#------------------------------------------------------------------------------
#$Date: 2016-03-23 15:08:04 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179314 $
#$URL: svn://www.crystallography.net/cod/cif/4/32/11/4321108.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_4321108
loop_
_publ_author_name
'Liliya Simkhovich'
'Nitsa Galili'
'Irena Saltsman'
'Israel Goldberg'
'Zeev Gross'
_publ_section_title
;
 Coordination Chemistry of the Novel
 5,10,15-Tris(pentafluorophenyl)corrole: Synthesis, Spectroscopy, and
 Structural Characterization of Its Cobalt(III), Rhodium(III), and
 Iron(IV) Complexes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              2704
_journal_page_last               2705
_journal_paper_doi               10.1021/ic991342c
_journal_volume                  39
_journal_year                    2000
_chemical_formula_sum            'C55 H23 F15 N4 P Rh'
_chemical_formula_weight         1158.65
_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                91.800(10)
_cell_angle_beta                 101.507(10)
_cell_angle_gamma                91.901(10)
_cell_formula_units_Z            2
_cell_length_a                   8.4130(10)
_cell_length_b                   15.3970(10)
_cell_length_c                   20.3560(10)
_cell_measurement_reflns_used    6016
_cell_measurement_temperature    117
_cell_measurement_theta_max      23.23
_cell_measurement_theta_min      2.39
_cell_volume                     2580.4(4)
_computing_cell_refinement       DENZO
_computing_data_collection       'Collect, Nonius B.V.'
_computing_data_reduction        DENZO
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      117
_diffrn_detector_area_resol_mean '56 microns'
_diffrn_measured_fraction_theta_full 0.942
_diffrn_measured_fraction_theta_max 0.942
_diffrn_measurement_device_type  'Nonius KappaCCD'
_diffrn_measurement_method       '1 degree Phi & Omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0000
_diffrn_reflns_av_sigmaI/netI    0.0535
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            6669
_diffrn_reflns_theta_full        23.23
_diffrn_reflns_theta_max         23.23
_diffrn_reflns_theta_min         2.39
_exptl_absorpt_coefficient_mu    0.457
_exptl_crystal_colour            'dark purple'
_exptl_crystal_density_diffrn    1.491
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prisms
_exptl_crystal_F_000             1152
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.206
_refine_diff_density_min         -0.484
_refine_diff_density_rms         0.131
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.128
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     685
_refine_ls_number_reflns         6669
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.128
_refine_ls_R_factor_all          0.0667
_refine_ls_R_factor_gt           0.0601
_refine_ls_shift/su_max          0.020
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0927P)²+12.4150P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1776
_refine_ls_wR_factor_ref         0.1808
_reflns_number_gt                6016
_reflns_number_total             6669
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic991342c_2.cif
_cod_data_source_block           (tpfc)Rh-PPh3
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.0927P)^2^+12.4150P] where P=(Fo^2^+2Fc^2^)/3'
was changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to
'w=1/[\s^2^(Fo^2^)+(0.0927P)^2^+12.4150P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_database_code               4321108
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_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Rh Rh 0.23639(5) 0.21519(3) -0.21010(2) 0.0183(2) Uani 1 d . . .
P P 0.49496(18) 0.20305(11) -0.16107(7) 0.0191(4) Uani 1 d . . .
F1 F -0.1891(4) -0.0588(2) -0.27402(17) 0.0299(9) Uani 1 d . . .
F2 F -0.3013(5) -0.2240(3) -0.27085(19) 0.0387(10) Uani 1 d . . .
F3 F -0.1439(6) -0.3323(3) -0.1784(2) 0.0504(12) Uani 1 d . . .
F4 F 0.1224(6) -0.2723(3) -0.0881(2) 0.0527(12) Uani 1 d . . .
F5 F 0.2409(5) -0.1091(3) -0.09361(19) 0.0403(10) Uani 1 d . . .
F6 F 0.0872(5) 0.1982(3) -0.49009(19) 0.0490(12) Uani 1 d . . .
