#------------------------------------------------------------------------------
#$Date: 2016-03-22 23:44:30 +0200 (Tue, 22 Mar 2016) $
#$Revision: 179075 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/37/4303709.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_4303709
loop_
_publ_author_name
'Arup Sinha'
'S. M. Wahidur Rahaman'
'Mithun Sarkar'
'Biswajit Saha'
'Prosenjit Daw'
'Jitendra K. Bera'
_publ_contact_author_address
'Department of Chemistry, IIT Kanpur, Kanpur 208016, INDIA.'
_publ_contact_author_email       jbera@iitk.ac.in
_publ_contact_author_fax         '+ 91-512-2597436'
_publ_contact_author_name        'Jitendra K. Bera'
_publ_contact_author_phone       '+ 91-512-2597336'
_publ_section_title
;
Multifaceted Coordination of Naphthyridine-Functionalized N-Heterocyclic
Carbene: A Novel "IrIII(CN)(CC)" Compound and Its Evaluation as
Transfer Hydrogenation Catalyst
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              11114
_journal_page_last               11122
_journal_paper_doi               10.1021/ic901502n
_journal_volume                  48
_journal_year                    2009
_chemical_formula_moiety         'C36 H42 Br2 N4 Rh2'
_chemical_formula_sum            'C36 H42 Br2 N4 Rh2'
_chemical_formula_weight         896.38
_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   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                105.890(2)
_cell_angle_beta                 100.108(2)
_cell_angle_gamma                110.761(2)
_cell_formula_units_Z            2
_cell_length_a                   10.4180(13)
_cell_length_b                   13.2320(17)
_cell_length_c                   13.9807(17)
_cell_measurement_reflns_used    3622
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      27.06
_cell_measurement_theta_min      2.29
_cell_volume                     1651.7(4)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    ORTEP
_computing_publication_material  ciftab
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.977
_diffrn_measured_fraction_theta_max 0.977
_diffrn_measurement_device_type  'Bruker SMART APEX'
_diffrn_measurement_method       'omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0399
_diffrn_reflns_av_sigmaI/netI    0.0669
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            12341
_diffrn_reflns_theta_full        25.68
_diffrn_reflns_theta_max         25.68
_diffrn_reflns_theta_min         2.29
_exptl_absorpt_coefficient_mu    3.451
_exptl_absorpt_correction_T_max  0.4344
_exptl_absorpt_correction_T_min  0.3539
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.802
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             892
_exptl_crystal_size_max          0.38
_exptl_crystal_size_mid          0.35
_exptl_crystal_size_min          0.29
_refine_diff_density_max         2.904
_refine_diff_density_min         -2.389
_refine_diff_density_rms         0.256
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.036
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     394
_refine_ls_number_reflns         6125
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.036
_refine_ls_R_factor_all          0.0842
_refine_ls_R_factor_gt           0.0666
_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)+(0.1310P)²+10.1940P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1884
_refine_ls_wR_factor_ref         0.2051
_reflns_number_gt                4771
_reflns_number_total             6125
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic901502n_si_002_5.cif
_cod_data_source_block           compound4
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4303709
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
Rh2 Rh 0.81762(6) 0.53166(5) 0.72396(5) 0.0115(2) Uani 1 1 d . . .
Rh1 Rh 1.43414(6) 1.00952(5) 1.23066(5) 0.0133(2) Uani 1 1 d . . .
Br2 Br 0.66962(12) 0.51688(10) 0.84414(9) 0.0376(3) Uani 1 1 d . . .
Br1 Br 1.26855(13) 1.07364(11) 1.31206(10) 0.0456(3) Uani 1 1 d . . .
N3 N 1.0874(7) 0.6687(6) 0.9206(5) 0.0116(13) Uani 1 1 d . . .
C34 C 0.9579(8) 0.3633(7) 0.8001(6) 0.0145(17) Uani 1 1 d . . .
H34A H 0.8655 0.3469 0.7511 0.017 Uiso 1 1 calc R . .
H34B H 0.9353 0.3196 0.8467 0.017 Uiso 1 1 calc R . .
N2 N 1.2139(7) 0.8657(6) 1.0103(5) 0.0135(14) Uani 1 1 d . . .
