# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2018

####################################################################### 
# 
# 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. 
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data_caok_195
_database_code_depnum_ccdc_archive 'CCDC 1852798'
_audit_update_record             
;
2018-07-02 deposited with the CCDC.
2018-12-12 downloaded from the CCDC.
;
_audit_creation_date             2018-05-24
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.18 svn.r3508 for OlexSys, GUI svn.r5497)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C22 H40 B18 Cs2 N2 O2'
_chemical_formula_sum            'C22 H40 B18 Cs2 N2 O2'
_chemical_formula_weight         824.96
_chemical_melting_point          ?
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'
Cs Cs -0.3680 2.1192 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   9.9229(8)
_cell_length_b                   13.5206(9)
_cell_length_c                   14.4241(11)
_cell_angle_alpha                108.368(7)
_cell_angle_beta                 92.326(6)
_cell_angle_gamma                94.863(6)
_cell_volume                     1825.4(2)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    4567
_cell_measurement_temperature    292.78(10)
_cell_measurement_theta_max      27.5610
_cell_measurement_theta_min      3.5250
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    2.023
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.84400
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.38.41 (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear light colourless'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.501
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             804
_exptl_crystal_size_max          0.21
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.14
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0272
_diffrn_reflns_av_unetI/netI     0.0489
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            11975
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         26.022
_diffrn_reflns_theta_min         3.418
_diffrn_ambient_environment      air
_diffrn_ambient_temperature      292.78(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 16.0733
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω     72.00  99.00   1.50    2.50    --   25.05  57.00-120.00   18
  2  ω     31.00  97.00   1.50    2.50    --   25.05  57.00-150.00   44
  3  ω     22.00  74.50   1.50    2.50    --   25.05 -99.00-120.00   35
  4  ω     87.00 112.50   1.50    2.50    --   25.05-178.00-150.00   17
  5  ω    -44.00  55.00   1.50    2.50    --   25.05 -57.00  90.00   66
  6  ω    -33.00  51.00   1.50    2.50    --  -22.08  57.00 -30.00   56
  7  ω     36.00 109.50   1.50    2.50    --   25.05 178.00 120.00   49
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Eos'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0480130000
_diffrn_orient_matrix_UB_12      -0.0077247000
_diffrn_orient_matrix_UB_13      0.0342025000
_diffrn_orient_matrix_UB_21      0.0526452000
_diffrn_orient_matrix_UB_22      0.0046542000
_diffrn_orient_matrix_UB_23      -0.0306564000
_diffrn_orient_matrix_UB_31      0.0097945000
_diffrn_orient_matrix_UB_32      0.0548350000
_diffrn_orient_matrix_UB_33      0.0242646000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'SuperNova (Mo) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                5584
_reflns_number_total             7171
_reflns_odcompleteness_completeness 99.68
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXS (Sheldrick, 2008)'
_refine_diff_density_max         0.434
_refine_diff_density_min         -0.558
_refine_diff_density_rms         0.075
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.033
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     509
_refine_ls_number_reflns         7171
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0509
_refine_ls_R_factor_gt           0.0360
_refine_ls_restrained_S_all      1.033
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0246P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0674
_refine_ls_wR_factor_ref         0.0751
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All B(H) groups, All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Shared sites
{C7A, B9}
{B9A, C7}
3. Restrained distances
 B3A-H3A
 1 with sigma of 0.01
4. Uiso/Uaniso restraints and constraints
Uanis(C7A) = Uanis(B9)
Uanis(B9A) = Uanis(C7)
5. Others
 Fixed Sof: C7(0.75) C12(0.75) B3'(0.6) H3'(0.6) B9(0.75) C7A(0.25) C12A(0.25)
 B3A(0.4) H3A(0.4) B9A(0.25)
6.a Aromatic/amide H refined with riding coordinates:
 C16(H16), C16'(H16'), C17(H17), C17'(H17'), C18(H18), C18'(H18'), C19(H19),
 C19'(H19'), C20(H20), C20'(H20')
6.b Idealised Me refined as rotating group:
 C12'(H12A,H12B,H12C), C13(H13A,H13B,H13C), C13'(H13D,H13E,H13F), C12(H12D,
 H12E,H12F)
6.c Boron cage BH refined with riding coordinates:
 B3'(H3')
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     heavy
_atom_sites_solution_secondary   ?
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
Cs1 Cs 0.35907(2) 0.44649(2) 0.61566(2) 0.04479(8) Uani 1 1 d . . . . .
H1A H 0.629(3) 0.381(2) 0.6872(18) 0.019(7) Uiso 1 1 d . . . . .
H4 H 0.584(3) 0.379(2) 0.483(2) 0.031(8) Uiso 1 1 d . . . . .
H4' H 0.366(4) 0.648(3) 0.794(3) 0.063(12) Uiso 1 1 d . . . . .
H10A H 0.847(3) 0.401(2) 0.411(2) 0.039(9) Uiso 1 1 d . . . . .
H11 H 1.056(4) 0.397(3) 0.572(2) 0.056(11) Uiso 1 1 d . . . . .
Cs2 Cs 0.70757(3) 0.58029(2) 0.86630(2) 0.05280(9) Uani 1 1 d . . . . .
H6' H 0.002(3) 0.594(2) 0.984(2) 0.043(10) Uiso 1 1 d . . . . .
H9' H 0.478(4) 0.670(2) 0.988(2) 0.045(10) Uiso 1 1 d . . . . .
H10' H 0.243(4) 0.626(3) 1.101(3) 0.069(12) Uiso 1 1 d . . . . .
O1 O 0.6153(3) 0.57773(18) 0.6450(2) 0.0529(7) Uani 1 1 d . . . . .
O1' O 0.4418(3) 0.45476(19) 0.82988(19) 0.0514(7) Uani 1 1 d . . . . .
