0.4586(8) 0.045(3) Uani 1 1 d . . .
H8A H 0.4774 0.1789 0.4198 0.054 Uiso 1 1 calc R U .
C9 C 0.5798(7) 0.0922(7) 0.4262(6) 0.0301(19) Uani 1 1 d . . .
C10 C 0.5847(8) 0.0355(8) 0.3331(7) 0.036(2) Uani 1 1 d . . .
C11 C 0.6343(8) -0.0419(7) 0.3036(6) 0.032(2) Uani 1 1 d . . .
C12 C 0.6471(8) -0.1002(8) 0.2091(6) 0.037(2) Uani 1 1 d . . .
H12A H 0.6294 -0.0893 0.1559 0.045 Uiso 1 1 calc R U .
C13 C 0.6892(8) -0.1729(8) 0.2107(6) 0.035(2) Uani 1 1 d . . .
H13A H 0.7054 -0.2224 0.1586 0.042 Uiso 1 1 calc R U .
C14 C 0.7046(8) -0.1620(7) 0.3041(6) 0.0316(19) Uani 1 1 d . . .
C15 C 0.7424(7) -0.2253(7) 0.3351(6) 0.0304(19) Uani 1 1 d . . .
C16 C 0.7649(8) -0.2098(8) 0.4274(6) 0.035(2) Uani 1 1 d . . .
C17 C 0.8019(8) -0.2760(8) 0.4588(7) 0.037(2) Uani 1 1 d . . .
H17A H 0.8081 -0.3416 0.4199 0.044 Uiso 1 1 calc R U .
C18 C 0.8259(8) -0.2276(8) 0.5536(7) 0.040(2) Uani 1 1 d . . .
H18A H 0.8508 -0.2537 0.5933 0.048 Uiso 1 1 calc R U .
C19 C 0.8065(7) -0.1285(7) 0.5836(6) 0.0287(19) Uani 1 1 d . . .
C20 C 0.8349(7) -0.0481(8) 0.6776(6) 0.0311(19) Uani 1 1 d . . .
C21 C 0.6953(9) 0.3255(8) 0.7481(7) 0.041(2) Uani 1 1 d . . .
C22 C 0.6153(10) 0.3274(10) 0.8050(8) 0.060(3) Uani 1 1 d . . .
H22A H 0.5539 0.2600 0.7966 0.071 Uiso 1 1 calc R U .
C23 C 0.6219(12) 0.4261(13) 0.8748(9) 0.069(4) Uani 1 1 d . . .
H23A H 0.5617 0.4236 0.9095 0.083 Uiso 1 1 calc R U .
C24 C 0.7093(15) 0.5235(12) 0.8946(9) 0.071(4) Uani 1 1 d . . .
C25 C 0.7989(17) 0.5253(11) 0.8428(12) 0.105(7) Uani 1 1 d . . .
H25A H 0.8632 0.5932 0.8562 0.126 Uiso 1 1 calc R U .
C26 C 0.7932(13) 0.4264(11) 0.7711(10) 0.080(4) Uani 1 1 d . U .
H26A H 0.8551 0.4280 0.7385 0.097 Uiso 1 1 calc R U .
C27 C 0.7182(19) 0.6313(13) 0.9753(11) 0.104(6) Uani 1 1 d . . .
H27A H 0.7882 0.6935 0.9785 0.157 Uiso 1 1 calc R U .
H27B H 0.6486 0.6428 0.9635 0.157 Uiso 1 1 calc R U .
H27C H 0.7236 0.6258 1.0349 0.157 Uiso 1 1 calc R U .
C31 C 0.5400(8) 0.0603(8) 0.2577(7) 0.036(2) Uani 1 1 d . . .
C32 C 0.5929(13) 0.1632(11) 0.2606(9) 0.075(4) Uani 1 1 d . . .
H32A H 0.6573 0.2194 0.3100 0.090 Uiso 1 1 calc R U .
C33 C 0.5516(13) 0.1856(11) 0.1896(10) 0.077(4) Uani 1 1 d . . .
H33A H 0.5895 0.2569 0.1921 0.092 Uiso 1 1 calc R U .
C34 C 0.4583(12) 0.1065(12) 0.1175(9) 0.064(3) Uani 1 1 d . . .
C35 C 0.4063(11) 0.0040(13) 0.1170(9) 0.069(4) Uani 1 1 d . . .
H35A H 0.3425 -0.0525 0.0671 0.083 Uiso 1 1 calc R U .
C36 C 0.4442(9) -0.0202(11) 0.1877(8) 0.057(3) Uani 1 1 d . . .
H36A H 0.4044 -0.0906 0.1868 0.068 Uiso 1 1 calc R U .
C37 C 0.4168(15) 0.1315(15) 0.0402(11) 0.093(5) Uani 1 1 d . . .