C32 C 1.1436(9) 0.5351(7) 0.9529(6) 0.0169(17) Uani 1 1 d . . .
H32 H 1.1864 0.4944 0.9835 0.020 Uiso 1 1 calc R . .
C26 C 1.1585(9) 1.0078(7) 0.9549(6) 0.0153(17) Uani 1 1 d . . .
N4 N 1.0294(7) 0.4863(6) 0.8624(5) 0.0128(14) Uani 1 1 d . . .
C13 C 0.6184(10) 0.4320(7) 0.5920(7) 0.0199(18) Uiso 1 1 d . . .
H13 H 0.5322 0.3935 0.6129 0.024 Uiso 1 1 calc R . .
C28 C 1.0331(9) 0.9167(7) 0.8781(6) 0.0168(17) Uani 1 1 d . . .
H28 H 0.9703 0.9338 0.8337 0.020 Uiso 1 1 calc R . .
C33 C 0.9893(9) 0.5662(7) 0.8406(6) 0.0157(17) Uani 1 1 d . . .
C30 C 1.1021(8) 0.7835(6) 0.9337(6) 0.0120(16) Uani 1 1 d . . .
C29 C 1.0019(9) 0.8032(7) 0.8673(6) 0.0150(16) Uani 1 1 d . . .
H29 H 0.9167 0.7409 0.8175 0.018 Uiso 1 1 calc R . .
C25 C 1.1201(10) 1.1651(8) 0.8982(7) 0.0222(19) Uani 1 1 d . . .
H25A H 1.1291 1.1398 0.8280 0.033 Uiso 1 1 calc R . .
H25B H 1.1571 1.2499 0.9264 0.033 Uiso 1 1 calc R . .
H25C H 1.0185 1.1303 0.8950 0.033 Uiso 1 1 calc R . .
C23 C 1.3291(9) 1.2055(7) 1.0446(7) 0.0173(17) Uani 1 1 d . . .
H23 H 1.3668 1.2845 1.0507 0.021 Uiso 1 1 calc R . .
C24 C 1.2050(9) 1.1275(7) 0.9676(7) 0.0174(18) Uani 1 1 d . . .
C9 C 0.9470(9) 0.5984(7) 0.6365(6) 0.0174(17) Uani 1 1 d . . .
H9 H 1.0505 0.6473 0.6782 0.021 Uiso 1 1 calc R . .
C31 C 1.1828(9) 0.6486(7) 0.9895(7) 0.0161(17) Uani 1 1 d . . .
H31 H 1.2596 0.7048 1.0498 0.019 Uiso 1 1 calc R . .
C35 C 1.0457(9) 0.3198(8) 0.7380(7) 0.0195(18) Uani 1 1 d . . .
C36 C 1.1874(9) 0.3878(7) 0.7454(7) 0.0199(18) Uani 1 1 d . . .
H36 H 1.2337 0.4668 0.7910 0.024 Uiso 1 1 calc R . .
C22 C 1.4041(10) 1.1719(7) 1.1164(7) 0.0181(18) Uani 1 1 d . . .
C21 C 1.5347(11) 1.2604(8) 1.2010(7) 0.026(2) Uani 1 1 d . . .
H21A H 1.6161 1.2812 1.1729 0.039 Uiso 1 1 calc R . .
H21B H 1.5557 1.2292 1.2549 0.039 Uiso 1 1 calc R . .
H21C H 1.5192 1.3295 1.2316 0.039 Uiso 1 1 calc R . .
C14 C 0.6556(9) 0.5487(8) 0.6130(7) 0.0210(19) Uani 1 1 d . . .
H14 H 0.5909 0.5782 0.6447 0.025 Uiso 1 1 calc R . .
C27 C 1.2420(9) 0.9784(7) 1.0222(7) 0.0158(17) Uani 1 1 d . . .
C11 C 0.7965(10) 0.3850(10) 0.5063(8) 0.038(3) Uani 1 1 d . . .
H11A H 0.8059 0.4134 0.4481 0.045 Uiso 1 1 calc R . .
H11B H 0.8179 0.3161 0.4913 0.045 Uiso 1 1 calc R . .