N1 N 0.8294(3) 0.5438(2) 0.6153(2) 0.0357(8) Uani 1 1 d . . . . .
H1 H 0.890(4) 0.566(3) 0.612(3) 0.029(12) Uiso 1 1 d . . . . .
N1' N 0.2378(4) 0.4707(2) 0.8915(2) 0.0415(8) Uani 1 1 d . . . . .
H1' H 0.173(3) 0.442(2) 0.899(2) 0.024(10) Uiso 1 1 d . . . . .
C7' C 0.2060(4) 0.8329(3) 0.9852(3) 0.0474(10) Uani 1 1 d . . . . .
C8 C 0.7992(4) 0.1756(3) 0.5156(3) 0.0431(9) Uani 1 1 d . . . . .
C8' C 0.3362(4) 0.7836(3) 0.9408(3) 0.0483(11) Uani 1 1 d . . . . .
C12' C 0.2028(5) 0.9518(3) 1.0142(3) 0.0740(15) Uani 1 1 d . . . . .
H12A H 0.2696 0.9858 1.0672 0.111 Uiso 1 1 calc GR . . . .
H12B H 0.1145 0.9695 1.0344 0.111 Uiso 1 1 calc GR . . . .
H12C H 0.2222 0.9746 0.9591 0.111 Uiso 1 1 calc GR . . . .
C13 C 0.7987(5) 0.0565(3) 0.4849(3) 0.0688(14) Uani 1 1 d . . . . .
H13A H 0.8111 0.0355 0.5421 0.103 Uiso 1 1 calc GR . . . .
H13B H 0.8711 0.0353 0.4432 0.103 Uiso 1 1 calc GR . . . .
H13C H 0.7136 0.0239 0.4502 0.103 Uiso 1 1 calc GR . . . .
C13' C 0.4562(5) 0.8574(3) 0.9301(4) 0.0840(18) Uani 1 1 d . . . . .
H13D H 0.4966 0.8980 0.9937 0.126 Uiso 1 1 calc GR . . . .
H13E H 0.4248 0.9035 0.8969 0.126 Uiso 1 1 calc GR . . . .
H13F H 0.5222 0.8170 0.8928 0.126 Uiso 1 1 calc GR . . . .
C14 C 0.7346(4) 0.6092(2) 0.6402(2) 0.0309(8) Uani 1 1 d . . . . .
C14' C 0.3369(4) 0.4147(3) 0.8514(2) 0.0359(8) Uani 1 1 d . . . . .
C15 C 0.7731(4) 0.7246(2) 0.6630(2) 0.0340(8) Uani 1 1 d . . . . .
C15' C 0.3205(4) 0.2975(3) 0.8316(2) 0.0357(8) Uani 1 1 d . . . . .
C16 C 0.9036(4) 0.7717(3) 0.6927(3) 0.0465(10) Uani 1 1 d . . . . .
H16 H 0.9729 0.7312 0.6981 0.056 Uiso 1 1 calc R . . . .
C16' C 0.2139(4) 0.2461(3) 0.8620(3) 0.0511(11) Uani 1 1 d . . . . .
H16' H 0.1466 0.2837 0.8954 0.061 Uiso 1 1 calc R . . . .
C17 C 0.9316(5) 0.8796(3) 0.7147(3) 0.0639(13) Uani 1 1 d . . . . .
H17 H 1.0193 0.9114 0.7351 0.077 Uiso 1 1 calc R . . . .
C17' C 0.2068(5) 0.1386(3) 0.8428(3) 0.0680(14) Uani 1 1 d . . . . .
H17' H 0.1354 0.1042 0.8641 0.082 Uiso 1 1 calc R . . . .
C18 C 0.8302(6) 0.9384(3) 0.7060(3) 0.0738(15) Uani 1 1 d . . . . .
H18 H 0.8493 1.0104 0.7202 0.089 Uiso 1 1 calc R . . . .
C18' C 0.3045(6) 0.0830(3) 0.7925(4) 0.0748(15) Uani 1 1 d . . . . .
H18' H 0.2990 0.0108 0.7791 0.090 Uiso 1 1 calc R . . . .
C19 C 0.7010(6) 0.8934(3) 0.6769(4) 0.0897(18) Uani 1 1 d . . . . .
H19 H 0.6325 0.9341 0.6705 0.108 Uiso 1 1 calc R . . . .
C19' C 0.4091(6) 0.1329(3) 0.7623(4) 0.0778(16) Uani 1 1 d . . . . .
H19' H 0.4755 0.0949 0.7283 0.093 Uiso 1 1 calc R . . . .
C20 C 0.6724(5) 0.7862(3) 0.6568(3) 0.0657(13) Uani 1 1 d . . . . .
H20 H 0.5836 0.7557 0.6389 0.079 Uiso 1 1 calc R . . . .
C20' C 0.4177(5) 0.2405(3) 0.7817(3) 0.0580(12) Uani 1 1 d . . . . .
H20' H 0.4902 0.2742 0.7608 0.070 Uiso 1 1 calc R . . . .
B1 B 0.6992(4) 0.3495(3) 0.6350(3) 0.0356(10) Uani 1 1 d . . . . .
B1' B 0.1226(5) 0.6412(4) 0.8502(4) 0.0509(13) Uani 1 1 d . . . . .
H1'A H 0.063(4) 0.590(3) 0.785(3) 0.073(13) Uiso 1 1 d . . . . .
B2 B 0.8748(5) 0.3580(3) 0.6637(3) 0.0398(10) Uani 1 1 d . . . . .
H2 H 0.929(4) 0.391(3) 0.736(3) 0.061(12) Uiso 1 1 d . . . . .
B2' B 0.0648(5) 0.7540(4) 0.9343(4) 0.0521(12) Uani 1 1 d . . . . .
