# Electronic Supplementary Material (ESI) for Journal of Materials Chemistry C.
# This journal is © The Royal Society of Chemistry 2016

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_160115a
_database_code_depnum_ccdc_archive 'CCDC 1457202'
_audit_update_record             
;
2016-03-03 deposited with the CCDC.
2016-04-20 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C32 H22 O'
_chemical_formula_sum            'C32 H22 O'
_chemical_formula_weight         422.49

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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_shelx_space_group_comment       
; 
The symmetry employed for this shelxl refinement is uniquely defined 
by the following loop, which should always be used as a source of 
symmetry information in preference to the above space-group names. 
They are only intended as comments. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   5.9071(5)
_cell_length_b                   8.9508(8)
_cell_length_c                   20.8754(13)
_cell_angle_alpha                99.023(6)
_cell_angle_beta                 96.445(6)
_cell_angle_gamma                95.404(7)
_cell_volume                     1076.17(15)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    2441
_cell_measurement_theta_min      3.7490
_cell_measurement_theta_max      28.3780

_exptl_crystal_description       needle
_exptl_crystal_colour            colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.304
_exptl_crystal_F_000             444
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.400
_exptl_crystal_size_mid          0.080
_exptl_crystal_size_min          0.060
_exptl_absorpt_coefficient_mu    0.077
_shelx_estimated_absorpt_T_min   0.970
_shelx_estimated_absorpt_T_max   0.995
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.69952
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
; 
Olex2 1.2 
(compiled 2015.09.30 svn.r3233 for OlexSys, GUI svn.r5103) 
;
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, AtlasS2'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean 5.3127
_diffrn_reflns_number            7071
_diffrn_reflns_av_unetI/netI     0.0635
_diffrn_reflns_av_R_equivalents  0.0295
_diffrn_reflns_limit_h_min       -7
_diffrn_reflns_limit_h_max       6
_diffrn_reflns_limit_k_min       -8
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_theta_min         3.304
_diffrn_reflns_theta_max         25.250
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             3876
_reflns_number_gt                2843
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
; 
 Reflections were merged by SHELXL according to the crystal 
 class for the calculation of statistics and refinement. 
  
 _reflns_Friedel_fraction is defined as the number of unique 
 Friedel pairs measured divided by the number that would be 
 possible theoretically, ignoring centric projections and 
 systematic absences. 
;

