#------------------------------------------------------------------------------
#$Date: 2017-10-13 14:42:48 +0300 (Fri, 13 Oct 2017) $
#$Revision: 201982 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/06/04/4060441.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_4060441
loop_
_publ_author_name
'M. Doux'
'L. Ricard'
'P. Le Floch'
'Y. Jean'
_publ_section_title
;
 On the regioselectivity of the addition of O2 on SPS-based Rh(I) and
 Ir(I) complexes
;
_journal_name_full               Organometallics
_journal_paper_doi               10.1021/om0492045
_journal_year                    2005
_chemical_formula_sum            'C35 H54 N3 P'
_chemical_formula_weight         547.78
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                77.429(4)
_cell_angle_beta                 81.670(5)
_cell_angle_gamma                75.900(7)
_cell_formula_units_Z            4
_cell_length_a                   10.3660(10)
_cell_length_b                   17.230(2)
_cell_length_c                   19.646(3)
_cell_measurement_temperature    173(2)
_cell_volume                     3305.9(7)
_diffrn_ambient_temperature      173(2)
_exptl_crystal_density_diffrn    1.101
_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               4060441
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
P1 P 0.59211(4) 0.20393(2) 0.33057(2) 0.02578(9) Uani 1 1 d . . .
P2 P 0.00294(4) 0.15342(2) 0.887174(19) 0.02333(9) Uani 1 1 d . . .
N3 N 0.45744(12) 0.38951(7) 0.29436(7) 0.0292(3) Uani 1 1 d . . .
N2 N 0.58144(11) 0.27466(7) 0.25441(6) 0.0249(3) Uani 1 1 d . . .
N1 N 0.59405(13) 0.25196(8) 0.39794(7) 0.0300(3) Uani 1 1 d . . .
H1A H 0.5569(19) 0.3046(12) 0.3885(10) 0.049(5) Uiso 1 1 d . . .
N4 N 0.22060(12) 0.19893(7) 0.77332(6) 0.0272(3) Uani 1 1 d . . .
N5 N 0.17217(11) 0.11542(7) 0.87759(6) 0.0238(2) Uani 1 1 d . . .
N6 N -0.03035(13) 0.25654(7) 0.85590(7) 0.0260(3) Uani 1 1 d . . .
H6A H 0.0285(19) 0.2701(11) 0.8249(10) 0.041(5) Uiso 1 1 d . . .
C1 C 0.47729(13) 0.34776(8) 0.24632(7) 0.0250(3) Uani 1 1 d . . .
C2 C 0.40091(14) 0.36502(9) 0.18012(8) 0.0290(3) Uani 1 1 d . . .
C3 C 0.25137(15) 0.36592(11) 0.20240(10) 0.0409(4) Uani 1 1 d . . .
H3A H 0.2041 0.3753 0.1606 0.061 Uiso 1 1 calc R . .
H3B H 0.2128 0.4096 0.2289 0.061 Uiso 1 1 calc R . .
H3C H 0.2424 0.3134 0.2319 0.061 Uiso 1 1 calc R . .
C4 C 0.41995(18) 0.44583(10) 0.13254(9) 0.0414(4) Uani 1 1 d . . .
H4A H 0.5156 0.4446 0.1215 0.062 Uiso 1 1 calc R . .
H4B H 0.3777 0.4911 0.1567 0.062 Uiso 1 1 calc R . .
H4C H 0.3787 0.4533 0.0891 0.062 Uiso 1 1 calc R . .
C5 C 0.44851(16) 0.29804(10) 0.13603(9) 0.0369(4) Uani 1 1 d . . .
H5A H 0.4384 0.2455 0.1650 0.055 Uiso 1 1 calc R . .
H5B H 0.5427 0.2952 0.1186 0.055 Uiso 1 1 calc R . .
H5C H 0.3948 0.3107 0.0963 0.055 Uiso 1 1 calc R . .
C6 C 0.35671(15) 0.46574(9) 0.29498(8) 0.0320(3) Uani 1 1 d . . .
H6 H 0.2990 0.4747 0.2561 0.038 Uiso 1 1 calc R . .