H2' H -0.036(5) 0.793(3) 0.936(3) 0.089(15) Uiso 1 1 d . . . . .
B3 B 0.8149(4) 0.4258(3) 0.5865(3) 0.0320(9) Uani 1 1 d . . . . .
B4 B 0.6743(4) 0.3445(3) 0.5090(3) 0.0356(10) Uani 1 1 d . . . . .
B4' B 0.3015(5) 0.6672(3) 0.8534(3) 0.0471(12) Uani 1 1 d . . . . .
B5 B 0.6516(5) 0.2303(3) 0.5438(3) 0.0397(10) Uani 1 1 d . . . . .
H5 H 0.562(4) 0.180(2) 0.536(2) 0.038(9) Uiso 1 1 d . . . . .
B5' B 0.2348(4) 0.5880(3) 0.9186(3) 0.0351(9) Uani 1 1 d . . . . .
B6 B 0.7758(5) 0.2375(3) 0.6357(3) 0.0452(11) Uani 1 1 d . . . . .
H6 H 0.763(3) 0.187(2) 0.686(2) 0.047(10) Uiso 1 1 d . . . . .
B6' B 0.0845(5) 0.6429(3) 0.9708(3) 0.0413(10) Uani 1 1 d . . . . .
B9' B 0.3708(5) 0.6818(3) 0.9737(3) 0.0441(11) Uani 1 1 d . . . . .
B10 B 0.8348(4) 0.3554(3) 0.4617(3) 0.0374(10) Uani 1 1 d . . . . .
H10B H 0.860(5) 0.268(3) 0.428(3) 0.087(14) Uiso 1 1 d . . . . .
B10' B 0.2366(5) 0.6623(3) 1.0458(3) 0.0437(11) Uani 1 1 d . . . . .
B11 B 0.9573(5) 0.3577(3) 0.5561(3) 0.0408(10) Uani 1 1 d . . . . .
B11' B 0.1380(5) 0.7688(3) 1.0548(3) 0.0462(12) Uani 1 1 d . . . . .
H11' H 0.083(4) 0.807(3) 1.112(2) 0.051(11) Uiso 1 1 d . . . . .
C7 C 0.9254(4) 0.2467(3) 0.5776(3) 0.0460(10) Uani 0.75 1 d . . P A 1
C12 C 1.0418(6) 0.1955(4) 0.6032(4) 0.0544(15) Uani 0.75 1 d . . P A 1
H12D H 1.1059 0.2474 0.6480 0.082 Uiso 1 1 calc GR . . A 1
H12E H 1.0847 0.1613 0.5448 0.082 Uiso 1 1 calc GR . . A 1
H12F H 1.0097 0.1447 0.6332 0.082 Uiso 1 1 calc GR . . A 1
B3' B 0.2031(8) 0.7705(5) 0.8666(5) 0.0421(18) Uani 0.6 1 d . . P B 1
H3' H 0.1964 0.8090 0.8100 0.050 Uiso 0.6 1 calc R . P B 1
B9 B 0.7403(5) 0.2272(3) 0.4369(3) 0.0498(11) Uani 0.75 1 d . . P A 1
C7A C 0.7403(5) 0.2272(3) 0.4369(3) 0.0498(11) Uani 0.25 1 d . . P A 2
C12A C 0.6901(19) 0.1749(13) 0.3523(10) 0.063(5) Uani 0.25 1 d . . P A 2
B3A B 0.3016(13) 0.7908(10) 1.0527(9) 0.058(4) Uani 0.4 1 d D . P B 2
H3A H 0.351(7) 0.853(4) 1.103(4) 0.03(2) Uiso 0.4 1 d D . P C 2
B9A B 0.9254(4) 0.2467(3) 0.5776(3) 0.0460(10) Uani 0.25 1 d . . P A 2


_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
Cs1 Cs2 4.7015(5) . ?
Cs1 O1 3.690(3) 2_666 ?
Cs1 O1 2.910(2) . ?
Cs1 O1' 3.130(3) . ?
Cs1 N1 3.799(3) 2_666 ?
Cs1 C14 3.593(3) 2_666 ?
Cs1 C14' 3.571(3) . ?
Cs1 B1 3.754(5) . ?
Cs1 B4 3.826(4) 2_666 ?
Cs1 B4 3.720(4) . ?
Cs1 B4' 3.872(4) . ?
Cs1 B10 3.834(5) 2_666 ?
Cs2 O1 3.274(3) . ?
Cs2 O1' 2.946(3) . ?
Cs2 N1 3.760(3) . ?
Cs2 N1' 3.795(3) 2_667 ?
Cs2 C14 3.422(3) . ?
Cs2 C16' 3.889(4) 2_667 ?
Cs2 B1 3.775(4) . ?
Cs2 B6' 3.896(5) 1_655 ?
Cs2 B9' 3.913(5) . ?
Cs2 B10' 3.943(5) 2_667 ?
O1 Cs1 3.690(3) 2_666 ?
O1 C14 1.235(4) . ?
O1' C14' 1.228(4) . ?
N1 Cs1 3.799(3) 2_666 ?
N1 C14 1.328(5) . ?
N1 B3 1.510(5) . ?
N1' Cs2 3.795(3) 2_667 ?
N1' C14' 1.330(5) . ?
N1' B5' 1.513(5) . ?
C7' C8' 1.571(6) . ?
C7' C12' 1.532(5) . ?
C7' B2' 1.676(6) . ?
C7' B11' 1.648(6) . ?
C7' B3' 1.650(8) . ?
C7' B3A 1.593(14) . ?
C8 C13 1.529(5) . ?
C8 B5 1.704(6) . ?
C8 B6 1.706(5) . ?
C8 C7 1.567(5) . ?
C8 B9 1.623(6) . ?
C8 C7A 1.623(6) . ?
C8 B9A 1.567(5) . ?