C10 C 0.9087(9) 0.4785(8) 0.6055(7) 0.0188(18) Uani 1 1 d . . .
H10 H 0.9904 0.4598 0.6305 0.023 Uiso 1 1 calc R . .
C15 C 0.7253(11) 0.6129(12) 0.5483(10) 0.042(3) Uani 1 1 d . . .
H15A H 0.6830 0.5604 0.4742 0.050 Uiso 1 1 calc R . .
H15B H 0.7005 0.6796 0.5551 0.050 Uiso 1 1 calc R . .
C40 C 0.9820(9) 0.2047(7) 0.6702(7) 0.0208(19) Uani 1 1 d . . .
H40 H 0.8854 0.1574 0.6636 0.025 Uiso 1 1 calc R . .
C16 C 0.8827(10) 0.6563(10) 0.5753(9) 0.034(2) Uani 1 1 d . . .
H16A H 0.9264 0.7406 0.6166 0.041 Uiso 1 1 calc R . .
H16B H 0.9097 0.6460 0.5100 0.041 Uiso 1 1 calc R . .
C12 C 0.6440(12) 0.3478(12) 0.5076(9) 0.052(4) Uani 1 1 d . . .
H12A H 0.6115 0.2720 0.5166 0.063 Uiso 1 1 calc R . .
H12B H 0.5835 0.3359 0.4389 0.063 Uiso 1 1 calc R . .
N1 N 1.3601(7) 1.0591(6) 1.1051(5) 0.0157(14) Uani 1 1 d . . .
C1 C 1.5366(9) 0.9147(7) 1.1525(7) 0.0176(18) Uani 1 1 d . . .
H1 H 1.4979 0.8846 1.0747 0.021 Uiso 1 1 calc R . .
C8 C 1.5523(9) 0.8251(7) 1.1960(7) 0.0211(19) Uani 1 1 d . . .
H8A H 1.6552 0.8505 1.2322 0.025 Uiso 1 1 calc R . .
H8B H 1.5193 0.7503 1.1377 0.025 Uiso 1 1 calc R . .
C2 C 1.6284(9) 1.0303(8) 1.1960(7) 0.0196(18) Uani 1 1 d . . .
H2 H 1.6443 1.0683 1.1438 0.024 Uiso 1 1 calc R . .
C6 C 1.4453(9) 0.9123(7) 1.3279(6) 0.0162(17) Uani 1 1 d . . .
H6 H 1.3653 0.8956 1.3599 0.019 Uiso 1 1 calc R . .
C7 C 1.4648(9) 0.8065(7) 1.2731(7) 0.0205(19) Uani 1 1 d . . .
H7A H 1.3689 0.7412 1.2345 0.025 Uiso 1 1 calc R . .
H7B H 1.5145 0.7849 1.3257 0.025 Uiso 1 1 calc R . .
C38 C 1.1940(11) 0.2281(8) 0.6185(7) 0.025(2) Uani 1 1 d . . .
H38 H 1.2429 0.1983 0.5751 0.031 Uiso 1 1 calc R . .
C5 C 1.5547(10) 1.0240(8) 1.3784(7) 0.0206(19) Uani 1 1 d . . .
H5 H 1.5394 1.0727 1.4401 0.025 Uiso 1 1 calc R . .
C4 C 1.7132(9) 1.0519(7) 1.3866(7) 0.0199(18) Uani 1 1 d . . .
H4A H 1.7305 0.9827 1.3851 0.024 Uiso 1 1 calc R . .
H4B H 1.7753 1.1154 1.4540 0.024 Uiso 1 1 calc R . .
C3 C 1.7537(10) 1.0884(8) 1.2965(7) 0.026(2) Uani 1 1 d . . .
H3A H 1.7888 1.1737 1.3181 0.031 Uiso 1 1 calc R . .
H3B H 1.8336 1.0686 1.2828 0.031 Uiso 1 1 calc R . .
C37 C 1.2613(11) 0.3406(9) 0.6866(8) 0.030(2) Uani 1 1 d . . .
H37 H 1.3587 0.3867 0.6939 0.036 Uiso 1 1 calc R . .
C39 C 1.0553(11) 0.1565(9) 0.6115(8) 0.029(2) Uani 1 1 d . . .
