# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2020

####################################################################### 
# 
# 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_ydkr
_database_code_depnum_ccdc_archive 'CCDC 2032807'
loop_
_audit_author_name
_audit_author_address
'Junki Ochi'
;Kyoto University
Japan
;
_audit_update_record             
;
2020-09-19 deposited with the CCDC.	2020-12-07 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         'C14 H18 B10'
_chemical_formula_sum            'C14 H18 B10'
_chemical_formula_weight         294.38

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'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_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+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   11.0157(10)
_cell_length_b                   14.0510(10)
_cell_length_c                   20.5785(15)
_cell_angle_alpha                90
_cell_angle_beta                 92.719(7)
_cell_angle_gamma                90
_cell_volume                     3181.6(4)
_cell_formula_units_Z            8
_cell_measurement_temperature    93(2)
_cell_measurement_reflns_used    21152
_cell_measurement_theta_min      3.51
_cell_measurement_theta_max      54.91

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.229
_exptl_crystal_F_000             1216
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.500
_exptl_crystal_size_mid          0.500
_exptl_crystal_size_min          0.300
_exptl_absorpt_coefficient_mu    0.060
_shelx_estimated_absorpt_T_min   0.971
_shelx_estimated_absorpt_T_max   0.982
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.5450
_exptl_absorpt_correction_T_max  0.9654
_exptl_absorpt_process_details   'ABSCOR (Rigaku, 1995)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      93(2)
_diffrn_radiation_wavelength     0.71075
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            29478
_diffrn_reflns_av_unetI/netI     0.0525
_diffrn_reflns_av_R_equivalents  0.0580
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         2.351
_diffrn_reflns_theta_max         27.455
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             7247
_reflns_number_gt                5830
_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       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_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)+(0.0621P)²+2.0484P] 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         7247
_refine_ls_number_parameters     433
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0880
_refine_ls_R_factor_gt           0.0662
_refine_ls_wR_factor_ref         0.1511
_refine_ls_wR_factor_gt          0.1424
_refine_ls_goodness_of_fit_ref   1.107
_refine_ls_restrained_S_all      1.107
_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 0.09539(16) 0.69831(13) 0.34743(9) 0.0162(4) Uani 1 1 d . . . A 2
C15 C 0.42556(17) 0.50666(13) 0.33966(9) 0.0173(4) Uani 1 1 d . . . B 1
C16 C 0.25417(16) 0.39252(13) 0.25079(9) 0.0165(4) Uani 1 1 d . . . B 1
C17 C 0.19577(17) 0.44292(13) 0.37274(9) 0.0164(4) Uani 1 1 d . . . B 1
H19 H 0.1560 0.5115 0.3539 0.020 Uiso 1 1 calc R U . B 1
C18 C 0.32102(16) 0.47160(13) 0.22923(9) 0.0156(4) Uani 1 1 d . . . B 1
C2 C 0.16345(17) 0.72927(13) 0.23315(9) 0.0165(4) Uani 1 1 d . . . A 2
C19 C 0.31040(17) 0.49267(14) 0.16255(9) 0.0191(4) Uani 1 1 d . . . B 1
H20 H 0.3507 0.5472 0.1469 0.023 Uiso 1 1 calc R U . B 1
C3 C 0.33432(16) 0.76553(13) 0.36977(8) 0.0154(4) Uani 1 1 d . . . A 2
H1 H 0.3691 0.6965 0.3508 0.019 Uiso 1 1 calc R U . A 2
C4 C 0.09138(17) 0.67520(13) 0.28052(9) 0.0161(4) Uani 1 1 d . . . A 2
C5 C 0.23771(17) 0.80862(13) 0.25031(9) 0.0167(4) Uani 1 1 d . . . A 2
C20 C 0.47770(18) 0.60078(14) 0.24709(9) 0.0203(4) Uani 1 1 d . . . B 1
H21 H 0.4647 0.6181 0.2027 0.024 Uiso 1 1 calc R U . B 1
C21 C 0.40654(17) 0.52812(13) 0.27287(9) 0.0162(4) Uani 1 1 d . . . B 1
C6 C 0.01805(18) 0.65093(14) 0.38909(10) 0.0202(4) Uani 1 1 d . . . A 2
H2 H 0.0212 0.6668 0.4340 0.024 Uiso 1 1 calc R U . A 2
C22 C 0.25418(17) 0.36514(13) 0.32182(9) 0.0169(4) Uani 1 1 d . . . B 1
C7 C 0.25863(17) 0.84010(13) 0.32017(9) 0.0164(4) Uani 1 1 d . . . A 2
C23 C 0.18637(17) 0.33651(14) 0.20626(10) 0.0205(4) Uani 1 1 d . . . B 1
H22 H 0.1425 0.2834 0.2214 0.025 Uiso 1 1 calc R U . B 1
C24 C 0.51567(18) 0.55551(14) 0.37696(9) 0.0206(4) Uani 1 1 d . . . B 1
H23 H 0.5279 0.5407 0.4218 0.025 Uiso 1 1 calc R U . B 1
C8 C 0.15396(18) 0.70552(14) 0.16681(9) 0.0213(4) Uani 1 1 d . . . A 2
H3 H 0.1076 0.6513 0.1536 0.026 Uiso 1 1 calc R U . A 2
C25 C 0.56644(18) 0.64784(14) 0.28487(10) 0.0226(4) Uani 1 1 d . . . B 1
H24 H 0.6135 0.6963 0.2660 0.027 Uiso 1 1 calc R U . B 1
C26 C 0.24301(18) 0.43653(15) 0.11864(9) 0.0219(4) Uani 1 1 d . . . B 1
H25 H 0.2386 0.4524 0.0737 0.026 Uiso 1 1 calc R U . B 1
C27 C 0.18206(18) 0.35715(14) 0.14057(10) 0.0227(4) Uani 1 1 d . . . B 1
H26 H 0.1377 0.3173 0.1106 0.027 Uiso 1 1 calc R U . B 1
C9 C 0.29411(18) 0.86129(14) 0.20280(10) 0.0216(4) Uani 1 1 d . . . A 2
H4 H 0.3431 0.9145 0.2153 0.026 Uiso 1 1 calc R U . A 2
C10 C -0.06465(19) 0.55735(15) 0.30083(11) 0.0250(5) Uani 1 1 d . . . A 2
H5 H -0.1185 0.5091 0.2847 0.030 Uiso 1 1 calc R U . A 2
C11 C 0.01114(18) 0.60279(14) 0.25913(10) 0.0219(4) Uani 1 1 d . . . A 2
H6 H 0.0089 0.5845 0.2146 0.026 Uiso 1 1 calc R U . A 2
C12 C -0.06240(18) 0.58193(14) 0.36635(11) 0.0236(4) Uani 1 1 d . . . A 2
H7 H -0.1154 0.5517 0.3950 0.028 Uiso 1 1 calc R U . A 2
C28 C 0.58693(18) 0.62460(14) 0.35000(10) 0.0225(4) Uani 1 1 d . . . B 1
H27 H 0.6490 0.6557 0.3756 0.027 Uiso 1 1 calc R U . B 1
C13 C 0.27955(19) 0.83685(16) 0.13758(10) 0.0257(5) Uani 1 1 d . . . A 2
H8 H 0.3170 0.8736 0.1053 0.031 Uiso 1 1 calc R U . A 2
C14 C 0.20962(19) 0.75817(16) 0.12016(10) 0.0261(5) Uani 1 1 d . . . A 2
H9 H 0.1999 0.7403 0.0757 0.031 Uiso 1 1 calc R U . A 2
B1 B 0.18038(19) 0.77769(15) 0.37560(10) 0.0143(4) Uani 1 1 d . . . A 2
B11 B 0.34994(19) 0.42901(15) 0.37261(10) 0.0156(4) Uani 1 1 d . . . B 1
B2 B 0.15110(19) 0.90046(15) 0.36197(10) 0.0166(4) Uani 1 1 d . . . A 2
H10 H 0.0627 0.9268 0.3396 0.020 Uiso 1 1 calc R U . A 2
B3 B 0.2337(2) 0.96524(15) 0.42375(11) 0.0193(4) Uani 1 1 d . . . A 2
H11 H 0.1993 1.0342 0.4430 0.023 Uiso 1 1 calc R U . A 2
B4 B 0.1643(2) 0.85395(15) 0.44238(10) 0.0179(4) Uani 1 1 d . . . A 2
H12 H 0.0841 0.8492 0.4737 0.021 Uiso 1 1 calc R U . A 2
B12 B 0.37336(19) 0.30559(15) 0.36100(10) 0.0164(4) Uani 1 1 d . . . B 1
H28 H 0.4540 0.2773 0.3360 0.020 Uiso 1 1 calc R U . B 1
B5 B 0.2812(2) 0.76562(15) 0.44521(10) 0.0177(4) Uani 1 1 d . . . A 2
H13 H 0.2785 0.7018 0.4777 0.021 Uiso 1 1 calc R U . A 2
B6 B 0.4074(2) 0.86684(15) 0.34763(10) 0.0180(4) Uani 1 1 d . . . A 2
H14 H 0.4866 0.8694 0.3155 0.022 Uiso 1 1 calc R U . A 2
B7 B 0.3921(2) 0.94505(16) 0.41424(11) 0.0202(5) Uani 1 1 d . . . A 2
H15 H 0.4619 1.0009 0.4268 0.024 Uiso 1 1 calc R U . A 2
B13 B 0.3864(2) 0.35589(15) 0.44035(10) 0.0179(4) Uani 1 1 d . . . B 1
H29 H 0.4759 0.3613 0.4683 0.021 Uiso 1 1 calc R U . B 1
B8 B 0.2913(2) 0.95544(15) 0.34450(11) 0.0179(4) Uani 1 1 d . . . A 2
H16 H 0.2948 1.0174 0.3104 0.022 Uiso 1 1 calc R U . A 2
B14 B 0.3105(2) 0.24444(16) 0.42678(11) 0.0193(4) Uani 1 1 d . . . B 1
H30 H 0.3500 0.1760 0.4461 0.023 Uiso 1 1 calc R U . B 1
B15 B 0.2283(2) 0.25111(15) 0.35011(10) 0.0182(4) Uani 1 1 d . . . B 1
H31 H 0.2135 0.1875 0.3179 0.022 Uiso 1 1 calc R U . B 1
B9 B 0.4214(2) 0.82174(16) 0.42832(10) 0.0196(4) Uani 1 1 d . . . A 2
H17 H 0.5104 0.7953 0.4498 0.024 Uiso 1 1 calc R U . A 2
B16 B 0.1152(2) 0.34138(16) 0.35555(11) 0.0190(4) Uani 1 1 d . . . B 1
H32 H 0.0265 0.3384 0.3267 0.023 Uiso 1 1 calc R U . B 1
B17 B 0.2731(2) 0.44555(16) 0.44588(10) 0.0201(5) Uani 1 1 d . . . B 1
H33 H 0.2873 0.5105 0.4768 0.024 Uiso 1 1 calc R U . B 1
B18 B 0.1276(2) 0.39013(16) 0.43557(10) 0.0211(5) Uani 1 1 d . . . B 1
H34 H 0.0464 0.4185 0.4600 0.025 Uiso 1 1 calc R U . B 1
B10 B 0.3138(2) 0.88204(16) 0.47524(11) 0.0205(5) Uani 1 1 d . . . A 2
H18 H 0.3319 0.8962 0.5284 0.025 Uiso 1 1 calc R U . A 2
B19 B 0.2485(2) 0.33062(17) 0.47891(11) 0.0218(5) Uani 1 1 d . . . B 1
H35 H 0.2471 0.3187 0.5327 0.026 Uiso 1 1 calc R U . B 1
B20 B 0.1497(2) 0.26594(16) 0.42287(11) 0.0210(5) Uani 1 1 d . . . B 1
H36 H 0.0831 0.2117 0.4392 0.025 Uiso 1 1 calc R U . B 1


_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 C6 1.405(3) . ?
C1 C4 1.413(3) . ?
C1 B1 1.551(3) . ?
C15 C24 1.405(3) . ?
C15 C21 1.413(3) . ?
C15 B11 1.548(3) . ?
C16 C23 1.397(3) . ?
C16 C18 1.416(3) . ?
C16 C22 1.512(3) . ?
C17 C22 1.664(3) . ?
C17 B17 1.694(3) . ?
C17 B18 1.697(3) . ?
C17 B16 1.709(3) . ?
C17 B11 1.710(3) . ?
C17 H19 1.1200 . ?
C18 C19 1.403(3) . ?
C18 C21 1.498(3) . ?
C2 C8 1.405(3) . ?
C2 C5 1.418(3) . ?
C2 C4 1.494(3) . ?
C19 C26 1.388(3) . ?
C19 H20 0.9500 . ?
C3 C7 1.660(2) . ?
C3 B5 1.685(3) . ?
C3 B9 1.699(3) . ?
C3 B6 1.708(3) . ?
C3 B1 1.714(3) . ?
C3 H1 1.1200 . ?
C4 C11 1.405(3) . ?
C5 C9 1.395(3) . ?
C5 C7 1.511(3) . ?
C20 C25 1.387(3) . ?
C20 C21 1.406(3) . ?
C20 H21 0.9500 . ?
C6 C12 1.380(3) . ?
C6 H2 0.9500 . ?
C22 B11 1.705(3) . ?
C22 B12 1.724(3) . ?
C22 B15 1.733(3) . ?
C22 B16 1.743(3) . ?
C7 B1 1.705(3) . ?
C7 B2 1.720(3) . ?
C7 B8 1.729(3) . ?
C7 B6 1.749(3) . ?
C23 C27 1.381(3) . ?
C23 H22 0.9500 . ?
C24 C28 1.381(3) . ?
C24 H23 0.9500 . ?
C8 C14 1.379(3) . ?
C8 H3 0.9500 . ?
C25 C28 1.388(3) . ?
C25 H24 0.9500 . ?
C26 C27 1.388(3) . ?
C26 H25 0.9500 . ?
C27 H26 0.9500 . ?
C9 C13 1.387(3) . ?
C9 H4 0.9500 . ?
C10 C11 1.382(3) . ?
C10 C12 1.391(3) . ?
C10 H5 0.9500 . ?
C11 H6 0.9500 . ?
C12 H7 0.9500 . ?
C28 H27 0.9500 . ?
C13 C14 1.385(3) . ?
C13 H8 0.9500 . ?
C14 H9 0.9500 . ?
B1 B4 1.758(3) . ?
B1 B2 1.775(3) . ?
B1 B5 1.778(3) . ?
B11 B13 1.763(3) . ?
B11 B12 1.771(3) . ?
B11 B17 1.779(3) . ?
B2 B3 1.778(3) . ?
B2 B4 1.779(3) . ?
B2 B8 1.779(3) . ?
B2 H10 1.1200 . ?
B3 B8 1.783(3) . ?
B3 B10 1.783(3) . ?
B3 B7 1.788(3) . ?
B3 B4 1.790(3) . ?
B3 H11 1.1200 . ?
B4 B5 1.787(3) . ?
B4 B10 1.794(3) . ?
B4 H12 1.1200 . ?
B12 B14 1.772(3) . ?
B12 B15 1.777(3) . ?
B12 B13 1.779(3) . ?
B12 H28 1.1200 . ?
B5 B10 1.779(3) . ?
B5 B9 1.783(3) . ?
B5 H13 1.1200 . ?
B6 B7 1.771(3) . ?
B6 B9 1.777(3) . ?
B6 B8 1.784(3) . ?
B6 H14 1.1200 . ?
B7 B8 1.778(3) . ?
B7 B9 1.783(3) . ?
B7 B10 1.791(3) . ?
B7 H15 1.1200 . ?
B13 B17 1.780(3) . ?
B13 B19 1.783(3) . ?
B13 B14 1.791(3) . ?
B13 H29 1.1200 . ?
B8 H16 1.1200 . ?
B14 B19 1.776(3) . ?
B14 B15 1.784(3) . ?
B14 B20 1.795(3) . ?
B14 H30 1.1200 . ?
B15 B20 1.777(3) . ?
B15 B16 1.785(3) . ?
B15 H31 1.1200 . ?
B9 B10 1.778(3) . ?
B9 H17 1.1200 . ?
B16 B20 1.771(3) . ?
B16 B18 1.783(3) . ?
B16 H32 1.1200 . ?
B17 B19 1.778(3) . ?
B17 B18 1.786(3) . ?
B17 H33 1.1200 . ?
B18 B19 1.776(3) . ?
B18 B20 1.783(3) . ?
B18 H34 1.1200 . ?
B10 H18 1.1200 . ?
B19 B20 1.795(3) . ?
B19 H35 1.1200 . ?
B20 H36 1.1200 . ?

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
C6 C1 C4 119.60(17) . . ?
C6 C1 B1 119.05(17) . . ?
C4 C1 B1 121.32(16) . . ?
C24 C15 C21 119.70(18) . . ?
C24 C15 B11 119.07(17) . . ?
C21 C15 B11 121.22(17) . . ?
C23 C16 C18 120.42(17) . . ?
C23 C16 C22 117.81(17) . . ?
C18 C16 C22 121.77(17) . . ?
C22 C17 B17 112.36(15) . . ?
C22 C17 B18 113.02(15) . . ?
B17 C17 B18 63.56(13) . . ?
C22 C17 B16 62.23(12) . . ?
B17 C17 B16 115.88(15) . . ?
B18 C17 B16 63.13(12) . . ?
C22 C17 B11 60.68(11) . . ?
B17 C17 B11 63.01(12) . . ?
B18 C17 B11 115.28(15) . . ?
B16 C17 B11 114.25(15) . . ?
C22 C17 H19 120.3 . . ?
B17 C17 H19 117.4 . . ?
B18 C17 H19 117.3 . . ?
B16 C17 H19 117.1 . . ?
B11 C17 H19 118.1 . . ?
C19 C18 C16 116.85(17) . . ?
C19 C18 C21 119.68(16) . . ?
C16 C18 C21 123.35(17) . . ?
C8 C2 C5 116.39(17) . . ?
C8 C2 C4 119.75(17) . . ?
C5 C2 C4 123.77(16) . . ?
C26 C19 C18 122.27(18) . . ?
C26 C19 H20 118.9 . . ?
C18 C19 H20 118.9 . . ?
C7 C3 B5 112.32(14) . . ?
C7 C3 B9 113.13(15) . . ?
B5 C3 B9 63.60(12) . . ?
C7 C3 B6 62.55(11) . . ?
B5 C3 B6 115.72(15) . . ?
B9 C3 B6 62.89(12) . . ?
C7 C3 B1 60.68(11) . . ?
B5 C3 B1 63.08(12) . . ?
B9 C3 B1 115.54(15) . . ?
B6 C3 B1 114.57(14) . . ?
C7 C3 H1 120.2 . . ?
B5 C3 H1 117.5 . . ?
B9 C3 H1 117.3 . . ?
B6 C3 H1 117.1 . . ?
B1 C3 H1 117.8 . . ?
C11 C4 C1 117.50(17) . . ?
C11 C4 C2 120.66(17) . . ?
C1 C4 C2 121.73(16) . . ?
C9 C5 C2 120.89(17) . . ?
C9 C5 C7 117.29(17) . . ?
C2 C5 C7 121.82(16) . . ?
C25 C20 C21 121.68(18) . . ?
C25 C20 H21 119.2 . . ?
C21 C20 H21 119.2 . . ?
C20 C21 C15 117.54(17) . . ?
C20 C21 C18 120.31(17) . . ?
C15 C21 C18 122.00(17) . . ?
C12 C6 C1 121.61(18) . . ?
C12 C6 H2 119.2 . . ?
C1 C6 H2 119.2 . . ?
C16 C22 C17 117.35(15) . . ?
C16 C22 B11 115.51(15) . . ?
C17 C22 B11 60.97(11) . . ?
C16 C22 B12 122.74(15) . . ?
C17 C22 B12 109.44(14) . . ?
B11 C22 B12 62.19(12) . . ?
C16 C22 B15 124.59(16) . . ?
C17 C22 B15 108.72(14) . . ?
B11 C22 B15 112.81(14) . . ?
B12 C22 B15 61.85(12) . . ?
C16 C22 B16 118.29(15) . . ?
C17 C22 B16 60.13(11) . . ?
B11 C22 B16 112.73(14) . . ?
B12 C22 B16 112.62(15) . . ?
B15 C22 B16 61.80(12) . . ?
C5 C7 C3 116.73(15) . . ?
C5 C7 B1 115.26(15) . . ?
C3 C7 B1 61.25(11) . . ?
C5 C7 B2 122.85(15) . . ?
C3 C7 B2 109.97(14) . . ?
B1 C7 B2 62.42(12) . . ?
C5 C7 B8 124.75(15) . . ?
C3 C7 B8 108.78(14) . . ?
B1 C7 B8 113.16(14) . . ?
B2 C7 B8 62.09(12) . . ?
C5 C7 B6 117.94(15) . . ?
C3 C7 B6 60.08(11) . . ?
B1 C7 B6 112.96(14) . . ?
B2 C7 B6 112.92(14) . . ?
B8 C7 B6 61.70(12) . . ?
C27 C23 C16 121.07(18) . . ?
C27 C23 H22 119.5 . . ?
C16 C23 H22 119.5 . . ?
C28 C24 C15 121.62(18) . . ?
C28 C24 H23 119.2 . . ?
C15 C24 H23 119.2 . . ?
C14 C8 C2 122.30(19) . . ?
C14 C8 H3 118.9 . . ?
C2 C8 H3 118.9 . . ?
C20 C25 C28 120.46(19) . . ?
C20 C25 H24 119.8 . . ?
C28 C25 H24 119.8 . . ?
C19 C26 C27 119.81(18) . . ?
C19 C26 H25 120.1 . . ?
C27 C26 H25 120.1 . . ?
C23 C27 C26 119.47(18) . . ?
C23 C27 H26 120.3 . . ?
C26 C27 H26 120.3 . . ?
C13 C9 C5 120.78(19) . . ?
C13 C9 H4 119.6 . . ?
C5 C9 H4 119.6 . . ?
C11 C10 C12 120.25(19) . . ?
C11 C10 H5 119.9 . . ?
C12 C10 H5 119.9 . . ?
C10 C11 C4 122.00(19) . . ?
C10 C11 H6 119.0 . . ?
C4 C11 H6 119.0 . . ?
C6 C12 C10 119.00(19) . . ?
C6 C12 H7 120.5 . . ?
C10 C12 H7 120.5 . . ?
C24 C28 C25 118.94(18) . . ?
C24 C28 H27 120.5 . . ?
C25 C28 H27 120.5 . . ?
C14 C13 C9 119.04(19) . . ?
C14 C13 H8 120.5 . . ?
C9 C13 H8 120.5 . . ?
C8 C14 C13 120.56(19) . . ?
C8 C14 H9 119.7 . . ?
C13 C14 H9 119.7 . . ?
C1 B1 C7 115.81(15) . . ?
C1 B1 C3 118.93(15) . . ?
C7 B1 C3 58.08(11) . . ?
C1 B1 B4 130.48(16) . . ?
C7 B1 B4 106.39(14) . . ?
C3 B1 B4 104.59(14) . . ?
C1 B1 B2 122.55(16) . . ?
C7 B1 B2 59.21(11) . . ?
C3 B1 B2 105.00(14) . . ?
B4 B1 B2 60.45(12) . . ?
C1 B1 B5 125.11(16) . . ?
C7 B1 B5 105.77(14) . . ?
C3 B1 B5 57.65(11) . . ?
B4 B1 B5 60.70(12) . . ?
B2 B1 B5 108.77(15) . . ?
C15 B11 C22 115.63(15) . . ?
C15 B11 C17 118.37(15) . . ?
C22 B11 C17 58.35(11) . . ?
C15 B11 B13 130.55(17) . . ?
C22 B11 B13 106.80(15) . . ?
C17 B11 B13 104.73(15) . . ?
C15 B11 B12 123.10(16) . . ?
C22 B11 B12 59.45(11) . . ?
C17 B11 B12 105.26(14) . . ?
B13 B11 B12 60.45(12) . . ?
C15 B11 B17 124.51(16) . . ?
C22 B11 B17 106.43(15) . . ?
C17 B11 B17 58.07(12) . . ?
B13 B11 B17 60.36(12) . . ?
B12 B11 B17 108.69(15) . . ?
C7 B2 B1 58.37(11) . . ?
C7 B2 B3 105.60(15) . . ?
B1 B2 B3 107.56(15) . . ?
C7 B2 B4 104.84(15) . . ?
B1 B2 B4 59.31(11) . . ?
B3 B2 B4 60.42(12) . . ?
C7 B2 B8 59.20(11) . . ?
B1 B2 B8 107.52(15) . . ?
B3 B2 B8 60.17(12) . . ?
B4 B2 B8 108.30(15) . . ?
C7 B2 H10 124.3 . . ?
B1 B2 H10 122.3 . . ?
B3 B2 H10 122.0 . . ?
B4 B2 H10 122.3 . . ?
B8 B2 H10 121.3 . . ?