C8' C13' 1.532(5) . ?
C8' B4' 1.676(5) . ?
C8' B9' 1.649(6) . ?
C8' B3' 1.627(9) . ?
C8' B3A 1.638(14) . ?
C14 Cs1 3.593(3) 2_666 ?
C14 C15 1.502(4) . ?
C14' C15' 1.513(5) . ?
C15 C16 1.382(5) . ?
C15 C20 1.371(5) . ?
C15' C16' 1.378(5) . ?
C15' C20' 1.369(5) . ?
C16 C17 1.393(5) . ?
C16' Cs2 3.889(4) 2_667 ?
C16' C17' 1.387(5) . ?
C17 C18 1.359(7) . ?
C17' C18' 1.367(6) . ?
C18 C19 1.361(7) . ?
C18' C19' 1.350(6) . ?
C19 C20 1.386(5) . ?
C19' C20' 1.386(5) . ?
B1 B2 1.760(6) . ?
B1 B3 1.786(5) . ?
B1 B4 1.804(6) . ?
B1 B5 1.742(5) . ?
B1 B6 1.753(6) . ?
B1' B2' 1.780(7) . ?
B1' B4' 1.776(7) . ?
B1' B5' 1.796(7) . ?
B1' B6' 1.789(7) . ?
B1' B3' 1.799(8) . ?
B2 B3 1.764(6) . ?
B2 B6 1.751(6) . ?
B2 B11 1.782(6) . ?
B2 C7 1.749(6) . ?
B2 B9A 1.749(6) . ?
B2' B6' 1.764(7) . ?
B2' B11' 1.801(7) . ?
B2' B3' 1.756(9) . ?
B3 B4 1.801(5) . ?
B3 B10 1.780(5) . ?
B3 B11 1.747(6) . ?
B4 Cs1 3.826(4) 2_666 ?
B4 B5 1.768(6) . ?
B4 B10 1.772(6) . ?
B4 B9 1.794(6) . ?
B4 C7A 1.794(6) . ?
B4' B5' 1.742(6) . ?
B4' B9' 1.786(6) . ?
B4' B3' 1.737(9) . ?
B5 B6 1.746(6) . ?
B5 B9 1.798(6) . ?
B5 C7A 1.798(6) . ?
B5' B6' 1.808(6) . ?
B5' B9' 1.746(6) . ?
B5' B10' 1.791(6) . ?
B6 C7 1.748(6) . ?
B6 B9A 1.748(6) . ?
B6' Cs2 3.896(5) 1_455 ?
B6' B10' 1.772(7) . ?
B6' B11' 1.773(6) . ?
B9' B10' 1.775(6) . ?
B9' B3A 1.766(13) . ?
B10 Cs1 3.834(5) 2_666 ?
B10 B11 1.779(6) . ?
B10 B9 1.822(6) . ?
B10 C7A 1.822(6) . ?
B10' Cs2 3.943(5) 2_667 ?
B10' B11' 1.783(7) . ?
B10' B3A 1.772(14) . ?
B11 C7 1.633(6) . ?
B11 B9A 1.633(6) . ?
B11' B3A 1.629(14) . ?
C7 C12 1.487(6) . ?
C7A C12A 1.258(13) . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
O1 Cs1 Cs2 43.49(6) . . ?
O1 Cs1 Cs2 126.18(4) 2_666 . ?
O1 Cs1 O1 84.45(7) . 2_666 ?
O1 Cs1 O1' 81.36(7) . . ?
O1 Cs1 N1 108.23(8) . 2_666 ?
O1 Cs1 N1 34.78(6) 2_666 2_666 ?
O1 Cs1 C14 103.25(8) . 2_666 ?
O1 Cs1 C14' 100.82(8) . . ?
O1 Cs1 B1 56.18(8) . . ?
O1 Cs1 B1 92.70(7) 2_666 . ?
O1 Cs1 B4 70.73(8) . 2_666 ?
O1 Cs1 B4 51.40(7) 2_666 2_666 ?
O1 Cs1 B4 64.79(8) 2_666 . ?
O1 Cs1 B4 57.40(8) . . ?
O1 Cs1 B4' 79.39(9) . . ?
O1 Cs1 B4' 136.28(8) 2_666 . ?
O1 Cs1 B10 92.49(8) . 2_666 ?
O1 Cs1 B10 67.16(7) 2_666 2_666 ?
O1' Cs1 Cs2 37.90(5) . . ?
O1' Cs1 O1 160.38(7) . 2_666 ?
O1' Cs1 N1 164.80(7) . 2_666 ?
O1' Cs1 C14 170.48(7) . 2_666 ?
O1' Cs1 C14' 19.74(7) . . ?
O1' Cs1 B1 68.12(8) . . ?
O1' Cs1 B4 133.82(7) . 2_666 ?
O1' Cs1 B4 96.01(8) . . ?
O1' Cs1 B4' 53.61(9) . . ?
O1' Cs1 B10 126.78(8) . 2_666 ?
N1 Cs1 Cs2 150.46(5) 2_666 . ?
N1 Cs1 B4 44.92(7) 2_666 2_666 ?
N1 Cs1 B4' 115.41(9) 2_666 . ?
N1 Cs1 B10 43.15(8) 2_666 2_666 ?
C14 Cs1 Cs2 145.63(5) 2_666 . ?
C14 Cs1 O1 19.47(6) 2_666 2_666 ?
C14 Cs1 N1 20.45(7) 2_666 2_666 ?
C14 Cs1 B1 107.30(8) 2_666 . ?
C14 Cs1 B4 79.91(9) 2_666 . ?
C14 Cs1 B4 55.62(8) 2_666 2_666 ?
C14 Cs1 B4' 135.05(10) 2_666 . ?
C14 Cs1 B10 61.85(8) 2_666 2_666 ?
