#------------------------------------------------------------------------------
#$Date: 2016-01-01 01:08:40 +0200 (Fri, 01 Jan 2016) $
#$Revision: 171799 $
#$URL: svn://www.crystallography.net/cod/cif/4/51/37/4513764.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_4513764
loop_
_publ_author_name
'Ghorai, Debasish'
'Dutta, Champak'
'Choudhury, Joyanta'
_publ_section_title
;
 Switching of “Rollover Pathway” in Rhodium(III)-Catalyzed
 C--H Activation of Chelating Molecules
;
_journal_name_full               'ACS Catalysis'
_journal_page_first              709
_journal_paper_doi               10.1021/acscatal.5b02540
_journal_year                    2015
_chemical_formula_sum            'C20 H26 Cl F6 N3 O P Rh'
_chemical_formula_weight         607.77
_chemical_name_systematic
;
 ?
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           29
_space_group_name_Hall           'P 2c -2ac'
_space_group_name_H-M_alt        'P c a 21'
_symmetry_space_group_name_Hall  'P 2c -2ac'
_symmetry_space_group_name_H-M   'P c a 21'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.666(3)
_cell_length_b                   7.2906(13)
_cell_length_c                   21.328(4)
_cell_measurement_reflns_used    3847
_cell_measurement_temperature    160(2)
_cell_measurement_theta_max      24.417
_cell_measurement_theta_min      2.600
_cell_volume                     2436.0(8)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_collection       'Bruker XSCANS'
_computing_data_reduction        'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_structure_solution    SIR-92
_diffrn_ambient_temperature      160(2)
_diffrn_measured_fraction_theta_full 0.874
_diffrn_measured_fraction_theta_max 0.959
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0416
_diffrn_reflns_av_unetI/netI     0.0203
_diffrn_reflns_laue_measured_fraction_full 0.874
_diffrn_reflns_laue_measured_fraction_max 0.959
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       8
_diffrn_reflns_limit_k_min       -8
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            37678
_diffrn_reflns_point_group_measured_fraction_full 0.874
_diffrn_reflns_point_group_measured_fraction_max 0.960
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         24.417
_diffrn_reflns_theta_min         2.600
_diffrn_source                   'sealed tube'
_exptl_absorpt_coefficient_mu    0.940
_exptl_absorpt_correction_T_max  0.920
_exptl_absorpt_correction_T_min  0.875
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            Red
_exptl_crystal_density_diffrn    1.657
_exptl_crystal_description       Needle
_exptl_crystal_F_000             1224
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.070
_exptl_crystal_size_min          0.050
_refine_diff_density_max         0.945
_refine_diff_density_min         -0.998
_refine_diff_density_rms         0.341
_refine_ls_abs_structure_details
;
 Refined as an inversion twin.
;
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.305
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     261
_refine_ls_number_reflns         3847
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.305
_refine_ls_R_factor_all          0.0440
_refine_ls_R_factor_gt           0.0352
_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)+(0.0649P)²+2.4108P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0999
_refine_ls_wR_factor_ref         0.1197
_reflns_Friedel_coverage         0.942
_reflns_friedel_fraction_full    0.874
_reflns_friedel_fraction_max     0.962
_reflns_number_gt                3625
_reflns_number_total             3847
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            cs5b02540_si_002.cif
_cod_data_source_block           7
_cod_original_cell_volume        2436.1(8)
_cod_database_code               4513764
_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   0.896
_shelx_estimated_absorpt_t_max   0.955
_shelxl_version_number           2014-3
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z+1/2'
'-x+1/2, y, z+1/2'
'x+1/2, -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
C2 C 0.5645(14) 0.784(3) 0.7249(10) 0.104(8) Uani 1 1 d . .
H2A H 0.5179 0.7293 0.7474 0.157 Uiso 1 1 calc R U
H2B H 0.5478 0.9020 0.7095 0.157 Uiso 1 1 calc R U
H2C H 0.5798 0.7063 0.6902 0.157 Uiso 1 1 calc R U
C1 C 0.6327(4) 0.7678(10) 0.8299(3) 0.028(3) Uani 1 1 d G .
N1 N 0.6382(5) 0.8038(12) 0.7669(3) 0.038(2) Uani 1 1 d G .
C3 C 0.7177(5) 0.8739(11) 0.7551(3) 0.067(4) Uani 1 1 d G .