B2 B3 B8 59.93(12) . . ?
B2 B3 B10 108.14(15) . . ?
B8 B3 B10 107.76(15) . . ?
B2 B3 B7 108.02(15) . . ?
B8 B3 B7 59.72(12) . . ?
B10 B3 B7 60.18(13) . . ?
B2 B3 B4 59.80(12) . . ?
B8 B3 B4 107.61(15) . . ?
B10 B3 B4 60.28(12) . . ?
B7 B3 B4 108.27(15) . . ?
B2 B3 H11 121.7 . . ?
B8 B3 H11 122.1 . . ?
B10 B3 H11 121.6 . . ?
B7 B3 H11 121.6 . . ?
B4 B3 H11 121.7 . . ?
B1 B4 B2 60.24(11) . . ?
B1 B4 B5 60.21(12) . . ?
B2 B4 B5 108.22(15) . . ?
B1 B4 B3 107.78(15) . . ?
B2 B4 B3 59.78(12) . . ?
B5 B4 B3 107.45(15) . . ?
B1 B4 B10 107.71(15) . . ?
B2 B4 B10 107.64(15) . . ?
B5 B4 B10 59.59(12) . . ?
B3 B4 B10 59.68(12) . . ?
B1 B4 H12 121.6 . . ?
B2 B4 H12 121.6 . . ?
B5 B4 H12 121.8 . . ?
B3 B4 H12 122.1 . . ?
B10 B4 H12 122.1 . . ?
C22 B12 B11 58.36(11) . . ?
C22 B12 B14 106.03(15) . . ?
B11 B12 B14 107.89(15) . . ?
C22 B12 B15 59.32(12) . . ?
B11 B12 B15 107.64(15) . . ?
B14 B12 B15 60.37(12) . . ?
C22 B12 B13 105.24(15) . . ?
B11 B12 B13 59.54(12) . . ?
B14 B12 B13 60.57(12) . . ?
B15 B12 B13 108.65(15) . . ?
C22 B12 H28 124.1 . . ?
B11 B12 H28 122.2 . . ?
B14 B12 H28 121.7 . . ?
B15 B12 H28 121.2 . . ?
B13 B12 H28 122.0 . . ?
C3 B5 B1 59.26(11) . . ?
C3 B5 B10 104.32(15) . . ?
B1 B5 B10 107.47(15) . . ?
C3 B5 B9 58.58(11) . . ?
B1 B5 B9 108.32(15) . . ?
B10 B5 B9 59.89(12) . . ?
C3 B5 B4 104.58(14) . . ?
B1 B5 B4 59.09(12) . . ?
B10 B5 B4 60.40(12) . . ?
B9 B5 B4 108.40(15) . . ?
C3 B5 H13 124.8 . . ?
B1 B5 H13 121.6 . . ?
B10 B5 H13 122.6 . . ?
B9 B5 H13 121.2 . . ?
B4 B5 H13 122.4 . . ?
C3 B6 C7 57.37(11) . . ?
C3 B6 B7 104.33(15) . . ?
C7 B6 B7 105.16(15) . . ?
C3 B6 B9 58.30(11) . . ?
C7 B6 B9 105.29(15) . . ?
B7 B6 B9 60.35(12) . . ?
C3 B6 B8 104.20(14) . . ?
C7 B6 B8 58.61(11) . . ?
B7 B6 B8 60.04(12) . . ?
B9 B6 B8 108.23(15) . . ?
C3 B6 H14 125.0 . . ?
C7 B6 H14 124.1 . . ?
B7 B6 H14 122.8 . . ?
B9 B6 H14 121.8 . . ?
B8 B6 H14 122.3 . . ?
B6 B7 B8 60.33(12) . . ?
B6 B7 B9 60.00(12) . . ?
B8 B7 B9 108.18(15) . . ?
B6 B7 B3 108.19(15) . . ?
B8 B7 B3 59.99(12) . . ?
B9 B7 B3 107.82(15) . . ?
B6 B7 B10 107.60(15) . . ?
B8 B7 B10 107.64(16) . . ?
B9 B7 B10 59.68(12) . . ?
B3 B7 B10 59.77(12) . . ?
B6 B7 H15 121.6 . . ?
B8 B7 H15 121.6 . . ?
B9 B7 H15 121.8 . . ?
B3 B7 H15 121.7 . . ?
B10 B7 H15 122.2 . . ?
B11 B13 B12 60.01(12) . . ?
B11 B13 B17 60.27(12) . . ?
B12 B13 B17 108.28(15) . . ?
B11 B13 B19 107.53(15) . . ?
B12 B13 B19 107.23(15) . . ?
B17 B13 B19 59.86(12) . . ?
B11 B13 B14 107.42(15) . . ?
B12 B13 B14 59.51(12) . . ?
B17 B13 B14 107.79(15) . . ?
B19 B13 B14 59.60(13) . . ?
B11 B13 H29 121.8 . . ?
B12 B13 H29 121.9 . . ?
B17 B13 H29 121.4 . . ?
B19 B13 H29 122.2 . . ?
B14 B13 H29 122.2 . . ?
C7 B8 B7 105.68(15) . . ?
C7 B8 B2 58.71(11) . . ?
B7 B8 B2 108.43(15) . . ?
C7 B8 B3 105.00(14) . . ?
B7 B8 B3 60.28(12) . . ?
B2 B8 B3 59.89(12) . . ?
C7 B8 B6 59.69(11) . . ?
B7 B8 B6 59.63(12) . . ?
B2 B8 B6 108.51(15) . . ?
B3 B8 B6 107.86(15) . . ?
C7 B8 H16 124.1 . . ?
B7 B8 H16 122.0 . . ?
B2 B8 H16 121.3 . . ?
B3 B8 H16 122.5 . . ?
B6 B8 H16 121.3 . . ?
B12 B14 B19 107.84(15) . . ?
B12 B14 B15 59.96(12) . . ?
B19 B14 B15 107.73(15) . . ?
B12 B14 B13 59.91(12) . . ?
B19 B14 B13 59.98(13) . . ?
B15 B14 B13 107.80(15) . . ?
B12 B14 B20 107.74(15) . . ?
B19 B14 B20 60.33(13) . . ?
B15 B14 B20 59.53(12) . . ?
B13 B14 B20 108.18(15) . . ?
B12 B14 H30 121.9 . . ?
B19 B14 H30 121.7 . . ?
B15 B14 H30 122.0 . . ?
B13 B14 H30 121.7 . . ?
B20 B14 H30 121.7 . . ?
C22 B15 B12 58.83(11) . . ?
C22 B15 B20 105.62(15) . . ?
B12 B15 B20 108.33(15) . . ?
C22 B15 B14 105.12(15) . . ?
B12 B15 B14 59.67(12) . . ?
B20 B15 B14 60.55(12) . . ?
C22 B15 B16 59.38(12) . . ?
B12 B15 B16 108.20(15) . . ?
B20 B15 B16 59.63(12) . . ?
B14 B15 B16 107.97(15) . . ?
C22 B15 H31 124.1 . . ?
B12 B15 H31 121.5 . . ?
B20 B15 H31 122.0 . . ?
B14 B15 H31 122.3 . . ?
B16 B15 H31 121.5 . . ?
C3 B9 B6 58.81(11) . . ?
C3 B9 B10 103.79(15) . . ?
B6 B9 B10 107.87(16) . . ?
C3 B9 B5 57.82(11) . . ?
B6 B9 B5 107.60(15) . . ?
B10 B9 B5 59.95(12) . . ?
C3 B9 B7 104.18(15) . . ?
B6 B9 B7 59.65(12) . . ?
B10 B9 B7 60.36(13) . . ?
B5 B9 B7 108.05(16) . . ?
C3 B9 H17 125.5 . . ?
B6 B9 H17 121.6 . . ?
B10 B9 H17 122.5 . . ?
B5 B9 H17 121.7 . . ?
B7 B9 H17 122.3 . . ?
C17 B16 C22 57.64(11) . . ?
C17 B16 B20 104.34(15) . . ?
C22 B16 B20 105.42(15) . . ?
C17 B16 B18 58.11(12) . . ?
C22 B16 B18 105.31(15) . . ?
B20 B16 B18 60.22(13) . . ?
C17 B16 B15 104.41(15) . . ?
C22 B16 B15 58.82(12) . . ?
B20 B16 B15 59.95(12) . . ?
B18 B16 B15 107.93(16) . . ?
C17 B16 H32 124.9 . . ?
C22 B16 H32 123.8 . . ?
B20 B16 H32 122.8 . . ?
B18 B16 H32 122.1 . . ?
B15 B16 H32 122.3 . . ?
C17 B17 B19 103.91(16) . . ?
C17 B17 B11 58.91(11) . . ?
B19 B17 B11 107.03(16) . . ?
C17 B17 B13 104.61(15) . . ?
B19 B17 B13 60.13(13) . . ?
B11 B17 B13 59.36(12) . . ?
C17 B17 B18 58.29(12) . . ?
B19 B17 B18 59.80(13) . . ?
B11 B17 B18 107.64(15) . . ?
B13 B17 B18 108.17(16) . . ?
C17 B17 H33 125.0 . . ?
B19 B17 H33 122.9 . . ?
B11 B17 H33 121.9 . . ?
B13 B17 H33 122.3 . . ?
B18 B17 H33 121.5 . . ?
C17 B18 B19 103.87(15) . . ?
C17 B18 B16 58.76(12) . . ?
B19 B18 B16 107.79(16) . . ?
C17 B18 B20 104.33(15) . . ?
B19 B18 B20 60.56(13) . . ?
B16 B18 B20 59.57(12) . . ?
C17 B18 B17 58.15(12) . . ?
B19 B18 B17 59.88(13) . . ?
B16 B18 B17 107.83(15) . . ?
B20 B18 B17 108.41(16) . . ?
C17 B18 H34 125.3 . . ?
B19 B18 H34 122.5 . . ?
B16 B18 H34 121.6 . . ?
B20 B18 H34 122.2 . . ?
B17 B18 H34 121.5 . . ?
B9 B10 B5 60.16(12) . . ?
B9 B10 B3 108.28(15) . . ?
B5 B10 B3 108.06(15) . . ?
B9 B10 B7 59.96(13) . . ?
B5 B10 B7 107.89(15) . . ?
B3 B10 B7 60.05(12) . . ?
B9 B10 B4 108.29(15) . . ?
B5 B10 B4 60.00(12) . . ?
B3 B10 B4 60.04(12) . . ?
B7 B10 B4 107.98(15) . . ?
B9 B10 H18 121.5 . . ?
B5 B10 H18 121.7 . . ?
B3 B10 H18 121.6 . . ?
B7 B10 H18 121.8 . . ?
B4 B10 H18 121.6 . . ?
B14 B19 B18 108.58(16) . . ?
B14 B19 B17 108.56(15) . . ?
B18 B19 B17 60.33(13) . . ?
B14 B19 B13 60.42(12) . . ?
B18 B19 B13 108.50(15) . . ?
B17 B19 B13 60.01(12) . . ?
B14 B19 B20 60.37(13) . . ?
B18 B19 B20 59.90(13) . . ?
B17 B19 B20 108.25(15) . . ?
B13 B19 B20 108.57(15) . . ?
B14 B19 H35 121.2 . . ?
B18 B19 H35 121.5 . . ?
B17 B19 H35 121.5 . . ?
B13 B19 H35 121.4 . . ?
B20 B19 H35 121.6 . . ?
B16 B20 B15 60.42(12) . . ?
B16 B20 B18 60.21(12) . . ?
B15 B20 B18 108.29(15) . . ?
B16 B20 B19 107.49(15) . . ?
B15 B20 B19 107.22(15) . . ?
B18 B20 B19 59.54(13) . . ?
B16 B20 B14 108.09(15) . . ?
B15 B20 B14 59.92(12) . . ?
B18 B20 B14 107.43(16) . . ?
B19 B20 B14 59.30(13) . . ?
B16 B20 H36 121.5 . . ?
B15 B20 H36 121.6 . . ?
B18 B20 H36 121.8 . . ?
B19 B20 H36 122.5 . . ?
B14 B20 H36 122.0 . . ?

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
C23 C16 C18 C19 3.1(3) . . . . ?
C22 C16 C18 C19 -177.49(17) . . . . ?
C23 C16 C18 C21 -172.90(17) . . . . ?
C22 C16 C18 C21 6.5(3) . . . . ?
C16 C18 C19 C26 -3.2(3) . . . . ?
C21 C18 C19 C26 172.87(18) . . . . ?
C6 C1 C4 C11 -1.8(3) . . . . ?
B1 C1 C4 C11 -179.56(17) . . . . ?
C6 C1 C4 C2 174.45(17) . . . . ?
B1 C1 C4 C2 -3.3(3) . . . . ?
C8 C2 C4 C11 -2.1(3) . . . . ?
C5 C2 C4 C11 174.14(17) . . . . ?
C8 C2 C4 C1 -178.18(17) . . . . ?
C5 C2 C4 C1 -2.0(3) . . . . ?
C8 C2 C5 C9 2.1(3) . . . . ?
C4 C2 C5 C9 -174.20(17) . . . . ?
C8 C2 C5 C7 -178.23(16) . . . . ?
C4 C2 C5 C7 5.4(3) . . . . ?
C25 C20 C21 C15 2.2(3) . . . . ?
C25 C20 C21 C18 -173.37(17) . . . . ?
C24 C15 C21 C20 -1.9(3) . . . . ?
B11 C15 C21 C20 178.92(17) . . . . ?
C24 C15 C21 C18 173.54(17) . . . . ?
B11 C15 C21 C18 -5.6(3) . . . . ?
C19 C18 C21 C20 -1.2(3) . . . . ?
C16 C18 C21 C20 174.63(17) . . . . ?
C19 C18 C21 C15 -176.57(17) . . . . ?
C16 C18 C21 C15 -0.7(3) . . . . ?
C4 C1 C6 C12 0.0(3) . . . . ?
B1 C1 C6 C12 177.81(17) . . . . ?
C23 C16 C22 C17 -117.10(19) . . . . ?
C18 C16 C22 C17 63.4(2) . . . . ?
C23 C16 C22 B11 173.91(16) . . . . ?
C18 C16 C22 B11 -5.6(2) . . . . ?
C23 C16 C22 B12 101.8(2) . . . . ?
C18 C16 C22 B12 -77.6(2) . . . . ?
C23 C16 C22 B15 25.6(3) . . . . ?
C18 C16 C22 B15 -153.86(17) . . . . ?
C23 C16 C22 B16 -48.1(2) . . . . ?
C18 C16 C22 B16 132.44(18) . . . . ?
B17 C17 C22 C16 -142.97(17) . . . . ?
B18 C17 C22 C16 147.42(16) . . . . ?
B16 C17 C22 C16 108.56(18) . . . . ?
B11 C17 C22 C16 -105.52(18) . . . . ?
B17 C17 C22 B11 -37.45(15) . . . . ?
B18 C17 C22 B11 -107.07(17) . . . . ?
B16 C17 C22 B11 -145.92(15) . . . . ?
B17 C17 C22 B12 2.9(2) . . . . ?
B18 C17 C22 B12 -66.67(19) . . . . ?
B16 C17 C22 B12 -105.52(16) . . . . ?
B11 C17 C22 B12 40.40(14) . . . . ?
B17 C17 C22 B15 68.82(18) . . . . ?
B18 C17 C22 B15 -0.8(2) . . . . ?
B16 C17 C22 B15 -39.65(14) . . . . ?
B11 C17 C22 B15 106.27(15) . . . . ?
B17 C17 C22 B16 108.47(17) . . . . ?
B18 C17 C22 B16 38.85(15) . . . . ?
B11 C17 C22 B16 145.92(15) . . . . ?
C9 C5 C7 C3 -114.74(18) . . . . ?
C2 C5 C7 C3 65.6(2) . . . . ?
C9 C5 C7 B1 176.23(16) . . . . ?
C2 C5 C7 B1 -3.4(2) . . . . ?
C9 C5 C7 B2 104.0(2) . . . . ?
C2 C5 C7 B2 -75.7(2) . . . . ?
C9 C5 C7 B8 27.3(3) . . . . ?
C2 C5 C7 B8 -152.38(17) . . . . ?
C9 C5 C7 B6 -46.2(2) . . . . ?
C2 C5 C7 B6 134.19(18) . . . . ?
B5 C3 C7 C5 -143.23(16) . . . . ?
B9 C3 C7 C5 147.09(16) . . . . ?
B6 C3 C7 C5 108.39(17) . . . . ?
B1 C3 C7 C5 -105.59(17) . . . . ?
B5 C3 C7 B1 -37.64(14) . . . . ?
B9 C3 C7 B1 -107.32(16) . . . . ?
B6 C3 C7 B1 -146.02(15) . . . . ?
B5 C3 C7 B2 2.79(19) . . . . ?
B9 C3 C7 B2 -66.90(18) . . . . ?
B6 C3 C7 B2 -105.60(16) . . . . ?
B1 C3 C7 B2 40.42(14) . . . . ?
B5 C3 C7 B8 69.05(18) . . . . ?
B9 C3 C7 B8 -0.6(2) . . . . ?
B6 C3 C7 B8 -39.33(14) . . . . ?
B1 C3 C7 B8 106.69(15) . . . . ?
B5 C3 C7 B6 108.38(16) . . . . ?
B9 C3 C7 B6 38.70(15) . . . . ?
B1 C3 C7 B6 146.02(15) . . . . ?
C18 C16 C23 C27 -0.5(3) . . . . ?
C22 C16 C23 C27 -179.98(18) . . . . ?
C21 C15 C24 C28 0.0(3) . . . . ?
B11 C15 C24 C28 179.17(17) . . . . ?
C5 C2 C8 C14 -2.4(3) . . . . ?
C4 C2 C8 C14 174.06(18) . . . . ?
C21 C20 C25 C28 -0.5(3) . . . . ?
C18 C19 C26 C27 0.8(3) . . . . ?
C16 C23 C27 C26 -2.0(3) . . . . ?
C19 C26 C27 C23 1.9(3) . . . . ?
C2 C5 C9 C13 -0.4(3) . . . . ?
C7 C5 C9 C13 179.89(18) . . . . ?
C12 C10 C11 C4 -0.7(3) . . . . ?
C1 C4 C11 C10 2.2(3) . . . . ?
C2 C4 C11 C10 -174.11(18) . . . . ?
C1 C6 C12 C10 1.5(3) . . . . ?
C11 C10 C12 C6 -1.2(3) . . . . ?
C15 C24 C28 C25 1.8(3) . . . . ?
C20 C25 C28 C24 -1.5(3) . . . . ?
C5 C9 C13 C14 -1.1(3) . . . . ?
C2 C8 C14 C13 1.0(3) . . . . ?
C9 C13 C14 C8 0.8(3) . . . . ?
C6 C1 B1 C7 -173.07(16) . . . . ?
C4 C1 B1 C7 4.7(2) . . . . ?
C6 C1 B1 C3 120.75(18) . . . . ?
C4 C1 B1 C3 -61.5(2) . . . . ?
C6 C1 B1 B4 -27.5(3) . . . . ?
C4 C1 B1 B4 150.30(19) . . . . ?
C6 C1 B1 B2 -104.5(2) . . . . ?
C4 C1 B1 B2 73.3(2) . . . . ?
C6 C1 B1 B5 51.8(3) . . . . ?
C4 C1 B1 B5 -130.44(19) . . . . ?
C5 C7 B1 C1 -1.4(2) . . . . ?
C3 C7 B1 C1 -109.38(17) . . . . ?
B2 C7 B1 C1 114.06(18) . . . . ?
B8 C7 B1 C1 151.13(16) . . . . ?
B6 C7 B1 C1 -141.12(16) . . . . ?
C5 C7 B1 C3 107.96(17) . . . . ?
B2 C7 B1 C3 -136.56(15) . . . . ?
B8 C7 B1 C3 -99.48(16) . . . . ?
B6 C7 B1 C3 -31.74(14) . . . . ?
C5 C7 B1 B4 -154.80(15) . . . . ?
C3 C7 B1 B4 97.24(15) . . . . ?
B2 C7 B1 B4 -39.32(14) . . . . ?
B8 C7 B1 B4 -2.2(2) . . . . ?
B6 C7 B1 B4 65.50(18) . . . . ?
C5 C7 B1 B2 -115.48(17) . . . . ?
C3 C7 B1 B2 136.56(15) . . . . ?
B8 C7 B1 B2 37.08(15) . . . . ?
B6 C7 B1 B2 104.82(16) . . . . ?
C5 C7 B1 B5 141.75(16) . . . . ?
C3 C7 B1 B5 33.79(13) . . . . ?
B2 C7 B1 B5 -102.76(15) . . . . ?
B8 C7 B1 B5 -65.69(18) . . . . ?
B6 C7 B1 B5 2.06(19) . . . . ?
C7 C3 B1 C1 103.98(18) . . . . ?
B5 C3 B1 C1 -115.33(18) . . . . ?
B9 C3 B1 C1 -152.66(16) . . . . ?
B6 C3 B1 C1 137.03(17) . . . . ?
B5 C3 B1 C7 140.68(15) . . . . ?
B9 C3 B1 C7 103.36(16) . . . . ?
B6 C3 B1 C7 33.05(14) . . . . ?
C7 C3 B1 B4 -100.45(15) . . . . ?
B5 C3 B1 B4 40.23(13) . . . . ?
B9 C3 B1 B4 2.9(2) . . . . ?
B6 C3 B1 B4 -67.41(18) . . . . ?
C7 C3 B1 B2 -37.70(13) . . . . ?
B5 C3 B1 B2 102.98(15) . . . . ?
B9 C3 B1 B2 65.66(18) . . . . ?
B6 C3 B1 B2 -4.65(19) . . . . ?
C7 C3 B1 B5 -140.68(15) . . . . ?
B9 C3 B1 B5 -37.32(15) . . . . ?
B6 C3 B1 B5 -107.64(16) . . . . ?
C24 C15 B11 C22 -173.37(16) . . . . ?
C21 C15 B11 C22 5.8(2) . . . . ?
C24 C15 B11 C17 120.35(19) . . . . ?
C21 C15 B11 C17 -60.5(2) . . . . ?
C24 C15 B11 B13 -27.0(3) . . . . ?
C21 C15 B11 B13 152.12(19) . . . . ?
C24 C15 B11 B12 -104.5(2) . . . . ?
C21 C15 B11 B12 74.7(2) . . . . ?
C24 C15 B11 B17 51.3(3) . . . . ?
C21 C15 B11 B17 -129.51(19) . . . . ?
C16 C22 B11 C15 -0.4(2) . . . . ?
C17 C22 B11 C15 -108.86(17) . . . . ?
B12 C22 B11 C15 114.84(18) . . . . ?
B15 C22 B11 C15 151.66(16) . . . . ?
B16 C22 B11 C15 -140.65(16) . . . . ?
C16 C22 B11 C17 108.50(17) . . . . ?
B12 C22 B11 C17 -136.30(15) . . . . ?
B15 C22 B11 C17 -99.48(16) . . . . ?
B16 C22 B11 C17 -31.79(14) . . . . ?
C16 C22 B11 B13 -154.26(15) . . . . ?
C17 C22 B11 B13 97.24(15) . . . . ?
B12 C22 B11 B13 -39.06(14) . . . . ?
B15 C22 B11 B13 -2.2(2) . . . . ?
B16 C22 B11 B13 65.45(18) . . . . ?
C16 C22 B11 B12 -115.20(17) . . . . ?
C17 C22 B11 B12 136.30(15) . . . . ?
B15 C22 B11 B12 36.82(14) . . . . ?
B16 C22 B11 B12 104.51(16) . . . . ?
C16 C22 B11 B17 142.45(16) . . . . ?
C17 C22 B11 B17 33.95(13) . . . . ?
B12 C22 B11 B17 -102.35(16) . . . . ?
B15 C22 B11 B17 -65.53(18) . . . . ?
B16 C22 B11 B17 2.2(2) . . . . ?
C22 C17 B11 C15 104.16(18) . . . . ?
B17 C17 B11 C15 -114.97(19) . . . . ?
B18 C17 B11 C15 -152.50(17) . . . . ?
B16 C17 B11 C15 137.10(17) . . . . ?
B17 C17 B11 C22 140.87(15) . . . . ?
B18 C17 B11 C22 103.34(17) . . . . ?
B16 C17 B11 C22 32.94(14) . . . . ?
C22 C17 B11 B13 -100.89(15) . . . . ?
B17 C17 B11 B13 39.97(14) . . . . ?
B18 C17 B11 B13 2.4(2) . . . . ?
B16 C17 B11 B13 -67.95(18) . . . . ?
C22 C17 B11 B12 -38.08(13) . . . . ?
B17 C17 B11 B12 102.79(16) . . . . ?
B18 C17 B11 B12 65.26(18) . . . . ?
B16 C17 B11 B12 -5.14(19) . . . . ?
C22 C17 B11 B17 -140.87(15) . . . . ?
B18 C17 B11 B17 -37.52(16) . . . . ?