C14' Cs1 Cs2 57.52(6) . . ?
C14' Cs1 O1 168.57(7) . 2_666 ?
C14' Cs1 N1 147.17(8) . 2_666 ?
C14' Cs1 C14 155.40(8) . 2_666 ?
C14' Cs1 B1 82.09(9) . . ?
C14' Cs1 B4 109.42(9) . . ?
C14' Cs1 B4 139.90(8) . 2_666 ?
C14' Cs1 B4' 55.09(9) . . ?
C14' Cs1 B10 122.22(9) . 2_666 ?
B1 Cs1 Cs2 51.55(6) . . ?
B1 Cs1 N1 126.94(8) . 2_666 ?
B1 Cs1 B4 118.76(9) . 2_666 ?
B1 Cs1 B4' 110.59(10) . . ?
B1 Cs1 B10 145.20(9) . 2_666 ?
B4 Cs1 Cs2 106.81(6) 2_666 . ?
B4 Cs1 Cs2 73.77(6) . . ?
B4 Cs1 N1 99.11(8) . 2_666 ?
B4 Cs1 B1 27.92(9) . . ?
B4 Cs1 B4 98.71(9) . 2_666 ?
B4 Cs1 B4' 84.89(9) 2_666 . ?
B4 Cs1 B4' 131.65(10) . . ?
B4 Cs1 B10 26.74(9) 2_666 2_666 ?
B4 Cs1 B10 124.58(9) . 2_666 ?
B4' Cs1 Cs2 59.35(8) . . ?
B10 Cs1 Cs2 117.44(6) 2_666 . ?
B10 Cs1 B4' 73.24(10) 2_666 . ?
O1 Cs2 Cs1 37.71(4) . . ?
O1 Cs2 N1 36.32(7) . . ?
O1 Cs2 N1' 167.57(6) . 2_667 ?
O1 Cs2 C14 21.10(7) . . ?
O1 Cs2 C16' 145.34(7) . 2_667 ?
O1 Cs2 B1 53.89(8) . . ?
O1 Cs2 B6' 122.10(8) . 1_655 ?
O1 Cs2 B9' 93.66(8) . . ?
O1 Cs2 B10' 127.51(8) . 2_667 ?
O1' Cs2 Cs1 40.74(5) . . ?
O1' Cs2 O1 78.42(7) . . ?
O1' Cs2 N1 104.46(7) . . ?
O1' Cs2 N1' 90.17(7) . 2_667 ?
O1' Cs2 C14 98.86(8) . . ?
O1' Cs2 C16' 113.34(7) . 2_667 ?
O1' Cs2 B1 69.48(8) . . ?
O1' Cs2 B6' 152.47(9) . 1_655 ?
O1' Cs2 B9' 54.79(8) . . ?
O1' Cs2 B10' 74.68(9) . 2_667 ?
N1 Cs2 Cs1 67.09(5) . . ?
N1 Cs2 N1' 146.45(8) . 2_667 ?
N1 Cs2 C16' 141.24(7) . 2_667 ?
N1 Cs2 B1 45.75(8) . . ?
N1 Cs2 B6' 88.45(8) . 1_655 ?
N1 Cs2 B9' 129.55(9) . . ?
N1 Cs2 B10' 111.64(8) . 2_667 ?
N1' Cs2 Cs1 130.56(5) 2_667 . ?
N1' Cs2 C16' 44.60(7) 2_667 2_667 ?
N1' Cs2 B6' 67.24(8) 2_667 1_655 ?
N1' Cs2 B9' 83.56(9) 2_667 . ?
N1' Cs2 B10' 42.95(8) 2_667 2_667 ?
C14 Cs2 Cs1 58.20(6) . . ?
C14 Cs2 N1 20.62(8) . . ?
C14 Cs2 N1' 166.37(8) . 2_667 ?
C14 Cs2 C16' 137.07(7) . 2_667 ?
C14 Cs2 B1 57.50(8) . . ?
C14 Cs2 B6' 101.07(9) . 1_655 ?
C14 Cs2 B9' 109.98(9) . . ?
C14 Cs2 B10' 130.01(8) . 2_667 ?
C16' Cs2 Cs1 143.68(6) 2_667 . ?
C16' Cs2 B6' 61.61(9) 2_667 1_655 ?
C16' Cs2 B9' 71.18(9) 2_667 . ?
C16' Cs2 B10' 87.04(9) 2_667 2_667 ?
B1 Cs2 Cs1 51.16(7) . . ?
B1 Cs2 N1' 117.51(8) . 2_667 ?
B1 Cs2 C16' 160.10(9) . 2_667 ?
B1 Cs2 B6' 106.19(9) . 1_655 ?
B1 Cs2 B9' 120.66(9) . . ?
B1 Cs2 B10' 74.56(9) . 2_667 ?
B6' Cs2 Cs1 154.32(7) 1_655 . ?
B6' Cs2 B9' 132.47(9) 1_655 . ?
B6' Cs2 B10' 77.98(9) 1_655 2_667 ?
B9' Cs2 Cs1 72.49(6) . . ?
B9' Cs2 B10' 105.76(10) . 2_667 ?
B10' Cs2 Cs1 103.08(7) 2_667 . ?
Cs1 O1 Cs1 95.55(7) . 2_666 ?
Cs1 O1 Cs2 98.80(8) . . ?
Cs2 O1 Cs1 158.99(9) . 2_666 ?
C14 O1 Cs1 75.8(2) . 2_666 ?
C14 O1 Cs1 162.8(2) . . ?
C14 O1 Cs2 86.2(2) . . ?
Cs2 O1' Cs1 101.36(7) . . ?
C14' O1' Cs1 100.9(2) . . ?
C14' O1' Cs2 156.5(2) . . ?
Cs2 N1 Cs1 129.91(9) . 2_666 ?