_computing_data_collection       'CrysAlisPro 1.171.38.41k (Rigaku OD, 2015)'
_computing_cell_refinement       'CrysAlisPro 1.171.38.41k (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.41k (Rigaku OD, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0386P)²+0.3984P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         3876
_refine_ls_number_parameters     298
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0740
_refine_ls_R_factor_gt           0.0493
_refine_ls_wR_factor_ref         0.1181
_refine_ls_wR_factor_gt          0.1062
_refine_ls_goodness_of_fit_ref   1.052
_refine_ls_restrained_S_all      1.052
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.3582(3) 0.5745(3) 0.08262(9) 0.0180(5) Uani 1 1 d . . . . .
C2 C 0.2904(4) 0.6507(3) 0.03184(10) 0.0209(5) Uani 1 1 d . . . . .
H2 H 0.1400 0.6285 0.0088 0.025 Uiso 1 1 calc R U . . .
C3 C 0.4461(4) 0.7596(3) 0.01549(10) 0.0210(5) Uani 1 1 d . . . . .
H3 H 0.4022 0.8135 -0.0188 0.025 Uiso 1 1 calc R U . . .
C4 C 0.6655(4) 0.7900(3) 0.04909(10) 0.0219(5) Uani 1 1 d . . . . .
H4 H 0.7728 0.8631 0.0371 0.026 Uiso 1 1 calc R U . . .
C5 C 0.7296(3) 0.7145(3) 0.10009(9) 0.0188(5) Uani 1 1 d . . . . .
H5 H 0.8815 0.7353 0.1223 0.023 Uiso 1 1 calc R U . . .
C6 C 0.5741(3) 0.6079(2) 0.11943(9) 0.0167(5) Uani 1 1 d . . . . .
C7 C 0.6188(3) 0.5222(3) 0.17405(9) 0.0158(5) Uani 1 1 d . . . . .
C8 C 0.5077(3) 0.3631(3) 0.15577(9) 0.0171(5) Uani 1 1 d . . . . .
C9 C 0.6031(4) 0.2343(3) 0.17209(9) 0.0192(5) Uani 1 1 d . . . . .
H9 H 0.7523 0.2455 0.1958 0.023 Uiso 1 1 calc R U . . .
C10 C 0.4819(4) 0.0914(3) 0.15401(10) 0.0238(5) Uani 1 1 d . . . . .
H10 H 0.5499 0.0046 0.1643 0.029 Uiso 1 1 calc R U . . .
C11 C 0.2606(4) 0.0738(3) 0.12076(10) 0.0260(5) Uani 1 1 d . . . . .
H11 H 0.1752 -0.0241 0.1104 0.031 Uiso 1 1 calc R U . . .
C12 C 0.1648(4) 0.1993(3) 0.10271(10) 0.0224(5) Uani 1 1 d . . . . .
H12 H 0.0141 0.1882 0.0799 0.027 Uiso 1 1 calc R U . . .
C13 C 0.2924(3) 0.3405(3) 0.11858(9) 0.0187(5) Uani 1 1 d . . . . .
C14 C 0.7207(3) 0.5829(2) 0.23513(9) 0.0154(5) Uani 1 1 d . . . . .
C15 C 0.8157(3) 0.7469(3) 0.25459(9) 0.0155(5) Uani 1 1 d . . . . .
C16 C 1.0322(3) 0.8061(3) 0.24429(10) 0.0203(5) Uani 1 1 d . . . . .
H16 H 1.1288 0.7409 0.2229 0.024 Uiso 1 1 calc R U . . .
C17 C 1.1092(4) 0.9596(3) 0.26484(10) 0.0244(5) Uani 1 1 d . . . . .
H17 H 1.2572 0.9987 0.2573 0.029 Uiso 1 1 calc R U . . .
C18 C 0.9709(4) 1.0552(3) 0.29619(10) 0.0250(5) Uani 1 1 d . . . . .
H18 H 1.0225 1.1605 0.3093 0.030 Uiso 1 1 calc R U . . .
C19 C 0.7574(4) 0.9979(3) 0.30853(10) 0.0239(5) Uani 1 1 d . . . . .
H19 H 0.6632 1.0630 0.3310 0.029 Uiso 1 1 calc R U . . .
C20 C 0.6823(3) 0.8450(3) 0.28794(10) 0.0197(5) Uani 1 1 d . . . . .
H20 H 0.5360 0.8059 0.2968 0.024 Uiso 1 1 calc R U . . .
C21 C 0.7146(3) 0.5015(2) 0.29257(9) 0.0151(5) Uani 1 1 d . . . . .
C22 C 0.9092(3) 0.5108(2) 0.33831(9) 0.0170(5) Uani 1 1 d . . . . .
H22 H 1.0486 0.5644 0.3314 0.020 Uiso 1 1 calc R U . . .
C23 C 0.9027(3) 0.4433(2) 0.39357(9) 0.0168(5) Uani 1 1 d . . . . .
H23 H 1.0385 0.4494 0.4234 0.020 Uiso 1 1 calc R U . . .
C24 C 0.7003(3) 0.3666(2) 0.40617(9) 0.0158(5) Uani 1 1 d . . . . .
C25 C 0.5042(3) 0.3613(2) 0.36126(9) 0.0164(5) Uani 1 1 d . . . . .
H25 H 0.3631 0.3116 0.3691 0.020 Uiso 1 1 calc R U . . .
C26 C 0.5114(3) 0.4270(2) 0.30560(9) 0.0169(5) Uani 1 1 d . . . . .
H26 H 0.3756 0.4211 0.2758 0.020 Uiso 1 1 calc R U . . .
C27 C 0.6900(3) 0.2935(2) 0.46525(9) 0.0155(5) Uani 1 1 d . . . . .
C28 C 0.8662(3) 0.2120(2) 0.48660(10) 0.0178(5) Uani 1 1 d . . . . .
H28 H 0.9951 0.2042 0.4634 0.021 Uiso 1 1 calc R U . . .
C29 C 0.8552(3) 0.1427(3) 0.54107(10) 0.0199(5) Uani 1 1 d . . . . .
H29 H 0.9762 0.0876 0.5549 0.024 Uiso 1 1 calc R U . . .
C30 C 0.6686(3) 0.1534(3) 0.57539(10) 0.0213(5) Uani 1 1 d . . . . .
H30 H 0.6606 0.1048 0.6125 0.026 Uiso 1 1 calc R U . . .
C31 C 0.4930(3) 0.2352(3) 0.55539(10) 0.0215(5) Uani 1 1 d . . . . .
H31 H 0.3655 0.2438 0.5791 0.026 Uiso 1 1 calc R U . . .
C32 C 0.5042(3) 0.3041(3) 0.50079(9) 0.0188(5) Uani 1 1 d . . . . .
H32 H 0.3832 0.3595 0.4873 0.023 Uiso 1 1 calc R U . . .
O1 O 0.1988(2) 0.46208(18) 0.09569(7) 0.0210(4) Uani 1 1 d . . . . .