B16 C17 B11 B17 -107.93(17) . . . . ?
C5 C7 B2 B1 103.64(19) . . . . ?
C3 C7 B2 B1 -39.89(13) . . . . ?
B8 C7 B2 B1 -141.15(15) . . . . ?
B6 C7 B2 B1 -104.89(16) . . . . ?
C5 C7 B2 B3 -155.06(16) . . . . ?
C3 C7 B2 B3 61.40(17) . . . . ?
B1 C7 B2 B3 101.29(15) . . . . ?
B8 C7 B2 B3 -39.86(14) . . . . ?
B6 C7 B2 B3 -3.60(19) . . . . ?
C5 C7 B2 B4 142.08(17) . . . . ?
C3 C7 B2 B4 -1.46(18) . . . . ?
B1 C7 B2 B4 38.43(13) . . . . ?
B8 C7 B2 B4 -102.72(16) . . . . ?
B6 C7 B2 B4 -66.46(18) . . . . ?
C5 C7 B2 B8 -115.20(19) . . . . ?
C3 C7 B2 B8 101.26(15) . . . . ?
B1 C7 B2 B8 141.15(15) . . . . ?
B6 C7 B2 B8 36.26(14) . . . . ?
C1 B1 B2 C7 -102.76(19) . . . . ?
C3 B1 B2 C7 37.17(12) . . . . ?
B4 B1 B2 C7 135.67(15) . . . . ?
B5 B1 B2 C7 97.57(15) . . . . ?
C1 B1 B2 B3 159.40(16) . . . . ?
C7 B1 B2 B3 -97.84(15) . . . . ?
C3 B1 B2 B3 -60.67(17) . . . . ?
B4 B1 B2 B3 37.83(14) . . . . ?
B5 B1 B2 B3 -0.27(19) . . . . ?
C1 B1 B2 B4 121.6(2) . . . . ?
C7 B1 B2 B4 -135.67(15) . . . . ?
C3 B1 B2 B4 -98.50(15) . . . . ?
B5 B1 B2 B4 -38.10(14) . . . . ?
C1 B1 B2 B8 -137.16(17) . . . . ?
C7 B1 B2 B8 -34.40(13) . . . . ?
C3 B1 B2 B8 2.77(18) . . . . ?
B4 B1 B2 B8 101.27(16) . . . . ?
B5 B1 B2 B8 63.17(18) . . . . ?
C7 B2 B3 B8 39.39(13) . . . . ?
B1 B2 B3 B8 100.52(15) . . . . ?
B4 B2 B3 B8 137.86(16) . . . . ?
C7 B2 B3 B10 -61.05(18) . . . . ?
B1 B2 B3 B10 0.08(19) . . . . ?
B4 B2 B3 B10 37.41(14) . . . . ?
B8 B2 B3 B10 -100.44(16) . . . . ?
C7 B2 B3 B7 2.61(19) . . . . ?
B1 B2 B3 B7 63.74(18) . . . . ?
B4 B2 B3 B7 101.07(17) . . . . ?
B8 B2 B3 B7 -36.78(14) . . . . ?
C7 B2 B3 B4 -98.47(15) . . . . ?
B1 B2 B3 B4 -37.34(14) . . . . ?
B8 B2 B3 B4 -137.86(16) . . . . ?
C1 B1 B4 B2 -109.2(2) . . . . ?
C7 B1 B4 B2 38.74(14) . . . . ?
C3 B1 B4 B2 99.20(15) . . . . ?
B5 B1 B4 B2 137.93(15) . . . . ?
C1 B1 B4 B5 112.8(2) . . . . ?
C7 B1 B4 B5 -99.20(15) . . . . ?
C3 B1 B4 B5 -38.73(13) . . . . ?
B2 B1 B4 B5 -137.93(15) . . . . ?
C1 B1 B4 B3 -146.83(19) . . . . ?
C7 B1 B4 B3 1.13(19) . . . . ?
C3 B1 B4 B3 61.60(18) . . . . ?
B2 B1 B4 B3 -37.60(14) . . . . ?
B5 B1 B4 B3 100.33(16) . . . . ?
C1 B1 B4 B10 150.18(19) . . . . ?
C7 B1 B4 B10 -61.86(18) . . . . ?
C3 B1 B4 B10 -1.40(18) . . . . ?
B2 B1 B4 B10 -100.59(16) . . . . ?
B5 B1 B4 B10 37.34(14) . . . . ?
C7 B2 B4 B1 -37.98(13) . . . . ?
B3 B2 B4 B1 -137.75(16) . . . . ?
B8 B2 B4 B1 -99.93(16) . . . . ?
C7 B2 B4 B5 -0.24(19) . . . . ?
B1 B2 B4 B5 37.75(14) . . . . ?
B3 B2 B4 B5 -100.00(16) . . . . ?
B8 B2 B4 B5 -62.19(18) . . . . ?
C7 B2 B4 B3 99.76(15) . . . . ?
B1 B2 B4 B3 137.75(16) . . . . ?
B8 B2 B4 B3 37.81(14) . . . . ?
C7 B2 B4 B10 62.73(18) . . . . ?
B1 B2 B4 B10 100.72(16) . . . . ?
B3 B2 B4 B10 -37.03(14) . . . . ?
B8 B2 B4 B10 0.78(19) . . . . ?
B2 B3 B4 B1 37.81(14) . . . . ?
B8 B3 B4 B1 0.3(2) . . . . ?
B10 B3 B4 B1 -100.52(16) . . . . ?
B7 B3 B4 B1 -62.84(19) . . . . ?
B8 B3 B4 B2 -37.54(14) . . . . ?
B10 B3 B4 B2 -138.33(16) . . . . ?
B7 B3 B4 B2 -100.65(16) . . . . ?
B2 B3 B4 B5 101.31(15) . . . . ?
B8 B3 B4 B5 63.78(18) . . . . ?
B10 B3 B4 B5 -37.02(14) . . . . ?
B7 B3 B4 B5 0.66(19) . . . . ?
B2 B3 B4 B10 138.33(16) . . . . ?
B8 B3 B4 B10 100.79(17) . . . . ?
B7 B3 B4 B10 37.68(15) . . . . ?
C16 C22 B12 B11 103.87(19) . . . . ?
C17 C22 B12 B11 -39.84(13) . . . . ?
B15 C22 B12 B11 -141.21(15) . . . . ?
B16 C22 B12 B11 -104.69(16) . . . . ?
C16 C22 B12 B14 -154.69(17) . . . . ?
C17 C22 B12 B14 61.59(18) . . . . ?
B11 C22 B12 B14 101.44(16) . . . . ?
B15 C22 B12 B14 -39.77(14) . . . . ?
B16 C22 B12 B14 -3.2(2) . . . . ?
C16 C22 B12 B15 -114.92(19) . . . . ?
C17 C22 B12 B15 101.37(15) . . . . ?
B11 C22 B12 B15 141.21(15) . . . . ?
B16 C22 B12 B15 36.52(15) . . . . ?
C16 C22 B12 B13 142.15(17) . . . . ?
C17 C22 B12 B13 -1.56(19) . . . . ?
B11 C22 B12 B13 38.28(14) . . . . ?
B15 C22 B12 B13 -102.93(16) . . . . ?
B16 C22 B12 B13 -66.41(18) . . . . ?
C15 B11 B12 C22 -102.41(19) . . . . ?
C17 B11 B12 C22 37.57(13) . . . . ?
B13 B11 B12 C22 136.10(16) . . . . ?
B17 B11 B12 C22 98.46(16) . . . . ?
C15 B11 B12 B14 159.43(17) . . . . ?
C22 B11 B12 B14 -98.16(16) . . . . ?
C17 B11 B12 B14 -60.60(17) . . . . ?
B13 B11 B12 B14 37.94(14) . . . . ?
B17 B11 B12 B14 0.30(19) . . . . ?
C15 B11 B12 B15 -136.83(18) . . . . ?
C22 B11 B12 B15 -34.43(13) . . . . ?
C17 B11 B12 B15 3.14(18) . . . . ?
B13 B11 B12 B15 101.67(16) . . . . ?
B17 B11 B12 B15 64.03(18) . . . . ?
C15 B11 B12 B13 121.5(2) . . . . ?
C22 B11 B12 B13 -136.10(16) . . . . ?
C17 B11 B12 B13 -98.53(15) . . . . ?
B17 B11 B12 B13 -37.64(14) . . . . ?
C7 C3 B5 B1 36.67(14) . . . . ?
B9 C3 B5 B1 142.35(15) . . . . ?
B6 C3 B5 B1 105.85(16) . . . . ?
C7 C3 B5 B10 -65.38(18) . . . . ?
B9 C3 B5 B10 40.31(14) . . . . ?
B6 C3 B5 B10 3.8(2) . . . . ?
B1 C3 B5 B10 -102.05(16) . . . . ?
C7 C3 B5 B9 -105.69(16) . . . . ?
B6 C3 B5 B9 -36.50(15) . . . . ?
B1 C3 B5 B9 -142.35(15) . . . . ?
C7 C3 B5 B4 -2.79(19) . . . . ?
B9 C3 B5 B4 102.90(16) . . . . ?
B6 C3 B5 B4 66.40(19) . . . . ?
B1 C3 B5 B4 -39.45(13) . . . . ?
C1 B1 B5 C3 104.8(2) . . . . ?
C7 B1 B5 C3 -33.97(13) . . . . ?
B4 B1 B5 C3 -134.21(15) . . . . ?
B2 B1 B5 C3 -96.22(15) . . . . ?
C1 B1 B5 B10 -158.67(17) . . . . ?
C7 B1 B5 B10 62.60(18) . . . . ?
C3 B1 B5 B10 96.57(16) . . . . ?
B4 B1 B5 B10 -37.64(14) . . . . ?
B2 B1 B5 B10 0.36(19) . . . . ?
C1 B1 B5 B9 138.06(18) . . . . ?
C7 B1 B5 B9 -0.67(19) . . . . ?
C3 B1 B5 B9 33.30(14) . . . . ?
B4 B1 B5 B9 -100.91(16) . . . . ?
B2 B1 B5 B9 -62.92(18) . . . . ?
C1 B1 B5 B4 -121.0(2) . . . . ?
C7 B1 B5 B4 100.24(15) . . . . ?
C3 B1 B5 B4 134.21(15) . . . . ?
B2 B1 B5 B4 38.00(14) . . . . ?
B1 B4 B5 C3 39.54(13) . . . . ?
B2 B4 B5 C3 1.78(19) . . . . ?
B3 B4 B5 C3 -61.35(18) . . . . ?
B10 B4 B5 C3 -98.40(16) . . . . ?
B2 B4 B5 B1 -37.76(14) . . . . ?
B3 B4 B5 B1 -100.88(16) . . . . ?
B10 B4 B5 B1 -137.94(15) . . . . ?
B1 B4 B5 B10 137.94(15) . . . . ?
B2 B4 B5 B10 100.18(16) . . . . ?
B3 B4 B5 B10 37.06(14) . . . . ?
B1 B4 B5 B9 100.77(15) . . . . ?
B2 B4 B5 B9 63.01(18) . . . . ?
B3 B4 B5 B9 -0.11(19) . . . . ?
B10 B4 B5 B9 -37.17(14) . . . . ?
B5 C3 B6 C7 -102.99(16) . . . . ?
B9 C3 B6 C7 -139.76(15) . . . . ?
B1 C3 B6 C7 -32.40(14) . . . . ?
C7 C3 B6 B7 99.03(15) . . . . ?
B5 C3 B6 B7 -4.0(2) . . . . ?
B9 C3 B6 B7 -40.73(14) . . . . ?
B1 C3 B6 B7 66.63(18) . . . . ?
C7 C3 B6 B9 139.76(15) . . . . ?
B5 C3 B6 B9 36.77(16) . . . . ?
B1 C3 B6 B9 107.36(16) . . . . ?
C7 C3 B6 B8 36.87(13) . . . . ?
B5 C3 B6 B8 -66.12(18) . . . . ?
B9 C3 B6 B8 -102.89(16) . . . . ?
B1 C3 B6 B8 4.48(19) . . . . ?
C5 C7 B6 C3 -106.39(17) . . . . ?
B1 C7 B6 C3 32.15(14) . . . . ?
B2 C7 B6 C3 100.63(16) . . . . ?
B8 C7 B6 C3 137.04(15) . . . . ?
C5 C7 B6 B7 156.08(16) . . . . ?
C3 C7 B6 B7 -97.53(15) . . . . ?
B1 C7 B6 B7 -65.38(18) . . . . ?
B2 C7 B6 B7 3.10(19) . . . . ?
B8 C7 B6 B7 39.52(14) . . . . ?
C5 C7 B6 B9 -141.12(16) . . . . ?
C3 C7 B6 B9 -34.73(13) . . . . ?
B1 C7 B6 B9 -2.6(2) . . . . ?
B2 C7 B6 B9 65.89(18) . . . . ?
B8 C7 B6 B9 102.31(16) . . . . ?
C5 C7 B6 B8 116.57(18) . . . . ?
C3 C7 B6 B8 -137.04(15) . . . . ?
B1 C7 B6 B8 -104.89(16) . . . . ?
B2 C7 B6 B8 -36.41(14) . . . . ?
C3 B6 B7 B8 -98.33(15) . . . . ?
C7 B6 B7 B8 -38.82(13) . . . . ?
B9 B6 B7 B8 -138.04(16) . . . . ?
C3 B6 B7 B9 39.70(14) . . . . ?
C7 B6 B7 B9 99.21(15) . . . . ?
B8 B6 B7 B9 138.04(16) . . . . ?
C3 B6 B7 B3 -60.80(18) . . . . ?
C7 B6 B7 B3 -1.29(19) . . . . ?
B9 B6 B7 B3 -100.50(17) . . . . ?
B8 B6 B7 B3 37.53(14) . . . . ?
C3 B6 B7 B10 2.3(2) . . . . ?
C7 B6 B7 B10 61.85(18) . . . . ?
B9 B6 B7 B10 -37.36(15) . . . . ?
B8 B6 B7 B10 100.67(17) . . . . ?
B2 B3 B7 B6 -0.8(2) . . . . ?
B8 B3 B7 B6 -37.68(14) . . . . ?
B10 B3 B7 B6 100.19(16) . . . . ?
B4 B3 B7 B6 62.47(19) . . . . ?
B2 B3 B7 B8 36.87(14) . . . . ?
B10 B3 B7 B8 137.88(16) . . . . ?
B4 B3 B7 B8 100.15(16) . . . . ?
B2 B3 B7 B9 -64.24(19) . . . . ?
B8 B3 B7 B9 -101.12(16) . . . . ?
B10 B3 B7 B9 36.76(14) . . . . ?
B4 B3 B7 B9 -1.0(2) . . . . ?
B2 B3 B7 B10 -101.00(16) . . . . ?
B8 B3 B7 B10 -137.88(16) . . . . ?
B4 B3 B7 B10 -37.72(14) . . . . ?
C15 B11 B13 B12 -109.9(2) . . . . ?
C22 B11 B13 B12 38.59(14) . . . . ?
C17 B11 B13 B12 99.43(15) . . . . ?
B17 B11 B13 B12 138.28(16) . . . . ?
C15 B11 B13 B17 111.8(2) . . . . ?
C22 B11 B13 B17 -99.68(16) . . . . ?
C17 B11 B13 B17 -38.85(14) . . . . ?
B12 B11 B13 B17 -138.28(16) . . . . ?
C15 B11 B13 B19 149.91(19) . . . . ?
C22 B11 B13 B19 -61.56(18) . . . . ?
C17 B11 B13 B19 -0.73(19) . . . . ?
B12 B11 B13 B19 -100.16(16) . . . . ?
B17 B11 B13 B19 38.12(15) . . . . ?
C15 B11 B13 B14 -147.29(19) . . . . ?
C22 B11 B13 B14 1.24(19) . . . . ?
C17 B11 B13 B14 62.08(18) . . . . ?
B12 B11 B13 B14 -37.35(14) . . . . ?
B17 B11 B13 B14 100.93(16) . . . . ?
C22 B12 B13 B11 -37.72(13) . . . . ?
B14 B12 B13 B11 -137.80(16) . . . . ?
B15 B12 B13 B11 -99.93(16) . . . . ?
C22 B12 B13 B17 -0.23(19) . . . . ?
B11 B12 B13 B17 37.49(14) . . . . ?
B14 B12 B13 B17 -100.31(16) . . . . ?
B15 B12 B13 B17 -62.44(18) . . . . ?
C22 B12 B13 B19 62.95(18) . . . . ?
B11 B12 B13 B19 100.67(16) . . . . ?
B14 B12 B13 B19 -37.13(14) . . . . ?
B15 B12 B13 B19 0.74(19) . . . . ?
C22 B12 B13 B14 100.08(16) . . . . ?
B11 B12 B13 B14 137.80(16) . . . . ?
B15 B12 B13 B14 37.87(14) . . . . ?
C5 C7 B8 B7 -145.35(17) . . . . ?
C3 C7 B8 B7 -0.84(19) . . . . ?
B1 C7 B8 B7 65.14(18) . . . . ?
B2 C7 B8 B7 102.34(16) . . . . ?
B6 C7 B8 B7 -39.44(14) . . . . ?
C5 C7 B8 B2 112.31(19) . . . . ?
C3 C7 B8 B2 -103.18(15) . . . . ?
B1 C7 B8 B2 -37.21(15) . . . . ?
B6 C7 B8 B2 -141.78(15) . . . . ?
C5 C7 B8 B3 151.90(17) . . . . ?
C3 C7 B8 B3 -63.59(17) . . . . ?
B1 C7 B8 B3 2.4(2) . . . . ?
B2 C7 B8 B3 39.59(14) . . . . ?
B6 C7 B8 B3 -102.19(16) . . . . ?
C5 C7 B8 B6 -105.91(19) . . . . ?
C3 C7 B8 B6 38.60(14) . . . . ?
B1 C7 B8 B6 104.57(16) . . . . ?
B2 C7 B8 B6 141.78(15) . . . . ?
B6 B7 B8 C7 39.47(14) . . . . ?
B9 B7 B8 C7 1.91(19) . . . . ?
B3 B7 B8 C7 -98.59(15) . . . . ?
B10 B7 B8 C7 -61.14(18) . . . . ?
B6 B7 B8 B2 101.10(16) . . . . ?
B9 B7 B8 B2 63.55(19) . . . . ?
B3 B7 B8 B2 -36.96(14) . . . . ?
B10 B7 B8 B2 0.5(2) . . . . ?
B6 B7 B8 B3 138.06(15) . . . . ?
B9 B7 B8 B3 100.51(16) . . . . ?
B10 B7 B8 B3 37.45(14) . . . . ?
B9 B7 B8 B6 -37.55(14) . . . . ?
B3 B7 B8 B6 -138.06(15) . . . . ?
B10 B7 B8 B6 -100.60(16) . . . . ?
B1 B2 B8 C7 34.06(13) . . . . ?
B3 B2 B8 C7 134.64(15) . . . . ?
B4 B2 B8 C7 96.71(15) . . . . ?
C7 B2 B8 B7 -97.51(16) . . . . ?
B1 B2 B8 B7 -63.45(18) . . . . ?
B3 B2 B8 B7 37.13(14) . . . . ?
B4 B2 B8 B7 -0.8(2) . . . . ?
C7 B2 B8 B3 -134.64(15) . . . . ?
B1 B2 B8 B3 -100.58(16) . . . . ?
B4 B2 B8 B3 -37.93(14) . . . . ?
C7 B2 B8 B6 -34.28(14) . . . . ?
B1 B2 B8 B6 -0.22(19) . . . . ?
B3 B2 B8 B6 100.36(16) . . . . ?
B4 B2 B8 B6 62.43(18) . . . . ?
B2 B3 B8 C7 -39.01(13) . . . . ?
B10 B3 B8 C7 62.07(18) . . . . ?
B7 B3 B8 C7 99.74(16) . . . . ?
B4 B3 B8 C7 -1.54(19) . . . . ?
B2 B3 B8 B7 -138.75(16) . . . . ?
B10 B3 B8 B7 -37.66(14) . . . . ?
B4 B3 B8 B7 -101.27(17) . . . . ?
B10 B3 B8 B2 101.09(16) . . . . ?
B7 B3 B8 B2 138.75(16) . . . . ?
B4 B3 B8 B2 37.48(14) . . . . ?
B2 B3 B8 B6 -101.46(16) . . . . ?
B10 B3 B8 B6 -0.37(19) . . . . ?
B7 B3 B8 B6 37.29(14) . . . . ?
B4 B3 B8 B6 -63.98(19) . . . . ?
C3 B6 B8 C7 -36.30(13) . . . . ?
B7 B6 B8 C7 -134.86(15) . . . . ?
B9 B6 B8 C7 -97.14(16) . . . . ?
C3 B6 B8 B7 98.56(15) . . . . ?
C7 B6 B8 B7 134.86(15) . . . . ?
B9 B6 B8 B7 37.72(14) . . . . ?
C3 B6 B8 B2 -2.41(19) . . . . ?
C7 B6 B8 B2 33.89(13) . . . . ?
B7 B6 B8 B2 -100.97(16) . . . . ?
B9 B6 B8 B2 -63.25(18) . . . . ?
C3 B6 B8 B3 60.98(17) . . . . ?
C7 B6 B8 B3 97.28(15) . . . . ?
B7 B6 B8 B3 -37.58(14) . . . . ?
B9 B6 B8 B3 0.14(19) . . . . ?
C22 B12 B14 B19 -61.30(18) . . . . ?
B11 B12 B14 B19 0.0(2) . . . . ?
B15 B12 B14 B19 -100.56(17) . . . . ?
B13 B12 B14 B19 37.44(15) . . . . ?
C22 B12 B14 B15 39.27(14) . . . . ?
B11 B12 B14 B15 100.53(16) . . . . ?
B13 B12 B14 B15 138.00(16) . . . . ?
C22 B12 B14 B13 -98.74(15) . . . . ?
B11 B12 B14 B13 -37.47(14) . . . . ?
B15 B12 B14 B13 -138.00(16) . . . . ?
C22 B12 B14 B20 2.4(2) . . . . ?
B11 B12 B14 B20 63.67(19) . . . . ?
B15 B12 B14 B20 -36.86(15) . . . . ?
B13 B12 B14 B20 101.14(17) . . . . ?
B11 B13 B14 B12 37.57(14) . . . . ?
B17 B13 B14 B12 101.14(16) . . . . ?
B19 B13 B14 B12 138.06(16) . . . . ?
B11 B13 B14 B19 -100.49(16) . . . . ?
B12 B13 B14 B19 -138.06(16) . . . . ?
B17 B13 B14 B19 -36.92(14) . . . . ?
B11 B13 B14 B15 0.1(2) . . . . ?
B12 B13 B14 B15 -37.47(14) . . . . ?
B17 B13 B14 B15 63.67(19) . . . . ?
B19 B13 B14 B15 100.59(17) . . . . ?
B11 B13 B14 B20 -62.82(19) . . . . ?
B12 B13 B14 B20 -100.39(16) . . . . ?
B17 B13 B14 B20 0.8(2) . . . . ?
B19 B13 B14 B20 37.67(15) . . . . ?
C16 C22 B15 B12 112.09(19) . . . . ?
C17 C22 B15 B12 -102.55(16) . . . . ?
B11 C22 B15 B12 -36.95(14) . . . . ?
B16 C22 B15 B12 -141.44(15) . . . . ?
C16 C22 B15 B20 -145.63(17) . . . . ?
C17 C22 B15 B20 -0.27(19) . . . . ?
B11 C22 B15 B20 65.32(18) . . . . ?
B12 C22 B15 B20 102.28(16) . . . . ?
B16 C22 B15 B20 -39.16(14) . . . . ?
C16 C22 B15 B14 151.32(17) . . . . ?
C17 C22 B15 B14 -63.32(18) . . . . ?
B11 C22 B15 B14 2.3(2) . . . . ?
B12 C22 B15 B14 39.23(14) . . . . ?
B16 C22 B15 B14 -102.21(16) . . . . ?
C16 C22 B15 B16 -106.5(2) . . . . ?
C17 C22 B15 B16 38.89(14) . . . . ?
B11 C22 B15 B16 104.48(16) . . . . ?
B12 C22 B15 B16 141.44(15) . . . . ?
B11 B12 B15 C22 34.03(13) . . . . ?
B14 B12 B15 C22 134.98(16) . . . . ?
B13 B12 B15 C22 97.02(15) . . . . ?
C22 B12 B15 B20 -97.53(16) . . . . ?
B11 B12 B15 B20 -63.50(18) . . . . ?
B14 B12 B15 B20 37.45(14) . . . . ?
B13 B12 B15 B20 -0.5(2) . . . . ?
C22 B12 B15 B14 -134.98(16) . . . . ?
B11 B12 B15 B14 -100.95(16) . . . . ?
B13 B12 B15 B14 -37.96(14) . . . . ?
C22 B12 B15 B16 -34.38(14) . . . . ?
B11 B12 B15 B16 -0.35(19) . . . . ?