C7 C 0.27044(18) 0.46009(11) 0.36462(10) 0.0471(5) Uani 1 1 d . . .
H7A H 0.3281 0.4470 0.4034 0.056 Uiso 1 1 calc R . .
H7B H 0.2226 0.4156 0.3701 0.056 Uiso 1 1 calc R . .
C8 C 0.1684(2) 0.54089(13) 0.36860(11) 0.0577(6) Uani 1 1 d . . .
H8A H 0.1023 0.5494 0.3346 0.069 Uiso 1 1 calc R . .
H8B H 0.1199 0.5375 0.4160 0.069 Uiso 1 1 calc R . .
C9 C 0.2342(2) 0.61320(12) 0.35308(10) 0.0556(5) Uani 1 1 d . . .
H9A H 0.1642 0.6641 0.3509 0.067 Uiso 1 1 calc R . .
H9B H 0.2883 0.6096 0.3917 0.067 Uiso 1 1 calc R . .
C10 C 0.32270(19) 0.61668(11) 0.28500(10) 0.0469(4) Uani 1 1 d . . .
H10A H 0.3690 0.6620 0.2787 0.056 Uiso 1 1 calc R . .
H10B H 0.2672 0.6274 0.2456 0.056 Uiso 1 1 calc R . .
C11 C 0.42642(17) 0.53650(10) 0.28404(10) 0.0414(4) Uani 1 1 d . . .
H11A H 0.4822 0.5397 0.2386 0.050 Uiso 1 1 calc R . .
H11B H 0.4857 0.5273 0.3216 0.050 Uiso 1 1 calc R . .
C12 C 0.70719(13) 0.28302(8) 0.20865(8) 0.0250(3) Uani 1 1 d . . .
H12 H 0.6805 0.3231 0.1652 0.030 Uiso 1 1 calc R . .
C13 C 0.80016(15) 0.31774(10) 0.24138(9) 0.0318(3) Uani 1 1 d . . .
H13A H 0.8291 0.2798 0.2848 0.038 Uiso 1 1 calc R . .
H13B H 0.7515 0.3705 0.2540 0.038 Uiso 1 1 calc R . .
C14 C 0.92260(16) 0.33039(10) 0.19049(10) 0.0390(4) Uani 1 1 d . . .
H14A H 0.8942 0.3728 0.1494 0.047 Uiso 1 1 calc R . .
H14B H 0.9838 0.3498 0.2138 0.047 Uiso 1 1 calc R . .
C15 C 0.99655(15) 0.25200(10) 0.16581(10) 0.0387(4) Uani 1 1 d . . .
H15A H 1.0347 0.2116 0.2060 0.046 Uiso 1 1 calc R . .
H15B H 1.0712 0.2633 0.1304 0.046 Uiso 1 1 calc R . .
C16 C 0.90290(15) 0.21685(10) 0.13414(9) 0.0325(3) Uani 1 1 d . . .
H16A H 0.9517 0.1642 0.1213 0.039 Uiso 1 1 calc R . .
H16B H 0.8729 0.2546 0.0909 0.039 Uiso 1 1 calc R . .
C17 C 0.78116(14) 0.20368(9) 0.18556(8) 0.0300(3) Uani 1 1 d . . .
H17A H 0.7202 0.1832 0.1629 0.036 Uiso 1 1 calc R . .
H17B H 0.8103 0.1622 0.2271 0.036 Uiso 1 1 calc R . .
C18 C 0.70093(14) 0.23059(9) 0.44118(8) 0.0290(3) Uani 1 1 d . . .
C19 C 0.76558(15) 0.29131(10) 0.44866(8) 0.0311(3) Uani 1 1 d . . .
C20 C 0.86571(16) 0.26991(11) 0.49378(9) 0.0376(4) Uani 1 1 d . . .
H20 H 0.9069 0.3108 0.5008 0.045 Uiso 1 1 calc R . .
C21 C 0.90662(17) 0.19089(12) 0.52856(9) 0.0425(4) Uani 1 1 d . . .
H21 H 0.9772 0.1771 0.5579 0.051 Uiso 1 1 calc R . .
C22 C 0.84413(16) 0.13225(11) 0.52030(9) 0.0396(4) Uani 1 1 d . . .