H3 H 0.7385 0.9101 0.7162 0.080 Uiso 1 1 calc R U
C4 C 0.7614(4) 0.8813(10) 0.8108(3) 0.054(3) Uani 1 1 d G .
H4 H 0.8169 0.9234 0.8162 0.065 Uiso 1 1 calc R U
N2 N 0.7088(4) 0.8157(10) 0.8570(3) 0.0223(14) Uani 1 1 d G .
O1 O 0.5491(6) 0.764(2) 1.0298(5) 0.070(3) Uani 1 1 d . .
N3 N 0.6314(4) 0.7643(12) 0.9500(4) 0.041(3) Uani 1 1 d G .
C5 C 0.7067(5) 0.8070(15) 0.9189(3) 0.0583(17) Uani 1 1 d G .
C6 C 0.7756(4) 0.8779(13) 0.9520(4) 0.0583(17) Uani 1 1 d G .
H6 H 0.8260 0.9065 0.9311 0.070 Uiso 1 1 calc R U
C7 C 0.7692(4) 0.9062(10) 1.0163(4) 0.0583(17) Uani 1 1 d G .
H7 H 0.8153 0.9537 1.0384 0.070 Uiso 1 1 calc R U
C8 C 0.6938(5) 0.8635(12) 1.0474(3) 0.0583(17) Uani 1 1 d G .
H8 H 0.6895 0.8825 1.0904 0.070 Uiso 1 1 calc R U
C9 C 0.6249(4) 0.7926(12) 1.0143(4) 0.054(4) Uani 1 1 d G .
C10 C 0.5366(9) 0.789(2) 1.0941(7) 0.079(4) Uani 1 1 d . .
H10A H 0.4779 0.7657 1.1044 0.119 Uiso 1 1 calc R U
H10B H 0.5725 0.7059 1.1171 0.119 Uiso 1 1 calc R U
H10C H 0.5508 0.9130 1.1052 0.119 Uiso 1 1 calc R U
C11 C 0.5517(5) 0.3674(9) 0.8967(12) 0.045(3) Uani 1 1 d . .
C12 C 0.5006(9) 0.4107(19) 0.8337(7) 0.039(4) Uani 1 1 d . .
C13 C 0.4301(9) 0.5039(16) 0.8576(6) 0.033(3) Uani 1 1 d . .
C14 C 0.4261(8) 0.5065(15) 0.9258(5) 0.028(3) Uani 1 1 d . .
C15 C 0.5040(10) 0.414(2) 0.9435(8) 0.051(5) Uani 1 1 d . .
C16 C 0.6352(5) 0.2634(10) 0.889(2) 0.122(7) Uani 1 1 d . .
H16A H 0.6501 0.2574 0.8457 0.184 Uiso 1 1 calc R U
H16B H 0.6795 0.3258 0.9119 0.184 Uiso 1 1 calc R U
H16C H 0.6287 0.1414 0.9055 0.184 Uiso 1 1 calc R U
C17 C 0.5295(16) 0.358(2) 0.7700(14) 0.109(11) Uani 1 1 d . .
H17A H 0.5827 0.2932 0.7729 0.163 Uiso 1 1 calc R U
H17B H 0.4874 0.2801 0.7509 0.163 Uiso 1 1 calc R U
H17C H 0.5370 0.4661 0.7450 0.163 Uiso 1 1 calc R U
C18 C 0.3586(8) 0.5808(17) 0.8170(6) 0.041(3) Uani 1 1 d . .
H18A H 0.3168 0.6393 0.8432 0.062 Uiso 1 1 calc R U
H18B H 0.3817 0.6689 0.7881 0.062 Uiso 1 1 calc R U
H18C H 0.3322 0.4829 0.7940 0.062 Uiso 1 1 calc R U
C19 C 0.3585(9) 0.586(3) 0.9656(8) 0.066(5) Uani 1 1 d . .
H19A H 0.3727 0.5673 1.0089 0.099 Uiso 1 1 calc R U
H19B H 0.3535 0.7144 0.9572 0.099 Uiso 1 1 calc R U
H19C H 0.3052 0.5262 0.9566 0.099 Uiso 1 1 calc R U
C20 C 0.5189(14) 0.361(2) 1.0124(11) 0.088(8) Uani 1 1 d . .