H39 H 1.0114 0.0768 0.5678 0.035 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'
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'
Br Br -0.2901 2.4595 '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
C33 Rh2 C9 92.7(3) . . ?
C33 Rh2 C10 93.5(3) . . ?
C9 Rh2 C10 38.8(3) . . ?
C33 Rh2 C13 159.9(3) . . ?
C9 Rh2 C13 95.4(3) . . ?
C10 Rh2 C13 81.5(3) . . ?
C33 Rh2 C14 163.5(3) . . ?
C9 Rh2 C14 81.3(3) . . ?
C10 Rh2 C14 91.4(3) . . ?
C13 Rh2 C14 36.6(3) . . ?
C33 Rh2 H29 75.7 . . ?
C9 Rh2 H29 77.5 . . ?
C10 Rh2 H29 115.3 . . ?
C13 Rh2 H29 124.1 . . ?
C14 Rh2 H29 88.0 . . ?
C33 Rh2 Br2 89.3(2) . . ?
C9 Rh2 Br2 161.5(2) . . ?
C10 Rh2 Br2 159.3(3) . . ?
C13 Rh2 Br2 88.8(2) . . ?
C14 Rh2 Br2 91.6(2) . . ?
H29 Rh2 Br2 85.3 . . ?
C2 Rh1 C1 37.8(3) . . ?
C2 Rh1 C6 97.8(3) . . ?
C1 Rh1 C6 81.8(3) . . ?
C2 Rh1 C5 82.6(4) . . ?
C1 Rh1 C5 90.6(3) . . ?
C6 Rh1 C5 38.0(3) . . ?
C2 Rh1 N1 91.9(3) . . ?
C1 Rh1 N1 96.9(3) . . ?
C6 Rh1 N1 161.7(3) . . ?
C5 Rh1 N1 159.9(3) . . ?
C2 Rh1 Br1 155.8(2) . . ?
C1 Rh1 Br1 166.3(2) . . ?
C6 Rh1 Br1 91.0(2) . . ?
C5 Rh1 Br1 90.8(3) . . ?
N1 Rh1 Br1 86.26(19) . . ?
C33 N3 C31 111.3(7) . . ?
C33 N3 C30 127.4(7) . . ?
C31 N3 C30 121.3(6) . . ?
N4 C34 C35 113.9(7) . . ?
C30 N2 C27 117.9(7) . . ?
C31 C32 N4 108.1(7) . . ?
C27 C26 C28 117.6(8) . . ?
C27 C26 C24 118.3(8) . . ?
C28 C26 C24 124.2(8) . . ?
C33 N4 C32 112.2(7) . . ?
C33 N4 C34 123.8(7) . . ?
C32 N4 C34 124.0(7) . . ?
C14 C13 C12 128.3(10) . . ?
C14 C13 Rh2 71.8(5) . . ?
C12 C13 Rh2 108.6(6) . . ?
C29 C28 C26 120.1(7) . . ?
N4 C33 N3 102.6(7) . . ?
N4 C33 Rh2 125.5(6) . . ?
N3 C33 Rh2 131.7(6) . . ?
N2 C30 C29 124.3(7) . . ?
N2 C30 N3 114.5(7) . . ?
C29 C30 N3 121.2(7) . . ?
C28 C29 C30 117.2(7) . . ?
C24 C23 C22 121.8(8) . . ?
C23 C24 C26 117.5(8) . . ?
C23 C24 C25 121.4(8) . . ?
C26 C24 C25 121.1(8) . . ?
C10 C9 C16 125.6(8) . . ?
C10 C9 Rh2 71.6(5) . . ?
C16 C9 Rh2 111.9(6) . . ?
C32 C31 N3 105.8(7) . . ?
C40 C35 C36 117.8(8) . . ?
C40 C35 C34 118.0(8) . . ?
C36 C35 C34 124.1(8) . . ?
C37 C36 C35 120.6(8) . . ?
N1 C22 C23 120.7(8) . . ?
N1 C22 C21 119.5(8) . . ?
C23 C22 C21 119.7(8) . . ?
C13 C14 C15 123.5(9) . . ?
C13 C14 Rh2 71.6(5) . . ?