H37A H 0.3497 0.0660 -0.0050 0.140 Uiso 1 1 calc R U .
H37B H 0.3937 0.1921 0.0682 0.140 Uiso 1 1 calc R U .
H37C H 0.4805 0.1524 0.0082 0.140 Uiso 1 1 calc R U .
C41 C 0.7563(9) -0.3225(8) 0.2595(7) 0.040(2) Uani 1 1 d . . .
C42 C 0.8646(10) -0.3126(11) 0.2399(9) 0.066(3) Uani 1 1 d . . .
H42A H 0.9303 -0.2436 0.2712 0.079 Uiso 1 1 calc R U .
C43 C 0.8796(12) -0.4034(12) 0.1737(10) 0.080(4) Uani 1 1 d . . .
H43A H 0.9555 -0.3949 0.1626 0.096 Uiso 1 1 calc R U .
C44 C 0.7855(14) -0.5039(11) 0.1255(9) 0.066(4) Uani 1 1 d . . .
C45 C 0.6768(13) -0.5144(10) 0.1455(9) 0.067(4) Uani 1 1 d . . .
H45A H 0.6109 -0.5834 0.1143 0.081 Uiso 1 1 calc R U .
C46 C 0.6630(10) -0.4241(8) 0.2115(8) 0.055(3) Uani 1 1 d . . .
H46A H 0.5873 -0.4331 0.2234 0.066 Uiso 1 1 calc R U .
C47 C 0.7989(18) -0.6040(14) 0.0533(12) 0.116(7) Uani 1 1 d . . .
H47A H 0.7222 -0.6672 0.0269 0.174 Uiso 1 1 calc R U .
H47B H 0.8309 -0.5869 0.0029 0.174 Uiso 1 1 calc R U .
H47C H 0.8521 -0.6217 0.0840 0.174 Uiso 1 1 calc R U .
C51 C 0.8933(8) -0.0650(8) 0.7521(7) 0.038(2) Uani 1 1 d . . .
C52 C 1.0153(9) -0.0164(11) 0.7819(8) 0.056(3) Uani 1 1 d . . .
H52A H 1.0634 0.0301 0.7568 0.067 Uiso 1 1 calc R U .
C53 C 1.0660(9) -0.0365(11) 0.8484(9) 0.061(3) Uani 1 1 d . . .
H53A H 1.1485 -0.0001 0.8698 0.073 Uiso 1 1 calc R U .
C54 C 1.0003(10) -0.1078(10) 0.8847(8) 0.053(3) Uani 1 1 d . . .
C55 C 0.8800(10) -0.1537(10) 0.8555(8) 0.059(3) Uani 1 1 d . . .
H55A H 0.8322 -0.2010 0.8802 0.071 Uiso 1 1 calc R U .
C56 C 0.8264(9) -0.1327(10) 0.7905(8) 0.057(3) Uani 1 1 d . . .
H56A H 0.7436 -0.1650 0.7725 0.068 Uiso 1 1 calc R U .
C57 C 1.0589(13) -0.1342(12) 0.9527(10) 0.076(4) Uani 1 1 d . . .
H57A H 1.1440 -0.0937 0.9646 0.114 Uiso 1 1 calc R U .
H57B H 1.0323 -0.1125 1.0119 0.114 Uiso 1 1 calc R U .
H57C H 1.0378 -0.2134 0.9253 0.114 Uiso 1 1 calc R U .
C61 C 0.8821(8) 0.0962(7) 0.5009(9) 0.045(2) Uani 1 1 d D . .
H61A H 0.9377 0.1183 0.5582 0.054 Uiso 1 1 calc R U .
H61B H 0.9074 0.0543 0.4461 0.054 Uiso 1 1 calc R U .
C62 C 0.8852(9) 0.1970(10) 0.4944(10) 0.063(3) Uani 1 1 d D . .
H62A H 0.8848 0.2564 0.5480 0.076 Uiso 1 1 calc R U .
C63 C 0.8884(11) 0.2019(12) 0.4140(11) 0.076(4) Uani 1 1 d . . .
H63A H 0.8900 0.1419 0.3617 0.091 Uiso 1 1 calc R U .
C64 C 0.8899(11) 0.3010(11) 0.4009(11) 0.069(4) Uani 1 1 d . . .
C65 C 0.9229(16) 0.3103(14) 0.3197(12) 0.097(5) Uani 1 1 d . . .
H65A H 0.9483 0.2587 0.2792 0.116 Uiso 1 1 calc R U .
C66 C 0.9198(17) 0.3906(14) 0.2968(12) 0.098(5) Uani 1 1 d . . .
H66A H 0.9460 0.3962 0.2427 0.117 Uiso 1 1 calc R U .
C67 C 0.8782(17) 0.4636(16) 0.3528(15) 0.113(6) Uani 1 1 d . . .