F7 F 0.1702(6) 0.1703(3) -0.60919(19) 0.0550(13) Uani 1 d . . .
F8 F 0.4697(6) 0.1108(3) -0.61548(18) 0.0499(12) Uani 1 d . . .
F9 F 0.6803(5) 0.0771(3) -0.5003(2) 0.0478(12) Uani 1 d . . .
F10 F 0.5944(5) 0.1012(3) -0.38127(18) 0.0417(11) Uani 1 d . . .
F11 F 0.5073(5) 0.5384(3) -0.16509(19) 0.0368(10) Uani 1 d . . .
F12 F 0.5265(6) 0.7128(3) -0.1761(2) 0.0448(11) Uani 1 d . . .
F13 F 0.2863(7) 0.7929(3) -0.2564(2) 0.0580(14) Uani 1 d . . .
F14 F 0.0168(7) 0.7007(3) -0.3216(3) 0.0689(16) Uani 1 d . . .
F15 F -0.0101(6) 0.5281(3) -0.3067(2) 0.0572(13) Uani 1 d . . .
N1 N 0.1416(6) 0.1558(4) -0.1418(2) 0.0223(12) Uani 1 d . . .
N2 N 0.2153(6) 0.1080(4) -0.2671(2) 0.0224(12) Uani 1 d . . .
N3 N 0.2674(6) 0.2896(3) -0.2841(2) 0.0221(12) Uani 1 d . . .
N4 N 0.1837(6) 0.3157(3) -0.1584(2) 0.0228(12) Uani 1 d . . .
C1 C 0.0863(7) 0.2085(4) -0.0960(3) 0.0230(15) Uani 1 d . . .
C2 C 0.0010(8) 0.1528(5) -0.0594(3) 0.0275(16) Uani 1 d . . .
H2 H -0.0478 0.1698 -0.0242 0.033 Uiso 1 calc R . .
C3 C 0.0031(8) 0.0696(5) -0.0852(3) 0.0286(16) Uani 1 d . . .
H3 H -0.0426 0.0201 -0.0701 0.034 Uiso 1 calc R . .
C4 C 0.0887(7) 0.0723(4) -0.1397(3) 0.0201(14) Uani 1 d . . .
C5 C 0.0996(7) 0.0112(4) -0.1912(3) 0.0204(14) Uani 1 d . . .
C6 C 0.1569(7) 0.0276(4) -0.2504(3) 0.0197(13) Uani 1 d . . .
C7 C 0.1589(8) -0.0322(4) -0.3065(3) 0.0240(14) Uani 1 d . . .
H7 H 0.1267 -0.0908 -0.3096 0.029 Uiso 1 calc R . .
C8 C 0.2160(8) 0.0124(4) -0.3539(3) 0.0245(16) Uani 1 d . . .
H8 H 0.2310 -0.0106 -0.3949 0.029 Uiso 1 calc R . .
C9 C 0.2491(7) 0.1006(4) -0.3304(3) 0.0199(14) Uani 1 d . . .
C10 C 0.2966(8) 0.1729(4) -0.3642(3) 0.0225(15) Uani 1 d . . .
C11 C 0.3003(8) 0.2607(4) -0.3443(3) 0.0242(15) Uani 1 d . . .
C12 C 0.3278(9) 0.3361(5) -0.3810(3) 0.0312(16) Uani 1 d . . .
H12 H 0.3546 0.3360 -0.4231 0.037 Uiso 1 calc R . .
C13 C 0.3078(9) 0.4074(5) -0.3433(3) 0.0334(17) Uani 1 d . . .
H13 H 0.3172 0.4648 -0.3554 0.040 Uiso 1 calc R . .
C14 C 0.2697(8) 0.3794(4) -0.2817(3) 0.0254(15) Uani 1 d . . .
C15 C 0.2349(8) 0.4323(4) -0.2282(3) 0.0256(15) Uani 1 d . . .
C16 C 0.1878(7) 0.4025(4) -0.1701(3) 0.0241(14) Uani 1 d . . .