H20A H 0.4746 0.4126 1.0379 0.132 Uiso 1 1 calc R U
H20B H 0.5182 0.2297 1.0163 0.132 Uiso 1 1 calc R U
H20C H 0.5733 0.4071 1.0259 0.132 Uiso 1 1 calc R U
F1 F 0.6835(9) 0.193(2) 1.1630(6) 0.106(4) Uani 1 1 d . .
F2 F 0.6830(11) 0.5049(19) 1.1571(7) 0.099(4) Uani 1 1 d . .
F3 F 0.8223(11) 0.490(2) 1.1258(6) 0.108(6) Uani 1 1 d . .
F4 F 0.8197(6) 0.193(2) 1.1300(5) 0.089(4) Uani 1 1 d . .
F5 F 0.7805(7) 0.347(2) 1.2099(4) 0.097(5) Uani 1 1 d . .
F6 F 0.7242(7) 0.3450(15) 1.0674(4) 0.078(3) Uani 1 1 d . .
P1 P 0.7504(3) 0.3479(3) 1.1413(3) 0.0489(5) Uani 1 1 d . .
Cl1 Cl 0.46838(10) 0.9532(2) 0.8887(4) 0.0518(6) Uani 1 1 d . .
Rh1 Rh 0.53903(3) 0.65908(6) 0.89028(7) 0.0283(2) 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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 '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
N1 C2 H2A 109.5
N1 C2 H2B 109.5
H2A C2 H2B 109.5
N1 C2 H2C 109.5
H2A C2 H2C 109.5
H2B C2 H2C 109.5
N2 C1 N1 108.0
N2 C1 Rh1 116.4(4)
N1 C1 Rh1 135.6(4)
C3 N1 C1 108.0
C3 N1 C2 129.7(12)
C1 N1 C2 122.0(12)
C4 C3 N1 108.0
C4 C3 H3 126.0
N1 C3 H3 126.0
C3 C4 N2 108.0
C3 C4 H4 126.0
N2 C4 H4 126.0
C5 N2 C1 112.8(7)
C5 N2 C4 138.5(7)
C1 N2 C4 108.0
C9 O1 C10 111.7(10)
C5 N3 C9 120.0
C5 N3 Rh1 112.4(4)
C9 N3 Rh1 127.6(4)
N2 C5 C6 118.1(7)
N2 C5 N3 120.6(7)
C6 C5 N3 120.0
C5 C6 C7 120.0
C5 C6 H6 120.0
C7 C6 H6 120.0
C8 C7 C6 120.0
C8 C7 H7 120.0
C6 C7 H7 120.0
C7 C8 C9 120.0
C7 C8 H8 120.0
C9 C8 H8 120.0
O1 C9 C8 131.8(8)
O1 C9 N3 107.7(8)
C8 C9 N3 120.0
O1 C10 H10A 109.5
O1 C10 H10B 109.5
H10A C10 H10B 109.5
O1 C10 H10C 109.5
H10A C10 H10C 109.5
H10B C10 H10C 109.5
C15 C11 C16 135(3)
C15 C11 C12 108.0(7)
C16 C11 C12 116(2)
C15 C11 Rh1 74.6(7)
C16 C11 Rh1 124.6(7)
C12 C11 Rh1 72.7(7)
C13 C12 C17 134.7(17)
C13 C12 C11 100.7(12)
C17 C12 C11 124.6(17)
C13 C12 Rh1 68.0(9)
C17 C12 Rh1 128.1(11)
C11 C12 Rh1 64.8(6)
C12 C13 C14 113.9(14)
C12 C13 C18 123.7(12)
C14 C13 C18 122.2(15)
C12 C13 Rh1 75.4(9)
C14 C13 Rh1 72.8(9)
C18 C13 Rh1 124.8(9)
C19 C14 C13 127.6(14)
C19 C14 C15 129.7(13)
C13 C14 C15 102.7(15)
C19 C14 Rh1 124.9(9)
C13 C14 Rh1 68.4(9)
C15 C14 Rh1 69.5(8)
C11 C15 C14 114.2(15)
