#------------------------------------------------------------------------------
#$Date: 2016-03-21 07:55:27 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178588 $
#$URL: svn://www.crystallography.net/cod/cif/4/06/99/4069949.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_4069949
loop_
_publ_author_name
'Gao, Lei'
'Peay, Miya A.'
'Partyka, David V.'
'Updegraff, James B.'
'Teets, Thomas S.'
'Esswein, Arthur J.'
'Zeller, Matthias'
'Hunter, Allen D.'
'Gray, Thomas G.'
_publ_section_title
;
 Mono- and Di-Gold(I) Naphthalenes and Pyrenes: Syntheses, Crystal
 Structures, and Photophysics
;
_journal_issue                   19
_journal_name_full               Organometallics
_journal_page_first              5669
_journal_paper_doi               10.1021/om9005214
_journal_volume                  28
_journal_year                    2009
_chemical_formula_moiety         'C52 H74 Au2 P2, 2(C7 H8)'
_chemical_formula_sum            'C66 H90 Au2 P2'
_chemical_formula_weight         1339.25
_chemical_name_systematic
;

 ?

;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 94.5900(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   9.5322(9)
_cell_length_b                   16.7591(15)
_cell_length_c                   17.4417(16)
_cell_measurement_reflns_used    7658
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      26.87
_cell_measurement_theta_min      2.43
_cell_volume                     2777.4(4)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.985
_diffrn_measured_fraction_theta_max 0.985
_diffrn_measurement_device_type  'Bruker AXS APEX II CCD area detector'
_diffrn_measurement_method       'phi and 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  0.0297
_diffrn_reflns_av_sigmaI/netI    0.0246
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            30206
_diffrn_reflns_theta_full        26.92
_diffrn_reflns_theta_max         26.92
_diffrn_reflns_theta_min         2.34
_diffrn_standards_decay_%        none
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    5.374
_exptl_absorpt_correction_T_max  0.5540
_exptl_absorpt_correction_T_min  0.1565
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'AXScale in APEX2 (Bruker, 2004)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.601
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             1348
_exptl_crystal_size_max          0.52
_exptl_crystal_size_mid          0.17
_exptl_crystal_size_min          0.11
_refine_diff_density_max         0.816
_refine_diff_density_min         -0.935
_refine_diff_density_rms         0.097
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.104
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     317
_refine_ls_number_reflns         5929
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.104
_refine_ls_R_factor_all          0.0213
_refine_ls_R_factor_gt           0.0183
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0130P)²+3.2089P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0422
_refine_ls_wR_factor_ref         0.0435
_reflns_number_gt                5451
_reflns_number_total             5929
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om9005214_si_002.cif
_cod_data_source_block           map298_0m
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               4069949
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
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
Au1 Au 0.337828(9) 0.797597(5) 0.232919(5) 0.01505(4) Uani 1 1 d .
C22 C -0.0050(3) 0.80005(15) 0.27984(14) 0.0201(5) Uani 1 1 d .
H22A H 0.0590 0.8375 0.2560 0.024 Uiso 1 1 calc R
H22B H -0.0346 0.7587 0.2413 0.024 Uiso 1 1 calc R
P1 P 0.24692(6) 0.72254(4) 0.32795(3) 0.01418(12) Uani 1 1 d .
C1 C 0.4052(3) 0.86755(14) 0.14703(13) 0.0171(5) Uani 1 1 d .
C20 C 0.3808(3) 0.58025(14) 0.30413(14) 0.0190(5) Uani 1 1 d .
H20A H 0.4409 0.6151 0.2747 0.023 Uiso 1 1 calc R
H20B H 0.4219 0.5788 0.3581 0.023 Uiso 1 1 calc R
C26 C -0.0267(3) 0.70206(15) 0.38562(15) 0.0217(5) Uani 1 1 d .
H26A H -0.0544 0.6593 0.3483 0.026 Uiso 1 1 calc R
H26B H 0.0221 0.6771 0.4318 0.026 Uiso 1 1 calc R
C15 C 0.2321(2) 0.61646(14) 0.30206(13) 0.0163(5) Uani 1 1 d .
H15 H 0.1772 0.5882 0.3403 0.020 Uiso 1 1 calc R
C19 C 0.3817(3) 0.49642(15) 0.27089(15) 0.0219(5) Uani 1 1 d .