C17 C 0.1206(8) 0.4441(5) -0.1183(3) 0.0289(16) Uani 1 d . . .
H17 H 0.1102 0.5036 -0.1124 0.035 Uiso 1 calc R . .
C18 C 0.0746(8) 0.3812(5) -0.0791(3) 0.0281(15) Uani 1 d . . .
H18 H 0.0272 0.3904 -0.0420 0.034 Uiso 1 calc R . .
C19 C 0.1120(7) 0.2992(4) -0.1051(3) 0.0226(15) Uani 1 d . . .
C20 C 0.0323(7) -0.0786(4) -0.1855(3) 0.0219(14) Uani 1 d . . .
C21 C -0.1079(7) -0.1113(4) -0.2288(3) 0.0220(14) Uani 1 d . . .
C22 C -0.1673(8) -0.1953(5) -0.2271(3) 0.0287(16) Uani 1 d . . .
C23 C -0.0889(9) -0.2506(5) -0.1797(4) 0.0346(17) Uani 1 d . . .
C24 C 0.0464(9) -0.2193(5) -0.1348(3) 0.0358(18) Uani 1 d . . .
C25 C 0.1050(8) -0.1359(4) -0.1377(3) 0.0275(15) Uani 1 d . . .
C26 C 0.3391(8) 0.1532(4) -0.4316(3) 0.0236(14) Uani 1 d . . .
C27 C 0.2346(8) 0.1675(5) -0.4907(3) 0.0300(16) Uani 1 d . . .
C28 C 0.2755(9) 0.1534(5) -0.5529(3) 0.0331(17) Uani 1 d . . .
C29 C 0.4254(9) 0.1241(5) -0.5564(3) 0.0329(17) Uani 1 d . . .
C30 C 0.5327(8) 0.1059(5) -0.4975(3) 0.0305(16) Uani 1 d . . .
C31 C 0.4886(8) 0.1201(5) -0.4369(3) 0.0273(15) Uani 1 d . . .
C32 C 0.2464(8) 0.5284(4) -0.2359(3) 0.0278(15) Uani 1 d . . .
C33 C 0.3823(8) 0.5779(4) -0.2036(3) 0.0292(16) Uani 1 d . . .
C34 C 0.3945(9) 0.6653(5) -0.2094(3) 0.0345(17) Uani 1 d . . .
C35 C 0.2729(11) 0.7070(5) -0.2499(4) 0.0410(19) Uani 1 d . . .
C36 C 0.1371(11) 0.6607(5) -0.2824(4) 0.046(2) Uani 1 d . . .
C37 C 0.1260(9) 0.5722(5) -0.2748(4) 0.0381(18) Uani 1 d . . .
C38 C 0.5413(7) 0.0930(4) -0.1348(3) 0.0224(14) Uani 1 d . . .
C39 C 0.5998(7) 0.0748(4) -0.0677(3) 0.0241(14) Uani 1 d . . .
H39 H 0.6132 0.1193 -0.0348 0.029 Uiso 1 calc R . .
C40 C 0.6375(8) -0.0082(5) -0.0502(3) 0.0281(16) Uani 1 d . . .
H40 H 0.6765 -0.0199 -0.0054 0.034 Uiso 1 calc R . .
C41 C 0.6182(8) -0.0749(5) -0.0985(4) 0.0325(17) Uani 1 d . . .
H41 H 0.6447 -0.1310 -0.0860 0.039 Uiso 1 calc R . .
C42 C 0.5604(8) -0.0590(4) -0.1647(3) 0.0294(15) Uani 1 d . . .
H42 H 0.5474 -0.1042 -0.1970 0.035 Uiso 1 calc R . .
C43 C 0.5214(7) 0.0247(4) -0.1835(3) 0.0265(15) Uani 1 d . . .
H43 H 0.4821 0.0357 -0.2283 0.032 Uiso 1 calc R . .
C44 C 0.5457(7) 0.2752(4) -0.0869(3) 0.0224(14) Uani 1 d . . .
C45 C 0.4590(7) 0.2650(4) -0.0357(3) 0.0259(15) Uani 1 d . . .