B14 B12 B15 B16 100.60(16) . . . . ?
B13 B12 B15 B16 62.64(18) . . . . ?
B12 B14 B15 C22 -38.83(13) . . . . ?
B19 B14 B15 C22 61.94(18) . . . . ?
B13 B14 B15 C22 -1.38(19) . . . . ?
B20 B14 B15 C22 99.65(16) . . . . ?
B19 B14 B15 B12 100.76(16) . . . . ?
B13 B14 B15 B12 37.45(14) . . . . ?
B20 B14 B15 B12 138.48(16) . . . . ?
B12 B14 B15 B20 -138.48(16) . . . . ?
B19 B14 B15 B20 -37.72(15) . . . . ?
B13 B14 B15 B20 -101.03(17) . . . . ?
B12 B14 B15 B16 -100.99(16) . . . . ?
B19 B14 B15 B16 -0.22(19) . . . . ?
B13 B14 B15 B16 -63.54(18) . . . . ?
B20 B14 B15 B16 37.49(14) . . . . ?
C7 C3 B9 B6 -38.56(15) . . . . ?
B5 C3 B9 B6 -142.98(16) . . . . ?
B1 C3 B9 B6 -105.85(16) . . . . ?
C7 C3 B9 B10 64.19(18) . . . . ?
B5 C3 B9 B10 -40.22(14) . . . . ?
B6 C3 B9 B10 102.76(16) . . . . ?
B1 C3 B9 B10 -3.1(2) . . . . ?
C7 C3 B9 B5 104.42(16) . . . . ?
B6 C3 B9 B5 142.98(16) . . . . ?
B1 C3 B9 B5 37.13(15) . . . . ?
C7 C3 B9 B7 1.79(19) . . . . ?
B5 C3 B9 B7 -102.63(16) . . . . ?
B6 C3 B9 B7 40.35(14) . . . . ?
B1 C3 B9 B7 -65.50(18) . . . . ?
C7 B6 B9 C3 34.33(13) . . . . ?
B7 B6 B9 C3 133.33(16) . . . . ?
B8 B6 B9 C3 95.74(15) . . . . ?
C3 B6 B9 B10 -95.60(16) . . . . ?
C7 B6 B9 B10 -61.26(18) . . . . ?
B7 B6 B9 B10 37.73(15) . . . . ?
B8 B6 B9 B10 0.1(2) . . . . ?
C3 B6 B9 B5 -32.32(14) . . . . ?
C7 B6 B9 B5 2.01(19) . . . . ?
B7 B6 B9 B5 101.01(17) . . . . ?
B8 B6 B9 B5 63.42(18) . . . . ?
C3 B6 B9 B7 -133.33(16) . . . . ?
C7 B6 B9 B7 -99.00(16) . . . . ?
B8 B6 B9 B7 -37.58(14) . . . . ?
B1 B5 B9 C3 -33.57(14) . . . . ?
B10 B5 B9 C3 -133.57(16) . . . . ?
B4 B5 B9 C3 -96.18(15) . . . . ?
C3 B5 B9 B6 32.71(14) . . . . ?
B1 B5 B9 B6 -0.9(2) . . . . ?
B10 B5 B9 B6 -100.86(17) . . . . ?
B4 B5 B9 B6 -63.47(18) . . . . ?
C3 B5 B9 B10 133.57(16) . . . . ?
B1 B5 B9 B10 100.00(16) . . . . ?
B4 B5 B9 B10 37.39(14) . . . . ?
C3 B5 B9 B7 95.70(16) . . . . ?
B1 B5 B9 B7 62.12(18) . . . . ?
B10 B5 B9 B7 -37.87(14) . . . . ?
B4 B5 B9 B7 -0.48(19) . . . . ?
B6 B7 B9 C3 -39.93(13) . . . . ?
B8 B7 B9 C3 -2.23(19) . . . . ?
B3 B7 B9 C3 61.20(18) . . . . ?
B10 B7 B9 C3 97.99(16) . . . . ?
B8 B7 B9 B6 37.70(14) . . . . ?
B3 B7 B9 B6 101.13(16) . . . . ?
B10 B7 B9 B6 137.92(16) . . . . ?
B6 B7 B9 B10 -137.92(16) . . . . ?
B8 B7 B9 B10 -100.22(17) . . . . ?
B3 B7 B9 B10 -36.80(14) . . . . ?
B6 B7 B9 B5 -100.24(16) . . . . ?
B8 B7 B9 B5 -62.54(18) . . . . ?
B3 B7 B9 B5 0.89(19) . . . . ?
B10 B7 B9 B5 37.69(14) . . . . ?
B17 C17 B16 C22 -102.85(17) . . . . ?
B18 C17 B16 C22 -139.67(16) . . . . ?
B11 C17 B16 C22 -32.40(14) . . . . ?
C22 C17 B16 B20 99.38(16) . . . . ?
B17 C17 B16 B20 -3.5(2) . . . . ?
B18 C17 B16 B20 -40.29(14) . . . . ?
B11 C17 B16 B20 66.98(18) . . . . ?
C22 C17 B16 B18 139.67(16) . . . . ?
B17 C17 B16 B18 36.82(16) . . . . ?
B11 C17 B16 B18 107.27(17) . . . . ?
C22 C17 B16 B15 37.28(13) . . . . ?
B17 C17 B16 B15 -65.57(19) . . . . ?
B18 C17 B16 B15 -102.38(16) . . . . ?
B11 C17 B16 B15 4.88(19) . . . . ?
C16 C22 B16 C17 -107.01(17) . . . . ?
B11 C22 B16 C17 32.09(14) . . . . ?
B12 C22 B16 C17 100.16(16) . . . . ?
B15 C22 B16 C17 136.70(15) . . . . ?
C16 C22 B16 B20 155.56(16) . . . . ?
C17 C22 B16 B20 -97.43(16) . . . . ?
B11 C22 B16 B20 -65.35(18) . . . . ?
B12 C22 B16 B20 2.7(2) . . . . ?
B15 C22 B16 B20 39.27(14) . . . . ?
C16 C22 B16 B18 -141.74(16) . . . . ?
C17 C22 B16 B18 -34.73(13) . . . . ?
B11 C22 B16 B18 -2.6(2) . . . . ?
B12 C22 B16 B18 65.43(18) . . . . ?
B15 C22 B16 B18 101.97(16) . . . . ?
C16 C22 B16 B15 116.29(18) . . . . ?
C17 C22 B16 B15 -136.70(15) . . . . ?
B11 C22 B16 B15 -104.62(16) . . . . ?
B12 C22 B16 B15 -36.54(14) . . . . ?
C22 B15 B16 C17 -36.73(13) . . . . ?
B12 B15 B16 C17 -2.58(19) . . . . ?
B20 B15 B16 C17 98.44(16) . . . . ?
B14 B15 B16 C17 60.54(18) . . . . ?
B12 B15 B16 C22 34.16(14) . . . . ?
B20 B15 B16 C22 135.18(16) . . . . ?
B14 B15 B16 C22 97.27(16) . . . . ?
C22 B15 B16 B20 -135.18(16) . . . . ?
B12 B15 B16 B20 -101.02(16) . . . . ?
B14 B15 B16 B20 -37.90(14) . . . . ?
C22 B15 B16 B18 -97.38(16) . . . . ?
B12 B15 B16 B18 -63.23(18) . . . . ?
B20 B15 B16 B18 37.79(15) . . . . ?
B14 B15 B16 B18 -0.1(2) . . . . ?
C22 C17 B17 B19 -65.20(18) . . . . ?
B18 C17 B17 B19 40.33(15) . . . . ?
B16 C17 B17 B19 3.7(2) . . . . ?
B11 C17 B17 B19 -101.71(16) . . . . ?
C22 C17 B17 B11 36.51(14) . . . . ?
B18 C17 B17 B11 142.04(16) . . . . ?
B16 C17 B17 B11 105.38(17) . . . . ?
C22 C17 B17 B13 -3.0(2) . . . . ?
B18 C17 B17 B13 102.58(16) . . . . ?
B16 C17 B17 B13 65.92(19) . . . . ?
B11 C17 B17 B13 -39.46(14) . . . . ?
C22 C17 B17 B18 -105.53(16) . . . . ?
B16 C17 B17 B18 -36.66(16) . . . . ?
B11 C17 B17 B18 -142.04(16) . . . . ?
C15 B11 B17 C17 104.5(2) . . . . ?
C22 B11 B17 C17 -34.07(13) . . . . ?
B13 B11 B17 C17 -134.37(16) . . . . ?
B12 B11 B17 C17 -96.70(16) . . . . ?
C15 B11 B17 B19 -159.21(17) . . . . ?
C22 B11 B17 B19 62.19(18) . . . . ?
C17 B11 B17 B19 96.26(16) . . . . ?
B13 B11 B17 B19 -38.12(15) . . . . ?
B12 B11 B17 B19 -0.4(2) . . . . ?
C15 B11 B17 B13 -121.1(2) . . . . ?
C22 B11 B17 B13 100.31(16) . . . . ?
C17 B11 B17 B13 134.37(16) . . . . ?
B12 B11 B17 B13 37.67(14) . . . . ?
C15 B11 B17 B18 137.84(18) . . . . ?
C22 B11 B17 B18 -0.76(19) . . . . ?
C17 B11 B17 B18 33.30(14) . . . . ?
B13 B11 B17 B18 -101.07(17) . . . . ?
B12 B11 B17 B18 -63.40(19) . . . . ?
B11 B13 B17 C17 39.24(14) . . . . ?
B12 B13 B17 C17 1.87(19) . . . . ?
B19 B13 B17 C17 -97.86(16) . . . . ?
B14 B13 B17 C17 -61.06(18) . . . . ?
B11 B13 B17 B19 137.11(16) . . . . ?
B12 B13 B17 B19 99.73(16) . . . . ?
B14 B13 B17 B19 36.80(14) . . . . ?
B12 B13 B17 B11 -37.38(14) . . . . ?
B19 B13 B17 B11 -137.11(16) . . . . ?
B14 B13 B17 B11 -100.30(16) . . . . ?
B11 B13 B17 B18 100.15(16) . . . . ?
B12 B13 B17 B18 62.78(18) . . . . ?
B19 B13 B17 B18 -36.95(14) . . . . ?
B14 B13 B17 B18 -0.15(19) . . . . ?
C22 C17 B18 B19 64.13(19) . . . . ?
B17 C17 B18 B19 -40.37(15) . . . . ?
B16 C17 B18 B19 102.61(17) . . . . ?
B11 C17 B18 B19 -3.1(2) . . . . ?
C22 C17 B18 B16 -38.48(15) . . . . ?
B17 C17 B18 B16 -142.97(16) . . . . ?
B11 C17 B18 B16 -105.66(17) . . . . ?
C22 C17 B18 B20 1.5(2) . . . . ?
B17 C17 B18 B20 -103.01(17) . . . . ?
B16 C17 B18 B20 39.96(14) . . . . ?
B11 C17 B18 B20 -65.70(19) . . . . ?
C22 C17 B18 B17 104.49(17) . . . . ?
B16 C17 B18 B17 142.97(16) . . . . ?
B11 C17 B18 B17 37.31(15) . . . . ?
C22 B16 B18 C17 34.53(13) . . . . ?
B20 B16 B18 C17 133.80(16) . . . . ?
B15 B16 B18 C17 96.13(16) . . . . ?
C17 B16 B18 B19 -95.73(16) . . . . ?
C22 B16 B18 B19 -61.20(18) . . . . ?
B20 B16 B18 B19 38.07(15) . . . . ?
B15 B16 B18 B19 0.4(2) . . . . ?
C17 B16 B18 B20 -133.80(16) . . . . ?
C22 B16 B18 B20 -99.27(16) . . . . ?
B15 B16 B18 B20 -37.67(14) . . . . ?
C17 B16 B18 B17 -32.50(14) . . . . ?
C22 B16 B18 B17 2.0(2) . . . . ?
B20 B16 B18 B17 101.30(17) . . . . ?
B15 B16 B18 B17 63.63(19) . . . . ?
B19 B17 B18 C17 -133.37(16) . . . . ?
B11 B17 B18 C17 -33.56(14) . . . . ?
B13 B17 B18 C17 -96.27(16) . . . . ?
C17 B17 B18 B19 133.37(16) . . . . ?
B11 B17 B18 B19 99.81(17) . . . . ?
B13 B17 B18 B19 37.10(14) . . . . ?
C17 B17 B18 B16 32.74(14) . . . . ?
B19 B17 B18 B16 -100.63(17) . . . . ?
B11 B17 B18 B16 -0.8(2) . . . . ?
B13 B17 B18 B16 -63.53(19) . . . . ?
C17 B17 B18 B20 95.76(16) . . . . ?
B19 B17 B18 B20 -37.61(15) . . . . ?
B11 B17 B18 B20 62.20(19) . . . . ?
B13 B17 B18 B20 -0.5(2) . . . . ?
C3 B9 B10 B5 39.15(13) . . . . ?
B6 B9 B10 B5 100.40(16) . . . . ?
B7 B9 B10 B5 137.81(16) . . . . ?
C3 B9 B10 B3 -61.62(18) . . . . ?
B6 B9 B10 B3 -0.4(2) . . . . ?
B5 B9 B10 B3 -100.78(16) . . . . ?
B7 B9 B10 B3 37.03(14) . . . . ?
C3 B9 B10 B7 -98.66(16) . . . . ?
B6 B9 B10 B7 -37.42(15) . . . . ?
B5 B9 B10 B7 -137.81(16) . . . . ?
C3 B9 B10 B4 1.97(19) . . . . ?
B6 B9 B10 B4 63.21(19) . . . . ?
B5 B9 B10 B4 -37.19(14) . . . . ?
B7 B9 B10 B4 100.63(17) . . . . ?
C3 B5 B10 B9 -39.65(14) . . . . ?
B1 B5 B10 B9 -101.44(16) . . . . ?
B4 B5 B10 B9 -138.50(15) . . . . ?
C3 B5 B10 B3 61.49(18) . . . . ?
B1 B5 B10 B3 -0.3(2) . . . . ?
B9 B5 B10 B3 101.14(16) . . . . ?
B4 B5 B10 B3 -37.36(14) . . . . ?
C3 B5 B10 B7 -2.0(2) . . . . ?
B1 B5 B10 B7 -63.79(19) . . . . ?
B9 B5 B10 B7 37.65(15) . . . . ?
B4 B5 B10 B7 -100.84(17) . . . . ?
C3 B5 B10 B4 98.85(15) . . . . ?
B1 B5 B10 B4 37.05(14) . . . . ?
B9 B5 B10 B4 138.50(15) . . . . ?
B2 B3 B10 B9 63.81(19) . . . . ?
B8 B3 B10 B9 0.5(2) . . . . ?
B7 B3 B10 B9 -36.99(14) . . . . ?
B4 B3 B10 B9 101.01(16) . . . . ?
B2 B3 B10 B5 0.1(2) . . . . ?
B8 B3 B10 B5 -63.20(19) . . . . ?
B7 B3 B10 B5 -100.66(17) . . . . ?
B4 B3 B10 B5 37.35(14) . . . . ?
B2 B3 B10 B7 100.80(16) . . . . ?
B8 B3 B10 B7 37.46(14) . . . . ?
B4 B3 B10 B7 138.01(16) . . . . ?
B2 B3 B10 B4 -37.20(14) . . . . ?
B8 B3 B10 B4 -100.55(16) . . . . ?
B7 B3 B10 B4 -138.01(16) . . . . ?
B6 B7 B10 B9 37.50(15) . . . . ?
B8 B7 B10 B9 101.14(16) . . . . ?
B3 B7 B10 B9 138.70(16) . . . . ?
B6 B7 B10 B5 -0.2(2) . . . . ?
B8 B7 B10 B5 63.40(19) . . . . ?
B9 B7 B10 B5 -37.74(15) . . . . ?
B3 B7 B10 B5 100.96(17) . . . . ?
B6 B7 B10 B3 -101.19(16) . . . . ?
B8 B7 B10 B3 -37.55(14) . . . . ?
B9 B7 B10 B3 -138.70(16) . . . . ?
B6 B7 B10 B4 -63.65(19) . . . . ?
B8 B7 B10 B4 0.0(2) . . . . ?
B9 B7 B10 B4 -101.15(16) . . . . ?
B3 B7 B10 B4 37.54(15) . . . . ?
B1 B4 B10 B9 -0.4(2) . . . . ?
B2 B4 B10 B9 -63.92(19) . . . . ?
B5 B4 B10 B9 37.25(14) . . . . ?
B3 B4 B10 B9 -100.99(17) . . . . ?
B1 B4 B10 B5 -37.61(14) . . . . ?
B2 B4 B10 B5 -101.18(16) . . . . ?
B3 B4 B10 B5 -138.25(15) . . . . ?
B1 B4 B10 B3 100.63(16) . . . . ?
B2 B4 B10 B3 37.07(14) . . . . ?
B5 B4 B10 B3 138.25(15) . . . . ?
B1 B4 B10 B7 63.09(19) . . . . ?
B2 B4 B10 B7 -0.5(2) . . . . ?
B5 B4 B10 B7 100.70(16) . . . . ?
B3 B4 B10 B7 -37.55(14) . . . . ?
B12 B14 B19 B18 63.78(19) . . . . ?
B15 B14 B19 B18 0.5(2) . . . . ?
B13 B14 B19 B18 101.19(16) . . . . ?
B20 B14 B19 B18 -36.88(15) . . . . ?
B12 B14 B19 B17 -0.2(2) . . . . ?
B15 B14 B19 B17 -63.55(19) . . . . ?
B13 B14 B19 B17 37.17(15) . . . . ?
B20 B14 B19 B17 -100.91(17) . . . . ?
B12 B14 B19 B13 -37.41(14) . . . . ?
B15 B14 B19 B13 -100.71(16) . . . . ?
B20 B14 B19 B13 -138.07(16) . . . . ?
B12 B14 B19 B20 100.66(16) . . . . ?
B15 B14 B19 B20 37.36(14) . . . . ?
B13 B14 B19 B20 138.07(16) . . . . ?
C17 B18 B19 B14 -61.74(19) . . . . ?
B16 B18 B19 B14 -0.5(2) . . . . ?
B20 B18 B19 B14 37.09(15) . . . . ?
B17 B18 B19 B14 -101.24(17) . . . . ?
C17 B18 B19 B17 39.50(14) . . . . ?
B16 B18 B19 B17 100.69(16) . . . . ?
B20 B18 B19 B17 138.32(16) . . . . ?
C17 B18 B19 B13 2.4(2) . . . . ?
B16 B18 B19 B13 63.56(19) . . . . ?
B20 B18 B19 B13 101.19(17) . . . . ?
B17 B18 B19 B13 -37.13(15) . . . . ?
C17 B18 B19 B20 -98.82(16) . . . . ?
B16 B18 B19 B20 -37.63(14) . . . . ?
B17 B18 B19 B20 -138.32(16) . . . . ?
C17 B17 B19 B14 61.70(19) . . . . ?
B11 B17 B19 B14 0.4(2) . . . . ?
B13 B17 B19 B14 -37.35(14) . . . . ?
B18 B17 B19 B14 101.28(17) . . . . ?
C17 B17 B19 B18 -39.58(14) . . . . ?
B11 B17 B19 B18 -100.86(16) . . . . ?
B13 B17 B19 B18 -138.63(16) . . . . ?
C17 B17 B19 B13 99.05(16) . . . . ?
B11 B17 B19 B13 37.77(14) . . . . ?
B18 B17 B19 B13 138.63(16) . . . . ?
C17 B17 B19 B20 -2.3(2) . . . . ?
B11 B17 B19 B20 -63.58(19) . . . . ?
B13 B17 B19 B20 -101.35(17) . . . . ?
B18 B17 B19 B20 37.28(15) . . . . ?
B11 B13 B19 B14 100.29(16) . . . . ?
B12 B13 B19 B14 37.09(14) . . . . ?
B17 B13 B19 B14 138.60(16) . . . . ?
B11 B13 B19 B18 -1.0(2) . . . . ?
B12 B13 B19 B18 -64.24(19) . . . . ?
B17 B13 B19 B18 37.27(15) . . . . ?
B14 B13 B19 B18 -101.33(17) . . . . ?
B11 B13 B19 B17 -38.31(14) . . . . ?
B12 B13 B19 B17 -101.51(16) . . . . ?
B14 B13 B19 B17 -138.60(16) . . . . ?
B11 B13 B19 B20 62.51(19) . . . . ?
B12 B13 B19 B20 -0.7(2) . . . . ?
B17 B13 B19 B20 100.82(17) . . . . ?
B14 B13 B19 B20 -37.78(15) . . . . ?
C17 B16 B20 B15 -98.56(16) . . . . ?
C22 B16 B20 B15 -38.73(14) . . . . ?
B18 B16 B20 B15 -137.80(16) . . . . ?
C17 B16 B20 B18 39.24(14) . . . . ?
C22 B16 B20 B18 99.07(16) . . . . ?
B15 B16 B20 B18 137.80(16) . . . . ?
C17 B16 B20 B19 1.7(2) . . . . ?
C22 B16 B20 B19 61.52(19) . . . . ?
B18 B16 B20 B19 -37.55(15) . . . . ?
B15 B16 B20 B19 100.25(17) . . . . ?
C17 B16 B20 B14 -60.91(19) . . . . ?
C22 B16 B20 B14 -1.1(2) . . . . ?
B18 B16 B20 B14 -100.15(17) . . . . ?
B15 B16 B20 B14 37.65(15) . . . . ?
C22 B15 B20 B16 39.04(14) . . . . ?
B12 B15 B20 B16 100.78(16) . . . . ?
B14 B15 B20 B16 137.85(16) . . . . ?
C22 B15 B20 B18 1.2(2) . . . . ?
B12 B15 B20 B18 62.91(19) . . . . ?
B14 B15 B20 B18 99.97(17) . . . . ?
B16 B15 B20 B18 -37.88(15) . . . . ?
C22 B15 B20 B19 -61.67(18) . . . . ?
B12 B15 B20 B19 0.1(2) . . . . ?
B14 B15 B20 B19 37.14(14) . . . . ?
B16 B15 B20 B19 -100.72(17) . . . . ?
C22 B15 B20 B14 -98.81(16) . . . . ?
B12 B15 B20 B14 -37.07(14) . . . . ?
B16 B15 B20 B14 -137.85(16) . . . . ?
C17 B18 B20 B16 -39.56(14) . . . . ?
B19 B18 B20 B16 -137.60(16) . . . . ?
B17 B18 B20 B16 -100.29(16) . . . . ?
C17 B18 B20 B15 -1.6(2) . . . . ?
B19 B18 B20 B15 -99.63(17) . . . . ?
B16 B18 B20 B15 37.97(15) . . . . ?
B17 B18 B20 B15 -62.32(19) . . . . ?
C17 B18 B20 B19 98.04(16) . . . . ?
B16 B18 B20 B19 137.60(16) . . . . ?
B17 B18 B20 B19 37.31(14) . . . . ?
C17 B18 B20 B14 61.70(18) . . . . ?
B19 B18 B20 B14 -36.34(14) . . . . ?
B16 B18 B20 B14 101.26(16) . . . . ?
B17 B18 B20 B14 1.0(2) . . . . ?
B14 B19 B20 B16 -101.04(16) . . . . ?
B18 B19 B20 B16 37.85(15) . . . . ?
B17 B19 B20 B16 0.4(2) . . . . ?
B13 B19 B20 B16 -63.24(19) . . . . ?
B14 B19 B20 B15 -37.41(14) . . . . ?
B18 B19 B20 B15 101.47(16) . . . . ?
B17 B19 B20 B15 64.00(19) . . . . ?
B13 B19 B20 B15 0.4(2) . . . . ?
B14 B19 B20 B18 -138.89(16) . . . . ?
B17 B19 B20 B18 -37.47(15) . . . . ?
B13 B19 B20 B18 -101.08(16) . . . . ?
B18 B19 B20 B14 138.89(16) . . . . ?
B17 B19 B20 B14 101.42(17) . . . . ?
B13 B19 B20 B14 37.81(14) . . . . ?
B12 B14 B20 B16 -0.8(2) . . . . ?
B19 B14 B20 B16 100.01(17) . . . . ?
B15 B14 B20 B16 -37.87(15) . . . . ?
B13 B14 B20 B16 62.50(19) . . . . ?
B12 B14 B20 B15 37.05(14) . . . . ?
B19 B14 B20 B15 137.88(16) . . . . ?
B13 B14 B20 B15 100.37(16) . . . . ?
B12 B14 B20 B18 -64.39(19) . . . . ?
B19 B14 B20 B18 36.45(14) . . . . ?
B15 B14 B20 B18 -101.43(16) . . . . ?
B13 B14 B20 B18 -1.1(2) . . . . ?
B12 B14 B20 B19 -100.83(16) . . . . ?
B15 B14 B20 B19 -137.88(16) . . . . ?
B13 B14 B20 B19 -37.51(14) . . . . ?