H22 H 0.8735 0.0777 0.5439 0.048 Uiso 1 1 calc R . .
C23 C 0.73887(15) 0.15014(10) 0.47840(8) 0.0332(3) Uani 1 1 d . . .
C24 C 0.72505(17) 0.37923(10) 0.41090(9) 0.0369(4) Uani 1 1 d . . .
H24 H 0.6801 0.3789 0.3693 0.044 Uiso 1 1 calc R . .
C25 C 0.6233(2) 0.42995(12) 0.45769(10) 0.0523(5) Uani 1 1 d . . .
H25A H 0.5473 0.4040 0.4740 0.078 Uiso 1 1 calc R . .
H25B H 0.5921 0.4849 0.4309 0.078 Uiso 1 1 calc R . .
H25C H 0.6655 0.4335 0.4981 0.078 Uiso 1 1 calc R . .
C26 C 0.8439(2) 0.41895(14) 0.38399(12) 0.0633(6) Uani 1 1 d . . .
H26A H 0.8826 0.4273 0.4238 0.095 Uiso 1 1 calc R . .
H26B H 0.8138 0.4716 0.3534 0.095 Uiso 1 1 calc R . .
H26C H 0.9114 0.3834 0.3575 0.095 Uiso 1 1 calc R . .
C27 C 0.66698(18) 0.08271(10) 0.47896(9) 0.0396(4) Uani 1 1 d . . .
H27 H 0.5929 0.1061 0.4480 0.047 Uiso 1 1 calc R . .
C28 C 0.7588(2) 0.01133(13) 0.44967(13) 0.0624(6) Uani 1 1 d . . .
H28A H 0.7957 0.0310 0.4019 0.094 Uiso 1 1 calc R . .
H28B H 0.7079 -0.0294 0.4489 0.094 Uiso 1 1 calc R . .
H28C H 0.8320 -0.0134 0.4794 0.094 Uiso 1 1 calc R . .
C29 C 0.6039(2) 0.05401(14) 0.55278(11) 0.0605(6) Uani 1 1 d . . .
H29A H 0.6742 0.0311 0.5845 0.091 Uiso 1 1 calc R . .
H29B H 0.5553 0.0122 0.5517 0.091 Uiso 1 1 calc R . .
H29C H 0.5418 0.1004 0.5694 0.091 Uiso 1 1 calc R . .
C30 C 0.41769(14) 0.19363(9) 0.34308(8) 0.0284(3) Uani 1 1 d . . .
C31 C 0.32546(17) 0.22003(12) 0.39624(9) 0.0429(4) Uani 1 1 d . . .
H31 H 0.3507 0.2468 0.4280 0.051 Uiso 1 1 calc R . .
C32 C 0.19627(19) 0.20774(14) 0.40342(11) 0.0585(5) Uani 1 1 d . . .
H32 H 0.1335 0.2273 0.4395 0.070 Uiso 1 1 calc R . .
C33 C 0.15799(18) 0.16758(13) 0.35890(11) 0.0523(5) Uani 1 1 d . . .
H33 H 0.0694 0.1594 0.3642 0.063 Uiso 1 1 calc R . .
C34 C 0.24923(17) 0.13948(10) 0.30657(10) 0.0422(4) Uani 1 1 d . . .
H34 H 0.2240 0.1114 0.2758 0.051 Uiso 1 1 calc R . .
C35 C 0.37792(16) 0.15226(9) 0.29888(9) 0.0339(4) Uani 1 1 d . . .
H35 H 0.4403 0.1325 0.2628 0.041 Uiso 1 1 calc R . .
C36 C 0.24972(13) 0.12788(8) 0.81096(7) 0.0241(3) Uani 1 1 d . . .
C37 C 0.35295(14) 0.05209(9) 0.79035(8) 0.0287(3) Uani 1 1 d . . .
C38 C 0.31016(17) 0.03099(10) 0.72550(9) 0.0363(4) Uani 1 1 d . . .
H38A H 0.3755 -0.0158 0.7116 0.054 Uiso 1 1 calc R . .
H38B H 0.3058 0.0779 0.6867 0.054 Uiso 1 1 calc R . .