H67A H 0.8719 0.5173 0.3356 0.136 Uiso 1 1 calc R U .
C68 C 0.8447(15) 0.4581(14) 0.4365(14) 0.096(5) Uani 1 1 d . . .
H68A H 0.8181 0.5098 0.4752 0.115 Uiso 1 1 calc R U .
C69 C 0.8501(12) 0.3782(14) 0.4633(13) 0.094(5) Uani 1 1 d . . .
H69A H 0.8287 0.3752 0.5194 0.112 Uiso 1 1 calc R U .
C72 C 0.523(3) -0.426(3) 0.619(3) 0.16(2) Uani 0.5 1 d D . P
H72A H 0.5505 -0.3521 0.6200 0.195 Uiso 0.5 1 calc R U P
H72B H 0.4398 -0.4524 0.6227 0.195 Uiso 0.5 1 calc R U P
C73 C 0.543(2) -0.507(3) 0.530(2) 0.16(3) Uani 0.5 1 d D . P
H73A H 0.5148 -0.5830 0.5255 0.194 Uiso 0.5 1 calc R U P
H73B H 0.6240 -0.4809 0.5208 0.194 Uiso 0.5 1 calc R U P
C71 C 0.598(4) -0.424(3) 0.699(3) 0.141(18) Uani 0.5 1 d D . P
H71A H 0.5922 -0.3735 0.7594 0.211 Uiso 0.5 1 calc R U P
H71B H 0.5704 -0.4979 0.6956 0.211 Uiso 0.5 1 calc R U P
H71C H 0.6802 -0.3983 0.6929 0.211 Uiso 0.5 1 calc R U P
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_3
N1 Rh1 N4 90.3(3) .
N1 Rh1 N2 89.6(3) .
N4 Rh1 N2 173.0(3) .
N1 Rh1 N3 178.2(3) .
N4 Rh1 N3 90.0(3) .
N2 Rh1 N3 90.3(3) .
N1 Rh1 C61 89.2(4) .
N4 Rh1 C61 91.0(3) .
N2 Rh1 C61 96.0(3) .
N3 Rh1 C61 89.0(4) .
C4 N1 C1 105.4(7) .
C4 N1 Rh1 127.3(6) .
C1 N1 Rh1 126.2(6) .
C6 N2 C9 107.3(6) .
C6 N2 Rh1 126.8(5) .
C9 N2 Rh1 125.8(6) .
C14 N3 C11 106.6(7) .
C14 N3 Rh1 126.1(6) .
C11 N3 Rh1 125.9(6) .
C19 N4 C16 106.7(6) .
C19 N4 Rh1 126.3(6) .
C16 N4 Rh1 126.9(6) .
C20 C1 N1 125.3(8) .
C20 C1 C2 125.9(8) .
N1 C1 C2 108.7(8) .
C3 C2 C1 107.2(8) .
C2 C3 C4 108.4(9) .
N1 C4 C3 110.3(8) .
N1 C4 C5 123.1(8) .
C3 C4 C5 126.5(9) .
C6 C5 C4 125.3(8) .
C6 C5 C21 119.1(8) .
C4 C5 C21 115.5(8) .
N2 C6 C5 125.1(7) .
N2 C6 C7 109.6(8) .
C5 C6 C7 125.1(8) .
C8 C7 C6 106.6(9) .
C7 C8 C9 108.6(8) .
N2 C9 C10 126.2(8) .
N2 C9 C8 107.6(8) .
C10 C9 C8 125.8(8) .
C9 C10 C11 124.0(8) .
C9 C10 C31 119.2(8) .
C11 C10 C31 116.6(8) .
N3 C11 C10 124.7(8) .
N3 C11 C12 108.1(8) .
C10 C11 C12 127.1(8) .
C13 C12 C11 107.6(8) .
C12 C13 C14 108.1(8) .
N3 C14 C15 124.2(8) .
N3 C14 C13 109.6(8) .
C15 C14 C13 126.1(8) .
C16 C15 C14 126.1(8) .
C16 C15 C41 117.0(8) .
C14 C15 C41 116.9(8) .
C15 C16 N4 124.6(8) .
C15 C16 C17 126.0(8) .
N4 C16 C17 109.1(8) .
C18 C17 C16 107.7(8) .
C17 C18 C19 107.5(8) .
N4 C19 C20 125.7(7) .
N4 C19 C18 109.0(8) .
C20 C19 C18 125.0(7) .
C1 C20 C19 124.2(7) .
C1 C20 C51 118.2(8) .
C19 C20 C51 117.5(8) .
C22 C21 C26 116.6(11) .
C22 C21 C5 122.4(10) .
C26 C21 C5 120.3(10) .
C21 C22 C23 121.9(12) .
C24 C23 C22 122.6(12) .