_refine_diff_density_max         0.423
_refine_diff_density_min         -0.277
_refine_diff_density_rms         0.056


_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: CHCl3 / n-hexane'
####################################################################### 
# 
# 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_ydkr_CCDC1
_database_code_depnum_ccdc_archive 'CCDC 2032808'
loop_
_audit_author_name
_audit_author_address
'Junki Ochi'
;Kyoto University
Japan
;
_audit_update_record             
;
2020-09-19 deposited with the CCDC.	2020-12-07 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C14 H18 B10'
_chemical_formula_sum            'C14 H18 B10'
_chemical_formula_weight         294.38

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'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_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+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   11.1424(4)
_cell_length_b                   13.9931(4)
_cell_length_c                   20.6658(6)
_cell_angle_alpha                90
_cell_angle_beta                 92.798(7)
_cell_angle_gamma                90
_cell_volume                     3218.30(18)
_cell_formula_units_Z            8
_cell_measurement_temperature    83(2)
_cell_measurement_reflns_used    37924
_cell_measurement_theta_min      3.52
_cell_measurement_theta_max      55.11

_exptl_crystal_description       platelet
_exptl_crystal_colour            colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.215
_exptl_crystal_F_000             1216
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.750
_exptl_crystal_size_mid          0.250
_exptl_crystal_size_min          0.100
_exptl_absorpt_coefficient_mu    0.059
_shelx_estimated_absorpt_T_min   0.957
_shelx_estimated_absorpt_T_max   0.994
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.7816
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_process_details   'ABSCOR (Rigaku, 1995)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      83(2)
_diffrn_radiation_wavelength     0.71075
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            50386
_diffrn_reflns_av_unetI/netI     0.0348
_diffrn_reflns_av_R_equivalents  0.0544
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         2.338
_diffrn_reflns_theta_max         27.485
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             7376
_reflns_number_gt                6085
_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       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_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)+(0.0609P)²+1.6742P] 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         7376
_refine_ls_number_parameters     433
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0766
_refine_ls_R_factor_gt           0.0599
_refine_ls_wR_factor_ref         0.1410
_refine_ls_wR_factor_gt          0.1334
_refine_ls_goodness_of_fit_ref   1.104
_refine_ls_restrained_S_all      1.104
_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
B1 B 0.29460(16) 0.55053(14) 0.12809(9) 0.0197(4) Uani 1 1 d . . . . .
H1 H 0.332899 0.480848 0.146011 0.024 Uiso 1 1 calc R U . . .
B2 B 0.13876(16) 0.57601(13) 0.12615(9) 0.0177(4) Uani 1 1 d . . . . .
B3 B 0.11741(16) 0.69990(13) 0.13925(9) 0.0200(4) Uani 1 1 d . . . . .
H2 H 0.038048 0.728410 0.164333 0.024 Uiso 1 1 calc R U . . .
B4 B 0.26097(17) 0.75079(14) 0.15055(9) 0.0215(4) Uani 1 1 d . . . . .
H3 H 0.277596 0.812915 0.183967 0.026 Uiso 1 1 calc R U . . .
B5 B 0.33879(18) 0.73858(15) 0.07938(10) 0.0267(4) Uani 1 1 d . . . . .
H4 H 0.406594 0.792708 0.065023 0.032 Uiso 1 1 calc R U . . .
B6 B 0.35894(19) 0.61460(16) 0.06454(10) 0.0265(4) Uani 1 1 d . . . . .
H5 H 0.439497 0.587215 0.039997 0.032 Uiso 1 1 calc R U . . .
B7 B 0.21465(18) 0.56153(14) 0.05307(9) 0.0238(4) Uani 1 1 d . . . . .
H6 H 0.198561 0.498368 0.020511 0.029 Uiso 1 1 calc R U . . .
B8 B 0.24194(19) 0.67790(16) 0.02205(10) 0.0288(4) Uani 1 1 d . . . . .
H7 H 0.244338 0.691924 -0.031233 0.035 Uiso 1 1 calc R U . . .
B9 B 0.18185(18) 0.76305(14) 0.07550(10) 0.0248(4) Uani 1 1 d . . . . .
H8 H 0.144867 0.833217 0.057702 0.030 Uiso 1 1 calc R U . . .
B10 B 0.10502(18) 0.65325(14) 0.05971(9) 0.0231(4) Uani 1 1 d . . . . .
H9 H 0.016725 0.650336 0.031459 0.028 Uiso 1 1 calc R U . . .
B11 B 0.82500(16) 0.74948(13) 0.37161(9) 0.0183(4) Uani 1 1 d . . . . .
H10 H 0.858846 0.819071 0.352888 0.022 Uiso 1 1 calc R U . . .
B12 B 0.67000(16) 0.72586(13) 0.37971(9) 0.0176(4) Uani 1 1 d . . . . .
B13 B 0.64231(17) 0.60229(13) 0.36600(10) 0.0210(4) Uani 1 1 d . . . . .
H11 H 0.555089 0.575214 0.343838 0.025 Uiso 1 1 calc R U . . .
B14 B 0.77988(17) 0.54977(14) 0.34844(9) 0.0220(4) Uani 1 1 d . . . . .
H12 H 0.784383 0.488325 0.313915 0.026 Uiso 1 1 calc R U . . .
B15 B 0.88039(18) 0.55972(14) 0.41666(10) 0.0244(4) Uani 1 1 d . . . . .
H13 H 0.951074 0.504440 0.427851 0.029 Uiso 1 1 calc R U . . .
B16 B 0.90829(18) 0.68304(15) 0.43144(9) 0.0239(4) Uani 1 1 d . . . . .
H14 H 0.996997 0.708719 0.452557 0.029 Uiso 1 1 calc R U . . .
B17 B 0.76949(18) 0.73772(14) 0.44922(9) 0.0219(4) Uani 1 1 d . . . . .
H15 H 0.765351 0.800375 0.482760 0.026 Uiso 1 1 calc R U . . .
B18 B 0.65640(18) 0.64747(14) 0.44628(10) 0.0228(4) Uani 1 1 d . . . . .
H16 H 0.577788 0.650711 0.477980 0.027 Uiso 1 1 calc R U . . .
B19 B 0.72517(18) 0.53715(14) 0.42640(10) 0.0252(4) Uani 1 1 d . . . . .
H17 H 0.692522 0.467089 0.444971 0.030 Uiso 1 1 calc R U . . .
B20 B 0.80409(19) 0.62060(15) 0.47805(10) 0.0261(4) Uani 1 1 d . . . . .
H18 H 0.823233 0.605647 0.530788 0.031 Uiso 1 1 calc R U . . .
C1 C 0.23321(14) 0.63649(11) 0.17665(8) 0.0180(3) Uani 1 1 d . . . . .
C2 C 0.36192(16) 0.65959(13) 0.14161(9) 0.0252(4) Uani 1 1 d . . . . .
H19 H 0.449426 0.661526 0.170652 0.030 Uiso 1 1 calc R U . . .
C3 C 0.23360(13) 0.61279(11) 0.24759(8) 0.0176(3) Uani 1 1 d . . . . .
C4 C 0.30686(14) 0.66513(12) 0.29108(8) 0.0215(3) Uani 1 1 d . . . . .
H20 H 0.354342 0.715750 0.275462 0.026 Uiso 1 1 calc R U . . .
C5 C 0.31164(15) 0.64471(13) 0.35649(9) 0.0250(4) Uani 1 1 d . . . . .
H21 H 0.360692 0.681726 0.385833 0.030 Uiso 1 1 calc R U . . .
C6 C 0.24407(16) 0.56958(14) 0.37886(9) 0.0273(4) Uani 1 1 d . . . . .
H22 H 0.247491 0.554176 0.423680 0.033 Uiso 1 1 calc R U . . .
C7 C 0.17171(16) 0.51712(13) 0.33586(8) 0.0245(4) Uani 1 1 d . . . . .
H23 H 0.126827 0.465345 0.352000 0.029 Uiso 1 1 calc R U . . .
C8 C 0.16188(14) 0.53723(11) 0.26943(8) 0.0177(3) Uani 1 1 d . . . . .
C9 C 0.07524(14) 0.48225(11) 0.22621(8) 0.0179(3) Uani 1 1 d . . . . .
C10 C 0.00499(15) 0.40974(13) 0.25207(9) 0.0238(4) Uani 1 1 d . . . . .
H24 H 0.016406 0.393633 0.296601 0.029 Uiso 1 1 calc R U . . .
C11 C -0.08034(15) 0.36133(13) 0.21414(9) 0.0267(4) Uani 1 1 d . . . . .
H25 H -0.126647 0.312479 0.232852 0.032 Uiso 1 1 calc R U . . .
C12 C -0.09913(15) 0.38317(13) 0.14926(9) 0.0256(4) Uani 1 1 d . . . . .
H26 H -0.159291 0.350777 0.123542 0.031 Uiso 1 1 calc R U . . .
C13 C -0.02932(15) 0.45267(12) 0.12233(8) 0.0220(3) Uani 1 1 d . . . . .
H27 H -0.041086 0.467093 0.077545 0.026 Uiso 1 1 calc R U . . .
C14 C 0.05842(14) 0.50238(11) 0.15952(8) 0.0182(3) Uani 1 1 d . . . . .
C15 C 0.74662(14) 0.66549(11) 0.32511(8) 0.0181(3) Uani 1 1 d . . . . .
C16 C 0.88446(15) 0.63973(12) 0.35465(9) 0.0236(4) Uani 1 1 d . . . . .
H28 H 0.961997 0.637212 0.322184 0.028 Uiso 1 1 calc R U . . .
C17 C 0.72636(14) 0.69211(12) 0.25518(8) 0.0187(3) Uani 1 1 d . . . . .
C18 C 0.78885(15) 0.64290(13) 0.20865(8) 0.0231(4) Uani 1 1 d . . . . .
H29 H 0.841830 0.592608 0.221868 0.028 Uiso 1 1 calc R U . . .
C19 C 0.77505(16) 0.66600(14) 0.14383(9) 0.0287(4) Uani 1 1 d . . . . .
H30 H 0.817121 0.631537 0.112453 0.034 Uiso 1 1 calc R U . . .
C20 C 0.69924(18) 0.73987(15) 0.12538(9) 0.0337(4) Uani 1 1 d . . . . .
H31 H 0.689189 0.756670 0.080910 0.040 Uiso 1 1 calc R U . . .
C21 C 0.63760(17) 0.78982(14) 0.17101(9) 0.0281(4) Uani 1 1 d . . . . .
H32 H 0.586460 0.840838 0.156963 0.034 Uiso 1 1 calc R U . . .
C22 C 0.64789(14) 0.76785(12) 0.23729(8) 0.0192(3) Uani 1 1 d . . . . .
C23 C 0.57470(14) 0.82151(11) 0.28374(8) 0.0178(3) Uani 1 1 d . . . . .
C24 C 0.49578(15) 0.89376(12) 0.26172(9) 0.0241(4) Uani 1 1 d . . . . .
H33 H 0.492071 0.910096 0.217053 0.029 Uiso 1 1 calc R U . . .
C25 C 0.42317(16) 0.94192(13) 0.30318(9) 0.0281(4) Uani 1 1 d . . . . .
H34 H 0.370286 0.990338 0.286712 0.034 Uiso 1 1 calc R U . . .
C26 C 0.42709(15) 0.91996(13) 0.36858(9) 0.0262(4) Uani 1 1 d . . . . .
H35 H 0.376237 0.952188 0.397025 0.031 Uiso 1 1 calc R U . . .
C27 C 0.50572(15) 0.85078(12) 0.39177(9) 0.0225(4) Uani 1 1 d . . . . .
H36 H 0.509511 0.836377 0.436749 0.027 Uiso 1 1 calc R U . . .
C28 C 0.58039(14) 0.80102(11) 0.35072(8) 0.0177(3) 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
B1 C2 1.717(3) . ?
B1 C1 1.729(2) . ?
B1 B7 1.757(3) . ?
B1 B6 1.770(3) . ?
B1 B2 1.771(3) . ?
B1 H1 1.1200 . ?
B2 C14 1.549(2) . ?
B2 C1 1.675(2) . ?
B2 B3 1.773(3) . ?
B2 B10 1.773(3) . ?
B2 B7 1.778(3) . ?
B3 C1 1.718(2) . ?
B3 B4 1.756(3) . ?
B3 B9 1.768(3) . ?
B3 B10 1.768(3) . ?
B3 H2 1.1200 . ?
B4 C2 1.717(3) . ?
B4 C1 1.721(2) . ?
B4 B5 1.752(3) . ?
B4 B9 1.755(3) . ?
B4 H3 1.1200 . ?
B5 C2 1.706(3) . ?
B5 B6 1.778(3) . ?
B5 B8 1.779(3) . ?
B5 B9 1.780(3) . ?
B5 H4 1.1200 . ?
B6 C2 1.711(3) . ?
B6 B8 1.773(3) . ?
B6 B7 1.776(3) . ?
B6 H5 1.1200 . ?
B7 B8 1.782(3) . ?
B7 B10 1.782(3) . ?
B7 H6 1.1200 . ?
B8 B9 1.778(3) . ?
B8 B10 1.780(3) . ?
B8 H7 1.1200 . ?
B9 B10 1.781(3) . ?
B9 H8 1.1200 . ?
B10 H9 1.1200 . ?
B11 C16 1.715(2) . ?
B11 C15 1.728(2) . ?
B11 B17 1.755(3) . ?
B11 B16 1.773(3) . ?
B11 B12 1.774(3) . ?
B11 H10 1.1200 . ?
B12 C28 1.550(2) . ?
B12 C15 1.676(2) . ?
B12 B18 1.772(3) . ?
B12 B13 1.777(3) . ?
B12 B17 1.779(3) . ?
B13 C15 1.715(2) . ?
B13 B14 1.754(3) . ?
B13 B19 1.769(3) . ?
B13 B18 1.775(3) . ?
B13 H11 1.1200 . ?
B14 C16 1.716(3) . ?
B14 C15 1.725(2) . ?
B14 B19 1.759(3) . ?
B14 B15 1.763(3) . ?
B14 H12 1.1200 . ?
B15 C16 1.704(3) . ?
B15 B16 1.777(3) . ?
B15 B20 1.779(3) . ?
B15 B19 1.779(3) . ?
B15 H13 1.1200 . ?
B16 C16 1.707(3) . ?
B16 B20 1.774(3) . ?
B16 B17 1.780(3) . ?
B16 H14 1.1200 . ?
B17 B20 1.780(3) . ?
B17 B18 1.783(3) . ?
B17 H15 1.1200 . ?
B18 B19 1.780(3) . ?
B18 B20 1.782(3) . ?
B18 H16 1.1200 . ?
B19 B20 1.784(3) . ?
B19 H17 1.1200 . ?
B20 H18 1.1200 . ?
C1 C3 1.503(2) . ?
C1 C2 1.669(2) . ?
C2 H19 1.1200 . ?
C3 C4 1.392(2) . ?
C3 C8 1.413(2) . ?
C4 C5 1.380(2) . ?
C4 H20 0.9500 . ?
C5 C6 1.385(3) . ?
C5 H21 0.9500 . ?
C6 C7 1.382(2) . ?
C6 H22 0.9500 . ?
C7 C8 1.400(2) . ?
C7 H23 0.9500 . ?
C8 C9 1.496(2) . ?
C9 C10 1.403(2) . ?
C9 C14 1.410(2) . ?
C10 C11 1.380(2) . ?
C10 H24 0.9500 . ?
C11 C12 1.381(3) . ?
C11 H25 0.9500 . ?
C12 C13 1.380(2) . ?
C12 H26 0.9500 . ?
C13 C14 1.399(2) . ?
C13 H27 0.9500 . ?
C15 C17 1.499(2) . ?
C15 C16 1.664(2) . ?
C16 H28 1.1200 . ?
C17 C18 1.396(2) . ?
C17 C22 1.412(2) . ?
C18 C19 1.379(2) . ?
C18 H29 0.9500 . ?
C19 C20 1.377(3) . ?
C19 H30 0.9500 . ?
C20 C21 1.383(3) . ?
C20 H31 0.9500 . ?
C21 C22 1.403(2) . ?
C21 H32 0.9500 . ?
C22 C23 1.492(2) . ?
C23 C24 1.401(2) . ?
C23 C28 1.412(2) . ?
C24 C25 1.382(3) . ?
C24 H33 0.9500 . ?
C25 C26 1.385(3) . ?
C25 H34 0.9500 . ?
C26 C27 1.376(2) . ?
C26 H35 0.9500 . ?
C27 C28 1.402(2) . ?
C27 H36 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 B1 C1 57.95(10) . . ?
C2 B1 B7 105.33(13) . . ?
C1 B1 B7 104.67(13) . . ?
C2 B1 B6 58.75(11) . . ?
C1 B1 B6 105.32(13) . . ?
B7 B1 B6 60.47(11) . . ?
C2 B1 B2 104.16(13) . . ?
C1 B1 B2 57.17(10) . . ?
B7 B1 B2 60.52(11) . . ?
B6 B1 B2 108.25(13) . . ?
C2 B1 H1 124.3 . . ?
C1 B1 H1 124.7 . . ?
B7 B1 H1 122.5 . . ?
B6 B1 H1 121.6 . . ?
B2 B1 H1 122.7 . . ?
C14 B2 C1 114.70(13) . . ?
C14 B2 B1 116.32(13) . . ?
C1 B2 B1 60.14(10) . . ?
C14 B2 B3 119.85(14) . . ?
C1 B2 B3 59.71(10) . . ?
B1 B2 B3 109.40(13) . . ?
C14 B2 B10 130.16(14) . . ?
C1 B2 B10 106.11(13) . . ?
B1 B2 B10 108.11(13) . . ?
B3 B2 B10 59.81(11) . . ?
C14 B2 B7 127.71(14) . . ?
C1 B2 B7 106.05(13) . . ?
B1 B2 B7 59.33(10) . . ?
B3 B2 B7 108.31(13) . . ?
B10 B2 B7 60.23(11) . . ?
C1 B3 B4 59.36(10) . . ?
C1 B3 B9 105.66(13) . . ?
B4 B3 B9 59.73(11) . . ?
C1 B3 B10 104.50(13) . . ?
B4 B3 B10 107.62(14) . . ?
B9 B3 B10 60.50(11) . . ?
C1 B3 B2 57.33(10) . . ?
B4 B3 B2 106.78(13) . . ?
B9 B3 B2 108.21(14) . . ?
B10 B3 B2 60.11(10) . . ?
C1 B3 H2 124.6 . . ?
B4 B3 H2 121.9 . . ?
B9 B3 H2 121.7 . . ?
B10 B3 H2 122.3 . . ?
B2 B3 H2 122.3 . . ?
C2 B4 C1 58.10(10) . . ?
C2 B4 B5 58.90(11) . . ?
C1 B4 B5 106.05(14) . . ?
C2 B4 B9 106.32(14) . . ?
C1 B4 B9 106.12(13) . . ?
B5 B4 B9 61.01(11) . . ?
C2 B4 B3 106.35(13) . . ?
C1 B4 B3 59.22(10) . . ?
B5 B4 B3 109.50(14) . . ?
B9 B4 B3 60.46(11) . . ?
C2 B4 H3 123.6 . . ?
C1 B4 H3 123.7 . . ?
B5 B4 H3 121.3 . . ?
B9 B4 H3 122.0 . . ?
B3 B4 H3 121.3 . . ?
C2 B5 B4 59.54(11) . . ?
C2 B5 B6 58.80(11) . . ?
B4 B5 B6 108.17(14) . . ?
C2 B5 B8 104.91(14) . . ?
B4 B5 B8 107.26(14) . . ?
B6 B5 B8 59.80(12) . . ?
C2 B5 B9 105.70(14) . . ?
B4 B5 B9 59.58(11) . . ?
B6 B5 B9 108.18(15) . . ?
B8 B5 B9 59.94(12) . . ?
C2 B5 H4 124.0 . . ?
B4 B5 H4 121.6 . . ?
B6 B5 H4 121.4 . . ?
B8 B5 H4 122.8 . . ?
B9 B5 H4 122.1 . . ?
C2 B6 B1 59.08(10) . . ?
C2 B6 B8 104.93(14) . . ?
B1 B6 B8 107.81(14) . . ?
C2 B6 B7 104.74(13) . . ?
B1 B6 B7 59.38(11) . . ?
B8 B6 B7 60.26(12) . . ?
C2 B6 B5 58.49(11) . . ?
B1 B6 B5 107.89(14) . . ?
B8 B6 B5 60.13(12) . . ?
B7 B6 B5 108.05(14) . . ?
C2 B6 H5 124.6 . . ?
B1 B6 H5 121.7 . . ?
B8 B6 H5 122.2 . . ?
B7 B6 H5 122.5 . . ?
B5 B6 H5 121.5 . . ?
B1 B7 B6 60.14(11) . . ?
B1 B7 B2 60.14(10) . . ?
B6 B7 B2 107.69(13) . . ?
B1 B7 B8 108.04(14) . . ?
B6 B7 B8 59.78(12) . . ?
B2 B7 B8 107.35(14) . . ?
B1 B7 B10 108.38(14) . . ?
B6 B7 B10 107.94(14) . . ?
B2 B7 B10 59.75(11) . . ?
B8 B7 B10 59.94(11) . . ?
B1 B7 H6 121.4 . . ?
B6 B7 H6 121.8 . . ?
B2 B7 H6 122.1 . . ?
B8 B7 H6 122.0 . . ?
B10 B7 H6 121.6 . . ?
B6 B8 B9 108.49(14) . . ?
B6 B8 B5 60.07(12) . . ?
B9 B8 B5 60.06(12) . . ?
B6 B8 B10 108.16(14) . . ?
B9 B8 B10 60.09(11) . . ?
B5 B8 B10 107.83(14) . . ?
B6 B8 B7 59.96(12) . . ?
B9 B8 B7 108.23(14) . . ?
B5 B8 B7 107.77(14) . . ?
B10 B8 B7 60.03(11) . . ?
B6 B8 H7 121.5 . . ?
B9 B8 H7 121.4 . . ?
B5 B8 H7 121.9 . . ?
B10 B8 H7 121.7 . . ?
B7 B8 H7 121.8 . . ?
B4 B9 B3 59.81(11) . . ?
B4 B9 B8 107.19(14) . . ?
B3 B9 B8 107.89(14) . . ?
B4 B9 B5 59.42(11) . . ?
B3 B9 B5 107.71(13) . . ?
B8 B9 B5 60.01(12) . . ?
B4 B9 B10 107.09(13) . . ?
B3 B9 B10 59.75(11) . . ?
B8 B9 B10 60.02(12) . . ?
B5 B9 B10 107.74(14) . . ?
B4 B9 H8 122.5 . . ?
B3 B9 H8 121.8 . . ?
B8 B9 H8 121.8 . . ?
B5 B9 H8 121.9 . . ?
B10 B9 H8 122.0 . . ?
B3 B10 B2 60.08(10) . . ?
B3 B10 B8 107.78(14) . . ?
B2 B10 B8 107.63(13) . . ?
B3 B10 B9 59.74(11) . . ?
B2 B10 B9 107.59(13) . . ?
B8 B10 B9 59.89(12) . . ?
B3 B10 B7 108.36(13) . . ?
B2 B10 B7 60.02(10) . . ?
B8 B10 B7 60.03(12) . . ?
B9 B10 B7 108.07(14) . . ?
B3 B10 H9 121.7 . . ?
B2 B10 H9 121.9 . . ?
B8 B10 H9 121.9 . . ?
B9 B10 H9 121.9 . . ?
B7 B10 H9 121.5 . . ?
C16 B11 C15 57.81(10) . . ?
C16 B11 B17 105.05(13) . . ?
C15 B11 B17 104.67(13) . . ?
C16 B11 B16 58.58(10) . . ?
C15 B11 B16 105.33(13) . . ?
B17 B11 B16 60.60(11) . . ?
C16 B11 B12 103.88(13) . . ?
C15 B11 B12 57.17(9) . . ?
B17 B11 B12 60.53(11) . . ?
B16 B11 B12 108.38(13) . . ?
C16 B11 H10 124.6 . . ?
C15 B11 H10 124.7 . . ?
B17 B11 H10 122.5 . . ?
B16 B11 H10 121.6 . . ?
B12 B11 H10 122.7 . . ?
C28 B12 C15 114.92(14) . . ?
C28 B12 B18 129.95(14) . . ?
C15 B12 B18 106.04(13) . . ?
C28 B12 B11 116.66(13) . . ?
C15 B12 B11 60.02(10) . . ?
B18 B12 B11 108.01(13) . . ?
C28 B12 B13 119.67(14) . . ?
C15 B12 B13 59.49(10) . . ?
B18 B12 B13 60.04(11) . . ?
B11 B12 B13 109.18(13) . . ?
C28 B12 B17 127.81(14) . . ?
C15 B12 B17 105.83(13) . . ?
B18 B12 B17 60.29(11) . . ?
B11 B12 B17 59.19(10) . . ?
B13 B12 B17 108.43(13) . . ?
C15 B13 B14 59.61(10) . . ?