_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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 1.390(3) . ?
C1 O1 1.393(3) . ?
C1 C6 1.394(3) . ?
C2 C3 1.385(3) . ?
C2 H2 0.9500 . ?
C3 C4 1.384(3) . ?
C3 H3 0.9500 . ?
C4 C5 1.385(3) . ?
C4 H4 0.9500 . ?
C5 C6 1.398(3) . ?
C5 H5 0.9500 . ?
C6 C7 1.484(3) . ?
C7 C14 1.354(3) . ?
C7 C8 1.484(3) . ?
C8 C13 1.394(3) . ?
C8 C9 1.401(3) . ?
C9 C10 1.381(3) . ?
C9 H9 0.9500 . ?
C10 C11 1.392(3) . ?
C10 H10 0.9500 . ?
C11 C12 1.389(3) . ?
C11 H11 0.9500 . ?
C12 C13 1.382(3) . ?
C12 H12 0.9500 . ?
C13 O1 1.391(3) . ?
C14 C15 1.497(3) . ?
C14 C21 1.500(3) . ?
C15 C16 1.390(3) . ?
C15 C20 1.392(3) . ?
C16 C17 1.390(3) . ?
C16 H16 0.9500 . ?
C17 C18 1.380(3) . ?
C17 H17 0.9500 . ?
C18 C19 1.383(3) . ?
C18 H18 0.9500 . ?
C19 C20 1.384(3) . ?
C19 H19 0.9500 . ?
C20 H20 0.9500 . ?
C21 C26 1.392(3) . ?
C21 C22 1.397(3) . ?
C22 C23 1.386(3) . ?
C22 H22 0.9500 . ?
C23 C24 1.393(3) . ?
C23 H23 0.9500 . ?
C24 C25 1.398(3) . ?
C24 C27 1.489(3) . ?
C25 C26 1.385(3) . ?
C25 H25 0.9500 . ?
C26 H26 0.9500 . ?
C27 C32 1.395(3) . ?
C27 C28 1.398(3) . ?
C28 C29 1.383(3) . ?
C28 H28 0.9500 . ?
C29 C30 1.383(3) . ?
C29 H29 0.9500 . ?
C30 C31 1.389(3) . ?
C30 H30 0.9500 . ?
C31 C32 1.383(3) . ?
C31 H31 0.9500 . ?
C32 H32 0.9500 . ?