H19A H 0.4802 0.4784 0.2688 0.026 Uiso 1 1 calc R
H19B H 0.3348 0.4596 0.3051 0.026 Uiso 1 1 calc R
C6 C 0.5756(2) 0.95830(14) 0.09434(13) 0.0150(5) Uani 1 1 d .
C18 C 0.3070(3) 0.49275(16) 0.19066(15) 0.0244(6) Uani 1 1 d .
H18A H 0.3061 0.4370 0.1717 0.029 Uiso 1 1 calc R
H18B H 0.3582 0.5259 0.1551 0.029 Uiso 1 1 calc R
C16 C 0.1548(3) 0.60826(15) 0.22179(14) 0.0193(5) Uani 1 1 d .
H16A H 0.0560 0.6258 0.2239 0.023 Uiso 1 1 calc R
H16B H 0.1998 0.6437 0.1855 0.023 Uiso 1 1 calc R
C10 C 0.3976(3) 0.81089(15) 0.44331(14) 0.0200(5) Uani 1 1 d .
H10A H 0.4356 0.8395 0.3999 0.024 Uiso 1 1 calc R
H10B H 0.3127 0.8397 0.4575 0.024 Uiso 1 1 calc R
C17 C 0.1568(3) 0.52293(15) 0.19218(15) 0.0220(5) Uani 1 1 d .
H17A H 0.1045 0.4881 0.2258 0.026 Uiso 1 1 calc R
H17B H 0.1093 0.5207 0.1396 0.026 Uiso 1 1 calc R
C25 C -0.1575(3) 0.74600(17) 0.40795(16) 0.0252(6) Uani 1 1 d .
H25A H -0.2229 0.7071 0.4288 0.030 Uiso 1 1 calc R
H25B H -0.1298 0.7849 0.4491 0.030 Uiso 1 1 calc R
C13 C 0.4106(3) 0.67794(17) 0.55406(14) 0.0237(5) Uani 1 1 d .
H13A H 0.3703 0.6513 0.5980 0.028 Uiso 1 1 calc R
H13B H 0.4923 0.6461 0.5401 0.028 Uiso 1 1 calc R
C5 C 0.4811(2) 0.97375(13) 0.02958(13) 0.0138(4) Uani 1 1 d .
C3 C 0.3480(2) 0.93632(14) 0.02375(13) 0.0156(5) Uani 1 1 d .
C24 C -0.2335(3) 0.78976(16) 0.34030(16) 0.0246(6) Uani 1 1 d .
H24A H -0.2731 0.7505 0.3021 0.030 Uiso 1 1 calc R
H24B H -0.3124 0.8211 0.3585 0.030 Uiso 1 1 calc R
C9 C 0.3577(3) 0.72562(14) 0.41867(13) 0.0167(5) Uani 1 1 d .
H9 H 0.4478 0.6985 0.4084 0.020 Uiso 1 1 calc R
C2 C 0.3140(2) 0.88407(14) 0.08194(13) 0.0171(5) Uani 1 1 d .
H2 H 0.2248 0.8585 0.0771 0.020 Uiso 1 1 calc R
C8 C 0.5353(2) 0.90598(14) 0.15102(13) 0.0167(5) Uani 1 1 d .
H8 H 0.5997 0.8961 0.1944 0.020 Uiso 1 1 calc R
C21 C 0.0729(2) 0.76057(14) 0.34979(13) 0.0168(5) Uani 1 1 d .
H21 H 0.0919 0.8040 0.3885 0.020 Uiso 1 1 calc R
C12 C 0.4595(3) 0.76086(16) 0.57797(15) 0.0238(6) Uani 1 1 d .
H12A H 0.5383 0.7564 0.6183 0.029 Uiso 1 1 calc R
H12B H 0.3815 0.7893 0.6005 0.029 Uiso 1 1 calc R
C4 C 0.2536(2) 0.95324(14) -0.04255(13) 0.0171(5) Uani 1 1 d .
H4 H 0.1631 0.9291 -0.0469 0.021 Uiso 1 1 calc R
C7 C 0.7100(2) 0.99751(14) 0.09882(13) 0.0174(5) Uani 1 1 d .
