#------------------------------------------------------------------------------
#$Date: 2016-03-26 02:49:11 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180156 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/52/7105270.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_7105270
loop_
_publ_author_name
'Xue, Zhi-Yong'
'Liu, Tang-Lin'
'Lu, Zhou'
'Huang, He'
'Tao, Hai-Yan'
'Wang, Chun-Jiang'
_publ_section_title
;
 exo-Selective asymmetric 1,3-dipolar cycloaddition of azomethine
 ylides with alkylidene malonates catalyzed by AgOAc/TF-BiphamPhos.
;
_journal_issue                   10
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              1727
_journal_page_last               1729
_journal_paper_doi               10.1039/b919625k
_journal_volume                  46
_journal_year                    2010
_chemical_formula_sum            'C32 H37 N O6'
_chemical_formula_weight         531.63
_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                91.535(2)
_cell_angle_beta                 95.552(2)
_cell_angle_gamma                111.887(2)
_cell_formula_units_Z            2
_cell_length_a                   10.0784(12)
_cell_length_b                   12.2383(14)
_cell_length_c                   12.8767(15)
_cell_measurement_reflns_used    201
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      15
_cell_measurement_theta_min      7.5
_cell_volume                     1463.4(3)
_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      293(2)
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_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  0.0136
_diffrn_reflns_av_sigmaI/netI    0.0250
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            8536
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         2.25
_exptl_absorpt_coefficient_mu    0.083
_exptl_absorpt_correction_T_max  0.9788
_exptl_absorpt_correction_T_min  0.9740
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_density_diffrn    1.206
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             568
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.27
_exptl_crystal_size_min          0.26
_refine_diff_density_max         0.452
_refine_diff_density_min         -0.422
_refine_diff_density_rms         0.030
_refine_ls_extinction_coef       0.0309(18)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   0.984
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     360
_refine_ls_number_reflns         5649
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.984
_refine_ls_R_factor_all          0.0615
_refine_ls_R_factor_gt           0.0462
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0427P)²+0.5345P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1071
_refine_ls_wR_factor_ref         0.1175
_reflns_number_gt                4300
_reflns_number_total             5649
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b919625k.txt
_cod_data_source_block           90907_0m
_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_original_sg_symbol_H-M      P-1
_cod_database_code               7105270
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 0.92473(17) 0.83150(14) 0.42146(12) 0.0425(4) Uani 1 1 d . . .
C2 C 0.99589(19) 0.81612(17) 0.51192(13) 0.0538(4) Uani 1 1 d . . .
H2 H 1.0958 0.8428 0.5189 0.065 Uiso 1 1 calc R . .
C3 C 0.9218(2) 0.76092(19) 0.59498(15) 0.0654(5) Uani 1 1 d . . .
H3 H 0.9728 0.7520 0.6561 0.079 Uiso 1 1 calc R . .
C4 C 0.7763(2) 0.72076(19) 0.58630(15) 0.0654(5) Uani 1 1 d . . .
H4 H 0.7281 0.6843 0.6416 0.078 Uiso 1 1 calc R . .
C5 C 0.69718(19) 0.73358(17) 0.49463(15) 0.0572(5) Uani 1 1 d . . .
C6 C 0.5451(2) 0.6907(2) 0.4834(2) 0.0806(7) Uani 1 1 d . . .
H6 H 0.4960 0.6531 0.5379 0.097 Uiso 1 1 calc R . .
C7 C 0.4696(2) 0.7033(3) 0.3950(2) 0.0960(9) Uani 1 1 d . . .
H7 H 0.3696 0.6736 0.3887 0.115 Uiso 1 1 calc R . .
C8 C 0.5422(2) 0.7608(3) 0.3136(2) 0.0881(8) Uani 1 1 d . . .
H8 H 0.4899 0.7707 0.2535 0.106 Uiso 1 1 calc R . .
C9 C 0.6882(2) 0.80258(19) 0.32035(16) 0.0628(5) Uani 1 1 d . . .
H9 H 0.7340 0.8396 0.2643 0.075 Uiso 1 1 calc R . .
C10 C 0.77145(18) 0.79088(15) 0.41057(13) 0.0475(4) Uani 1 1 d . . .