C11 C15 C20 125.6(18)
C14 C15 C20 119.8(17)
C11 C15 Rh1 70.7(8)
C14 C15 Rh1 72.3(8)
C20 C15 Rh1 131.6(12)
C11 C16 H16A 109.5
C11 C16 H16B 109.5
H16A C16 H16B 109.5
C11 C16 H16C 109.5
H16A C16 H16C 109.5
H16B C16 H16C 109.5
C12 C17 H17A 109.5
C12 C17 H17B 109.5
H17A C17 H17B 109.5
C12 C17 H17C 109.5
H17A C17 H17C 109.5
H17B C17 H17C 109.5
C13 C18 H18A 109.5
C13 C18 H18B 109.5
H18A C18 H18B 109.5
C13 C18 H18C 109.5
H18A C18 H18C 109.5
H18B C18 H18C 109.5
C14 C19 H19A 109.5
C14 C19 H19B 109.5
H19A C19 H19B 109.5
C14 C19 H19C 109.5
H19A C19 H19C 109.5
H19B C19 H19C 109.5
C15 C20 H20A 109.5
C15 C20 H20B 109.5
H20A C20 H20B 109.5
C15 C20 H20C 109.5
H20A C20 H20C 109.5
H20B C20 H20C 109.5
F5 P1 F2 90.4(8)
F5 P1 F3 89.1(8)
F2 P1 F3 92.7(5)
F5 P1 F4 85.9(7)
F2 P1 F4 176.3(8)
F3 P1 F4 86.8(9)
F5 P1 F1 85.5(7)
F2 P1 F1 90.7(9)
F3 P1 F1 173.6(9)
F4 P1 F1 89.4(5)
F5 P1 F6 176.5(8)
F2 P1 F6 92.7(7)
F3 P1 F6 89.2(6)
F4 P1 F6 91.0(6)
F1 P1 F6 96.0(7)
C1 Rh1 N3 75.58(18)
C1 Rh1 C11 110.4(6)
N3 Rh1 C11 105.3(5)
C1 Rh1 C13 123.3(4)
N3 Rh1 C13 160.3(4)
C11 Rh1 C13 64.8(4)
C1 Rh1 C15 143.1(5)
N3 Rh1 C15 99.1(5)
C11 Rh1 C15 34.7(8)
C13 Rh1 C15 62.7(5)
C1 Rh1 C14 161.9(3)
N3 Rh1 C14 122.1(4)
C11 Rh1 C14 63.5(5)
C13 Rh1 C14 38.7(3)
C15 Rh1 C14 38.2(5)
C1 Rh1 C12 99.2(3)
N3 Rh1 C12 144.2(4)
C11 Rh1 C12 42.5(7)
C13 Rh1 C12 36.7(5)
C15 Rh1 C12 63.6(4)
C14 Rh1 C12 64.4(4)
C1 Rh1 Cl1 88.6(2)
N3 Rh1 Cl1 90.0(3)
C11 Rh1 Cl1 157.9(3)
C13 Rh1 Cl1 95.6(3)
C15 Rh1 Cl1 128.2(5)
C14 Rh1 Cl1 94.9(3)
C12 Rh1 Cl1 125.6(4)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
C2 N1 1.469(15)
C2 H2A 0.9600
C2 H2B 0.9600
C2 H2C 0.9600
C1 N2 1.370(4)
C1 N1 1.370(4)
C1 Rh1 2.107(6)
N1 C3 1.370(4)
C3 C4 1.370(4)
C3 H3 0.9300
C4 N2 1.370(4)
C4 H4 0.9300
N2 C5 1.322(7)
O1 C9 1.251(11)
O1 C10 1.399(18)
N3 C5 1.3900
N3 C9 1.3900
N3 Rh1 2.075(6)
C5 C6 1.3900
C6 C7 1.3900
C6 H6 0.9300
C7 C8 1.3900
C7 H7 0.9300
C8 C9 1.3900
C8 H8 0.9300
C10 H10A 0.9600
C10 H10B 0.9600
C10 H10C 0.9600
C11 C15 1.29(3)
C11 C16 1.520(13)
C11 C12 1.60(3)
C11 Rh1 2.140(7)
C12 C13 1.39(2)
C12 C17 1.48(3)
C12 Rh1 2.258(15)
C13 C14 1.456(10)
C13 C18 1.523(17)
C13 Rh1 2.163(14)
C14 C19 1.48(2)