H7 H 0.7747 0.9886 0.1423 0.021 Uiso 1 1 calc R
C14 C 0.3005(3) 0.68048(16) 0.48601(14) 0.0202(5) Uani 1 1 d .
H14A H 0.2146 0.7073 0.5014 0.024 Uiso 1 1 calc R
H14B H 0.2750 0.6254 0.4698 0.024 Uiso 1 1 calc R
C11 C 0.5073(3) 0.80944(16) 0.51164(15) 0.0230(5) Uani 1 1 d .
H11A H 0.5959 0.7866 0.4952 0.028 Uiso 1 1 calc R
H11B H 0.5269 0.8648 0.5292 0.028 Uiso 1 1 calc R
C23 C -0.1337(3) 0.84504(16) 0.30271(15) 0.0244(6) Uani 1 1 d .
H23A H -0.1036 0.8884 0.3389 0.029 Uiso 1 1 calc R
H23B H -0.1831 0.8696 0.2565 0.029 Uiso 1 1 calc R
C28 C 0.6145(3) 0.66424(18) 0.16687(17) 0.0307(6) Uani 1 1 d .
H28 H 0.5837 0.7071 0.1969 0.037 Uiso 1 1 calc R
C29 C 0.7114(3) 0.61038(17) 0.19865(17) 0.0295(6) Uani 1 1 d .
H29 H 0.7443 0.6151 0.2513 0.035 Uiso 1 1 calc R
C27 C 0.5621(3) 0.65583(18) 0.09126(17) 0.0320(6) Uani 1 1 d .
H27 H 0.4934 0.6920 0.0693 0.038 Uiso 1 1 calc R
C31 C 0.7117(3) 0.54119(17) 0.07794(17) 0.0304(6) Uani 1 1 d .
C30 C 0.7611(3) 0.54997(17) 0.15513(16) 0.0282(6) Uani 1 1 d .
H30 H 0.8295 0.5139 0.1776 0.034 Uiso 1 1 calc R
C32 C 0.6108(3) 0.59401(18) 0.04774(17) 0.0316(6) Uani 1 1 d .
H32 H 0.5739 0.5879 -0.0042 0.038 Uiso 1 1 calc R
C33 C 0.7689(4) 0.47818(19) 0.02996(18) 0.0407(8) Uani 1 1 d .
H33A H 0.6911 0.4493 0.0023 0.061 Uiso 1 1 calc R
H33B H 0.8255 0.4410 0.0629 0.061 Uiso 1 1 calc R
H33C H 0.8280 0.5025 -0.0071 0.061 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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -2.0133 8.8022 '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
C1 Au1 P1 176.09(7) . .
C23 C22 C21 110.9(2) . .
C23 C22 H22A 109.5 . .
C21 C22 H22A 109.5 . .
C23 C22 H22B 109.5 . .
C21 C22 H22B 109.5 . .
H22A C22 H22B 108.0 . .
C9 P1 C15 105.50(11) . .
C9 P1 C21 106.11(11) . .
C15 P1 C21 109.42(11) . .
C9 P1 Au1 112.47(8) . .
C15 P1 Au1 112.17(8) . .
C21 P1 Au1 110.85(8) . .
C8 C1 C2 116.2(2) . .
C8 C1 Au1 123.93(17) . .
C2 C1 Au1 119.73(17) . .
C19 C20 C15 112.9(2) . .
C19 C20 H20A 109.0 . .
C15 C20 H20A 109.0 . .
C19 C20 H20B 109.0 . .
C15 C20 H20B 109.0 . .
H20A C20 H20B 107.8 . .
C25 C26 C21 109.9(2) . .
C25 C26 H26A 109.7 . .
C21 C26 H26A 109.7 . .
C25 C26 H26B 109.7 . .
C21 C26 H26B 109.7 . .
H26A C26 H26B 108.2 . .
C16 C15 C20 111.08(19) . .
C16 C15 P1 109.43(16) . .
C20 C15 P1 108.86(16) . .
C16 C15 H15 109.1 . .
C20 C15 H15 109.1 . .
P1 C15 H15 109.1 . .
C18 C19 C20 111.8(2) . .
C18 C19 H19A 109.2 . .
C20 C19 H19A 109.2 . .