C11 C 1.00860(17) 0.89307(14) 0.33370(12) 0.0416(4) Uani 1 1 d . . .
H11 H 0.9585 0.9400 0.3000 0.050 Uiso 1 1 calc R . .
C12 C 1.03359(16) 0.81199(13) 0.24541(12) 0.0377(3) Uani 1 1 d . . .
C13 C 1.19684(16) 0.87714(13) 0.23242(12) 0.0405(4) Uani 1 1 d . . .
H13 H 1.2493 0.8411 0.2789 0.049 Uiso 1 1 calc R . .
C14 C 1.23122(18) 1.00111(14) 0.28150(13) 0.0456(4) Uani 1 1 d . . .
H14 H 1.1878 1.0437 0.2348 0.055 Uiso 1 1 calc R . .
C15 C 1.39037(19) 1.07234(16) 0.30682(14) 0.0519(4) Uani 1 1 d . . .
C16 C 1.6097(2) 1.0796(2) 0.3955(2) 0.0942(8) Uani 1 1 d . . .
H16A H 1.6576 1.0902 0.3335 0.141 Uiso 1 1 calc R . .
H16B H 1.6446 1.0335 0.4416 0.141 Uiso 1 1 calc R . .
H16C H 1.6286 1.1553 0.4300 0.141 Uiso 1 1 calc R . .
C17 C 1.24363(17) 0.86981(14) 0.12493(13) 0.0442(4) Uani 1 1 d . . .
C18 C 1.2583(2) 0.95623(17) 0.05512(15) 0.0624(5) Uani 1 1 d . . .
H18 H 1.2343 1.0203 0.0723 0.075 Uiso 1 1 calc R . .
C19 C 1.3084(3) 0.9485(2) -0.04046(17) 0.0777(7) Uani 1 1 d . . .
H19 H 1.3175 1.0073 -0.0867 0.093 Uiso 1 1 calc R . .
C20 C 1.3445(2) 0.8558(2) -0.06688(18) 0.0766(7) Uani 1 1 d . . .
H20 H 1.3793 0.8515 -0.1305 0.092 Uiso 1 1 calc R . .
C21 C 1.3291(2) 0.7684(2) 0.00089(18) 0.0735(6) Uani 1 1 d . . .
H21 H 1.3532 0.7046 -0.0171 0.088 Uiso 1 1 calc R . .
C22 C 1.27789(19) 0.77458(17) 0.09595(15) 0.0565(5) Uani 1 1 d . . .
H22 H 1.2664 0.7142 0.1408 0.068 Uiso 1 1 calc R . .
C23 C 0.94306(17) 0.81084(14) 0.14234(12) 0.0407(4) Uani 1 1 d . . .
C24 C 0.8331(2) 0.69385(17) -0.02313(13) 0.0580(5) Uani 1 1 d . . .
C25 C 0.9143(3) 0.7844(2) -0.09513(15) 0.0785(7) Uani 1 1 d . . .
H25A H 0.9286 0.8619 -0.0671 0.118 Uiso 1 1 calc R . .
H25B H 0.8598 0.7696 -0.1630 0.118 Uiso 1 1 calc R . .
H25C H 1.0059 0.7791 -0.1011 0.118 Uiso 1 1 calc R . .
C26 C 0.8249(4) 0.5719(2) -0.05742(18) 0.1010(9) Uani 1 1 d . . .
H26A H 0.9204 0.5721 -0.0558 0.151 Uiso 1 1 calc R . .
H26B H 0.7766 0.5504 -0.1273 0.151 Uiso 1 1 calc R . .
H26C H 0.7723 0.5159 -0.0109 0.151 Uiso 1 1 calc R . .
C27 C 0.6851(2) 0.6953(2) -0.01165(18) 0.0860(7) Uani 1 1 d . . .
H27A H 0.6405 0.6406 0.0385 0.129 Uiso 1 1 calc R . .
H27B H 0.6266 0.6729 -0.0780 0.129 Uiso 1 1 calc R . .
H27C H 0.6946 0.7733 0.0118 0.129 Uiso 1 1 calc R . .
C28 C 1.00422(17) 0.68725(14) 0.28027(12) 0.0418(4) Uani 1 1 d . . .