C15 B13 B19 105.69(13) . . ?
B14 B13 B19 59.92(11) . . ?
C15 B13 B18 104.22(13) . . ?
B14 B13 B18 107.72(14) . . ?
B19 B13 B18 60.31(11) . . ?
C15 B13 B12 57.34(10) . . ?
B14 B13 B12 107.11(13) . . ?
B19 B13 B12 107.96(14) . . ?
B18 B13 B12 59.84(10) . . ?
C15 B13 H11 124.6 . . ?
B14 B13 H11 121.6 . . ?
B19 B13 H11 121.8 . . ?
B18 B13 H11 122.5 . . ?
B12 B13 H11 122.3 . . ?
C16 B14 C15 57.86(10) . . ?
C16 B14 B13 105.92(13) . . ?
C15 B14 B13 59.09(10) . . ?
C16 B14 B19 105.64(14) . . ?
C15 B14 B19 105.72(13) . . ?
B13 B14 B19 60.47(11) . . ?
C16 B14 B15 58.64(11) . . ?
C15 B14 B15 105.60(13) . . ?
B13 B14 B15 109.21(14) . . ?
B19 B14 B15 60.69(11) . . ?
C16 B14 H12 124.0 . . ?
C15 B14 H12 123.9 . . ?
B13 B14 H12 121.4 . . ?
B19 B14 H12 122.3 . . ?
B15 B14 H12 121.6 . . ?
C16 B15 B14 59.31(11) . . ?
C16 B15 B16 58.69(11) . . ?
B14 B15 B16 108.25(14) . . ?
C16 B15 B20 104.65(14) . . ?
B14 B15 B20 107.53(14) . . ?
B16 B15 B20 59.87(11) . . ?
C16 B15 B19 105.28(14) . . ?
B14 B15 B19 59.56(11) . . ?
B16 B15 B19 108.41(14) . . ?
B20 B15 B19 60.21(12) . . ?
C16 B15 H13 124.4 . . ?
B14 B15 H13 121.6 . . ?
B16 B15 H13 121.3 . . ?
B20 B15 H13 122.6 . . ?
B19 B15 H13 122.1 . . ?
C16 B16 B11 59.04(10) . . ?
C16 B16 B20 104.69(14) . . ?
B11 B16 B20 107.62(14) . . ?
C16 B16 B15 58.51(11) . . ?
B11 B16 B15 107.95(13) . . ?
B20 B16 B15 60.11(11) . . ?
C16 B16 B17 104.31(13) . . ?
B11 B16 B17 59.20(10) . . ?
B20 B16 B17 60.09(11) . . ?
B15 B16 B17 107.84(14) . . ?
C16 B16 H14 124.8 . . ?
B11 B16 H14 121.7 . . ?
B20 B16 H14 122.3 . . ?
B15 B16 H14 121.5 . . ?
B17 B16 H14 122.7 . . ?
B11 B17 B12 60.28(10) . . ?
B11 B17 B20 108.19(13) . . ?
B12 B17 B20 107.50(14) . . ?
B11 B17 B16 60.20(10) . . ?
B12 B17 B16 107.86(13) . . ?
B20 B17 B16 59.80(11) . . ?
B11 B17 B18 108.38(13) . . ?
B12 B17 B18 59.66(11) . . ?
B20 B17 B18 60.02(11) . . ?
B16 B17 B18 107.96(14) . . ?
B11 B17 H15 121.3 . . ?
B12 B17 H15 122.0 . . ?
B20 B17 H15 121.9 . . ?
B16 B17 H15 121.8 . . ?
B18 B17 H15 121.7 . . ?
B12 B18 B13 60.12(10) . . ?
B12 B18 B19 107.67(13) . . ?
B13 B18 B19 59.67(11) . . ?
B12 B18 B20 107.71(13) . . ?
B13 B18 B20 107.89(14) . . ?
B19 B18 B20 60.12(11) . . ?
B12 B18 B17 60.05(10) . . ?
B13 B18 B17 108.31(13) . . ?
B19 B18 B17 108.09(14) . . ?
B20 B18 B17 59.89(11) . . ?
B12 B18 H16 121.9 . . ?
B13 B18 H16 121.7 . . ?
B19 B18 H16 121.9 . . ?
B20 B18 H16 121.8 . . ?
B17 B18 H16 121.5 . . ?
B14 B19 B13 59.61(11) . . ?
B14 B19 B15 59.75(11) . . ?
B13 B19 B15 107.78(14) . . ?
B14 B19 B18 107.25(13) . . ?
B13 B19 B18 60.02(11) . . ?
B15 B19 B18 107.70(14) . . ?
B14 B19 B20 107.43(14) . . ?
B13 B19 B20 108.05(14) . . ?
B15 B19 B20 59.88(11) . . ?
B18 B19 B20 59.98(11) . . ?
B14 B19 H17 122.3 . . ?
B13 B19 H17 121.7 . . ?
B15 B19 H17 121.9 . . ?
B18 B19 H17 122.0 . . ?
B20 B19 H17 121.8 . . ?
B16 B20 B15 60.03(11) . . ?
B16 B20 B17 60.10(11) . . ?
B15 B20 B17 107.79(14) . . ?
B16 B20 B18 108.25(14) . . ?
B15 B20 B18 107.65(14) . . ?
B17 B20 B18 60.08(11) . . ?
B16 B20 B19 108.30(14) . . ?
B15 B20 B19 59.91(11) . . ?
B17 B20 B19 108.06(14) . . ?
B18 B20 B19 59.90(11) . . ?
B16 B20 H18 121.4 . . ?
B15 B20 H18 122.0 . . ?
B17 B20 H18 121.7 . . ?
B18 B20 H18 121.8 . . ?
B19 B20 H18 121.6 . . ?
C3 C1 C2 120.28(13) . . ?
C3 C1 B2 117.91(13) . . ?
C2 C1 B2 110.76(13) . . ?
C3 C1 B3 121.27(13) . . ?
C2 C1 B3 110.31(13) . . ?
B2 C1 B3 62.97(10) . . ?
C3 C1 B4 121.26(13) . . ?
C2 C1 B4 60.84(10) . . ?
B2 C1 B4 113.04(13) . . ?
B3 C1 B4 61.42(10) . . ?
C3 C1 B1 115.48(13) . . ?
C2 C1 B1 60.68(10) . . ?
B2 C1 B1 62.69(10) . . ?
B3 C1 B1 114.08(13) . . ?
B4 C1 B1 112.49(12) . . ?
C1 C2 B5 110.55(13) . . ?
C1 C2 B6 110.75(13) . . ?
B5 C2 B6 62.70(12) . . ?
C1 C2 B4 61.06(10) . . ?
B5 C2 B4 61.57(11) . . ?
B6 C2 B4 112.98(14) . . ?
C1 C2 B1 61.37(10) . . ?
B5 C2 B1 113.86(14) . . ?
B6 C2 B1 62.17(11) . . ?
B4 C2 B1 113.25(13) . . ?
C1 C2 H19 121.1 . . ?
B5 C2 H19 118.9 . . ?
B6 C2 H19 119.0 . . ?
B4 C2 H19 118.8 . . ?
B1 C2 H19 118.1 . . ?
C4 C3 C8 120.69(15) . . ?
C4 C3 C1 119.16(14) . . ?
C8 C3 C1 120.14(14) . . ?
C5 C4 C3 121.11(16) . . ?
C5 C4 H20 119.4 . . ?
C3 C4 H20 119.4 . . ?
C4 C5 C6 119.23(16) . . ?
C4 C5 H21 120.4 . . ?
C6 C5 H21 120.4 . . ?
C7 C6 C5 119.88(16) . . ?
C7 C6 H22 120.1 . . ?
C5 C6 H22 120.1 . . ?
C6 C7 C8 122.61(16) . . ?
C6 C7 H23 118.7 . . ?
C8 C7 H23 118.7 . . ?
C7 C8 C3 116.44(15) . . ?
C7 C8 C9 119.95(14) . . ?
C3 C8 C9 123.57(14) . . ?
C10 C9 C14 117.82(15) . . ?
C10 C9 C8 120.03(15) . . ?
C14 C9 C8 122.13(14) . . ?
C11 C10 C9 121.36(16) . . ?
C11 C10 H24 119.3 . . ?
C9 C10 H24 119.3 . . ?
C10 C11 C12 120.69(16) . . ?
C10 C11 H25 119.7 . . ?
C12 C11 H25 119.7 . . ?
C13 C12 C11 119.08(16) . . ?
C13 C12 H26 120.5 . . ?
C11 C12 H26 120.5 . . ?
C12 C13 C14 121.43(16) . . ?
C12 C13 H27 119.3 . . ?
C14 C13 H27 119.3 . . ?
C13 C14 C9 119.58(15) . . ?
C13 C14 B2 119.32(15) . . ?
C9 C14 B2 121.06(14) . . ?
C17 C15 C16 120.02(13) . . ?
C17 C15 B12 117.79(13) . . ?
C16 C15 B12 110.69(13) . . ?
C17 C15 B13 121.96(13) . . ?
C16 C15 B13 110.06(13) . . ?
B12 C15 B13 63.17(10) . . ?
C17 C15 B14 121.54(13) . . ?
C16 C15 B14 60.81(10) . . ?
B12 C15 B14 113.24(13) . . ?
B13 C15 B14 61.30(10) . . ?
C17 C15 B11 114.55(13) . . ?
C16 C15 B11 60.72(10) . . ?
B12 C15 B11 62.81(10) . . ?
B13 C15 B11 114.39(13) . . ?
B14 C15 B11 112.79(12) . . ?
C15 C16 B15 111.11(14) . . ?
C15 C16 B16 111.28(13) . . ?
B15 C16 B16 62.80(11) . . ?
C15 C16 B11 61.47(10) . . ?
B15 C16 B11 114.20(14) . . ?
B16 C16 B11 62.38(11) . . ?
C15 C16 B14 61.33(10) . . ?
B15 C16 B14 62.05(11) . . ?
B16 C16 B14 113.84(14) . . ?
B11 C16 B14 113.85(13) . . ?
C15 C16 H28 120.8 . . ?
B15 C16 H28 118.7 . . ?
B16 C16 H28 118.6 . . ?
B11 C16 H28 117.9 . . ?
B14 C16 H28 118.2 . . ?
C18 C17 C22 120.89(15) . . ?
C18 C17 C15 119.00(15) . . ?
C22 C17 C15 120.08(14) . . ?
C19 C18 C17 121.17(17) . . ?
C19 C18 H29 119.4 . . ?
C17 C18 H29 119.4 . . ?
C20 C19 C18 118.86(17) . . ?
C20 C19 H30 120.6 . . ?
C18 C19 H30 120.6 . . ?
C19 C20 C21 120.60(17) . . ?
C19 C20 H31 119.7 . . ?
C21 C20 H31 119.7 . . ?
C20 C21 C22 122.36(17) . . ?
C20 C21 H32 118.8 . . ?
C22 C21 H32 118.8 . . ?
C21 C22 C17 116.11(15) . . ?
C21 C22 C23 119.77(15) . . ?
C17 C22 C23 124.08(14) . . ?
C24 C23 C28 117.53(15) . . ?
C24 C23 C22 120.55(15) . . ?
C28 C23 C22 121.91(14) . . ?
C25 C24 C23 121.85(16) . . ?
C25 C24 H33 119.1 . . ?
C23 C24 H33 119.1 . . ?
C24 C25 C26 120.35(16) . . ?
C24 C25 H34 119.8 . . ?
C26 C25 H34 119.8 . . ?
C27 C26 C25 119.03(16) . . ?
C27 C26 H35 120.5 . . ?
C25 C26 H35 120.5 . . ?
C26 C27 C28 121.68(16) . . ?
C26 C27 H36 119.2 . . ?
C28 C27 H36 119.2 . . ?
C27 C28 C23 119.52(15) . . ?
C27 C28 B12 119.55(15) . . ?
C23 C28 B12 120.92(14) . . ?

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
C2 B1 B2 C14 -140.18(14) . . . . ?
C1 B1 B2 C14 -104.69(15) . . . . ?
B7 B1 B2 C14 120.00(16) . . . . ?
B6 B1 B2 C14 158.52(14) . . . . ?
C2 B1 B2 C1 -35.49(11) . . . . ?
B7 B1 B2 C1 -135.31(14) . . . . ?
B6 B1 B2 C1 -96.79(14) . . . . ?
C2 B1 B2 B3 -0.46(17) . . . . ?
C1 B1 B2 B3 35.03(12) . . . . ?
B7 B1 B2 B3 -100.28(14) . . . . ?
B6 B1 B2 B3 -61.76(17) . . . . ?
C2 B1 B2 B10 63.07(15) . . . . ?
C1 B1 B2 B10 98.56(14) . . . . ?
B7 B1 B2 B10 -36.75(13) . . . . ?
B6 B1 B2 B10 1.77(18) . . . . ?
C2 B1 B2 B7 99.82(14) . . . . ?
C1 B1 B2 B7 135.31(14) . . . . ?
B6 B1 B2 B7 38.51(13) . . . . ?
C14 B2 B3 C1 102.87(16) . . . . ?
B1 B2 B3 C1 -35.21(12) . . . . ?
B10 B2 B3 C1 -135.37(14) . . . . ?
B7 B2 B3 C1 -98.27(14) . . . . ?
C14 B2 B3 B4 137.21(15) . . . . ?
C1 B2 B3 B4 34.34(12) . . . . ?
B1 B2 B3 B4 -0.87(17) . . . . ?
B10 B2 B3 B4 -101.03(15) . . . . ?
B7 B2 B3 B4 -63.93(16) . . . . ?
C14 B2 B3 B9 -159.86(14) . . . . ?
C1 B2 B3 B9 97.27(14) . . . . ?
B1 B2 B3 B9 62.06(16) . . . . ?
B10 B2 B3 B9 -38.10(13) . . . . ?
B7 B2 B3 B9 -1.00(17) . . . . ?
C14 B2 B3 B10 -121.76(17) . . . . ?
C1 B2 B3 B10 135.37(14) . . . . ?
B1 B2 B3 B10 100.16(14) . . . . ?
B7 B2 B3 B10 37.10(13) . . . . ?
C1 B3 B4 C2 35.34(12) . . . . ?
B9 B3 B4 C2 -99.81(15) . . . . ?
B10 B3 B4 C2 -61.39(16) . . . . ?
B2 B3 B4 C2 1.85(17) . . . . ?
B9 B3 B4 C1 -135.15(14) . . . . ?
B10 B3 B4 C1 -96.73(13) . . . . ?
B2 B3 B4 C1 -33.50(12) . . . . ?
C1 B3 B4 B5 97.49(15) . . . . ?
B9 B3 B4 B5 -37.66(13) . . . . ?
B10 B3 B4 B5 0.76(18) . . . . ?
B2 B3 B4 B5 63.99(17) . . . . ?
C1 B3 B4 B9 135.15(14) . . . . ?
B10 B3 B4 B9 38.42(13) . . . . ?
B2 B3 B4 B9 101.65(15) . . . . ?
C1 B4 B5 C2 -35.35(12) . . . . ?
B9 B4 B5 C2 -135.20(14) . . . . ?
B3 B4 B5 C2 -97.77(14) . . . . ?
C2 B4 B5 B6 34.36(13) . . . . ?
C1 B4 B5 B6 -0.99(18) . . . . ?
B9 B4 B5 B6 -100.84(15) . . . . ?
B3 B4 B5 B6 -63.41(17) . . . . ?
C2 B4 B5 B8 97.46(15) . . . . ?
C1 B4 B5 B8 62.10(16) . . . . ?
B9 B4 B5 B8 -37.74(13) . . . . ?
B3 B4 B5 B8 -0.31(18) . . . . ?
C2 B4 B5 B9 135.20(14) . . . . ?
C1 B4 B5 B9 99.84(14) . . . . ?
B3 B4 B5 B9 37.42(13) . . . . ?
C1 B1 B6 C2 35.92(12) . . . . ?
B7 B1 B6 C2 134.35(14) . . . . ?
B2 B1 B6 C2 95.81(14) . . . . ?
C2 B1 B6 B8 -97.06(16) . . . . ?
C1 B1 B6 B8 -61.15(17) . . . . ?
B7 B1 B6 B8 37.29(14) . . . . ?
B2 B1 B6 B8 -1.25(19) . . . . ?
C2 B1 B6 B7 -134.35(14) . . . . ?
C1 B1 B6 B7 -98.43(14) . . . . ?
B2 B1 B6 B7 -38.54(13) . . . . ?
C2 B1 B6 B5 -33.55(13) . . . . ?
C1 B1 B6 B5 2.37(17) . . . . ?
B7 B1 B6 B5 100.80(15) . . . . ?
B2 B1 B6 B5 62.26(17) . . . . ?
B4 B5 B6 C2 -34.66(13) . . . . ?
B8 B5 B6 C2 -134.47(15) . . . . ?
B9 B5 B6 C2 -97.71(15) . . . . ?
C2 B5 B6 B1 33.78(13) . . . . ?
B4 B5 B6 B1 -0.88(19) . . . . ?
B8 B5 B6 B1 -100.68(15) . . . . ?
B9 B5 B6 B1 -63.93(17) . . . . ?
C2 B5 B6 B8 134.47(15) . . . . ?
B4 B5 B6 B8 99.81(15) . . . . ?
B9 B5 B6 B8 36.76(13) . . . . ?
C2 B5 B6 B7 96.54(14) . . . . ?
B4 B5 B6 B7 61.88(17) . . . . ?
B8 B5 B6 B7 -37.92(13) . . . . ?
B9 B5 B6 B7 -1.17(18) . . . . ?
C2 B1 B7 B6 39.34(13) . . . . ?
C1 B1 B7 B6 99.53(14) . . . . ?
B2 B1 B7 B6 137.18(14) . . . . ?
C2 B1 B7 B2 -97.85(13) . . . . ?
C1 B1 B7 B2 -37.66(11) . . . . ?
B6 B1 B7 B2 -137.18(14) . . . . ?
C2 B1 B7 B8 2.21(17) . . . . ?
C1 B1 B7 B8 62.40(16) . . . . ?
B6 B1 B7 B8 -37.13(14) . . . . ?
B2 B1 B7 B8 100.06(15) . . . . ?
C2 B1 B7 B10 -61.24(16) . . . . ?
C1 B1 B7 B10 -1.05(17) . . . . ?
B6 B1 B7 B10 -100.58(15) . . . . ?
B2 B1 B7 B10 36.60(13) . . . . ?
C2 B6 B7 B1 -39.37(12) . . . . ?
B8 B6 B7 B1 -138.38(15) . . . . ?
B5 B6 B7 B1 -100.51(15) . . . . ?
C2 B6 B7 B2 -1.15(18) . . . . ?
B1 B6 B7 B2 38.22(13) . . . . ?
B8 B6 B7 B2 -100.16(15) . . . . ?
B5 B6 B7 B2 -62.29(17) . . . . ?
C2 B6 B7 B8 99.01(15) . . . . ?
B1 B6 B7 B8 138.38(15) . . . . ?
B5 B6 B7 B8 37.87(13) . . . . ?
C2 B6 B7 B10 61.94(16) . . . . ?
B1 B6 B7 B10 101.31(14) . . . . ?
B8 B6 B7 B10 -37.06(13) . . . . ?
B5 B6 B7 B10 0.80(18) . . . . ?
C14 B2 B7 B1 -101.13(18) . . . . ?
C1 B2 B7 B1 39.40(12) . . . . ?
B3 B2 B7 B1 102.16(14) . . . . ?
B10 B2 B7 B1 139.08(14) . . . . ?
C14 B2 B7 B6 -139.35(16) . . . . ?
C1 B2 B7 B6 1.18(17) . . . . ?
B1 B2 B7 B6 -38.22(13) . . . . ?
B3 B2 B7 B6 63.94(16) . . . . ?
B10 B2 B7 B6 100.85(15) . . . . ?
C14 B2 B7 B8 157.64(16) . . . . ?
C1 B2 B7 B8 -61.83(16) . . . . ?
B1 B2 B7 B8 -101.23(15) . . . . ?
B3 B2 B7 B8 0.93(17) . . . . ?
B10 B2 B7 B8 37.85(13) . . . . ?
C14 B2 B7 B10 119.79(18) . . . . ?
C1 B2 B7 B10 -99.68(14) . . . . ?
B1 B2 B7 B10 -139.08(14) . . . . ?
B3 B2 B7 B10 -36.92(12) . . . . ?
C2 B6 B8 B9 2.14(18) . . . . ?
B1 B6 B8 B9 63.92(18) . . . . ?
B7 B6 B8 B9 100.82(15) . . . . ?
B5 B6 B8 B9 -36.89(13) . . . . ?
C2 B6 B8 B5 39.03(13) . . . . ?
B1 B6 B8 B5 100.80(15) . . . . ?
B7 B6 B8 B5 137.70(14) . . . . ?
C2 B6 B8 B10 -61.52(18) . . . . ?
B1 B6 B8 B10 0.3(2) . . . . ?
B7 B6 B8 B10 37.16(14) . . . . ?
B5 B6 B8 B10 -100.54(16) . . . . ?
C2 B6 B8 B7 -98.68(14) . . . . ?
B1 B6 B8 B7 -36.90(14) . . . . ?
B5 B6 B8 B7 -137.70(14) . . . . ?
C2 B5 B8 B6 -39.18(13) . . . . ?
B4 B5 B8 B6 -101.36(15) . . . . ?
B9 B5 B8 B6 -138.94(14) . . . . ?
C2 B5 B8 B9 99.76(15) . . . . ?
B4 B5 B8 B9 37.58(13) . . . . ?
B6 B5 B8 B9 138.94(14) . . . . ?
C2 B5 B8 B10 61.93(17) . . . . ?
B4 B5 B8 B10 -0.25(19) . . . . ?
B6 B5 B8 B10 101.11(15) . . . . ?
B9 B5 B8 B10 -37.83(13) . . . . ?
C2 B5 B8 B7 -1.46(19) . . . . ?
B4 B5 B8 B7 -63.64(18) . . . . ?
B6 B5 B8 B7 37.72(13) . . . . ?
B9 B5 B8 B7 -101.22(15) . . . . ?
B1 B7 B8 B6 37.29(13) . . . . ?
B2 B7 B8 B6 100.75(15) . . . . ?
B10 B7 B8 B6 138.51(15) . . . . ?
B1 B7 B8 B9 -63.97(17) . . . . ?
B6 B7 B8 B9 -101.26(15) . . . . ?
B2 B7 B8 B9 -0.51(18) . . . . ?
B10 B7 B8 B9 37.25(13) . . . . ?
B1 B7 B8 B5 -0.48(19) . . . . ?
B6 B7 B8 B5 -37.77(13) . . . . ?
B2 B7 B8 B5 62.98(17) . . . . ?
B10 B7 B8 B5 100.74(16) . . . . ?
B1 B7 B8 B10 -101.22(15) . . . . ?
B6 B7 B8 B10 -138.51(15) . . . . ?
B2 B7 B8 B10 -37.76(13) . . . . ?
C2 B4 B9 B3 99.86(14) . . . . ?
C1 B4 B9 B3 39.10(12) . . . . ?
B5 B4 B9 B3 138.82(15) . . . . ?
C2 B4 B9 B8 -1.20(17) . . . . ?
C1 B4 B9 B8 -61.97(16) . . . . ?
B5 B4 B9 B8 37.75(14) . . . . ?
B3 B4 B9 B8 -101.07(15) . . . . ?
C2 B4 B9 B5 -38.96(13) . . . . ?
C1 B4 B9 B5 -99.72(14) . . . . ?
B3 B4 B9 B5 -138.82(15) . . . . ?
C2 B4 B9 B10 61.92(17) . . . . ?
C1 B4 B9 B10 1.16(18) . . . . ?
B5 B4 B9 B10 100.87(15) . . . . ?
B3 B4 B9 B10 -37.95(13) . . . . ?
C1 B3 B9 B4 -39.06(12) . . . . ?
B10 B3 B9 B4 -137.12(14) . . . . ?
B2 B3 B9 B4 -99.20(14) . . . . ?
C1 B3 B9 B8 60.81(16) . . . . ?
B4 B3 B9 B8 99.88(15) . . . . ?
B10 B3 B9 B8 -37.25(13) . . . . ?
B2 B3 B9 B8 0.68(17) . . . . ?
C1 B3 B9 B5 -2.55(18) . . . . ?
B4 B3 B9 B5 36.51(13) . . . . ?
B10 B3 B9 B5 -100.61(16) . . . . ?
B2 B3 B9 B5 -62.68(17) . . . . ?
C1 B3 B9 B10 98.06(14) . . . . ?
B4 B3 B9 B10 137.12(14) . . . . ?
B2 B3 B9 B10 37.92(12) . . . . ?
B6 B8 B9 B4 -0.59(19) . . . . ?
B5 B8 B9 B4 -37.49(13) . . . . ?
B10 B8 B9 B4 100.17(14) . . . . ?
B7 B8 B9 B4 62.95(17) . . . . ?