C18 C19 H19B 109.2 . .
C20 C19 H19B 109.2 . .
H19A C19 H19B 107.9 . .
C8 C6 C5 119.1(2) . .
C8 C6 C7 122.9(2) . .
C5 C6 C7 118.0(2) . .
C19 C18 C17 110.0(2) . .
C19 C18 H18A 109.7 . .
C17 C18 H18A 109.7 . .
C19 C18 H18B 109.7 . .
C17 C18 H18B 109.7 . .
H18A C18 H18B 108.2 . .
C17 C16 C15 112.1(2) . .
C17 C16 H16A 109.2 . .
C15 C16 H16A 109.2 . .
C17 C16 H16B 109.2 . .
C15 C16 H16B 109.2 . .
H16A C16 H16B 107.9 . .
C11 C10 C9 110.2(2) . .
C11 C10 H10A 109.6 . .
C9 C10 H10A 109.6 . .
C11 C10 H10B 109.6 . .
C9 C10 H10B 109.6 . .
H10A C10 H10B 108.1 . .
C18 C17 C16 110.9(2) . .
C18 C17 H17A 109.5 . .
C16 C17 H17A 109.5 . .
C18 C17 H17B 109.5 . .
C16 C17 H17B 109.5 . .
H17A C17 H17B 108.1 . .
C24 C25 C26 112.5(2) . .
C24 C25 H25A 109.1 . .
C26 C25 H25A 109.1 . .
C24 C25 H25B 109.1 . .
C26 C25 H25B 109.1 . .
H25A C25 H25B 107.8 . .
C12 C13 C14 111.6(2) . .
C12 C13 H13A 109.3 . .
C14 C13 H13A 109.3 . .
C12 C13 H13B 109.3 . .
C14 C13 H13B 109.3 . .
H13A C13 H13B 108.0 . .
C6 C5 C3 119.3(2) . .
C6 C5 C5 120.7(3) . 3_675
C3 C5 C5 120.0(3) . 3_675
C2 C3 C5 119.0(2) . .
C2 C3 C4 122.8(2) . .
C5 C3 C4 118.2(2) . .
C23 C24 C25 110.7(2) . .
C23 C24 H24A 109.5 . .
C25 C24 H24A 109.5 . .
C23 C24 H24B 109.5 . .
C25 C24 H24B 109.5 . .
H24A C24 H24B 108.1 . .
C10 C9 C14 109.9(2) . .
C10 C9 P1 112.44(17) . .
C14 C9 P1 115.61(17) . .
C10 C9 H9 106.0 . .
C14 C9 H9 106.0 . .
P1 C9 H9 106.0 . .
C3 C2 C1 123.2(2) . .
C3 C2 H2 118.4 . .
C1 C2 H2 118.4 . .
C1 C8 C6 123.3(2) . .
C1 C8 H8 118.4 . .
C6 C8 H8 118.4 . .
C22 C21 C26 109.0(2) . .
C22 C21 P1 111.89(17) . .
C26 C21 P1 117.37(17) . .
C22 C21 H21 105.9 . .
C26 C21 H21 105.9 . .
P1 C21 H21 105.9 . .
C13 C12 C11 112.8(2) . .
C13 C12 H12A 109.0 . .
C11 C12 H12A 109.0 . .
C13 C12 H12B 109.0 . .
C11 C12 H12B 109.0 . .
H12A C12 H12B 107.8 . .
C7 C4 C3 121.7(2) 3_675 .
C7 C4 H4 119.1 3_675 .
C3 C4 H4 119.1 . .
C4 C7 C6 121.4(2) 3_675 .
C4 C7 H7 119.3 3_675 .
C6 C7 H7 119.3 . .
C13 C14 C9 110.3(2) . .
C13 C14 H14A 109.6 . .
C9 C14 H14A 109.6 . .
C13 C14 H14B 109.6 . .
C9 C14 H14B 109.6 . .
H14A C14 H14B 108.1 . .
C12 C11 C10 112.1(2) . .
C12 C11 H11A 109.2 . .
C10 C11 H11A 109.2 . .
C12 C11 H11B 109.2 . .
C10 C11 H11B 109.2 . .
H11A C11 H11B 107.9 . .
C24 C23 C22 111.0(2) . .