C23 C24 C25 117.8(12) .
C23 C24 C27 121.9(13) .
C25 C24 C27 120.2(15) .
C24 C25 C26 120.5(14) .
C21 C26 C25 120.1(12) .
C32 C31 C36 119.9(9) .
C32 C31 C10 120.3(9) .
C36 C31 C10 119.7(9) .
C31 C32 C33 120.1(11) .
C34 C33 C32 121.5(12) .
C33 C34 C35 117.0(10) .
C33 C34 C37 120.7(13) .
C35 C34 C37 122.2(13) .
C34 C35 C36 122.8(12) .
C31 C36 C35 118.6(11) .
C42 C41 C46 117.4(10) .
C42 C41 C15 120.7(10) .
C46 C41 C15 121.9(9) .
C41 C42 C43 121.3(12) .
C44 C43 C42 120.7(12) .
C43 C44 C45 118.2(11) .
C43 C44 C47 122.0(14) .
C45 C44 C47 119.8(14) .
C44 C45 C46 120.6(12) .
C41 C46 C45 121.8(11) .
C56 C51 C52 118.1(9) .
C56 C51 C20 120.3(8) .
C52 C51 C20 121.6(9) .
C53 C52 C51 120.0(10) .
C52 C53 C54 122.6(10) .
C55 C54 C53 116.6(9) .
C55 C54 C57 122.0(11) .
C53 C54 C57 121.4(11) .
C54 C55 C56 122.0(10) .
C51 C56 C55 120.7(10) .
C62 C61 Rh1 111.6(6) .
C63 C62 C61 118.9(13) .
C62 C63 C64 122.3(14) .
C65 C64 C69 119.7(13) .
C65 C64 C63 117.0(14) .
C69 C64 C63 123.1(14) .
C66 C65 C64 122.6(15) .
C65 C66 C67 119.5(16) .
C66 C67 C68 119.8(15) .
C69 C68 C67 121.9(16) .
C68 C69 C64 116.5(16) .
C71 C72 C73 103(3) .
C72 C73 C73 89(3) 2_646
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Rh1 N1 2.009(7) .
Rh1 N4 2.014(6) .
Rh1 N2 2.016(6) .
Rh1 N3 2.022(7) .
Rh1 C61 2.100(9) .
N1 C4 1.376(11) .
N1 C1 1.388(10) .
N2 C6 1.352(11) .
N2 C9 1.384(10) .
N3 C14 1.381(11) .
N3 C11 1.389(10) .
N4 C19 1.372(10) .
N4 C16 1.378(12) .
C1 C20 1.385(13) .
C1 C2 1.440(13) .
C2 C3 1.330(13) .
C3 C4 1.400(12) .
C4 C5 1.406(12) .
C5 C6 1.390(12) .
C5 C21 1.504(13) .
C6 C7 1.437(11) .
C7 C8 1.337(14) .
C8 C9 1.433(12) .
C9 C10 1.385(13) .
C10 C11 1.408(13) .
C10 C31 1.507(12) .
C11 C12 1.441(12) .
C12 C13 1.347(13) .
C13 C14 1.409(12) .
C14 C15 1.395(12) .
C15 C16 1.378(12) .
C15 C41 1.518(12) .
C16 C17 1.431(12) .
C17 C18 1.339(12) .
C18 C19 1.438(12) .
C19 C20 1.402(12) .
C20 C51 1.503(11) .
C21 C22 1.362(15) .
C21 C26 1.402(17) .
C22 C23 1.388(17) .
C23 C24 1.319(19) .
C24 C25 1.40(2) .
C24 C27 1.537(18) .
C25 C26 1.405(19) .
C31 C32 1.359(15) .
C31 C36 1.364(15) .
C32 C33 1.405(15) .
C33 C34 1.359(18) .
C34 C35 1.368(18) .
C34 C37 1.519(15) .
C35 C36 1.402(15) .
C41 C42 1.364(15) .
C41 C46 1.367(15) .
C42 C43 1.403(17) .
C43 C44 1.363(19) .
C44 C45 1.371(19) .
C44 C47 1.522(18) .
C45 C46 1.389(16) .
C51 C56 1.373(14) .
C51 C52 1.388(14) .
C52 C53 1.378(14) .
C53 C54 1.380(16) .
C54 C55 1.370(16) .
C54 C57 1.515(14) .
C55 C56 1.388(14) .
C61 C62 1.482(8) .
C62 C63 1.292(17) .
C63 C64 1.514(18) .
C64 C65 1.39(2) .
C64 C69 1.43(2) .
C65 C66 1.35(2) .
C66 C67 1.37(2) .
C67 C68 1.41(2) .
C68 C69 1.39(2) .
C72 C71 1.524(10) .
C72 C73 1.530(10) .
C73 C73 1.537(10) 2_646
