#------------------------------------------------------------------------------
#$Date: 2025-01-11 10:06:07 +0200 (Sat, 11 Jan 2025) $
#$Revision: 297289 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/58/7715865.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_7715865
loop_
_publ_author_name
'Martins, Francisco Mainardi'
'Iglesias, Bernardo Almeida'
'Chaves, Otávio Augusto'
'Gutknecht da Silva, Jean Lucas'
'Leal, Daniela Bitencourt Rosa'
'Back, Davi Fernando'
_publ_section_title
;
 Vanadium(V) complexes derived from triphenylphosphonium and hydrazides:
 cytotoxicity evaluation and interaction with biomolecules.
;
_journal_issue                   19
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              8315
_journal_page_last               8327
_journal_paper_doi               10.1039/d4dt00464g
_journal_volume                  53
_journal_year                    2024
_chemical_formula_moiety         'C26 H22 O2 P, Cl'
_chemical_formula_sum            'C26 H22 Cl O2 P'
_chemical_formula_weight         432.85
_chemical_melting_point          519
_chemical_name_common            none
_chemical_name_systematic
;
        3-formyl-4-hydroxybenzyl)triphenylphosphonium chloride
;
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_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_conform_dict_location     ftp://ftp.iucr.org/pub/cif_core.dic
_audit_conform_dict_name         cif_core.dic
_audit_conform_dict_version      2.4
_audit_creation_date             2024-03-19T11:13:48-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'
_audit_update_record
;
2024-03-27 deposited with the CCDC.	2024-04-17 downloaded from the CCDC.
;
_cell_angle_alpha                105.387(2)
_cell_angle_beta                 92.247(2)
_cell_angle_gamma                90.731(2)
_cell_formula_units_Z            4
_cell_length_a                   9.7713(5)
_cell_length_b                   13.1128(6)
_cell_length_c                   17.6654(9)
_cell_measurement_reflns_used    9860
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      29.576
_cell_measurement_theta_min      2.359
_cell_volume                     2180.01(19)
_computing_cell_refinement       'SAINT V8.34A (Bruker AXS Inc., 2013)'
_computing_data_collection       'Bruker Instrument Service v4.2.7'
_computing_data_reduction        'SAINT V8.34A (Bruker AXS Inc., 2013)'
_computing_molecular_graphics    'Diamond (version 3.2i; Crystal Impact GbR'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXL97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 10.4167
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker D8 Quest Photon 100 diffractometer'
_diffrn_measurement_method       '2° φ & ω scans'
_diffrn_radiation_monochromator  'Montel type 2-dim beam shaping X ray optics'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0354
_diffrn_reflns_av_unetI/netI     0.0429
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            43134
_diffrn_reflns_theta_full        29.63
_diffrn_reflns_theta_max         29.63
_diffrn_reflns_theta_min         2.09
_diffrn_source                   'micro-focus tube'
_exptl_absorpt_coefficient_mu    0.269
_exptl_absorpt_correction_T_max  0.9458
_exptl_absorpt_correction_T_min  0.8483
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
        SADABS (version 2012/1; Bruker, 2012) was used to perform the
        numerical absorption correction based on the indexed faces
        of the crystal.
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.319
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             904
_exptl_crystal_size_max          0.38
_exptl_crystal_size_mid          0.29
_exptl_crystal_size_min          0.25
_refine_diff_density_max         0.117
_refine_diff_density_min         -0.442
_refine_diff_density_rms         0.104
_refine_ls_extinction_coef       none
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.165
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     547
_refine_ls_number_reflns         12285
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.165
_refine_ls_R_factor_all          0.0923
_refine_ls_R_factor_gt           0.076
_refine_ls_shift/su_max          0
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0487P)²+3.7695P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.148
_refine_ls_wR_factor_ref         0.1452
_reflns_number_gt                9901
_reflns_number_total             12285
_reflns_threshold_expression     >2σ(I)
_cod_data_source_file            d4dt00464g2.cif
_cod_data_source_block           AHCl
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_chemical_melting_point' value '519K' was changed to '519'
-- the value should be numeric and without a unit designator.