C24 C23 H23A 109.4 . .
C22 C23 H23A 109.4 . .
C24 C23 H23B 109.4 . .
C22 C23 H23B 109.4 . .
H23A C23 H23B 108.0 . .
C29 C28 C27 119.9(3) . .
C29 C28 H28 120.1 . .
C27 C28 H28 120.1 . .
C30 C29 C28 120.8(3) . .
C30 C29 H29 119.6 . .
C28 C29 H29 119.6 . .
C28 C27 C32 119.2(3) . .
C28 C27 H27 120.4 . .
C32 C27 H27 120.4 . .
C32 C31 C30 118.1(3) . .
C32 C31 C33 121.3(3) . .
C30 C31 C33 120.6(3) . .
C29 C30 C31 120.4(3) . .
C29 C30 H30 119.8 . .
C31 C30 H30 119.8 . .
C31 C32 C27 121.6(3) . .
C31 C32 H32 119.2 . .
C27 C32 H32 119.2 . .
C31 C33 H33A 109.5 . .
C31 C33 H33B 109.5 . .
H33A C33 H33B 109.5 . .
C31 C33 H33C 109.5 . .
H33A C33 H33C 109.5 . .
H33B C33 H33C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Au1 C1 2.046(2) .
Au1 P1 2.3044(6) .
C22 C23 1.520(3) .
C22 C21 1.528(3) .
C22 H22A 0.9900 .
C22 H22B 0.9900 .
P1 C9 1.831(2) .
P1 C15 1.837(2) .
P1 C21 1.845(2) .
C1 C8 1.394(3) .
C1 C2 1.401(3) .
C20 C19 1.520(3) .
C20 C15 1.539(3) .
C20 H20A 0.9900 .
C20 H20B 0.9900 .
C26 C25 1.526(3) .
C26 C21 1.533(3) .
C26 H26A 0.9900 .
C26 H26B 0.9900 .
C15 C16 1.535(3) .
C15 H15 1.0000 .
C19 C18 1.519(4) .
C19 H19A 0.9900 .
C19 H19B 0.9900 .
C6 C8 1.398(3) .
C6 C5 1.411(3) .
C6 C7 1.437(3) .
C18 C17 1.521(4) .
C18 H18A 0.9900 .
C18 H18B 0.9900 .
C16 C17 1.521(3) .
C16 H16A 0.9900 .
C16 H16B 0.9900 .
C10 C11 1.522(4) .
C10 C9 1.531(3) .
C10 H10A 0.9900 .
C10 H10B 0.9900 .
C17 H17A 0.9900 .
C17 H17B 0.9900 .
C25 C24 1.522(4) .
C25 H25A 0.9900 .
C25 H25B 0.9900 .
C13 C12 1.514(4) .
C13 C14 1.520(3) .
C13 H13A 0.9900 .
C13 H13B 0.9900 .
C5 C3 1.412(3) .
C5 C5 1.424(4) 3_675
C3 C2 1.398(3) .
C3 C4 1.435(3) .
C24 C23 1.514(4) .
C24 H24A 0.9900 .
C24 H24B 0.9900 .
C9 C14 1.533(3) .
C9 H9 1.0000 .
C2 H2 0.9500 .
C8 H8 0.9500 .
C21 H21 1.0000 .
C12 C11 1.514(4) .
C12 H12A 0.9900 .
C12 H12B 0.9900 .
C4 C7 1.349(3) 3_675
C4 H4 0.9500 .
C7 C4 1.349(3) 3_675
C7 H7 0.9500 .
C14 H14A 0.9900 .
C14 H14B 0.9900 .
C11 H11A 0.9900 .
C11 H11B 0.9900 .
C23 H23A 0.9900 .
C23 H23B 0.9900 .
C28 C29 1.376(4) .
C28 C27 1.379(4) .
C28 H28 0.9500 .
C29 C30 1.372(4) .
C29 H29 0.9500 .
C27 C32 1.386(4) .
C27 H27 0.9500 .
C31 C32 1.380(4) .
C31 C30 1.398(4) .
C31 C33 1.478(4) .
C30 H30 0.9500 .
C32 H32 0.9500 .
C33 H33A 0.9800 .
C33 H33B 0.9800 .
C33 H33C 0.9800 .