C14 N1 Cs1 71.0(2) . 2_666 ?
C14 N1 Cs2 65.19(19) . . ?
C14 N1 B3 128.8(3) . . ?
B3 N1 Cs1 95.2(2) . 2_666 ?
B3 N1 Cs2 93.9(2) . . ?
C14' N1' Cs2 93.4(2) . 2_667 ?
C14' N1' B5' 127.4(3) . . ?
B5' N1' Cs2 105.0(2) . 2_667 ?
C8' C7' B2' 111.4(3) . . ?
C8' C7' B11' 110.7(3) . . ?
C8' C7' B3' 60.6(3) . . ?
C8' C7' B3A 62.4(5) . . ?
C12' C7' C8' 119.0(3) . . ?
C12' C7' B2' 119.2(4) . . ?
C12' C7' B11' 119.5(3) . . ?
C12' C7' B3' 115.6(4) . . ?
C12' C7' B3A 116.8(5) . . ?
B11' C7' B2' 65.6(3) . . ?
B11' C7' B3' 117.7(3) . . ?
B3' C7' B2' 63.7(3) . . ?
B3A C7' B2' 115.3(5) . . ?
B3A C7' B11' 60.3(6) . . ?
C13 C8 B5 119.4(3) . . ?
C13 C8 B6 116.2(3) . . ?
C13 C8 C7 119.2(4) . . ?
C13 C8 B9 118.6(3) . . ?
C13 C8 C7A 118.6(3) . . ?
C13 C8 B9A 119.2(4) . . ?
B5 C8 B6 61.6(3) . . ?
C7 C8 B5 112.4(3) . . ?
C7 C8 B6 64.4(2) . . ?
C7 C8 B9 110.2(3) . . ?
B9 C8 B5 65.4(3) . . ?
B9 C8 B6 116.7(3) . . ?
C7A C8 B5 65.4(3) . . ?
C7A C8 B6 116.7(3) . . ?
B9A C8 B5 112.4(3) . . ?
B9A C8 B6 64.4(2) . . ?
B9A C8 C7A 110.2(3) . . ?
C7' C8' B4' 113.2(3) . . ?
C7' C8' B9' 113.5(3) . . ?
C7' C8' B3' 62.1(3) . . ?
C7' C8' B3A 59.5(5) . . ?
C13' C8' C7' 118.3(3) . . ?
C13' C8' B4' 118.3(3) . . ?
C13' C8' B9' 117.5(4) . . ?
C13' C8' B3' 115.7(4) . . ?
C13' C8' B3A 116.6(5) . . ?
B9' C8' B4' 65.0(3) . . ?
B3' C8' B4' 63.4(3) . . ?
B3' C8' B9' 118.1(4) . . ?
B3A C8' B4' 117.5(5) . . ?
B3A C8' B9' 65.0(5) . . ?
Cs2 C14 Cs1 154.95(10) . 2_666 ?
O1 C14 Cs1 84.7(2) . 2_666 ?
O1 C14 Cs2 72.7(2) . . ?
O1 C14 N1 121.9(3) . . ?
O1 C14 C15 118.9(3) . . ?
N1 C14 Cs1 88.6(2) . 2_666 ?
N1 C14 Cs2 94.2(2) . . ?
N1 C14 C15 119.2(3) . . ?
C15 C14 Cs1 96.69(19) . 2_666 ?
C15 C14 Cs2 103.57(18) . . ?
O1' C14' Cs1 59.37(19) . . ?
O1' C14' N1' 122.5(3) . . ?
O1' C14' C15' 118.5(3) . . ?
N1' C14' Cs1 105.2(2) . . ?
N1' C14' C15' 119.0(3) . . ?
C15' C14' Cs1 104.91(19) . . ?
C16 C15 C14 123.2(3) . . ?
C20 C15 C14 118.0(3) . . ?
C20 C15 C16 118.8(3) . . ?
C16' C15' C14' 123.2(3) . . ?
C20' C15' C14' 117.8(3) . . ?
C20' C15' C16' 118.9(3) . . ?
C15 C16 C17 120.2(4) . . ?
C15' C16' Cs2 92.2(2) . 2_667 ?
C15' C16' C17' 120.1(4) . . ?
C17' C16' Cs2 116.7(3) . 2_667 ?
C18 C17 C16 119.7(4) . . ?
C18' C17' C16' 120.1(4) . . ?
C17 C18 C19 120.9(4) . . ?
C19' C18' C17' 120.1(4) . . ?
C18 C19 C20 119.5(5) . . ?
C18' C19' C20' 120.3(4) . . ?
C15 C20 C19 120.9(4) . . ?
C15' C20' C19' 120.5(4) . . ?
Cs1 B1 Cs2 77.29(8) . . ?
B2 B1 Cs1 157.2(2) . . ?
B2 B1 Cs2 84.34(19) . . ?
B2 B1 B3 59.7(2) . . ?
B2 B1 B4 107.8(3) . . ?
B3 B1 Cs1 106.1(2) . . ?
B3 B1 Cs2 88.98(18) . . ?
B3 B1 B4 60.2(2) . . ?
B4 B1 Cs1 75.0(2) . . ?
B4 B1 Cs2 129.5(2) . . ?
B5 B1 Cs1 93.0(2) . . ?
B5 B1 Cs2 162.3(2) . . ?
B5 B1 B2 108.1(3) . . ?
B5 B1 B3 108.1(3) . . ?
B5 B1 B4 59.8(2) . . ?
B5 B1 B6 60.0(2) . . ?
B6 B1 Cs1 142.2(2) . . ?
B6 B1 Cs2 120.3(2) . . ?
B6 B1 B2 59.8(3) . . ?
B6 B1 B3 107.3(3) . . ?
B6 B1 B4 107.3(3) . . ?
B2' B1' B5' 107.2(3) . . ?