data item '_exptl_crystal_density_meas' value 'none' was changed to
'?' -- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 8170 2020-07-09 18:12:32Z antanas 

 Adding full bibliography for 7715863--7715870.cif.

2025-01-11
Z value and formula fixed to values more according to usual
chemical conventions.                 miguel
;
_cod_original_formula_sum            'C52 H44 Cl2 O4 P2'
_cod_original_formula_weight         865.71
_cod_original_formula_units_Z            2
_cod_original_sg_symbol_Hall     -P1
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7715865
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
C1 C 0.2556(4) 0.3888(3) 0.6518(2) 0.0220(7) Uani 1 1 d . . .
C2 C 0.2356(4) 0.3545(3) 0.5700(2) 0.0199(7) Uani 1 1 d . . .
C3 C 0.3188(4) 0.2767(3) 0.5255(2) 0.0203(7) Uani 1 1 d . . .
H3 H 0.3045 0.2543 0.47 0.024 Uiso 1 1 calc R . .
C4 C 0.4220(4) 0.2319(3) 0.5617(2) 0.0197(7) Uani 1 1 d . . .
C5 C 0.4376(4) 0.2643(3) 0.6439(2) 0.0231(7) Uani 1 1 d . . .
H5 H 0.5057 0.2327 0.6695 0.028 Uiso 1 1 calc R . .
C6 C 0.3565(4) 0.3411(3) 0.6888(2) 0.0245(7) Uani 1 1 d . . .
H6 H 0.369 0.3614 0.7445 0.029 Uiso 1 1 calc R . .
C7 C 0.1257(4) 0.4008(3) 0.5307(2) 0.0260(8) Uani 1 1 d . . .
H7 H 0.0821 0.4618 0.5607 0.031 Uiso 1 1 calc R . .
C8 C 0.5153(4) 0.1500(3) 0.5148(2) 0.0190(6) Uani 1 1 d . . .
H8A H 0.463 0.1059 0.4682 0.023 Uiso 1 1 calc R . .
H8B H 0.5463 0.1032 0.5475 0.023 Uiso 1 1 calc R . .
C9 C 0.6125(4) 0.2707(3) 0.4075(2) 0.0207(7) Uani 1 1 d . . .
C10 C 0.5475(4) 0.3685(3) 0.4253(2) 0.0247(7) Uani 1 1 d . . .
H10 H 0.5341 0.4051 0.4785 0.03 Uiso 1 1 calc R . .
C11 C 0.5027(5) 0.4118(3) 0.3653(2) 0.0299(8) Uani 1 1 d . . .
H11 H 0.4618 0.4792 0.3775 0.036 Uiso 1 1 calc R . .
C12 C 0.5175(5) 0.3571(4) 0.2880(2) 0.0361(10) Uani 1 1 d . . .
H12 H 0.4864 0.3873 0.2472 0.043 Uiso 1 1 calc R . .
C13 C 0.5768(6) 0.2594(4) 0.2690(2) 0.0432(12) Uani 1 1 d . . .
H13 H 0.5854 0.2219 0.2155 0.052 Uiso 1 1 calc R . .
C14 C 0.6242(5) 0.2160(4) 0.3291(2) 0.0365(10) Uani 1 1 d . . .
H14 H 0.6649 0.1484 0.3163 0.044 Uiso 1 1 calc R . .
C15 C 0.7832(4) 0.1072(3) 0.44325(19) 0.0182(6) Uani 1 1 d . . .
C16 C 0.9233(4) 0.1319(3) 0.4522(2) 0.0241(7) Uani 1 1 d . . .
H16 H 0.9546 0.2005 0.4811 0.029 Uiso 1 1 calc R . .