B6 B8 B9 B3 -63.64(17) . . . . ?
B5 B8 B9 B3 -100.53(15) . . . . ?
B10 B8 B9 B3 37.13(13) . . . . ?
B7 B8 B9 B3 -0.10(18) . . . . ?
B6 B8 B9 B5 36.89(14) . . . . ?
B10 B8 B9 B5 137.66(14) . . . . ?
B7 B8 B9 B5 100.43(15) . . . . ?
B6 B8 B9 B10 -100.77(15) . . . . ?
B5 B8 B9 B10 -137.66(14) . . . . ?
B7 B8 B9 B10 -37.23(13) . . . . ?
C2 B5 B9 B4 39.12(13) . . . . ?
B6 B5 B9 B4 100.83(15) . . . . ?
B8 B5 B9 B4 137.52(15) . . . . ?
C2 B5 B9 B3 2.43(19) . . . . ?
B4 B5 B9 B3 -36.69(13) . . . . ?
B6 B5 B9 B3 64.14(17) . . . . ?
B8 B5 B9 B3 100.83(15) . . . . ?
C2 B5 B9 B8 -98.40(16) . . . . ?
B4 B5 B9 B8 -137.52(15) . . . . ?
B6 B5 B9 B8 -36.69(13) . . . . ?
C2 B5 B9 B10 -60.63(18) . . . . ?
B4 B5 B9 B10 -99.75(15) . . . . ?
B6 B5 B9 B10 1.08(18) . . . . ?
B8 B5 B9 B10 37.78(13) . . . . ?
C1 B3 B10 B2 37.65(11) . . . . ?
B4 B3 B10 B2 99.61(14) . . . . ?
B9 B3 B10 B2 137.67(14) . . . . ?
C1 B3 B10 B8 -62.86(16) . . . . ?
B4 B3 B10 B8 -0.90(17) . . . . ?
B9 B3 B10 B8 37.16(13) . . . . ?
B2 B3 B10 B8 -100.51(14) . . . . ?
C1 B3 B10 B9 -100.02(13) . . . . ?
B4 B3 B10 B9 -38.07(13) . . . . ?
B2 B3 B10 B9 -137.67(14) . . . . ?
C1 B3 B10 B7 0.63(17) . . . . ?
B4 B3 B10 B7 62.59(17) . . . . ?
B9 B3 B10 B7 100.65(15) . . . . ?
B2 B3 B10 B7 -37.02(13) . . . . ?
C14 B2 B10 B3 105.22(19) . . . . ?
C1 B2 B10 B3 -39.15(12) . . . . ?
B1 B2 B10 B3 -102.36(14) . . . . ?
B7 B2 B10 B3 -138.72(14) . . . . ?
C14 B2 B10 B8 -154.02(17) . . . . ?
C1 B2 B10 B8 61.61(16) . . . . ?
B1 B2 B10 B8 -1.60(18) . . . . ?
B3 B2 B10 B8 100.77(15) . . . . ?
B7 B2 B10 B8 -37.95(14) . . . . ?
C14 B2 B10 B9 142.82(17) . . . . ?
C1 B2 B10 B9 -1.55(17) . . . . ?
B1 B2 B10 B9 -64.76(17) . . . . ?
B3 B2 B10 B9 37.60(13) . . . . ?
B7 B2 B10 B9 -101.12(15) . . . . ?
C14 B2 B10 B7 -116.1(2) . . . . ?
C1 B2 B10 B7 99.57(14) . . . . ?
B1 B2 B10 B7 36.36(13) . . . . ?
B3 B2 B10 B7 138.72(14) . . . . ?
B6 B8 B10 B3 64.22(18) . . . . ?
B9 B8 B10 B3 -37.10(13) . . . . ?
B5 B8 B10 B3 0.71(18) . . . . ?
B7 B8 B10 B3 101.35(14) . . . . ?
B6 B8 B10 B2 0.83(19) . . . . ?
B9 B8 B10 B2 -100.50(14) . . . . ?
B5 B8 B10 B2 -62.68(17) . . . . ?
B7 B8 B10 B2 37.95(13) . . . . ?
B6 B8 B10 B9 101.32(16) . . . . ?
B5 B8 B10 B9 37.81(13) . . . . ?
B7 B8 B10 B9 138.45(14) . . . . ?
B6 B8 B10 B7 -37.13(14) . . . . ?
B9 B8 B10 B7 -138.45(14) . . . . ?
B5 B8 B10 B7 -100.64(15) . . . . ?
B4 B9 B10 B3 37.97(13) . . . . ?
B8 B9 B10 B3 138.32(14) . . . . ?
B5 B9 B10 B3 100.55(15) . . . . ?
B4 B9 B10 B2 0.22(18) . . . . ?
B3 B9 B10 B2 -37.75(12) . . . . ?
B8 B9 B10 B2 100.57(15) . . . . ?
B5 B9 B10 B2 62.80(17) . . . . ?
B4 B9 B10 B8 -100.35(15) . . . . ?
B3 B9 B10 B8 -138.32(14) . . . . ?
B5 B9 B10 B8 -37.77(13) . . . . ?
B4 B9 B10 B7 -63.16(17) . . . . ?
B3 B9 B10 B7 -101.14(14) . . . . ?
B8 B9 B10 B7 37.19(13) . . . . ?
B5 B9 B10 B7 -0.58(18) . . . . ?
B1 B7 B10 B3 0.27(18) . . . . ?
B6 B7 B10 B3 -63.38(17) . . . . ?
B2 B7 B10 B3 37.04(13) . . . . ?
B8 B7 B10 B3 -100.37(15) . . . . ?
B1 B7 B10 B2 -36.77(13) . . . . ?
B6 B7 B10 B2 -100.42(14) . . . . ?
B8 B7 B10 B2 -137.42(14) . . . . ?
B1 B7 B10 B8 100.65(15) . . . . ?
B6 B7 B10 B8 36.99(13) . . . . ?
B2 B7 B10 B8 137.42(14) . . . . ?
B1 B7 B10 B9 63.52(17) . . . . ?
B6 B7 B10 B9 -0.13(18) . . . . ?
B2 B7 B10 B9 100.29(14) . . . . ?
B8 B7 B10 B9 -37.13(13) . . . . ?
C16 B11 B12 C28 -140.41(14) . . . . ?
C15 B11 B12 C28 -104.75(16) . . . . ?
B17 B11 B12 C28 119.95(16) . . . . ?
B16 B11 B12 C28 158.52(14) . . . . ?
C16 B11 B12 C15 -35.66(11) . . . . ?
B17 B11 B12 C15 -135.30(13) . . . . ?
B16 B11 B12 C15 -96.73(14) . . . . ?
C16 B11 B12 B18 62.85(15) . . . . ?
C15 B11 B12 B18 98.51(14) . . . . ?
B17 B11 B12 B18 -36.80(13) . . . . ?
B16 B11 B12 B18 1.78(17) . . . . ?
C16 B11 B12 B13 -0.86(17) . . . . ?
C15 B11 B12 B13 34.80(12) . . . . ?
B17 B11 B12 B13 -100.50(14) . . . . ?
B16 B11 B12 B13 -61.93(16) . . . . ?
C16 B11 B12 B17 99.64(14) . . . . ?
C15 B11 B12 B17 135.30(13) . . . . ?
B16 B11 B12 B17 38.57(13) . . . . ?
C28 B12 B13 C15 103.12(16) . . . . ?
B18 B12 B13 C15 -135.23(14) . . . . ?
B11 B12 B13 C15 -35.01(12) . . . . ?
B17 B12 B13 C15 -97.90(13) . . . . ?
C28 B12 B13 B14 137.44(15) . . . . ?
C15 B12 B13 B14 34.31(12) . . . . ?
B18 B12 B13 B14 -100.92(15) . . . . ?
B11 B12 B13 B14 -0.70(18) . . . . ?
B17 B12 B13 B14 -63.59(16) . . . . ?
C28 B12 B13 B19 -159.41(14) . . . . ?
C15 B12 B13 B19 97.47(14) . . . . ?
B18 B12 B13 B19 -37.77(13) . . . . ?
B11 B12 B13 B19 62.45(16) . . . . ?
B17 B12 B13 B19 -0.43(17) . . . . ?
C28 B12 B13 B18 -121.64(17) . . . . ?
C15 B12 B13 B18 135.23(14) . . . . ?
B11 B12 B13 B18 100.22(14) . . . . ?
B17 B12 B13 B18 37.33(13) . . . . ?
C15 B13 B14 C16 35.36(12) . . . . ?
B19 B13 B14 C16 -99.24(14) . . . . ?
B18 B13 B14 C16 -61.05(16) . . . . ?
B12 B13 B14 C16 1.98(17) . . . . ?
B19 B13 B14 C15 -134.59(14) . . . . ?
B18 B13 B14 C15 -96.41(13) . . . . ?
B12 B13 B14 C15 -33.38(12) . . . . ?
C15 B13 B14 B19 134.59(14) . . . . ?
B18 B13 B14 B19 38.18(13) . . . . ?
B12 B13 B14 B19 101.22(15) . . . . ?
C15 B13 B14 B15 97.08(14) . . . . ?
B19 B13 B14 B15 -37.52(13) . . . . ?
B18 B13 B14 B15 0.67(18) . . . . ?
B12 B13 B14 B15 63.70(17) . . . . ?
C15 B14 B15 C16 -35.22(12) . . . . ?
B13 B14 B15 C16 -97.34(14) . . . . ?
B19 B14 B15 C16 -134.76(14) . . . . ?
C16 B14 B15 B16 33.70(13) . . . . ?
C15 B14 B15 B16 -1.51(17) . . . . ?
B13 B14 B15 B16 -63.64(17) . . . . ?
B19 B14 B15 B16 -101.06(15) . . . . ?
C16 B14 B15 B20 96.95(15) . . . . ?
C15 B14 B15 B20 61.74(16) . . . . ?
B13 B14 B15 B20 -0.39(18) . . . . ?
B19 B14 B15 B20 -37.81(13) . . . . ?
C16 B14 B15 B19 134.76(14) . . . . ?
C15 B14 B15 B19 99.55(14) . . . . ?
B13 B14 B15 B19 37.42(13) . . . . ?
C15 B11 B16 C16 35.44(12) . . . . ?
B17 B11 B16 C16 133.89(14) . . . . ?
B12 B11 B16 C16 95.35(14) . . . . ?
C16 B11 B16 B20 -96.88(15) . . . . ?
C15 B11 B16 B20 -61.44(16) . . . . ?
B17 B11 B16 B20 37.02(13) . . . . ?
B12 B11 B16 B20 -1.52(18) . . . . ?
C16 B11 B16 B15 -33.41(13) . . . . ?
C15 B11 B16 B15 2.02(17) . . . . ?
B17 B11 B16 B15 100.48(15) . . . . ?
B12 B11 B16 B15 61.94(17) . . . . ?
C16 B11 B16 B17 -133.89(14) . . . . ?
C15 B11 B16 B17 -98.46(14) . . . . ?
B12 B11 B16 B17 -38.54(13) . . . . ?
B14 B15 B16 C16 -33.95(13) . . . . ?
B20 B15 B16 C16 -134.05(14) . . . . ?
B19 B15 B16 C16 -97.05(15) . . . . ?
C16 B15 B16 B11 33.63(12) . . . . ?
B14 B15 B16 B11 -0.33(18) . . . . ?
B20 B15 B16 B11 -100.42(15) . . . . ?
B19 B15 B16 B11 -63.42(17) . . . . ?
C16 B15 B16 B20 134.05(14) . . . . ?
B14 B15 B16 B20 100.09(15) . . . . ?
B19 B15 B16 B20 37.00(13) . . . . ?
C16 B15 B16 B17 96.16(14) . . . . ?
B14 B15 B16 B17 62.21(17) . . . . ?
B20 B15 B16 B17 -37.88(13) . . . . ?
B19 B15 B16 B17 -0.88(18) . . . . ?
C16 B11 B17 B12 -97.67(13) . . . . ?
C15 B11 B17 B12 -37.66(11) . . . . ?
B16 B11 B17 B12 -137.22(14) . . . . ?
C16 B11 B17 B20 2.52(17) . . . . ?
C15 B11 B17 B20 62.53(16) . . . . ?
B16 B11 B17 B20 -37.03(13) . . . . ?
B12 B11 B17 B20 100.19(15) . . . . ?
C16 B11 B17 B16 39.55(12) . . . . ?
C15 B11 B17 B16 99.56(14) . . . . ?
B12 B11 B17 B16 137.22(14) . . . . ?
C16 B11 B17 B18 -61.05(16) . . . . ?
C15 B11 B17 B18 -1.04(17) . . . . ?
B16 B11 B17 B18 -100.61(15) . . . . ?
B12 B11 B17 B18 36.62(12) . . . . ?
C28 B12 B17 B11 -101.44(18) . . . . ?
C15 B12 B17 B11 39.29(12) . . . . ?
B18 B12 B17 B11 139.02(14) . . . . ?
B13 B12 B17 B11 101.79(14) . . . . ?
C28 B12 B17 B20 157.20(15) . . . . ?
C15 B12 B17 B20 -62.06(16) . . . . ?
B18 B12 B17 B20 37.66(13) . . . . ?
B11 B12 B17 B20 -101.35(14) . . . . ?
B13 B12 B17 B20 0.44(17) . . . . ?
C28 B12 B17 B16 -139.70(16) . . . . ?
C15 B12 B17 B16 1.04(17) . . . . ?
B18 B12 B17 B16 100.76(15) . . . . ?
B11 B12 B17 B16 -38.25(13) . . . . ?
B13 B12 B17 B16 63.54(16) . . . . ?
C28 B12 B17 B18 119.54(18) . . . . ?
C15 B12 B17 B18 -99.72(14) . . . . ?
B11 B12 B17 B18 -139.02(14) . . . . ?
B13 B12 B17 B18 -37.22(12) . . . . ?
C16 B16 B17 B11 -39.62(12) . . . . ?
B20 B16 B17 B11 -138.55(14) . . . . ?
B15 B16 B17 B11 -100.66(14) . . . . ?
C16 B16 B17 B12 -1.33(17) . . . . ?
B11 B16 B17 B12 38.29(12) . . . . ?
B20 B16 B17 B12 -100.25(15) . . . . ?
B15 B16 B17 B12 -62.37(17) . . . . ?
C16 B16 B17 B20 98.93(15) . . . . ?
B11 B16 B17 B20 138.55(14) . . . . ?
B15 B16 B17 B20 37.89(13) . . . . ?
C16 B16 B17 B18 61.71(16) . . . . ?
B11 B16 B17 B18 101.33(14) . . . . ?
B20 B16 B17 B18 -37.22(13) . . . . ?
B15 B16 B17 B18 0.67(17) . . . . ?
C28 B12 B18 B13 105.21(19) . . . . ?
C15 B12 B18 B13 -39.15(12) . . . . ?
B11 B12 B18 B13 -102.19(14) . . . . ?
B17 B12 B18 B13 -138.51(14) . . . . ?
C28 B12 B18 B19 142.62(17) . . . . ?
C15 B12 B18 B19 -1.74(17) . . . . ?
B11 B12 B18 B19 -64.78(16) . . . . ?
B13 B12 B18 B19 37.41(13) . . . . ?
B17 B12 B18 B19 -101.10(15) . . . . ?
C28 B12 B18 B20 -153.93(17) . . . . ?
C15 B12 B18 B20 61.71(16) . . . . ?
B11 B12 B18 B20 -1.34(17) . . . . ?
B13 B12 B18 B20 100.86(15) . . . . ?
B17 B12 B18 B20 -37.66(13) . . . . ?
C28 B12 B18 B17 -116.27(19) . . . . ?
C15 B12 B18 B17 99.37(13) . . . . ?
B11 B12 B18 B17 36.32(12) . . . . ?
B13 B12 B18 B17 138.51(14) . . . . ?
C15 B13 B18 B12 37.71(11) . . . . ?
B14 B13 B18 B12 99.87(14) . . . . ?
B19 B13 B18 B12 137.88(14) . . . . ?
C15 B13 B18 B19 -100.17(14) . . . . ?
B14 B13 B18 B19 -38.01(13) . . . . ?
B12 B13 B18 B19 -137.88(14) . . . . ?
C15 B13 B18 B20 -62.85(16) . . . . ?
B14 B13 B18 B20 -0.69(18) . . . . ?
B19 B13 B18 B20 37.32(13) . . . . ?
B12 B13 B18 B20 -100.56(14) . . . . ?
C15 B13 B18 B17 0.51(17) . . . . ?
B14 B13 B18 B17 62.67(17) . . . . ?
B19 B13 B18 B17 100.68(15) . . . . ?
B12 B13 B18 B17 -37.20(12) . . . . ?
B11 B17 B18 B12 -36.89(12) . . . . ?
B20 B17 B18 B12 -137.72(14) . . . . ?
B16 B17 B18 B12 -100.60(14) . . . . ?
B11 B17 B18 B13 0.34(18) . . . . ?
B12 B17 B18 B13 37.23(12) . . . . ?
B20 B17 B18 B13 -100.49(15) . . . . ?
B16 B17 B18 B13 -63.37(16) . . . . ?
B11 B17 B18 B19 63.51(17) . . . . ?
B12 B17 B18 B19 100.39(14) . . . . ?
B20 B17 B18 B19 -37.33(13) . . . . ?
B16 B17 B18 B19 -0.21(18) . . . . ?
B11 B17 B18 B20 100.84(15) . . . . ?
B12 B17 B18 B20 137.72(14) . . . . ?
B16 B17 B18 B20 37.12(13) . . . . ?
C16 B14 B19 B13 99.72(14) . . . . ?
C15 B14 B19 B13 39.40(12) . . . . ?
B15 B14 B19 B13 138.74(14) . . . . ?
C16 B14 B19 B15 -39.02(12) . . . . ?
C15 B14 B19 B15 -99.34(14) . . . . ?
B13 B14 B19 B15 -138.74(14) . . . . ?
C16 B14 B19 B18 61.78(16) . . . . ?
C15 B14 B19 B18 1.46(17) . . . . ?
B13 B14 B19 B18 -37.94(13) . . . . ?
B15 B14 B19 B18 100.80(15) . . . . ?
C16 B14 B19 B20 -1.37(17) . . . . ?
C15 B14 B19 B20 -61.70(16) . . . . ?
B13 B14 B19 B20 -101.10(14) . . . . ?
B15 B14 B19 B20 37.64(13) . . . . ?
C15 B13 B19 B14 -39.64(12) . . . . ?
B18 B13 B19 B14 -137.32(14) . . . . ?
B12 B13 B19 B14 -99.76(14) . . . . ?
C15 B13 B19 B15 -2.90(17) . . . . ?
B14 B13 B19 B15 36.75(13) . . . . ?
B18 B13 B19 B15 -100.57(15) . . . . ?
B12 B13 B19 B15 -63.02(17) . . . . ?
C15 B13 B19 B18 97.68(14) . . . . ?
B14 B13 B19 B18 137.32(14) . . . . ?
B12 B13 B19 B18 37.56(12) . . . . ?
C15 B13 B19 B20 60.38(16) . . . . ?
B14 B13 B19 B20 100.02(15) . . . . ?
B18 B13 B19 B20 -37.30(13) . . . . ?
B12 B13 B19 B20 0.26(17) . . . . ?
C16 B15 B19 B14 39.27(13) . . . . ?
B16 B15 B19 B14 100.79(15) . . . . ?
B20 B15 B19 B14 137.65(14) . . . . ?
C16 B15 B19 B13 2.58(18) . . . . ?
B14 B15 B19 B13 -36.69(13) . . . . ?
B16 B15 B19 B13 64.11(17) . . . . ?
B20 B15 B19 B13 100.96(15) . . . . ?
C16 B15 B19 B18 -60.77(17) . . . . ?
B14 B15 B19 B18 -100.04(15) . . . . ?
B16 B15 B19 B18 0.75(18) . . . . ?
B20 B15 B19 B18 37.61(13) . . . . ?
C16 B15 B19 B20 -98.38(15) . . . . ?
B14 B15 B19 B20 -137.65(14) . . . . ?
B16 B15 B19 B20 -36.86(13) . . . . ?
B12 B18 B19 B14 0.14(18) . . . . ?
B13 B18 B19 B14 37.76(13) . . . . ?
B20 B18 B19 B14 -100.53(15) . . . . ?
B17 B18 B19 B14 -63.30(17) . . . . ?
B12 B18 B19 B13 -37.61(13) . . . . ?
B20 B18 B19 B13 -138.29(14) . . . . ?
B17 B18 B19 B13 -101.06(14) . . . . ?
B12 B18 B19 B15 63.11(17) . . . . ?
B13 B18 B19 B15 100.72(15) . . . . ?
B20 B18 B19 B15 -37.56(13) . . . . ?
B17 B18 B19 B15 -0.34(18) . . . . ?
B12 B18 B19 B20 100.67(15) . . . . ?
B13 B18 B19 B20 138.29(14) . . . . ?
B17 B18 B19 B20 37.23(13) . . . . ?
C16 B16 B20 B15 39.32(13) . . . . ?
B11 B16 B20 B15 100.97(15) . . . . ?
B17 B16 B20 B15 137.60(14) . . . . ?
C16 B16 B20 B17 -98.28(14) . . . . ?
B11 B16 B20 B17 -36.63(13) . . . . ?
B15 B16 B20 B17 -137.60(14) . . . . ?
C16 B16 B20 B18 -60.96(17) . . . . ?
B11 B16 B20 B18 0.69(18) . . . . ?
B15 B16 B20 B18 -100.28(15) . . . . ?
B17 B16 B20 B18 37.32(13) . . . . ?
C16 B16 B20 B19 2.47(18) . . . . ?
B11 B16 B20 B19 64.12(17) . . . . ?
B15 B16 B20 B19 -36.85(13) . . . . ?
B17 B16 B20 B19 100.75(15) . . . . ?
C16 B15 B20 B16 -39.40(13) . . . . ?
B14 B15 B20 B16 -101.33(15) . . . . ?
B19 B15 B20 B16 -138.85(14) . . . . ?
C16 B15 B20 B17 -1.52(18) . . . . ?
B14 B15 B20 B17 -63.45(18) . . . . ?
B16 B15 B20 B17 37.88(13) . . . . ?
B19 B15 B20 B17 -100.97(15) . . . . ?
C16 B15 B20 B18 61.89(17) . . . . ?
B14 B15 B20 B18 -0.04(18) . . . . ?
B16 B15 B20 B18 101.29(15) . . . . ?
B19 B15 B20 B18 -37.56(13) . . . . ?
C16 B15 B20 B19 99.45(14) . . . . ?
B14 B15 B20 B19 37.52(13) . . . . ?
B16 B15 B20 B19 138.85(14) . . . . ?
B11 B17 B20 B16 37.20(13) . . . . ?
B12 B17 B20 B16 100.87(14) . . . . ?
B18 B17 B20 B16 138.37(14) . . . . ?
B11 B17 B20 B15 -0.64(19) . . . . ?
B12 B17 B20 B15 63.03(17) . . . . ?
B16 B17 B20 B15 -37.84(13) . . . . ?
B18 B17 B20 B15 100.53(15) . . . . ?
B11 B17 B20 B18 -101.17(14) . . . . ?
B12 B17 B20 B18 -37.50(12) . . . . ?
B16 B17 B20 B18 -138.37(14) . . . . ?
B11 B17 B20 B19 -63.95(17) . . . . ?
B12 B17 B20 B19 -0.28(18) . . . . ?
B16 B17 B20 B19 -101.15(15) . . . . ?
B18 B17 B20 B19 37.22(13) . . . . ?
B12 B18 B20 B16 0.40(18) . . . . ?
B13 B18 B20 B16 63.89(17) . . . . ?
B19 B18 B20 B16 101.01(15) . . . . ?
B17 B18 B20 B16 -37.33(13) . . . . ?
B12 B18 B20 B15 -63.04(17) . . . . ?
B13 B18 B20 B15 0.45(18) . . . . ?
B19 B18 B20 B15 37.57(13) . . . . ?
B17 B18 B20 B15 -100.77(15) . . . . ?
B12 B18 B20 B17 37.73(13) . . . . ?
B13 B18 B20 B17 101.21(14) . . . . ?
B19 B18 B20 B17 138.33(14) . . . . ?
B12 B18 B20 B19 -100.61(14) . . . . ?
B13 B18 B20 B19 -37.12(13) . . . . ?
B17 B18 B20 B19 -138.33(14) . . . . ?
B14 B19 B20 B16 -0.69(18) . . . . ?
B13 B19 B20 B16 -63.60(17) . . . . ?
B15 B19 B20 B16 36.90(13) . . . . ?
B18 B19 B20 B16 -100.92(15) . . . . ?
B14 B19 B20 B15 -37.59(13) . . . . ?
B13 B19 B20 B15 -100.50(15) . . . . ?
B18 B19 B20 B15 -137.82(14) . . . . ?
B14 B19 B20 B17 62.93(17) . . . . ?
B13 B19 B20 B17 0.01(18) . . . . ?