B2' B1' B6' 59.3(3) . . ?
B2' B1' B3' 58.8(3) . . ?
B4' B1' B2' 106.2(3) . . ?
B4' B1' B5' 58.4(3) . . ?
B4' B1' B6' 106.3(3) . . ?
B4' B1' B3' 58.1(3) . . ?
B5' B1' B3' 104.0(4) . . ?
B6' B1' B5' 60.6(3) . . ?
B6' B1' B3' 104.5(3) . . ?
B1 B2 B3 60.9(2) . . ?
B1 B2 B11 107.2(3) . . ?
B3 B2 B11 59.0(2) . . ?
B6 B2 B1 59.9(3) . . ?
B6 B2 B3 108.4(3) . . ?
B6 B2 B11 106.8(3) . . ?
C7 B2 B1 103.6(3) . . ?
C7 B2 B3 101.0(3) . . ?
C7 B2 B6 59.9(2) . . ?
C7 B2 B11 55.1(2) . . ?
B9A B2 B1 103.6(3) . . ?
B9A B2 B3 101.0(3) . . ?
B9A B2 B6 59.9(2) . . ?
B9A B2 B11 55.1(2) . . ?
C7' B2' B1' 105.0(4) . . ?
C7' B2' B6' 102.6(3) . . ?
C7' B2' B11' 56.5(2) . . ?
C7' B2' B3' 57.4(3) . . ?
B1' B2' B11' 108.3(4) . . ?
B6' B2' B1' 60.6(3) . . ?
B6' B2' B11' 59.6(3) . . ?
B3' B2' B1' 61.2(3) . . ?
B3' B2' B6' 107.5(4) . . ?
B3' B2' B11' 105.0(4) . . ?
N1 B3 B1 125.2(3) . . ?
N1 B3 B2 122.7(3) . . ?
N1 B3 B4 123.0(3) . . ?
N1 B3 B10 116.9(3) . . ?
N1 B3 B11 119.7(3) . . ?
B1 B3 B4 60.4(2) . . ?
B2 B3 B1 59.5(2) . . ?
B2 B3 B4 107.7(3) . . ?
B2 B3 B10 110.6(3) . . ?
B10 B3 B1 109.2(3) . . ?
B10 B3 B4 59.3(2) . . ?
B11 B3 B1 107.7(3) . . ?
B11 B3 B2 61.0(3) . . ?
B11 B3 B4 106.3(3) . . ?
B11 B3 B10 60.6(2) . . ?
Cs1 B4 Cs1 81.28(9) . 2_666 ?
B1 B4 Cs1 77.1(2) . . ?
B1 B4 Cs1 133.5(2) . 2_666 ?
B3 B4 Cs1 89.40(19) . 2_666 ?
B3 B4 Cs1 107.0(2) . . ?
B3 B4 B1 59.4(2) . . ?
B5 B4 Cs1 93.7(2) . . ?
B5 B4 Cs1 164.3(2) . 2_666 ?
B5 B4 B1 58.4(2) . . ?
B5 B4 B3 106.3(3) . . ?
B5 B4 B10 110.8(3) . . ?
B5 B4 B9 60.6(2) . . ?
B5 B4 C7A 60.6(2) . . ?
B10 B4 Cs1 76.9(2) . 2_666 ?
B10 B4 Cs1 154.3(2) . . ?
B10 B4 B1 108.8(3) . . ?
B10 B4 B3 59.8(2) . . ?
B10 B4 B9 61.4(2) . . ?
B10 B4 C7A 61.4(2) . . ?
B9 B4 Cs1 142.4(2) . . ?
B9 B4 Cs1 115.6(2) . 2_666 ?
B9 B4 B1 106.4(3) . . ?
B9 B4 B3 106.5(3) . . ?
C7A B4 Cs1 115.6(2) . 2_666 ?
C7A B4 Cs1 142.4(2) . . ?
C7A B4 B1 106.4(3) . . ?
C7A B4 B3 106.5(3) . . ?
C8' B4' Cs1 155.6(3) . . ?
C8' B4' B1' 104.1(3) . . ?
C8' B4' B5' 102.4(3) . . ?
C8' B4' B9' 56.8(2) . . ?
C8' B4' B3' 56.9(3) . . ?
B1' B4' Cs1 97.6(2) . . ?
B1' B4' B9' 108.4(3) . . ?
B5' B4' Cs1 97.7(2) . . ?
B5' B4' B1' 61.4(3) . . ?
B5' B4' B9' 59.3(2) . . ?
B9' B4' Cs1 126.2(3) . . ?
B3' B4' Cs1 128.0(3) . . ?
B3' B4' B1' 61.6(3) . . ?
B3' B4' B5' 109.1(4) . . ?
B3' B4' B9' 105.8(4) . . ?
C8 B5 B1 104.9(3) . . ?
C8 B5 B4 102.9(3) . . ?
C8 B5 B6 59.2(3) . . ?
C8 B5 B9 55.1(2) . . ?
C8 B5 C7A 55.1(2) . . ?
B1 B5 B4 61.8(2) . . ?
B1 B5 B6 60.3(2) . . ?
B1 B5 B9 108.9(3) . . ?
B1 B5 C7A 108.9(3) . . ?
B4 B5 B9 60.4(2) . . ?
B4 B5 C7A 60.4(2) . . ?
B6 B5 B4 109.3(3) . . ?
B6 B5 B9 106.1(3) . . ?
B6 B5 C7A 106.1(3) . . ?
N1' B5' B1' 120.0(3) . . ?
N1' B5' B4' 126.1(3) . . ?
N1' B5' B6' 117.8(3) . . ?
N1' B5' B9' 125.4(3) . . ?
N1' B5' B10' 118.0(3) . . ?
B1' B5' B6' 59.5(3) . . ?
B4' B5' B1' 60.2(3) . . ?