C17 C 1.0173(4) 0.0555(3) 0.4185(2) 0.0280(8) Uani 1 1 d . . .
H17 H 1.1127 0.0721 0.4243 0.034 Uiso 1 1 calc R . .
C18 C 0.9711(4) -0.0445(3) 0.3768(2) 0.0293(8) Uani 1 1 d . . .
H18 H 1.035 -0.0959 0.3531 0.035 Uiso 1 1 calc R . .
C19 C 0.8323(4) -0.0703(3) 0.3692(2) 0.0310(9) Uani 1 1 d . . .
H19 H 0.802 -0.1398 0.3416 0.037 Uiso 1 1 calc R . .
C20 C 0.7366(4) 0.0056(3) 0.4019(2) 0.0263(8) Uani 1 1 d . . .
H20 H 0.6413 -0.0116 0.3962 0.032 Uiso 1 1 calc R . .
C21 C 0.7454(4) 0.3008(3) 0.56637(19) 0.0186(6) Uani 1 1 d . . .
C22 C 0.7707(4) 0.2646(3) 0.6332(2) 0.0255(8) Uani 1 1 d . . .
H22 H 0.7484 0.1934 0.6321 0.031 Uiso 1 1 calc R . .
C23 C 0.8285(5) 0.3329(3) 0.7010(2) 0.0303(8) Uani 1 1 d . . .
H23 H 0.8475 0.3079 0.746 0.036 Uiso 1 1 calc R . .
C24 C 0.8584(4) 0.4362(3) 0.7036(2) 0.0282(8) Uani 1 1 d . . .
H24 H 0.8951 0.483 0.7509 0.034 Uiso 1 1 calc R . .
C25 C 0.8354(4) 0.4727(3) 0.6375(2) 0.0295(8) Uani 1 1 d . . .
H25 H 0.8573 0.5441 0.6393 0.035 Uiso 1 1 calc R . .
C26 C 0.7800(4) 0.4042(3) 0.5684(2) 0.0252(7) Uani 1 1 d . . .
H26 H 0.766 0.4286 0.5226 0.03 Uiso 1 1 calc R . .
C27 C -0.2874(4) 0.1050(3) -0.1308(2) 0.0208(7) Uani 1 1 d . . .
C28 C -0.3033(4) 0.1464(3) -0.04972(19) 0.0185(6) Uani 1 1 d . . .
C29 C -0.2105(4) 0.2240(3) -0.00570(19) 0.0174(6) Uani 1 1 d . . .
H29 H -0.2222 0.2519 0.049 0.021 Uiso 1 1 calc R . .
C30 C -0.1021(3) 0.2611(3) -0.04004(19) 0.0168(6) Uani 1 1 d . . .
C31 C -0.0870(4) 0.2171(3) -0.12111(19) 0.0197(7) Uani 1 1 d . . .
H31 H -0.0128 0.2409 -0.1457 0.024 Uiso 1 1 calc R . .
C32 C -0.1768(4) 0.1406(3) -0.16573(19) 0.0207(7) Uani 1 1 d . . .
H32 H -0.1635 0.112 -0.2202 0.025 Uiso 1 1 calc R . .
C33 C -0.4181(4) 0.1082(3) -0.0116(2) 0.0231(7) Uani 1 1 d . . .
H33 H -0.4784 0.0549 -0.0431 0.028 Uiso 1 1 calc R . .
C34 C -0.0029(3) 0.3466(3) 0.00535(18) 0.0162(6) Uani 1 1 d . . .
H34A H -0.0514 0.3951 0.0481 0.019 Uiso 1 1 calc R . .
H34B H 0.0292 0.3881 -0.0301 0.019 Uiso 1 1 calc R . .
C35 C 0.1027(4) 0.2592(3) 0.13479(19) 0.0200(7) Uani 1 1 d . . .
C36 C 0.1898(5) 0.1934(3) 0.1641(2) 0.0329(9) Uani 1 1 d . . .