H38C H 0.2220 0.0175 0.7371 0.054 Uiso 1 1 calc R . .
C39 C 0.49439(15) 0.06946(11) 0.77580(9) 0.0386(4) Uani 1 1 d . . .
H39A H 0.5199 0.0807 0.8182 0.058 Uiso 1 1 calc R . .
H39B H 0.4952 0.1168 0.7378 0.058 Uiso 1 1 calc R . .
H39C H 0.5581 0.0219 0.7622 0.058 Uiso 1 1 calc R . .
C40 C 0.35909(16) -0.02519(9) 0.84761(9) 0.0346(4) Uani 1 1 d . . .
H40A H 0.2685 -0.0339 0.8627 0.052 Uiso 1 1 calc R . .
H40B H 0.3988 -0.0185 0.8877 0.052 Uiso 1 1 calc R . .
H40C H 0.4138 -0.0723 0.8289 0.052 Uiso 1 1 calc R . .
C41 C 0.27733(15) 0.22237(9) 0.70113(8) 0.0296(3) Uani 1 1 d . . .
H41 H 0.3407 0.1740 0.6860 0.036 Uiso 1 1 calc R . .
C42 C 0.35155(19) 0.28958(11) 0.69694(9) 0.0435(4) Uani 1 1 d . . .
H42A H 0.4263 0.2692 0.7269 0.052 Uiso 1 1 calc R . .
H42B H 0.2902 0.3363 0.7145 0.052 Uiso 1 1 calc R . .
C43 C 0.4060(2) 0.31755(14) 0.62127(10) 0.0575(6) Uani 1 1 d . . .
H43A H 0.4511 0.3626 0.6191 0.069 Uiso 1 1 calc R . .
H43B H 0.4730 0.2719 0.6052 0.069 Uiso 1 1 calc R . .
C44 C 0.2946(2) 0.34622(14) 0.57302(11) 0.0639(6) Uani 1 1 d . . .
H44A H 0.3334 0.3606 0.5241 0.077 Uiso 1 1 calc R . .
H44B H 0.2331 0.3957 0.5858 0.077 Uiso 1 1 calc R . .
C45 C 0.2168(2) 0.28034(13) 0.57819(9) 0.0524(5) Uani 1 1 d . . .
H45A H 0.1410 0.3019 0.5490 0.063 Uiso 1 1 calc R . .
H45B H 0.2757 0.2333 0.5600 0.063 Uiso 1 1 calc R . .
C46 C 0.16401(17) 0.25232(11) 0.65389(9) 0.0399(4) Uani 1 1 d . . .
H46A H 0.0985 0.2982 0.6706 0.048 Uiso 1 1 calc R . .
H46B H 0.1176 0.2078 0.6563 0.048 Uiso 1 1 calc R . .
C47 C 0.24412(14) 0.10319(9) 0.94091(7) 0.0257(3) Uani 1 1 d . . .
H47 H 0.3409 0.0821 0.9270 0.031 Uiso 1 1 calc R . .
C48 C 0.23367(16) 0.18208(9) 0.96664(8) 0.0323(3) Uani 1 1 d . . .
H48A H 0.1390 0.2051 0.9811 0.039 Uiso 1 1 calc R . .
H48B H 0.2661 0.2223 0.9280 0.039 Uiso 1 1 calc R . .
C49 C 0.31648(17) 0.16646(11) 1.02870(9) 0.0405(4) Uani 1 1 d . . .
H49A H 0.4124 0.1504 1.0124 0.049 Uiso 1 1 calc R . .
H49B H 0.3026 0.2175 1.0467 0.049 Uiso 1 1 calc R . .
C50 C 0.27943(16) 0.10011(11) 1.08762(8) 0.0385(4) Uani 1 1 d . . .
H50A H 0.1874 0.1192 1.1086 0.046 Uiso 1 1 calc R . .
H50B H 0.3407 0.0887 1.1246 0.046 Uiso 1 1 calc R . .
C51 C 0.28783(16) 0.02229(10) 1.06102(8) 0.0349(4) Uani 1 1 d . . .
H51A H 0.2577 -0.0188 1.0997 0.042 Uiso 1 1 calc R . .