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 O1 116.78(18) . . ?
C2 C1 C6 122.4(2) . . ?
O1 C1 C6 120.80(18) . . ?
C3 C2 C1 118.85(19) . . ?
C3 C2 H2 120.6 . . ?
C1 C2 H2 120.6 . . ?
C4 C3 C2 120.0(2) . . ?
C4 C3 H3 120.0 . . ?
C2 C3 H3 120.0 . . ?
C3 C4 C5 120.4(2) . . ?
C3 C4 H4 119.8 . . ?
C5 C4 H4 119.8 . . ?
C4 C5 C6 121.01(19) . . ?
C4 C5 H5 119.5 . . ?
C6 C5 H5 119.5 . . ?
C1 C6 C5 117.11(19) . . ?
C1 C6 C7 116.44(19) . . ?
C5 C6 C7 126.42(18) . . ?
C14 C7 C8 123.36(19) . . ?
C14 C7 C6 125.5(2) . . ?
C8 C7 C6 110.66(17) . . ?
C13 C8 C9 117.7(2) . . ?
C13 C8 C7 116.99(19) . . ?
C9 C8 C7 125.33(19) . . ?
C10 C9 C8 120.6(2) . . ?
C10 C9 H9 119.7 . . ?
C8 C9 H9 119.7 . . ?
C9 C10 C11 120.4(2) . . ?
C9 C10 H10 119.8 . . ?
C11 C10 H10 119.8 . . ?
C12 C11 C10 120.0(2) . . ?
C12 C11 H11 120.0 . . ?
C10 C11 H11 120.0 . . ?
C13 C12 C11 118.8(2) . . ?
C13 C12 H12 120.6 . . ?
C11 C12 H12 120.6 . . ?
C12 C13 O1 117.53(18) . . ?
C12 C13 C8 122.3(2) . . ?
O1 C13 C8 120.2(2) . . ?
C7 C14 C15 123.08(19) . . ?
C7 C14 C21 123.5(2) . . ?
C15 C14 C21 112.61(17) . . ?
C16 C15 C20 117.9(2) . . ?
C16 C15 C14 124.36(18) . . ?
C20 C15 C14 117.63(18) . . ?
C17 C16 C15 120.78(19) . . ?
C17 C16 H16 119.6 . . ?
C15 C16 H16 119.6 . . ?
C18 C17 C16 120.1(2) . . ?
C18 C17 H17 119.9 . . ?
C16 C17 H17 119.9 . . ?
C17 C18 C19 120.1(2) . . ?
C17 C18 H18 120.0 . . ?
C19 C18 H18 120.0 . . ?
C18 C19 C20 119.4(2) . . ?
C18 C19 H19 120.3 . . ?
C20 C19 H19 120.3 . . ?
C19 C20 C15 121.6(2) . . ?
C19 C20 H20 119.2 . . ?
C15 C20 H20 119.2 . . ?
C26 C21 C22 117.70(18) . . ?
C26 C21 C14 121.47(17) . . ?
C22 C21 C14 120.55(18) . . ?
C23 C22 C21 121.21(19) . . ?
C23 C22 H22 119.4 . . ?
C21 C22 H22 119.4 . . ?
C22 C23 C24 121.13(18) . . ?
C22 C23 H23 119.4 . . ?
C24 C23 H23 119.4 . . ?
C23 C24 C25 117.53(18) . . ?
C23 C24 C27 121.88(17) . . ?
C25 C24 C27 120.59(18) . . ?
C26 C25 C24 121.33(19) . . ?
C26 C25 H25 119.3 . . ?
C24 C25 H25 119.3 . . ?
C25 C26 C21 121.06(18) . . ?
C25 C26 H26 119.5 . . ?
C21 C26 H26 119.5 . . ?
C32 C27 C28 118.11(18) . . ?
C32 C27 C24 120.96(17) . . ?
C28 C27 C24 120.93(17) . . ?
C29 C28 C27 120.88(18) . . ?
C29 C28 H28 119.6 . . ?
C27 C28 H28 119.6 . . ?
C28 C29 C30 120.18(19) . . ?
C28 C29 H29 119.9 . . ?
C30 C29 H29 119.9 . . ?
C29 C30 C31 119.8(2) . . ?
C29 C30 H30 120.1 . . ?
C31 C30 H30 120.1 . . ?
C32 C31 C30 119.87(18) . . ?
C32 C31 H31 120.1 . . ?
C30 C31 H31 120.1 . . ?
C31 C32 C27 121.14(18) . . ?
C31 C32 H32 119.4 . . ?
C27 C32 H32 119.4 . . ?
C13 O1 C1 114.93(15) . . ?