C29 C 0.8033(2) 0.49948(14) 0.29514(14) 0.0538(5) Uani 1 1 d . . .
C30 C 0.8679(3) 0.42966(19) 0.2318(2) 0.0871(7) Uani 1 1 d . . .
H30A H 0.8631 0.4490 0.1601 0.131 Uiso 1 1 calc R . .
H30B H 0.8150 0.3468 0.2359 0.131 Uiso 1 1 calc R . .
H30C H 0.9666 0.4491 0.2592 0.131 Uiso 1 1 calc R . .
C31 C 0.6456(2) 0.46650(19) 0.2592(2) 0.0844(7) Uani 1 1 d . . .
H31A H 0.6096 0.5161 0.2971 0.127 Uiso 1 1 calc R . .
H31B H 0.5936 0.3855 0.2719 0.127 Uiso 1 1 calc R . .
H31C H 0.6331 0.4769 0.1858 0.127 Uiso 1 1 calc R . .
C32 C 0.8291(3) 0.49006(19) 0.41118(16) 0.0764(6) Uani 1 1 d . . .
H32A H 0.9308 0.5179 0.4326 0.115 Uiso 1 1 calc R . .
H32B H 0.7848 0.4091 0.4272 0.115 Uiso 1 1 calc R . .
H32C H 0.7883 0.5371 0.4477 0.115 Uiso 1 1 calc R . .
N1 N 1.15500(15) 0.97311(12) 0.37364(11) 0.0506(4) Uani 1 1 d . . .
H1 H 1.1885 0.9980 0.4375 0.061 Uiso 1 1 calc R . .
O1 O 1.44990(16) 1.16608(12) 0.27349(12) 0.0777(5) Uani 1 1 d . . .
O2 O 1.45627(14) 1.01926(14) 0.36740(13) 0.0825(5) Uani 1 1 d . . .
O3 O 0.90836(14) 0.89179(11) 0.11901(9) 0.0575(3) Uani 1 1 d . . .
O4 O 0.91839(12) 0.71491(10) 0.08127(8) 0.0478(3) Uani 1 1 d . . .
O5 O 1.09662(14) 0.65386(11) 0.31390(12) 0.0659(4) Uani 1 1 d . . .
O6 O 0.86380(11) 0.62523(9) 0.27179(9) 0.0445(3) 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'
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
C2 C1 C10 119.40(15) . . ?
C2 C1 C11 120.10(15) . . ?
C10 C1 C11 120.49(14) . . ?
C1 C2 C3 121.53(17) . . ?
C4 C3 C2 120.22(18) . . ?
C3 C4 C5 120.74(17) . . ?
C4 C5 C6 121.63(19) . . ?
C4 C5 C10 119.45(17) . . ?
C6 C5 C10 118.92(19) . . ?
C7 C6 C5 121.4(2) . . ?
C6 C7 C8 119.7(2) . . ?
C9 C8 C7 121.1(2) . . ?
C8 C9 C10 121.2(2) . . ?
C9 C10 C1 123.69(16) . . ?
C9 C10 C5 117.66(16) . . ?
C1 C10 C5 118.64(16) . . ?
N1 C11 C1 111.56(13) . . ?
N1 C11 C12 103.36(12) . . ?
C1 C11 C12 117.22(13) . . ?
C28 C12 C23 111.95(12) . . ?
C28 C12 C13 110.70(12) . . ?
C23 C12 C13 109.11(12) . . ?
C28 C12 C11 111.36(12) . . ?
C23 C12 C11 110.52(12) . . ?
C13 C12 C11 102.82(11) . . ?
C17 C13 C14 116.32(13) . . ?
C17 C13 C12 117.82(13) . . ?
C14 C13 C12 103.01(12) . . ?
N1 C14 C15 113.44(14) . . ?
N1 C14 C13 100.55(12) . . ?
C15 C14 C13 113.70(14) . . ?
O1 C15 O2 123.75(18) . . ?
O1 C15 C14 123.31(19) . . ?
O2 C15 C14 112.92(15) . . ?
C18 C17 C22 118.06(17) . . ?
C18 C17 C13 122.85(16) . . ?
C22 C17 C13 119.05(16) . . ?
C17 C18 C19 120.8(2) . . ?
C20 C19 C18 120.5(2) . . ?