C14 C15 1.44(2)
C14 Rh1 2.222(12)
C15 C20 1.54(3)
C15 Rh1 2.186(13)
C16 H16A 0.9600
C16 H16B 0.9600
C16 H16C 0.9600
C17 H17A 0.9600
C17 H17B 0.9600
C17 H17C 0.9600
C18 H18A 0.9600
C18 H18B 0.9600
C18 H18C 0.9600
C19 H19A 0.9600
C19 H19B 0.9600
C19 H19C 0.9600
C20 H20A 0.9600
C20 H20B 0.9600
C20 H20C 0.9600
F1 P1 1.609(13)
F2 P1 1.593(13)
F3 P1 1.565(13)
F4 P1 1.585(12)
F5 P1 1.538(10)
F6 P1 1.628(11)
Cl1 Rh1 2.4130(16)
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
N2 C1 N1 C3 0.0
Rh1 C1 N1 C3 -179.2(7)
N2 C1 N1 C2 -174.3(11)
Rh1 C1 N1 C2 6.4(11)
C1 N1 C3 C4 0.0
C2 N1 C3 C4 173.8(12)
N1 C3 C4 N2 0.0
N1 C1 N2 C5 172.4(10)
Rh1 C1 N2 C5 -8.2(9)
N1 C1 N2 C4 0.0
Rh1 C1 N2 C4 179.4(5)
C3 C4 N2 C5 -169.4(14)
C3 C4 N2 C1 0.0
C1 N2 C5 C6 -170.7(5)
C4 N2 C5 C6 -1.6(16)
C1 N2 C5 N3 -3.9(12)
C4 N2 C5 N3 165.2(7)
C9 N3 C5 N2 -166.5(12)
Rh1 N3 C5 N2 13.9(10)
C9 N3 C5 C6 0.0
Rh1 N3 C5 C6 -179.6(5)
N2 C5 C6 C7 166.9(12)
N3 C5 C6 C7 0.0
C5 C6 C7 C8 0.0
C6 C7 C8 C9 0.0
C10 O1 C9 C8 -8(2)
C10 O1 C9 N3 -180.0(12)
C7 C8 C9 O1 -170.8(13)
C7 C8 C9 N3 0.0
C5 N3 C9 O1 172.8(11)
Rh1 N3 C9 O1 -7.7(10)
C5 N3 C9 C8 0.0
Rh1 N3 C9 C8 179.5(6)
C15 C11 C12 C13 7.5(9)
C16 C11 C12 C13 -180.0(9)
Rh1 C11 C12 C13 -59.3(10)
C15 C11 C12 C17 -172.9(17)
C16 C11 C12 C17 -0.5(17)
Rh1 C11 C12 C17 120.2(14)
C15 C11 C12 Rh1 66.8(7)
C16 C11 C12 Rh1 -120.7(8)
C17 C12 C13 C14 174.3(16)
C11 C12 C13 C14 -6.2(17)
Rh1 C12 C13 C14 -63.3(12)
C17 C12 C13 C18 0(3)
C11 C12 C13 C18 179.4(11)
Rh1 C12 C13 C18 122.4(13)
C17 C12 C13 Rh1 -122.4(19)
C11 C12 C13 Rh1 57.1(7)
C12 C13 C14 C19 -177.0(11)
C18 C13 C14 C19 -3(3)
Rh1 C13 C14 C19 118.2(15)
C12 C13 C14 C15 3(2)
C18 C13 C14 C15 177.6(10)
Rh1 C13 C14 C15 -61.7(10)
C12 C13 C14 Rh1 64.8(12)
C18 C13 C14 Rh1 -120.8(13)
C16 C11 C15 C14 -176.7(9)
C12 C11 C15 C14 -6.3(12)
Rh1 C11 C15 C14 59.3(11)
C16 C11 C15 C20 -4(2)
C12 C11 C15 C20 166.5(17)
Rh1 C11 C15 C20 -127.9(16)
C16 C11 C15 Rh1 124.0(11)
C12 C11 C15 Rh1 -65.6(6)
C19 C14 C15 C11 -177.3(13)
C13 C14 C15 C11 2.5(18)
Rh1 C14 C15 C11 -58.4(10)
C19 C14 C15 C20 9(2)
C13 C14 C15 C20 -170.7(14)
Rh1 C14 C15 C20 128.4(16)
C19 C14 C15 Rh1 -118.9(14)
C13 C14 C15 Rh1 60.9(10)