H45 H 0.3878 0.2171 -0.0371 0.031 Uiso 1 calc R . .
C46 C 0.4788(8) 0.3261(5) 0.0174(3) 0.0311(17) Uani 1 d . . .
H46 H 0.4201 0.3192 0.0512 0.037 Uiso 1 calc R . .
C47 C 0.5845(9) 0.3966(5) 0.0201(4) 0.0365(18) Uani 1 d . . .
H47 H 0.5942 0.4385 0.0548 0.044 Uiso 1 calc R . .
C48 C 0.6760(8) 0.4054(5) -0.0283(4) 0.0364(17) Uani 1 d . . .
H48 H 0.7505 0.4520 -0.0253 0.044 Uiso 1 calc R . .
C49 C 0.6578(8) 0.3446(4) -0.0822(3) 0.0302(16) Uani 1 d . . .
H49 H 0.7205 0.3507 -0.1147 0.036 Uiso 1 calc R . .
C50 C 0.6349(7) 0.2331(4) -0.2148(3) 0.0238(14) Uani 1 d . . .
C51 C 0.7430(7) 0.1737(5) -0.2335(3) 0.0246(14) Uani 1 d . . .
H51 H 0.7461 0.1176 -0.2176 0.030 Uiso 1 calc R . .
C52 C 0.8457(7) 0.1995(5) -0.2760(3) 0.0341(18) Uani 1 d . . .
H52 H 0.9143 0.1597 -0.2897 0.041 Uiso 1 calc R . .
C53 C 0.8464(8) 0.2841(6) -0.2981(3) 0.041(2) Uani 1 d . . .
H53 H 0.9163 0.3010 -0.3259 0.050 Uiso 1 calc R . .
C54 C 0.7432(9) 0.3422(6) -0.2785(4) 0.044(2) Uani 1 d . . .
H54 H 0.7445 0.3990 -0.2926 0.052 Uiso 1 calc R . .
C55 C 0.6369(8) 0.3171(5) -0.2378(4) 0.0339(17) Uani 1 d . . .
H55 H 0.5661 0.3570 -0.2257 0.041 Uiso 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'
F F 0.0171 0.0103 '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'
P P 0.1023 0.0942 '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
N4 Rh N2 162.0(2) . . ?
N4 Rh N1 79.8(2) . . ?
N2 Rh N1 91.6(2) . . ?
N4 Rh N3 91.1(2) . . ?
N2 Rh N3 92.9(2) . . ?
N1 Rh N3 163.0(2) . . ?
N4 Rh P 99.62(15) . . ?
N2 Rh P 97.02(14) . . ?
N1 Rh P 96.86(15) . . ?
N3 Rh P 98.84(15) . . ?
C44 P C50 106.3(3) . . ?
C44 P C38 107.5(3) . . ?
C50 P C38 106.8(3) . . ?
C44 P Rh 110.07(19) . . ?
C50 P Rh 113.0(2) . . ?
C38 P Rh 112.8(2) . . ?
C4 N1 C1 111.5(5) . . ?
C4 N1 Rh 130.6(4) . . ?
C1 N1 Rh 116.3(4) . . ?
C9 N2 C6 108.9(5) . . ?
C9 N2 Rh 126.1(4) . . ?
C6 N2 Rh 124.9(4) . . ?
C11 N3 C14 109.2(5) . . ?
C11 N3 Rh 125.5(4) . . ?
C14 N3 Rh 125.2(4) . . ?
C16 N4 C19 111.2(5) . . ?
C16 N4 Rh 131.1(4) . . ?
C19 N4 Rh 117.1(4) . . ?
N1 C1 C2 106.2(6) . . ?
N1 C1 C19 113.5(5) . . ?
C2 C1 C19 139.6(6) . . ?
C3 C2 C1 108.1(6) . . ?
C3 C2 H2 126.0 . . ?
C1 C2 H2 126.0 . . ?
C2 C3 C4 107.9(6) . . ?
C2 C3 H3 126.0 . . ?