H36 H 0.2658 0.1625 0.1353 0.04 Uiso 1 1 calc R . .
C37 C 0.1635(6) 0.1738(4) 0.2360(2) 0.0429(12) Uani 1 1 d . . .
H37 H 0.2213 0.1286 0.2563 0.051 Uiso 1 1 calc R . .
C38 C 0.0535(6) 0.2200(3) 0.2780(2) 0.0402(11) Uani 1 1 d . . .
H38 H 0.0367 0.2064 0.3271 0.048 Uiso 1 1 calc R . .
C39 C -0.0319(5) 0.2853(3) 0.2498(2) 0.0327(9) Uani 1 1 d . . .
H39 H -0.1073 0.3163 0.2791 0.039 Uiso 1 1 calc R . .
C40 C -0.0074(4) 0.3058(3) 0.1779(2) 0.0229(7) Uani 1 1 d . . .
H40 H -0.0655 0.3515 0.1584 0.027 Uiso 1 1 calc R . .
C41 C 0.2771(4) 0.3959(3) 0.07077(18) 0.0176(6) Uani 1 1 d . . .
C42 C 0.4140(4) 0.3670(3) 0.0749(2) 0.0269(8) Uani 1 1 d . . .
H42 H 0.4364 0.2945 0.0648 0.032 Uiso 1 1 calc R . .
C43 C 0.5164(4) 0.4443(4) 0.0937(2) 0.0301(9) Uani 1 1 d . . .
H43 H 0.6095 0.4249 0.096 0.036 Uiso 1 1 calc R . .
C44 C 0.4837(4) 0.5498(3) 0.1090(2) 0.0275(8) Uani 1 1 d . . .
H44 H 0.5546 0.6026 0.1214 0.033 Uiso 1 1 calc R . .
C45 C 0.3479(4) 0.5793(3) 0.1063(2) 0.0273(8) Uani 1 1 d . . .
H45 H 0.3263 0.6521 0.1175 0.033 Uiso 1 1 calc R . .
C46 C 0.2436(4) 0.5025(3) 0.0873(2) 0.0214(7) Uani 1 1 d . . .
H46 H 0.1506 0.5224 0.0857 0.026 Uiso 1 1 calc R . .
C47 C 0.1988(4) 0.1833(3) -0.02639(19) 0.0209(7) Uani 1 1 d . . .
C48 C 0.1505(5) 0.0814(3) -0.0290(2) 0.0292(8) Uani 1 1 d . . .
H48 H 0.1016 0.0691 0.0133 0.035 Uiso 1 1 calc R . .
C49 C 0.1749(6) -0.0016(3) -0.0942(3) 0.0401(11) Uani 1 1 d . . .
H49 H 0.1428 -0.0711 -0.0965 0.048 Uiso 1 1 calc R . .
C50 C 0.2454(6) 0.0167(4) -0.1553(3) 0.0424(12) Uani 1 1 d . . .
H50 H 0.262 -0.0407 -0.1995 0.051 Uiso 1 1 calc R . .
C51 C 0.2925(5) 0.1167(4) -0.1537(2) 0.0367(10) Uani 1 1 d . . .
H51 H 0.3408 0.1282 -0.1964 0.044 Uiso 1 1 calc R . .
C52 C 0.2687(4) 0.2007(3) -0.0889(2) 0.0290(8) Uani 1 1 d . . .
H52 H 0.3003 0.2701 -0.0874 0.035 Uiso 1 1 calc R . .
Cl1 Cl 0.14258(9) 0.44195(7) 0.85477(5) 0.02133(18) Uani 1 1 d . . .
Cl2 Cl -0.36137(10) 0.01218(7) -0.34283(5) 0.0257(2) Uani 1 1 d . . .
O1 O 0.1776(3) 0.4661(2) 0.69298(16) 0.0299(6) Uani 1 1 d . . .
O2 O 0.0882(3) 0.3655(2) 0.46239(17) 0.0322(6) Uani 1 1 d . . .