H51B H 0.3818 -0.0002 1.0448 0.042 Uiso 1 1 calc R . .
C52 C 0.20065(15) 0.03911(9) 1.00064(8) 0.0304(3) Uani 1 1 d . . .
H52A H 0.2084 -0.0119 0.9835 0.036 Uiso 1 1 calc R . .
H52B H 0.1059 0.0586 1.0175 0.036 Uiso 1 1 calc R . .
C53 C -0.09017(15) 0.31286(8) 0.90049(8) 0.0269(3) Uani 1 1 d . . .
C54 C -0.02427(16) 0.37322(9) 0.90765(9) 0.0335(4) Uani 1 1 d . . .
C55 C -0.0858(2) 0.42670(10) 0.95293(10) 0.0438(4) Uani 1 1 d . . .
H55 H -0.0426 0.4676 0.9580 0.053 Uiso 1 1 calc R . .
C56 C -0.2074(2) 0.42163(10) 0.99035(9) 0.0447(4) Uani 1 1 d . . .
H56 H -0.2458 0.4573 1.0222 0.054 Uiso 1 1 calc R . .
C57 C -0.27293(18) 0.36467(10) 0.98141(9) 0.0393(4) Uani 1 1 d . . .
H57 H -0.3579 0.3624 1.0065 0.047 Uiso 1 1 calc R . .
C58 C -0.21773(15) 0.31002(9) 0.93637(8) 0.0301(3) Uani 1 1 d . . .
C59 C 0.10574(17) 0.38318(10) 0.86381(10) 0.0407(4) Uani 1 1 d . . .
H59 H 0.1530 0.3287 0.8529 0.049 Uiso 1 1 calc R . .
C60 C 0.1999(2) 0.41250(13) 0.90109(15) 0.0694(7) Uani 1 1 d . . .
H60A H 0.1600 0.4683 0.9079 0.104 Uiso 1 1 calc R . .
H60B H 0.2858 0.4113 0.8725 0.104 Uiso 1 1 calc R . .
H60C H 0.2141 0.3766 0.9467 0.104 Uiso 1 1 calc R . .
C61 C 0.0765(2) 0.44125(12) 0.79448(12) 0.0579(5) Uani 1 1 d . . .
H61A H 0.0247 0.4188 0.7686 0.087 Uiso 1 1 calc R . .
H61B H 0.1608 0.4479 0.7666 0.087 Uiso 1 1 calc R . .
H61C H 0.0250 0.4943 0.8037 0.087 Uiso 1 1 calc R . .
C62 C -0.29864(15) 0.25104(10) 0.92735(9) 0.0334(3) Uani 1 1 d . . .
H62 H -0.2505 0.2224 0.8888 0.040 Uiso 1 1 calc R . .
C63 C -0.43852(17) 0.29533(12) 0.90593(11) 0.0492(5) Uani 1 1 d . . .
H63A H -0.4912 0.3195 0.9448 0.074 Uiso 1 1 calc R . .
H63B H -0.4831 0.2563 0.8946 0.074 Uiso 1 1 calc R . .
H63C H -0.4305 0.3384 0.8648 0.074 Uiso 1 1 calc R . .
C64 C -0.30990(17) 0.18616(10) 0.99365(9) 0.0418(4) Uani 1 1 d . . .
H64A H -0.2203 0.1587 1.0072 0.063 Uiso 1 1 calc R . .
H64B H -0.3548 0.1461 0.9845 0.063 Uiso 1 1 calc R . .
H64C H -0.3618 0.2122 1.0317 0.063 Uiso 1 1 calc R . .
C65 C -0.04389(14) 0.11732(8) 0.81517(7) 0.0246(3) Uani 1 1 d . . .
C66 C -0.12036(15) 0.16886(9) 0.76361(8) 0.0319(3) Uani 1 1 d . . .
H66 H -0.1420 0.2260 0.7623 0.038 Uiso 1 1 calc R . .
C67 C -0.16552(17) 0.13770(10) 0.71398(9) 0.0387(4) Uani 1 1 d . . .
H67 H -0.2179 0.1735 0.6792 0.046 Uiso 1 1 calc R . .