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
O1 C1 C2 C3 -177.68(18) . . . . ?
C6 C1 C2 C3 2.6(3) . . . . ?
C1 C2 C3 C4 0.6(3) . . . . ?
C2 C3 C4 C5 -1.4(3) . . . . ?
C3 C4 C5 C6 -0.9(3) . . . . ?
C2 C1 C6 C5 -4.8(3) . . . . ?
O1 C1 C6 C5 175.48(17) . . . . ?
C2 C1 C6 C7 177.30(18) . . . . ?
O1 C1 C6 C7 -2.4(3) . . . . ?
C4 C5 C6 C1 4.0(3) . . . . ?
C4 C5 C6 C7 -178.42(18) . . . . ?
C1 C6 C7 C14 -135.5(2) . . . . ?
C5 C6 C7 C14 46.9(3) . . . . ?
C1 C6 C7 C8 36.7(2) . . . . ?
C5 C6 C7 C8 -141.0(2) . . . . ?
C14 C7 C8 C13 134.1(2) . . . . ?
C6 C7 C8 C13 -38.2(2) . . . . ?
C14 C7 C8 C9 -46.8(3) . . . . ?
C6 C7 C8 C9 140.85(19) . . . . ?
C13 C8 C9 C10 -2.7(3) . . . . ?
C7 C8 C9 C10 178.27(18) . . . . ?
C8 C9 C10 C11 -1.7(3) . . . . ?
C9 C10 C11 C12 3.2(3) . . . . ?
C10 C11 C12 C13 -0.2(3) . . . . ?
C11 C12 C13 O1 175.35(18) . . . . ?
C11 C12 C13 C8 -4.3(3) . . . . ?
C9 C8 C13 C12 5.8(3) . . . . ?
C7 C8 C13 C12 -175.09(17) . . . . ?
C9 C8 C13 O1 -173.91(16) . . . . ?
C7 C8 C13 O1 5.2(3) . . . . ?
C8 C7 C14 C15 -174.92(17) . . . . ?
C6 C7 C14 C15 -3.8(3) . . . . ?
C8 C7 C14 C21 -5.7(3) . . . . ?
C6 C7 C14 C21 165.41(17) . . . . ?
C7 C14 C15 C16 -83.5(2) . . . . ?
C21 C14 C15 C16 106.3(2) . . . . ?
C7 C14 C15 C20 99.7(2) . . . . ?
C21 C14 C15 C20 -70.6(2) . . . . ?
C20 C15 C16 C17 -2.1(3) . . . . ?
C14 C15 C16 C17 -178.93(19) . . . . ?
C15 C16 C17 C18 0.4(3) . . . . ?
C16 C17 C18 C19 1.4(3) . . . . ?
C17 C18 C19 C20 -1.4(3) . . . . ?
C18 C19 C20 C15 -0.4(3) . . . . ?
C16 C15 C20 C19 2.2(3) . . . . ?
C14 C15 C20 C19 179.20(19) . . . . ?
C7 C14 C21 C26 -46.7(3) . . . . ?
C15 C14 C21 C26 123.5(2) . . . . ?
C7 C14 C21 C22 139.6(2) . . . . ?
C15 C14 C21 C22 -50.2(2) . . . . ?
C26 C21 C22 C23 2.4(3) . . . . ?
C14 C21 C22 C23 176.32(18) . . . . ?
C21 C22 C23 C24 -1.4(3) . . . . ?
C22 C23 C24 C25 -0.4(3) . . . . ?
C22 C23 C24 C27 -179.98(19) . . . . ?
C23 C24 C25 C26 1.3(3) . . . . ?
C27 C24 C25 C26 -179.14(19) . . . . ?
C24 C25 C26 C21 -0.3(3) . . . . ?
C22 C21 C26 C25 -1.5(3) . . . . ?
C14 C21 C26 C25 -175.40(18) . . . . ?
C23 C24 C27 C32 138.6(2) . . . . ?
C25 C24 C27 C32 -40.9(3) . . . . ?
C23 C24 C27 C28 -41.5(3) . . . . ?
C25 C24 C27 C28 138.9(2) . . . . ?
C32 C27 C28 C29 0.6(3) . . . . ?
C24 C27 C28 C29 -179.3(2) . . . . ?
C27 C28 C29 C30 -0.1(3) . . . . ?
C28 C29 C30 C31 -0.6(3) . . . . ?
C29 C30 C31 C32 0.8(3) . . . . ?
C30 C31 C32 C27 -0.2(3) . . . . ?
C28 C27 C32 C31 -0.4(3) . . . . ?
C24 C27 C32 C31 179.4(2) . . . . ?
C12 C13 O1 C1 -148.79(18) . . . . ?
C8 C13 O1 C1 30.9(2) . . . . ?
C2 C1 O1 C13 147.76(18) . . . . ?
C6 C1 O1 C13 -32.5(2) . . . . ?

_refine_diff_density_max         0.172
_refine_diff_density_min         -0.241
_refine_diff_density_rms         0.050