O3 O -0.3802(3) 0.0320(2) -0.17156(16) 0.0287(6) Uani 1 1 d . . .
O4 O -0.4394(3) 0.1414(2) 0.05795(16) 0.0270(6) Uani 1 1 d . . .
P1 P 0.66419(9) 0.20839(7) 0.48250(5) 0.01694(18) Uani 1 1 d . . .
P2 P 0.14400(9) 0.29551(7) 0.04739(5) 0.01557(17) Uani 1 1 d . . .
H8 H 0.177(5) 0.461(4) 0.748(3) 0.023 Uiso 1 1 d . . .
H9 H -0.371(5) 0.027(4) -0.223(3) 0.023 Uiso 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 0 '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'
O O 0.0106 0.006 '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'
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
O1 C1 C2 119.3(3) . . ?
O1 C1 C6 121.7(3) . . ?
C2 C1 C6 119.0(3) . . ?
C1 C2 C3 120.4(3) . . ?
C1 C2 C7 119.5(3) . . ?
C3 C2 C7 120.1(3) . . ?
C4 C3 C2 120.7(3) . . ?
C3 C4 C5 118.2(3) . . ?
C3 C4 C8 121.7(3) . . ?
C5 C4 C8 120.1(3) . . ?
C6 C5 C4 121.8(3) . . ?
C5 C6 C1 119.7(3) . . ?
O2 C7 C2 123.7(4) . . ?
C4 C8 P1 112.8(2) . . ?
C14 C9 C10 118.9(3) . . ?
C14 C9 P1 119.1(3) . . ?
C10 C9 P1 121.7(3) . . ?
C11 C10 C9 120.1(3) . . ?
C12 C11 C10 120.1(4) . . ?
C13 C12 C11 120.8(4) . . ?
C12 C13 C14 119.4(4) . . ?
C9 C14 C13 120.6(4) . . ?
C16 C15 C20 120.3(3) . . ?
C16 C15 P1 119.1(3) . . ?
C20 C15 P1 120.6(3) . . ?
C15 C16 C17 119.9(4) . . ?
C18 C17 C16 119.8(4) . . ?
C17 C18 C19 120.6(4) . . ?
C18 C19 C20 120.4(4) . . ?
C15 C20 C19 119.0(4) . . ?
C26 C21 C22 119.6(3) . . ?
C26 C21 P1 123.7(3) . . ?
C22 C21 P1 116.6(3) . . ?
C23 C22 C21 119.7(4) . . ?
C24 C23 C22 120.5(4) . . ?
C23 C24 C25 120.3(4) . . ?
C24 C25 C26 119.8(4) . . ?
C21 C26 C25 120.0(4) . . ?
O3 C27 C32 122.9(3) . . ?
O3 C27 C28 118.0(3) . . ?
C32 C27 C28 119.1(3) . . ?
C29 C28 C27 119.7(3) . . ?
C29 C28 C33 120.5(3) . . ?
C27 C28 C33 119.9(3) . . ?
C30 C29 C28 121.6(3) . . ?
C29 C30 C31 117.7(3) . . ?
C29 C30 C34 122.8(3) . . ?
C31 C30 C34 119.5(3) . . ?
C32 C31 C30 121.9(3) . . ?
C31 C32 C27 120.0(3) . . ?
O4 C33 C28 123.5(3) . . ?
C30 C34 P2 113.2(2) . . ?
C40 C35 C36 120.2(3) . . ?
C40 C35 P2 119.7(3) . . ?
C36 C35 P2 119.7(3) . . ?
C37 C36 C35 119.1(4) . . ?
C38 C37 C36 120.1(4) . . ?
C39 C38 C37 121.0(4) . . ?
C38 C39 C40 119.7(4) . . ?
C39 C40 C35 119.8(4) . . ?
C46 C41 C42 120.2(3) . . ?
C46 C41 P2 120.0(3) . . ?