B15 B19 B20 B17 100.52(15) . . . . ?
B18 B19 B20 B17 -37.30(13) . . . . ?
B14 B19 B20 B18 100.23(14) . . . . ?
B13 B19 B20 B18 37.32(13) . . . . ?
B15 B19 B20 B18 137.82(14) . . . . ?
C14 B2 C1 C3 1.5(2) . . . . ?
B1 B2 C1 C3 -105.93(15) . . . . ?
B3 B2 C1 C3 112.90(15) . . . . ?
B10 B2 C1 C3 152.11(14) . . . . ?
B7 B2 C1 C3 -144.94(14) . . . . ?
C14 B2 C1 C2 145.64(14) . . . . ?
B1 B2 C1 C2 38.26(12) . . . . ?
B3 B2 C1 C2 -102.91(14) . . . . ?
B10 B2 C1 C2 -63.70(16) . . . . ?
B7 B2 C1 C2 -0.75(17) . . . . ?
C14 B2 C1 B3 -111.45(15) . . . . ?
B1 B2 C1 B3 141.17(13) . . . . ?
B10 B2 C1 B3 39.20(12) . . . . ?
B7 B2 C1 B3 102.16(14) . . . . ?
C14 B2 C1 B4 -148.25(14) . . . . ?
B1 B2 C1 B4 104.37(14) . . . . ?
B3 B2 C1 B4 -36.80(13) . . . . ?
B10 B2 C1 B4 2.41(17) . . . . ?
B7 B2 C1 B4 65.36(16) . . . . ?
C14 B2 C1 B1 107.38(15) . . . . ?
B3 B2 C1 B1 -141.17(13) . . . . ?
B10 B2 C1 B1 -101.97(14) . . . . ?
B7 B2 C1 B1 -39.01(12) . . . . ?
B4 B3 C1 C3 111.13(16) . . . . ?
B9 B3 C1 C3 150.37(14) . . . . ?
B10 B3 C1 C3 -146.74(14) . . . . ?
B2 B3 C1 C3 -107.75(16) . . . . ?
B4 B3 C1 C2 -37.50(13) . . . . ?
B9 B3 C1 C2 1.74(17) . . . . ?
B10 B3 C1 C2 64.63(16) . . . . ?
B2 B3 C1 C2 103.62(14) . . . . ?
B4 B3 C1 B2 -141.12(14) . . . . ?
B9 B3 C1 B2 -101.88(14) . . . . ?
B10 B3 C1 B2 -38.99(12) . . . . ?
B9 B3 C1 B4 39.24(13) . . . . ?
B10 B3 C1 B4 102.13(14) . . . . ?
B2 B3 C1 B4 141.12(14) . . . . ?
B4 B3 C1 B1 -103.52(14) . . . . ?
B9 B3 C1 B1 -64.28(16) . . . . ?
B10 B3 C1 B1 -1.38(17) . . . . ?
B2 B3 C1 B1 37.60(13) . . . . ?
C2 B4 C1 C3 109.68(16) . . . . ?
B5 B4 C1 C3 145.38(14) . . . . ?
B9 B4 C1 C3 -150.84(14) . . . . ?
B3 B4 C1 C3 -111.15(16) . . . . ?
B5 B4 C1 C2 35.70(12) . . . . ?
B9 B4 C1 C2 99.48(15) . . . . ?
B3 B4 C1 C2 139.17(14) . . . . ?
C2 B4 C1 B2 -101.76(14) . . . . ?
B5 B4 C1 B2 -66.06(16) . . . . ?
B9 B4 C1 B2 -2.28(17) . . . . ?
B3 B4 C1 B2 37.42(13) . . . . ?
C2 B4 C1 B3 -139.17(14) . . . . ?
B5 B4 C1 B3 -103.47(14) . . . . ?
B9 B4 C1 B3 -39.70(13) . . . . ?
C2 B4 C1 B1 -33.08(13) . . . . ?
B5 B4 C1 B1 2.62(17) . . . . ?
B9 B4 C1 B1 66.40(16) . . . . ?
B3 B4 C1 B1 106.10(14) . . . . ?
C2 B1 C1 C3 -111.90(15) . . . . ?
B7 B1 C1 C3 148.99(13) . . . . ?
B6 B1 C1 C3 -148.17(14) . . . . ?
B2 B1 C1 C3 109.72(15) . . . . ?
B7 B1 C1 C2 -99.12(14) . . . . ?
B6 B1 C1 C2 -36.28(12) . . . . ?
B2 B1 C1 C2 -138.38(13) . . . . ?
C2 B1 C1 B2 138.38(13) . . . . ?
B7 B1 C1 B2 39.27(12) . . . . ?
B6 B1 C1 B2 102.11(14) . . . . ?
C2 B1 C1 B3 100.67(14) . . . . ?
B7 B1 C1 B3 1.55(17) . . . . ?
B6 B1 C1 B3 64.39(16) . . . . ?
B2 B1 C1 B3 -37.71(13) . . . . ?
C2 B1 C1 B4 33.14(12) . . . . ?
B7 B1 C1 B4 -65.98(16) . . . . ?
B6 B1 C1 B4 -3.14(17) . . . . ?
B2 B1 C1 B4 -105.25(14) . . . . ?
C3 C1 C2 B5 -149.20(15) . . . . ?
B2 C1 C2 B5 67.58(17) . . . . ?
B3 C1 C2 B5 -0.21(18) . . . . ?
B4 C1 C2 B5 -37.96(14) . . . . ?
B1 C1 C2 B5 106.71(15) . . . . ?
C3 C1 C2 B6 143.24(15) . . . . ?
B2 C1 C2 B6 0.02(18) . . . . ?
B3 C1 C2 B6 -67.78(17) . . . . ?
B4 C1 C2 B6 -105.52(15) . . . . ?
B1 C1 C2 B6 39.15(13) . . . . ?
C3 C1 C2 B4 -111.24(16) . . . . ?
B2 C1 C2 B4 105.54(14) . . . . ?
B3 C1 C2 B4 37.75(13) . . . . ?
B1 C1 C2 B4 144.67(13) . . . . ?
C3 C1 C2 B1 104.09(16) . . . . ?
B2 C1 C2 B1 -39.13(13) . . . . ?
B3 C1 C2 B1 -106.92(14) . . . . ?
B4 C1 C2 B1 -144.67(13) . . . . ?
B4 B5 C2 C1 37.74(13) . . . . ?
B6 B5 C2 C1 -103.44(15) . . . . ?
B8 B5 C2 C1 -63.77(17) . . . . ?
B9 B5 C2 C1 -1.40(19) . . . . ?
B4 B5 C2 B6 141.18(14) . . . . ?
B8 B5 C2 B6 39.66(14) . . . . ?
B9 B5 C2 B6 102.04(16) . . . . ?
B6 B5 C2 B4 -141.18(14) . . . . ?
B8 B5 C2 B4 -101.52(15) . . . . ?
B9 B5 C2 B4 -39.14(13) . . . . ?
B4 B5 C2 B1 104.56(15) . . . . ?
B6 B5 C2 B1 -36.62(14) . . . . ?
B8 B5 C2 B1 3.04(19) . . . . ?
B9 B5 C2 B1 65.42(18) . . . . ?
B1 B6 C2 C1 -38.80(13) . . . . ?
B8 B6 C2 C1 63.29(17) . . . . ?
B7 B6 C2 C1 0.72(18) . . . . ?
B5 B6 C2 C1 103.11(15) . . . . ?
B1 B6 C2 B5 -141.91(14) . . . . ?
B8 B6 C2 B5 -39.83(13) . . . . ?
B7 B6 C2 B5 -102.39(15) . . . . ?
B1 B6 C2 B4 -105.13(14) . . . . ?
B8 B6 C2 B4 -3.04(19) . . . . ?
B7 B6 C2 B4 -65.61(17) . . . . ?
B5 B6 C2 B4 36.78(14) . . . . ?
B8 B6 C2 B1 102.09(15) . . . . ?
B7 B6 C2 B1 39.52(13) . . . . ?
B5 B6 C2 B1 141.91(14) . . . . ?
B5 B4 C2 C1 -139.08(14) . . . . ?
B9 B4 C2 C1 -99.12(14) . . . . ?
B3 B4 C2 C1 -35.83(12) . . . . ?
C1 B4 C2 B5 139.08(14) . . . . ?
B9 B4 C2 B5 39.96(13) . . . . ?
B3 B4 C2 B5 103.25(15) . . . . ?
C1 B4 C2 B6 101.84(15) . . . . ?
B5 B4 C2 B6 -37.24(14) . . . . ?
B9 B4 C2 B6 2.72(18) . . . . ?
B3 B4 C2 B6 66.02(17) . . . . ?
C1 B4 C2 B1 33.54(12) . . . . ?
B5 B4 C2 B1 -105.54(16) . . . . ?
B9 B4 C2 B1 -65.58(17) . . . . ?
B3 B4 C2 B1 -2.29(18) . . . . ?
B7 B1 C2 C1 97.94(13) . . . . ?
B6 B1 C2 C1 138.12(14) . . . . ?
B2 B1 C2 C1 35.14(11) . . . . ?
C1 B1 C2 B5 -101.30(15) . . . . ?
B7 B1 C2 B5 -3.35(18) . . . . ?
B6 B1 C2 B5 36.83(14) . . . . ?
B2 B1 C2 B5 -66.16(16) . . . . ?
C1 B1 C2 B6 -138.12(14) . . . . ?
B7 B1 C2 B6 -40.18(13) . . . . ?
B2 B1 C2 B6 -102.98(14) . . . . ?
C1 B1 C2 B4 -33.42(13) . . . . ?
B7 B1 C2 B4 64.52(16) . . . . ?
B6 B1 C2 B4 104.70(15) . . . . ?
B2 B1 C2 B4 1.72(17) . . . . ?
C2 C1 C3 C4 42.4(2) . . . . ?
B2 C1 C3 C4 -176.86(14) . . . . ?
B3 C1 C3 C4 -103.13(17) . . . . ?
B4 C1 C3 C4 -29.8(2) . . . . ?
B1 C1 C3 C4 111.97(16) . . . . ?
C2 C1 C3 C8 -136.50(15) . . . . ?
B2 C1 C3 C8 4.2(2) . . . . ?
B3 C1 C3 C8 77.93(19) . . . . ?
B4 C1 C3 C8 151.30(15) . . . . ?
B1 C1 C3 C8 -66.98(18) . . . . ?
C8 C3 C4 C5 0.1(2) . . . . ?
C1 C3 C4 C5 -178.84(15) . . . . ?
C3 C4 C5 C6 1.3(3) . . . . ?
C4 C5 C6 C7 -0.9(3) . . . . ?
C5 C6 C7 C8 -0.8(3) . . . . ?
C6 C7 C8 C3 2.1(2) . . . . ?
C6 C7 C8 C9 -175.58(16) . . . . ?
C4 C3 C8 C7 -1.7(2) . . . . ?
C1 C3 C8 C7 177.18(14) . . . . ?
C4 C3 C8 C9 175.86(14) . . . . ?
C1 C3 C8 C9 -5.2(2) . . . . ?
C7 C8 C9 C10 -0.8(2) . . . . ?
C3 C8 C9 C10 -178.36(15) . . . . ?
C7 C8 C9 C14 177.35(15) . . . . ?
C3 C8 C9 C14 -0.2(2) . . . . ?
C14 C9 C10 C11 -1.8(2) . . . . ?
C8 C9 C10 C11 176.42(15) . . . . ?
C9 C10 C11 C12 -0.1(3) . . . . ?
C10 C11 C12 C13 1.5(3) . . . . ?
C11 C12 C13 C14 -1.1(3) . . . . ?
C12 C13 C14 C9 -0.9(2) . . . . ?
C12 C13 C14 B2 176.86(15) . . . . ?
C10 C9 C14 C13 2.3(2) . . . . ?
C8 C9 C14 C13 -175.95(14) . . . . ?
C10 C9 C14 B2 -175.41(15) . . . . ?
C8 C9 C14 B2 6.4(2) . . . . ?
C1 B2 C14 C13 175.69(13) . . . . ?
B1 B2 C14 C13 -116.88(16) . . . . ?
B3 B2 C14 C13 107.80(17) . . . . ?
B10 B2 C14 C13 33.7(2) . . . . ?
B7 B2 C14 C13 -46.6(2) . . . . ?
C1 B2 C14 C9 -6.6(2) . . . . ?
B1 B2 C14 C9 60.8(2) . . . . ?
B3 B2 C14 C9 -74.52(19) . . . . ?
B10 B2 C14 C9 -148.60(17) . . . . ?
B7 B2 C14 C9 131.12(17) . . . . ?
C28 B12 C15 C17 2.7(2) . . . . ?
B18 B12 C15 C17 153.23(14) . . . . ?
B11 B12 C15 C17 -104.90(15) . . . . ?
B13 B12 C15 C17 113.82(16) . . . . ?
B17 B12 C15 C17 -143.80(14) . . . . ?
C28 B12 C15 C16 146.22(14) . . . . ?
B18 B12 C15 C16 -63.29(16) . . . . ?
B11 B12 C15 C16 38.57(12) . . . . ?
B13 B12 C15 C16 -102.70(14) . . . . ?
B17 B12 C15 C16 -0.33(17) . . . . ?
C28 B12 C15 B13 -111.08(16) . . . . ?
B18 B12 C15 B13 39.41(13) . . . . ?
B11 B12 C15 B13 141.27(13) . . . . ?
B17 B12 C15 B13 102.37(14) . . . . ?
C28 B12 C15 B14 -147.68(14) . . . . ?
B18 B12 C15 B14 2.81(17) . . . . ?
B11 B12 C15 B14 104.67(14) . . . . ?
B13 B12 C15 B14 -36.60(13) . . . . ?
B17 B12 C15 B14 65.77(16) . . . . ?
C28 B12 C15 B11 107.64(15) . . . . ?
B18 B12 C15 B11 -101.86(14) . . . . ?
B13 B12 C15 B11 -141.27(13) . . . . ?
B17 B12 C15 B11 -38.90(12) . . . . ?
B14 B13 C15 C17 111.18(16) . . . . ?
B19 B13 C15 C17 150.98(15) . . . . ?
B18 B13 C15 C17 -146.38(15) . . . . ?
B12 B13 C15 C17 -107.47(16) . . . . ?
B14 B13 C15 C16 -37.65(12) . . . . ?
B19 B13 C15 C16 2.15(17) . . . . ?
B18 B13 C15 C16 64.79(15) . . . . ?
B12 B13 C15 C16 103.70(14) . . . . ?
B14 B13 C15 B12 -141.35(14) . . . . ?
B19 B13 C15 B12 -101.56(14) . . . . ?
B18 B13 C15 B12 -38.92(12) . . . . ?
B19 B13 C15 B14 39.79(12) . . . . ?
B18 B13 C15 B14 102.43(14) . . . . ?
B12 B13 C15 B14 141.35(14) . . . . ?
B14 B13 C15 B11 -103.68(14) . . . . ?
B19 B13 C15 B11 -63.89(16) . . . . ?
B18 B13 C15 B11 -1.25(17) . . . . ?
B12 B13 C15 B11 37.66(13) . . . . ?
C16 B14 C15 C17 109.24(16) . . . . ?
B13 B14 C15 C17 -111.84(16) . . . . ?
B19 B14 C15 C17 -151.91(14) . . . . ?
B15 B14 C15 C17 144.80(14) . . . . ?
B13 B14 C15 C16 138.92(14) . . . . ?
B19 B14 C15 C16 98.85(14) . . . . ?
B15 B14 C15 C16 35.56(12) . . . . ?
C16 B14 C15 B12 -101.58(14) . . . . ?
B13 B14 C15 B12 37.34(13) . . . . ?
B19 B14 C15 B12 -2.73(17) . . . . ?
B15 B14 C15 B12 -66.02(16) . . . . ?
C16 B14 C15 B13 -138.92(14) . . . . ?
B19 B14 C15 B13 -40.07(13) . . . . ?
B15 B14 C15 B13 -103.36(14) . . . . ?
C16 B14 C15 B11 -32.62(13) . . . . ?
B13 B14 C15 B11 106.30(14) . . . . ?
B19 B14 C15 B11 66.23(16) . . . . ?
B15 B14 C15 B11 2.94(17) . . . . ?
C16 B11 C15 C17 -112.00(15) . . . . ?
B17 B11 C15 C17 149.24(13) . . . . ?
B16 B11 C15 C17 -147.78(14) . . . . ?
B12 B11 C15 C17 109.97(15) . . . . ?
B17 B11 C15 C16 -98.76(14) . . . . ?
B16 B11 C15 C16 -35.78(12) . . . . ?
B12 B11 C15 C16 -138.03(13) . . . . ?
C16 B11 C15 B12 138.03(13) . . . . ?
B17 B11 C15 B12 39.27(12) . . . . ?
B16 B11 C15 B12 102.25(14) . . . . ?
C16 B11 C15 B13 100.23(14) . . . . ?
B17 B11 C15 B13 1.47(17) . . . . ?
B16 B11 C15 B13 64.44(16) . . . . ?
B12 B11 C15 B13 -37.81(13) . . . . ?
C16 B11 C15 B14 32.65(13) . . . . ?
B17 B11 C15 B14 -66.11(16) . . . . ?
B16 B11 C15 B14 -3.13(17) . . . . ?
B12 B11 C15 B14 -105.39(14) . . . . ?
C17 C15 C16 B15 -150.06(15) . . . . ?
B12 C15 C16 B15 67.39(16) . . . . ?
B13 C15 C16 B15 -0.54(18) . . . . ?
B14 C15 C16 B15 -38.40(13) . . . . ?
B11 C15 C16 B15 106.87(15) . . . . ?
C17 C15 C16 B16 141.99(15) . . . . ?
B12 C15 C16 B16 -0.55(18) . . . . ?
B13 C15 C16 B16 -68.49(16) . . . . ?
B14 C15 C16 B16 -106.34(15) . . . . ?
B11 C15 C16 B16 38.93(13) . . . . ?
C17 C15 C16 B11 103.06(16) . . . . ?
B12 C15 C16 B11 -39.48(13) . . . . ?
B13 C15 C16 B11 -107.42(14) . . . . ?
B14 C15 C16 B11 -145.27(13) . . . . ?
C17 C15 C16 B14 -111.67(16) . . . . ?
B12 C15 C16 B14 105.79(14) . . . . ?
B13 C15 C16 B14 37.85(13) . . . . ?
B11 C15 C16 B14 145.27(13) . . . . ?
B14 B15 C16 C15 38.09(13) . . . . ?
B16 B15 C16 C15 -103.83(15) . . . . ?
B20 B15 C16 C15 -63.85(17) . . . . ?
B19 B15 C16 C15 -1.30(18) . . . . ?
B14 B15 C16 B16 141.92(14) . . . . ?
B20 B15 C16 B16 39.98(13) . . . . ?
B19 B15 C16 B16 102.53(15) . . . . ?
B14 B15 C16 B11 105.27(15) . . . . ?
B16 B15 C16 B11 -36.64(13) . . . . ?
B20 B15 C16 B11 3.34(18) . . . . ?
B19 B15 C16 B11 65.89(17) . . . . ?
B16 B15 C16 B14 -141.92(14) . . . . ?
B20 B15 C16 B14 -101.94(15) . . . . ?
B19 B15 C16 B14 -39.39(13) . . . . ?
B11 B16 C16 C15 -38.54(13) . . . . ?
B20 B16 C16 C15 63.45(17) . . . . ?
B15 B16 C16 C15 103.55(15) . . . . ?
B17 B16 C16 C15 1.17(18) . . . . ?
B11 B16 C16 B15 -142.09(14) . . . . ?
B20 B16 C16 B15 -40.10(13) . . . . ?
B17 B16 C16 B15 -102.39(15) . . . . ?
B20 B16 C16 B11 101.99(14) . . . . ?
B15 B16 C16 B11 142.09(14) . . . . ?
B17 B16 C16 B11 39.70(12) . . . . ?
B11 B16 C16 B14 -105.53(15) . . . . ?
B20 B16 C16 B14 -3.54(18) . . . . ?
B15 B16 C16 B14 36.56(14) . . . . ?
B17 B16 C16 B14 -65.83(17) . . . . ?
B17 B11 C16 C15 98.09(13) . . . . ?
B16 B11 C16 C15 138.64(14) . . . . ?
B12 B11 C16 C15 35.37(11) . . . . ?
C15 B11 C16 B15 -101.84(15) . . . . ?
B17 B11 C16 B15 -3.75(18) . . . . ?
B16 B11 C16 B15 36.80(14) . . . . ?
B12 B11 C16 B15 -66.47(16) . . . . ?
C15 B11 C16 B16 -138.64(14) . . . . ?
B17 B11 C16 B16 -40.55(13) . . . . ?
B12 B11 C16 B16 -103.27(14) . . . . ?
C15 B11 C16 B14 -33.13(13) . . . . ?
B17 B11 C16 B14 64.96(16) . . . . ?
B16 B11 C16 B14 105.51(16) . . . . ?
B12 B11 C16 B14 2.24(17) . . . . ?
B13 B14 C16 C15 -35.90(12) . . . . ?
B19 B14 C16 C15 -99.00(14) . . . . ?
B15 B14 C16 C15 -139.01(14) . . . . ?
C15 B14 C16 B15 139.01(14) . . . . ?
B13 B14 C16 B15 103.11(15) . . . . ?
B19 B14 C16 B15 40.01(13) . . . . ?
C15 B14 C16 B16 102.16(15) . . . . ?
B13 B14 C16 B16 66.26(17) . . . . ?
B19 B14 C16 B16 3.15(18) . . . . ?
B15 B14 C16 B16 -36.85(14) . . . . ?
C15 B14 C16 B11 33.18(13) . . . . ?
B13 B14 C16 B11 -2.72(18) . . . . ?
B19 B14 C16 B11 -65.82(17) . . . . ?
B15 B14 C16 B11 -105.83(15) . . . . ?
C16 C15 C17 C18 40.1(2) . . . . ?
B12 C15 C17 C18 -179.91(14) . . . . ?
B13 C15 C17 C18 -105.72(18) . . . . ?
B14 C15 C17 C18 -32.1(2) . . . . ?
B11 C15 C17 C18 109.19(16) . . . . ?
C16 C15 C17 C22 -137.96(15) . . . . ?
B12 C15 C17 C22 2.0(2) . . . . ?
B13 C15 C17 C22 76.2(2) . . . . ?
B14 C15 C17 C22 149.87(15) . . . . ?
B11 C15 C17 C22 -68.88(19) . . . . ?
C22 C17 C18 C19 -0.7(2) . . . . ?
C15 C17 C18 C19 -178.73(16) . . . . ?
C17 C18 C19 C20 0.9(3) . . . . ?
C18 C19 C20 C21 -0.3(3) . . . . ?
C19 C20 C21 C22 -0.6(3) . . . . ?
C20 C21 C22 C17 0.7(3) . . . . ?
C20 C21 C22 C23 -177.19(17) . . . . ?
C18 C17 C22 C21 -0.1(2) . . . . ?
C15 C17 C22 C21 177.90(15) . . . . ?
C18 C17 C22 C23 177.71(15) . . . . ?
C15 C17 C22 C23 -4.3(2) . . . . ?
C21 C22 C23 C24 -0.1(2) . . . . ?
C17 C22 C23 C24 -177.82(15) . . . . ?
C21 C22 C23 C28 178.95(15) . . . . ?
C17 C22 C23 C28 1.2(2) . . . . ?
C28 C23 C24 C25 -1.8(2) . . . . ?
C22 C23 C24 C25 177.24(15) . . . . ?
C23 C24 C25 C26 0.3(3) . . . . ?
C24 C25 C26 C27 1.1(3) . . . . ?
C25 C26 C27 C28 -1.1(3) . . . . ?
C26 C27 C28 C23 -0.5(2) . . . . ?
C26 C27 C28 B12 178.21(15) . . . . ?
C24 C23 C28 C27 1.8(2) . . . . ?
C22 C23 C28 C27 -177.19(14) . . . . ?
C24 C23 C28 B12 -176.81(15) . . . . ?
C22 C23 C28 B12 4.2(2) . . . . ?
C15 B12 C28 C27 175.59(14) . . . . ?
B18 B12 C28 C27 33.7(2) . . . . ?
B11 B12 C28 C27 -116.95(16) . . . . ?
B13 B12 C28 C27 107.90(17) . . . . ?
B17 B12 C28 C27 -46.6(2) . . . . ?
C15 B12 C28 C23 -5.8(2) . . . . ?
B18 B12 C28 C23 -147.63(17) . . . . ?
B11 B12 C28 C23 61.7(2) . . . . ?
B13 B12 C28 C23 -73.45(19) . . . . ?
B17 B12 C28 C23 132.06(17) . . . . ?

_refine_diff_density_max         0.355
_refine_diff_density_min         -0.265
_refine_diff_density_rms         0.054


_exptl_crystal_recrystallization_method 
'Re-crystallisation from solvent: CHCl3 / n-hexane'