C15 C14 Rh2 110.5(6) . . ?
N2 C27 N1 114.1(7) . . ?
N2 C27 C26 122.5(8) . . ?
N1 C27 C26 123.4(7) . . ?
C12 C11 C10 115.6(8) . . ?
C9 C10 C11 126.4(9) . . ?
C9 C10 Rh2 69.6(5) . . ?
C11 C10 Rh2 112.8(6) . . ?
C16 C15 C14 115.7(9) . . ?
C35 C40 C39 122.1(9) . . ?
C15 C16 C9 115.1(8) . . ?
C11 C12 C13 115.1(9) . . ?
C22 N1 C27 118.0(7) . . ?
C22 N1 Rh1 121.2(6) . . ?
C27 N1 Rh1 119.1(5) . . ?
C2 C1 C8 123.7(8) . . ?
C2 C1 Rh1 70.3(5) . . ?
C8 C1 Rh1 113.6(6) . . ?
C1 C8 C7 112.2(7) . . ?
C1 C2 C3 125.8(8) . . ?
C1 C2 Rh1 72.0(5) . . ?
C3 C2 Rh1 110.1(6) . . ?
C5 C6 C7 125.5(8) . . ?
C5 C6 Rh1 71.5(5) . . ?
C7 C6 Rh1 111.1(6) . . ?
C6 C7 C8 112.9(7) . . ?
C37 C38 C39 121.1(9) . . ?
C6 C5 C4 122.5(8) . . ?
C6 C5 Rh1 70.5(5) . . ?
C4 C5 Rh1 112.7(6) . . ?
C5 C4 C3 111.4(7) . . ?
C2 C3 C4 113.1(7) . . ?
C38 C37 C36 120.1(9) . . ?
C38 C39 C40 118.2(9) . . ?
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
Rh2 C33 2.014(9) . ?
Rh2 C9 2.101(9) . ?
Rh2 C10 2.127(8) . ?
Rh2 C13 2.199(9) . ?
Rh2 C14 2.202(9) . ?
Rh2 H29 2.4405 . ?
Rh2 Br2 2.4727(13) . ?
Rh1 C2 2.104(8) . ?
Rh1 C1 2.125(8) . ?
Rh1 C6 2.127(8) . ?
Rh1 C5 2.140(9) . ?
Rh1 N1 2.150(7) . ?
Rh1 Br1 2.4878(14) . ?
N3 C33 1.386(10) . ?
N3 C31 1.406(10) . ?
N3 C30 1.427(10) . ?
C34 N4 1.448(10) . ?
C34 C35 1.517(12) . ?
N2 C30 1.309(10) . ?
N2 C27 1.369(10) . ?
C32 C31 1.324(12) . ?
C32 N4 1.383(11) . ?
C26 C27 1.395(12) . ?
C26 C28 1.413(12) . ?
C26 C24 1.431(12) . ?
N4 C33 1.353(10) . ?
C13 C14 1.381(13) . ?
C13 C12 1.519(13) . ?
C28 C29 1.377(12) . ?
C30 C29 1.417(11) . ?
C25 C24 1.499(11) . ?
C23 C24 1.362(12) . ?
C23 C22 1.424(12) . ?
C9 C10 1.406(12) . ?
C9 C16 1.513(13) . ?
C35 C40 1.389(12) . ?
C35 C36 1.397(12) . ?
C36 C37 1.394(13) . ?
C22 N1 1.350(11) . ?
C22 C21 1.473(13) . ?
C14 C15 1.509(14) . ?
C27 N1 1.373(11) . ?
C11 C12 1.492(15) . ?
C11 C10 1.513(13) . ?
C15 C16 1.469(14) . ?
C40 C39 1.394(13) . ?
C1 C2 1.369(12) . ?
C1 C8 1.517(12) . ?
C8 C7 1.543(13) . ?
C2 C3 1.524(12) . ?
C6 C5 1.391(12) . ?
C6 C7 1.502(12) . ?
C38 C37 1.365(14) . ?
C38 C39 1.387(15) . ?
C5 C4 1.534(13) . ?
C4 C3 1.541(13) . ?
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
Rh2 C33 C29 H29 8.6 . . . . ?