C42 C41 P2 119.8(3) . . ?
C43 C42 C41 119.8(4) . . ?
C44 C43 C42 120.1(4) . . ?
C43 C44 C45 120.5(4) . . ?
C44 C45 C46 120.1(4) . . ?
C45 C46 C41 119.2(3) . . ?
C52 C47 C48 120.0(3) . . ?
C52 C47 P2 118.5(3) . . ?
C48 C47 P2 120.4(3) . . ?
C49 C48 C47 119.2(4) . . ?
C50 C49 C48 120.1(4) . . ?
C49 C50 C51 121.2(4) . . ?
C50 C51 C52 119.4(4) . . ?
C47 C52 C51 120.1(4) . . ?
C15 P1 C9 108.97(16) . . ?
C15 P1 C21 108.47(16) . . ?
C9 P1 C21 111.88(17) . . ?
C15 P1 C8 109.59(16) . . ?
C9 P1 C8 109.63(17) . . ?
C21 P1 C8 108.27(16) . . ?
C47 P2 C35 110.96(17) . . ?
C47 P2 C41 109.79(17) . . ?
C35 P2 C41 109.24(16) . . ?
C47 P2 C34 106.76(15) . . ?
C35 P2 C34 111.46(17) . . ?
C41 P2 C34 108.58(16) . . ?
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
C1 O1 1.346(4) . ?
C1 C2 1.399(5) . ?
C1 C6 1.404(5) . ?
C2 C3 1.403(5) . ?
C2 C7 1.478(5) . ?
C3 C4 1.391(5) . ?
C4 C5 1.403(5) . ?
C4 C8 1.510(5) . ?
C5 C6 1.384(5) . ?
C7 O2 1.213(5) . ?
C8 P1 1.816(4) . ?
C9 C14 1.390(5) . ?
C9 C10 1.403(5) . ?
C9 P1 1.793(4) . ?
C10 C11 1.388(5) . ?
C11 C12 1.378(6) . ?
C12 C13 1.377(7) . ?
C13 C14 1.400(6) . ?
C15 C16 1.396(5) . ?
C15 C20 1.398(5) . ?
C15 P1 1.791(3) . ?
C16 C17 1.397(5) . ?
C17 C18 1.383(6) . ?
C18 C19 1.385(6) . ?
C19 C20 1.401(5) . ?
C21 C26 1.385(5) . ?
C21 C22 1.400(5) . ?
C21 P1 1.796(3) . ?
C22 C23 1.386(5) . ?
C23 C24 1.371(6) . ?
C24 C25 1.386(6) . ?
C25 C26 1.394(5) . ?
C27 O3 1.349(4) . ?
C27 C32 1.399(5) . ?
C27 C28 1.407(5) . ?
C28 C29 1.402(5) . ?
C28 C33 1.478(5) . ?
C29 C30 1.385(5) . ?
C30 C31 1.409(5) . ?
C30 C34 1.508(5) . ?
C31 C32 1.379(5) . ?
C33 O4 1.217(5) . ?
C34 P2 1.807(3) . ?
C35 C40 1.395(5) . ?
C35 C36 1.399(5) . ?
C35 P2 1.791(3) . ?
C36 C37 1.395(6) . ?
C37 C38 1.383(7) . ?
C38 C39 1.375(7) . ?
C39 C40 1.394(5) . ?
C41 C46 1.397(5) . ?
C41 C42 1.399(5) . ?
C41 P2 1.794(4) . ?
C42 C43 1.382(6) . ?
C43 C44 1.381(6) . ?
C44 C45 1.389(6) . ?
C45 C46 1.390(5) . ?
C47 C52 1.387(5) . ?
C47 C48 1.400(6) . ?
C47 P2 1.791(3) . ?
C48 C49 1.389(5) . ?
C49 C50 1.374(7) . ?
C50 C51 1.377(7) . ?
C51 C52 1.392(6) . ?