C19 C20 C21 119.6(2) . . ?
C20 C21 C22 120.4(2) . . ?
C21 C22 C17 120.7(2) . . ?
O3 C23 O4 125.42(15) . . ?
O3 C23 C12 122.93(14) . . ?
O4 C23 C12 111.48(13) . . ?
O4 C24 C25 109.64(15) . . ?
O4 C24 C26 101.78(15) . . ?
C25 C24 C26 110.96(19) . . ?
O4 C24 C27 109.72(16) . . ?
C25 C24 C27 112.45(19) . . ?
C26 C24 C27 111.8(2) . . ?
O5 C28 O6 125.86(15) . . ?
O5 C28 C12 123.83(15) . . ?
O6 C28 C12 110.26(13) . . ?
O6 C29 C31 101.66(14) . . ?
O6 C29 C32 109.22(15) . . ?
C31 C29 C32 111.49(18) . . ?
O6 C29 C30 109.73(15) . . ?
C31 C29 C30 111.48(19) . . ?
C32 C29 C30 112.69(19) . . ?
C14 N1 C11 104.87(12) . . ?
C15 O2 C16 117.33(17) . . ?
C23 O4 C24 121.51(13) . . ?
C28 O6 C29 122.38(13) . . ?
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 C2 1.363(2) . ?
C1 C10 1.427(2) . ?
C1 C11 1.521(2) . ?
C2 C3 1.405(3) . ?
C3 C4 1.354(3) . ?
C4 C5 1.405(3) . ?
C5 C6 1.414(3) . ?
C5 C10 1.425(2) . ?
C6 C7 1.351(3) . ?
C7 C8 1.391(4) . ?
C8 C9 1.359(3) . ?
C9 C10 1.409(3) . ?
C11 N1 1.466(2) . ?
C11 C12 1.588(2) . ?
C12 C28 1.531(2) . ?
C12 C23 1.533(2) . ?
C12 C13 1.566(2) . ?
C13 C17 1.516(2) . ?
C13 C14 1.528(2) . ?
C14 N1 1.455(2) . ?
C14 C15 1.510(2) . ?
C15 O1 1.193(2) . ?
C15 O2 1.312(2) . ?
C16 O2 1.447(2) . ?
C17 C18 1.381(2) . ?
C17 C22 1.385(2) . ?
C18 C19 1.389(3) . ?
C19 C20 1.359(3) . ?
C20 C21 1.372(3) . ?
C21 C22 1.384(3) . ?
C23 O3 1.2034(19) . ?
C23 O4 1.3243(19) . ?
C24 O4 1.485(2) . ?
C24 C25 1.511(3) . ?
C24 C26 1.515(3) . ?
C24 C27 1.520(3) . ?
C28 O5 1.1987(19) . ?
C28 O6 1.3250(19) . ?
C29 O6 1.4804(19) . ?
C29 C31 1.508(3) . ?
C29 C32 1.507(3) . ?
C29 C30 1.517(3) . ?
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
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C10 C1 C2 C3 0.1(3) . . . . ?
C11 C1 C2 C3 179.21(17) . . . . ?
C1 C2 C3 C4 0.4(3) . . . . ?
C2 C3 C4 C5 -0.1(3) . . . . ?
C3 C4 C5 C6 179.1(2) . . . . ?
C3 C4 C5 C10 -0.8(3) . . . . ?
C4 C5 C6 C7 -180.0(2) . . . . ?
C10 C5 C6 C7 -0.1(4) . . . . ?
C5 C6 C7 C8 -0.8(4) . . . . ?
C6 C7 C8 C9 1.4(4) . . . . ?
C7 C8 C9 C10 -1.0(4) . . . . ?
C8 C9 C10 C1 179.1(2) . . . . ?
C8 C9 C10 C5 0.0(3) . . . . ?
C2 C1 C10 C9 -179.98(18) . . . . ?
C11 C1 C10 C9 0.9(3) . . . . ?
C2 C1 C10 C5 -0.9(3) . . . . ?
C11 C1 C10 C5 179.94(15) . . . . ?
C4 C5 C10 C9 -179.61(18) . . . . ?
C6 C5 C10 C9 0.5(3) . . . . ?