C4 C3 H3 126.0 . . ?
N1 C4 C5 121.0(5) . . ?
N1 C4 C3 106.1(5) . . ?
C5 C4 C3 132.0(6) . . ?
C4 C5 C6 126.5(6) . . ?
C4 C5 C20 117.0(5) . . ?
C6 C5 C20 116.3(5) . . ?
N2 C6 C5 125.3(5) . . ?
N2 C6 C7 106.7(5) . . ?
C5 C6 C7 127.9(6) . . ?
C8 C7 C6 107.9(6) . . ?
C8 C7 H7 126.1 . . ?
C6 C7 H7 126.1 . . ?
C7 C8 C9 108.5(5) . . ?
C7 C8 H8 125.7 . . ?
C9 C8 H8 125.7 . . ?
N2 C9 C10 122.6(6) . . ?
N2 C9 C8 108.0(5) . . ?
C10 C9 C8 129.3(5) . . ?
C11 C10 C9 127.6(6) . . ?
C11 C10 C26 116.2(6) . . ?
C9 C10 C26 116.1(6) . . ?
N3 C11 C10 123.5(6) . . ?
N3 C11 C12 107.3(6) . . ?
C10 C11 C12 129.1(6) . . ?
C13 C12 C11 107.9(6) . . ?
C13 C12 H12 126.0 . . ?
C11 C12 H12 126.0 . . ?
C12 C13 C14 108.4(6) . . ?
C12 C13 H13 125.8 . . ?
C14 C13 H13 125.8 . . ?
N3 C14 C15 125.2(6) . . ?
N3 C14 C13 107.2(5) . . ?
C15 C14 C13 127.6(6) . . ?
C16 C15 C14 126.1(6) . . ?
C16 C15 C32 117.6(5) . . ?
C14 C15 C32 116.2(6) . . ?
N4 C16 C15 120.4(5) . . ?
N4 C16 C17 105.8(6) . . ?
C15 C16 C17 133.3(6) . . ?
C18 C17 C16 108.3(6) . . ?
C18 C17 H17 125.8 . . ?
C16 C17 H17 125.8 . . ?
C17 C18 C19 107.8(6) . . ?
C17 C18 H18 126.1 . . ?
C19 C18 H18 126.1 . . ?
N4 C19 C18 106.7(6) . . ?
N4 C19 C1 113.3(5) . . ?
C18 C19 C1 139.8(6) . . ?
C21 C20 C25 115.3(6) . . ?
C21 C20 C5 121.6(5) . . ?
C25 C20 C5 123.1(6) . . ?
F1 C21 C22 118.3(5) . . ?
F1 C21 C20 118.9(6) . . ?
C22 C21 C20 122.8(6) . . ?
F2 C22 C21 120.4(6) . . ?
F2 C22 C23 119.7(6) . . ?
C21 C22 C23 119.9(6) . . ?
F3 C23 C24 121.0(7) . . ?
F3 C23 C22 120.3(6) . . ?
C24 C23 C22 118.7(7) . . ?
F4 C24 C25 120.3(6) . . ?
F4 C24 C23 119.1(7) . . ?
C25 C24 C23 120.6(6) . . ?
F5 C25 C24 118.3(6) . . ?
F5 C25 C20 119.0(6) . . ?
C24 C25 C20 122.7(6) . . ?
C27 C26 C31 116.3(5) . . ?
C27 C26 C10 122.2(6) . . ?
C31 C26 C10 121.5(5) . . ?
F6 C27 C26 120.1(6) . . ?
F6 C27 C28 117.3(6) . . ?
C26 C27 C28 122.6(6) . . ?
F7 C28 C29 120.1(6) . . ?
F7 C28 C27 120.2(6) . . ?
C29 C28 C27 119.7(6) . . ?
F8 C29 C28 121.2(6) . . ?
F8 C29 C30 119.4(6) . . ?
C28 C29 C30 119.4(6) . . ?
F9 C30 C31 120.6(6) . . ?
F9 C30 C29 119.8(6) . . ?
C31 C30 C29 119.6(6) . . ?