C68 C -0.13434(17) 0.05487(11) 0.71523(9) 0.0394(4) Uani 1 1 d . . .
H68 H -0.1641 0.0337 0.6810 0.047 Uiso 1 1 calc R . .
C69 C -0.05972(17) 0.00285(10) 0.76638(9) 0.0371(4) Uani 1 1 d . . .
H69 H -0.0384 -0.0542 0.7674 0.045 Uiso 1 1 calc R . .
C70 C -0.01586(15) 0.03373(9) 0.81630(9) 0.0313(3) Uani 1 1 d . . .
H70 H 0.0340 -0.0026 0.8518 0.038 Uiso 1 1 calc R . .
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
P1 N2 1.7102(12) . ?
P1 N1 1.7116(13) . ?
P1 C30 1.8356(15) . ?
P2 N5 1.7146(12) . ?
P2 N6 1.7150(13) . ?
P2 C65 1.8310(14) . ?
N3 C1 1.2718(19) . ?
N3 C6 1.4664(18) . ?
N2 C1 1.4413(17) . ?
N2 C12 1.4912(18) . ?
N1 C18 1.4221(18) . ?
N4 C36 1.2757(18) . ?
N4 C41 1.4645(19) . ?
N5 C36 1.4362(18) . ?
N5 C47 1.4921(17) . ?
N6 C53 1.4189(18) . ?
C1 C2 1.556(2) . ?
C2 C5 1.536(2) . ?
C2 C4 1.538(2) . ?
C2 C3 1.546(2) . ?
C6 C7 1.520(2) . ?
C6 C11 1.525(2) . ?
C7 C8 1.539(2) . ?
C8 C9 1.516(3) . ?
C9 C10 1.506(3) . ?
C10 C11 1.532(2) . ?
C12 C17 1.523(2) . ?
C12 C13 1.526(2) . ?
C13 C14 1.526(2) . ?
C14 C15 1.523(2) . ?
C15 C16 1.524(2) . ?
C16 C17 1.528(2) . ?
C18 C23 1.410(2) . ?
C18 C19 1.415(2) . ?
C19 C20 1.392(2) . ?
C19 C24 1.521(2) . ?
C20 C21 1.378(2) . ?
C21 C22 1.374(2) . ?
C22 C23 1.396(2) . ?
C23 C27 1.523(2) . ?
C24 C26 1.526(3) . ?
C24 C25 1.530(2) . ?
C27 C28 1.526(3) . ?
C27 C29 1.532(3) . ?
C30 C31 1.385(2) . ?
C30 C35 1.396(2) . ?
C31 C32 1.389(3) . ?
C32 C33 1.378(3) . ?
C33 C34 1.378(3) . ?
C34 C35 1.386(2) . ?
C36 C37 1.561(2) . ?
C37 C40 1.539(2) . ?
C37 C39 1.541(2) . ?
C37 C38 1.548(2) . ?
C41 C42 1.521(2) . ?
C41 C46 1.523(2) . ?
C42 C43 1.529(3) . ?
C43 C44 1.520(3) . ?
C44 C45 1.524(3) . ?
C45 C46 1.525(2) . ?
C47 C52 1.524(2) . ?
C47 C48 1.525(2) . ?
C48 C49 1.531(2) . ?
C49 C50 1.518(2) . ?
C50 C51 1.521(2) . ?
C51 C52 1.530(2) . ?
C53 C58 1.412(2) . ?
C53 C54 1.416(2) . ?
C54 C55 1.398(2) . ?
C54 C59 1.516(2) . ?
C55 C56 1.376(3) . ?
C56 C57 1.375(3) . ?
C57 C58 1.397(2) . ?
C58 C62 1.518(2) . ?
C59 C61 1.526(3) . ?
C59 C60 1.534(2) . ?
C62 C64 1.531(2) . ?
C62 C63 1.536(2) . ?
C65 C66 1.393(2) . ?
C65 C70 1.394(2) . ?
C66 C67 1.393(2) . ?
C67 C68 1.380(2) . ?
C68 C69 1.381(2) . ?
C69 C70 1.388(2) . ?
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 ChemSpider 9482314