C4 C5 C10 C1 1.3(3) . . . . ?
C6 C5 C10 C1 -178.57(18) . . . . ?
C2 C1 C11 N1 -25.4(2) . . . . ?
C10 C1 C11 N1 153.76(15) . . . . ?
C2 C1 C11 C12 93.50(19) . . . . ?
C10 C1 C11 C12 -87.38(19) . . . . ?
N1 C11 C12 C28 107.29(14) . . . . ?
C1 C11 C12 C28 -15.86(19) . . . . ?
N1 C11 C12 C23 -127.61(13) . . . . ?
C1 C11 C12 C23 109.23(15) . . . . ?
N1 C11 C12 C13 -11.28(15) . . . . ?
C1 C11 C12 C13 -134.43(14) . . . . ?
C28 C12 C13 C17 92.93(16) . . . . ?
C23 C12 C13 C17 -30.69(18) . . . . ?
C11 C12 C13 C17 -148.03(14) . . . . ?
C28 C12 C13 C14 -137.53(13) . . . . ?
C23 C12 C13 C14 98.84(14) . . . . ?
C11 C12 C13 C14 -18.50(15) . . . . ?
C17 C13 C14 N1 172.56(13) . . . . ?
C12 C13 C14 N1 42.12(15) . . . . ?
C17 C13 C14 C15 -65.86(19) . . . . ?
C12 C13 C14 C15 163.70(14) . . . . ?
N1 C14 C15 O1 -122.75(19) . . . . ?
C13 C14 C15 O1 123.14(19) . . . . ?
N1 C14 C15 O2 58.5(2) . . . . ?
C13 C14 C15 O2 -55.6(2) . . . . ?
C14 C13 C17 C18 -27.1(2) . . . . ?
C12 C13 C17 C18 95.93(19) . . . . ?
C14 C13 C17 C22 150.74(15) . . . . ?
C12 C13 C17 C22 -86.23(19) . . . . ?
C22 C17 C18 C19 -1.1(3) . . . . ?
C13 C17 C18 C19 176.73(18) . . . . ?
C17 C18 C19 C20 -0.2(3) . . . . ?
C18 C19 C20 C21 0.9(4) . . . . ?
C19 C20 C21 C22 -0.3(3) . . . . ?
C20 C21 C22 C17 -1.1(3) . . . . ?
C18 C17 C22 C21 1.8(3) . . . . ?
C13 C17 C22 C21 -176.19(17) . . . . ?
C28 C12 C23 O3 152.86(15) . . . . ?
C13 C12 C23 O3 -84.26(18) . . . . ?
C11 C12 C23 O3 28.1(2) . . . . ?
C28 C12 C23 O4 -31.68(18) . . . . ?
C13 C12 C23 O4 91.21(15) . . . . ?
C11 C12 C23 O4 -156.43(12) . . . . ?
C23 C12 C28 O5 136.51(17) . . . . ?
C13 C12 C28 O5 14.5(2) . . . . ?
C11 C12 C28 O5 -99.20(19) . . . . ?
C23 C12 C28 O6 -46.08(17) . . . . ?
C13 C12 C28 O6 -168.06(12) . . . . ?
C11 C12 C28 O6 78.21(15) . . . . ?
C15 C14 N1 C11 -173.39(14) . . . . ?
C13 C14 N1 C11 -51.62(16) . . . . ?
C1 C11 N1 C14 166.03(13) . . . . ?
C12 C11 N1 C14 39.21(16) . . . . ?
O1 C15 O2 C16 0.7(3) . . . . ?
C14 C15 O2 C16 179.37(18) . . . . ?
O3 C23 O4 C24 -4.6(2) . . . . ?
C12 C23 O4 C24 -179.88(13) . . . . ?
C25 C24 O4 C23 66.9(2) . . . . ?
C26 C24 O4 C23 -175.60(18) . . . . ?
C27 C24 O4 C23 -57.1(2) . . . . ?
O5 C28 O6 C29 -5.7(3) . . . . ?
C12 C28 O6 C29 176.99(13) . . . . ?
C31 C29 O6 C28 -172.16(16) . . . . ?
C32 C29 O6 C28 69.9(2) . . . . ?
C30 C29 O6 C28 -54.0(2) . . . . ?