F10 C31 C30 118.0(6) . . ?
F10 C31 C26 119.6(5) . . ?
C30 C31 C26 122.4(6) . . ?
C37 C32 C33 116.4(7) . . ?
C37 C32 C15 122.5(6) . . ?
C33 C32 C15 121.1(6) . . ?
F11 C33 C34 118.4(6) . . ?
F11 C33 C32 119.5(6) . . ?
C34 C33 C32 122.1(6) . . ?
F12 C34 C33 121.1(6) . . ?
F12 C34 C35 118.9(7) . . ?
C33 C34 C35 120.0(7) . . ?
F13 C35 C36 120.4(7) . . ?
F13 C35 C34 119.9(7) . . ?
C36 C35 C34 119.8(7) . . ?
F14 C36 C35 120.3(7) . . ?
F14 C36 C37 120.4(8) . . ?
C35 C36 C37 119.2(7) . . ?
F15 C37 C32 119.4(7) . . ?
F15 C37 C36 118.1(7) . . ?
C32 C37 C36 122.5(7) . . ?
C39 C38 C43 118.9(6) . . ?
C39 C38 P 121.9(5) . . ?
C43 C38 P 119.2(5) . . ?
C40 C39 C38 120.2(6) . . ?
C40 C39 H39 119.9 . . ?
C38 C39 H39 119.9 . . ?
C39 C40 C41 120.5(6) . . ?
C39 C40 H40 119.7 . . ?
C41 C40 H40 119.7 . . ?
C42 C41 C40 120.5(6) . . ?
C42 C41 H41 119.7 . . ?
C40 C41 H41 119.7 . . ?
C41 C42 C43 119.8(6) . . ?
C41 C42 H42 120.1 . . ?
C43 C42 H42 120.1 . . ?
C42 C43 C38 120.1(6) . . ?
C42 C43 H43 120.0 . . ?
C38 C43 H43 120.0 . . ?
C49 C44 C45 119.0(6) . . ?
C49 C44 P 122.0(5) . . ?
C45 C44 P 118.7(5) . . ?
C46 C45 C44 120.2(6) . . ?
C46 C45 H45 119.9 . . ?
C44 C45 H45 119.9 . . ?
C47 C46 C45 120.3(6) . . ?
C47 C46 H46 119.9 . . ?
C45 C46 H46 119.9 . . ?
C48 C47 C46 120.1(6) . . ?
C48 C47 H47 120.0 . . ?
C46 C47 H47 120.0 . . ?
C47 C48 C49 120.5(7) . . ?
C47 C48 H48 119.8 . . ?
C49 C48 H48 119.8 . . ?
C44 C49 C48 119.8(6) . . ?
C44 C49 H49 120.1 . . ?
C48 C49 H49 120.1 . . ?
C55 C50 C51 118.8(6) . . ?
C55 C50 P 119.5(5) . . ?
C51 C50 P 121.8(5) . . ?
C52 C51 C50 119.5(7) . . ?
C52 C51 H51 120.3 . . ?
C50 C51 H51 120.3 . . ?
C53 C52 C51 120.8(7) . . ?
C53 C52 H52 119.6 . . ?
C51 C52 H52 119.6 . . ?
C54 C53 C52 119.3(6) . . ?
C54 C53 H53 120.3 . . ?
C52 C53 H53 120.3 . . ?
C53 C54 C55 120.7(7) . . ?
C53 C54 H54 119.6 . . ?
C55 C54 H54 119.6 . . ?
C54 C55 C50 120.8(7) . . ?
C54 C55 H55 119.6 . . ?
C50 C55 H55 119.6 . . ?
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
Rh N4 1.957(5) . ?
Rh N2 1.969(5) . ?
Rh N1 1.969(5) . ?
Rh N3 1.973(5) . ?
Rh P 2.2217(16) . ?
P C44 1.818(6) . ?
P C50 1.818(6) . ?
P C38 1.825(7) . ?
F1 C21 1.342(7) . ?
F2 C22 1.342(7) . ?
F3 C23 1.329(9) . ?
F4 C24 1.348(8) . ?
F5 C25 1.349(8) . ?
F6 C27 1.344(8) . ?
F7 C28 1.339(8) . ?
F8 C29 1.341(7) . ?
F9 C30 1.344(8) . ?
F10 C31 1.340(7) . ?
F11 C33 1.354(8) . ?
F12 C34 1.356(9) . ?
F13 C35 1.337(9) . ?
F14 C36 1.337(9) . ?
F15 C37 1.349(9) . ?
N1 C4 1.352(8) . ?
N1 C1 1.376(8) . ?
N2 C9 1.376(7) . ?
N2 C6 1.394(8) . ?
N3 C11 1.374(8) . ?
N3 C14 1.382(8) . ?
N4 C16 1.365(8) . ?
N4 C19 1.369(8) . ?
C1 C2 1.421(9) . ?
C1 C19 1.430(10) . ?
C2 C3 1.371(10) . ?
C2 H2 0.9300 . ?
C3 C4 1.439(9) . ?
C3 H3 0.9300 . ?
C4 C5 1.404(9) . ?
C5 C6 1.411(8) . ?
C5 C20 1.493(9) . ?
C6 C7 1.448(9) . ?
C7 C8 1.356(9) . ?
C7 H7 0.9300 . ?
C8 C9 1.424(10) . ?
C8 H8 0.9300 . ?
C9 C10 1.415(9) . ?
C10 C11 1.397(10) . ?
C10 C26 1.508(8) . ?
C11 C12 1.436(9) . ?
C12 C13 1.354(10) . ?
C12 H12 0.9300 . ?
C13 C14 1.429(9) . ?
C13 H13 0.9300 . ?
C14 C15 1.422(9) . ?
C15 C16 1.405(9) . ?
C15 C32 1.495(10) . ?
C16 C17 1.436(9) . ?
C17 C18 1.369(10) . ?
C17 H17 0.9300 . ?
C18 C19 1.423(9) . ?
C18 H18 0.9300 . ?
C20 C21 1.392(9) . ?
C20 C25 1.397(9) . ?
C21 C22 1.374(10) . ?
C22 C23 1.389(10) . ?
C23 C24 1.372(11) . ?
C24 C25 1.368(10) . ?
C26 C27 1.371(9) . ?
C26 C31 1.395(9) . ?
C27 C28 1.389(9) . ?
C28 C29 1.368(10) . ?
C29 C30 1.391(10) . ?
C30 C31 1.370(9) . ?
C32 C37 1.366(10) . ?
C32 C33 1.390(10) . ?
C33 C34 1.357(10) . ?
C34 C35 1.371(11) . ?
C35 C36 1.366(12) . ?
C36 C37 1.378(11) . ?
C38 C39 1.396(9) . ?
C38 C43 1.404(9) . ?
C39 C40 1.369(9) . ?
C39 H39 0.9300 . ?
C40 C41 1.381(10) . ?
C40 H40 0.9300 . ?
C41 C42 1.372(10) . ?
C41 H41 0.9300 . ?
C42 C43 1.387(10) . ?
C42 H42 0.9300 . ?
C43 H43 0.9300 . ?
C44 C49 1.390(9) . ?
C44 C45 1.396(9) . ?
C45 C46 1.391(9) . ?
C45 H45 0.9300 . ?
C46 C47 1.373(11) . ?
C46 H46 0.9300 . ?
C47 C48 1.373(10) . ?
C47 H47 0.9300 . ?
C48 C49 1.400(10) . ?
C48 H48 0.9300 . ?
C49 H49 0.9300 . ?
C50 C55 1.390(10) . ?
C50 C51 1.407(9) . ?
C51 C52 1.397(9) . ?
C51 H51 0.9300 . ?
C52 C53 1.391(11) . ?
C52 H52 0.9300 . ?
C53 C54 1.371(12) . ?
C53 H53 0.9300 . ?
C54 C55 1.390(10) . ?
C54 H54 0.9300 . ?
C55 H55 0.9300 . ?