B4' B5' B6' 106.9(3) . . ?
B4' B5' B9' 61.6(3) . . ?
B4' B5' B10' 110.0(3) . . ?
B9' B5' B1' 109.3(3) . . ?
B9' B5' B6' 106.2(3) . . ?
B9' B5' B10' 60.2(2) . . ?
B10' B5' B1' 108.8(3) . . ?
B10' B5' B6' 59.0(2) . . ?
C8 B6 B1 104.3(3) . . ?
C8 B6 B2 104.3(3) . . ?
C8 B6 B5 59.1(2) . . ?
C8 B6 C7 53.9(2) . . ?
C8 B6 B9A 53.9(2) . . ?
B2 B6 B1 60.3(2) . . ?
B5 B6 B1 59.7(2) . . ?
B5 B6 B2 108.3(3) . . ?
B5 B6 C7 102.1(3) . . ?
B5 B6 B9A 102.1(3) . . ?
C7 B6 B1 103.9(3) . . ?
C7 B6 B2 60.0(2) . . ?
B9A B6 B1 103.9(3) . . ?
B9A B6 B2 60.0(2) . . ?
B1' B6' Cs2 85.6(2) . 1_455 ?
B1' B6' B5' 59.9(3) . . ?
B2' B6' Cs2 80.0(2) . 1_455 ?
B2' B6' B1' 60.1(3) . . ?
B2' B6' B5' 107.4(3) . . ?
B2' B6' B10' 110.3(3) . . ?
B2' B6' B11' 61.2(3) . . ?
B5' B6' Cs2 129.9(2) . 1_455 ?
B10' B6' Cs2 164.0(3) . 1_455 ?
B10' B6' B1' 110.0(3) . . ?
B10' B6' B5' 60.0(2) . . ?
B10' B6' B11' 60.4(3) . . ?
B11' B6' Cs2 118.8(3) . 1_455 ?
B11' B6' B1' 109.1(3) . . ?
B11' B6' B5' 106.9(3) . . ?
C8' B9' Cs2 110.1(2) . . ?
C8' B9' B4' 58.2(2) . . ?
C8' B9' B5' 103.4(3) . . ?
C8' B9' B10' 104.9(3) . . ?
C8' B9' B3A 57.2(5) . . ?
B4' B9' Cs2 90.1(2) . . ?
B5' B9' Cs2 109.5(2) . . ?
B5' B9' B4' 59.1(2) . . ?
B5' B9' B10' 61.2(2) . . ?
B5' B9' B3A 106.8(5) . . ?
B10' B9' Cs2 145.0(3) . . ?
B10' B9' B4' 108.8(3) . . ?
B3A B9' Cs2 143.6(5) . . ?
B3A B9' B4' 105.8(5) . . ?
B3A B9' B10' 60.1(5) . . ?
B3 B10 Cs1 89.5(2) . 2_666 ?
B3 B10 B9 106.2(3) . . ?
B3 B10 C7A 106.2(3) . . ?
B4 B10 Cs1 76.4(2) . 2_666 ?
B4 B10 B3 60.9(2) . . ?
B4 B10 B11 106.2(3) . . ?
B4 B10 B9 59.9(2) . . ?
B4 B10 C7A 59.9(2) . . ?
B11 B10 Cs1 137.4(2) . 2_666 ?
B11 B10 B3 58.8(2) . . ?
B11 B10 B9 102.1(3) . . ?
B11 B10 C7A 102.1(3) . . ?
B9 B10 Cs1 114.4(2) . 2_666 ?
C7A B10 Cs1 114.4(2) . 2_666 ?
B5' B10' Cs2 93.7(2) . 2_667 ?
B6' B10' Cs2 112.4(2) . 2_667 ?
B6' B10' B5' 61.0(2) . . ?
B6' B10' B9' 106.5(3) . . ?
B6' B10' B11' 59.8(3) . . ?
B6' B10' B3A 102.2(5) . . ?
B9' B10' Cs2 109.3(3) . 2_667 ?
B9' B10' B5' 58.6(2) . . ?
B9' B10' B11' 104.4(3) . . ?
B11' B10' Cs2 146.1(3) . 2_667 ?
B11' B10' B5' 107.2(3) . . ?
B3A B10' Cs2 145.3(5) . 2_667 ?
B3A B10' B5' 104.5(5) . . ?
B3A B10' B9' 59.7(5) . . ?
B3A B10' B11' 54.5(5) . . ?
B3 B11 B2 59.9(2) . . ?
B3 B11 B10 60.6(2) . . ?
B10 B11 B2 109.8(3) . . ?
C7 B11 B2 61.4(2) . . ?
C7 B11 B3 106.5(3) . . ?
C7 B11 B10 105.8(3) . . ?
B9A B11 B2 61.4(2) . . ?
B9A B11 B3 106.5(3) . . ?
B9A B11 B10 105.8(3) . . ?
C7' B11' B2' 57.9(3) . . ?
C7' B11' B6' 103.4(3) . . ?
C7' B11' B10' 106.3(3) . . ?
B6' B11' B2' 59.2(3) . . ?
B6' B11' B10' 59.8(3) . . ?
B10' B11' B2' 108.2(3) . . ?
B3A B11' C7' 58.2(5) . . ?
B3A B11' B2' 107.2(5) . . ?
B3A B11' B6' 108.3(5) . . ?
B3A B11' B10' 62.4(5) . . ?
C8 C7 B2 110.6(3) . . ?
C8 C7 B6 61.6(2) . . ?
C8 C7 B11 114.3(3) . . ?
B6 C7 B2 60.1(2) . . ?
B11 C7 B2 63.5(2) . . ?
B11 C7 B6 114.0(3) . . ?
C12 C7 C8 118.5(3) . . ?
C12 C7 B2 119.9(3) . . ?
C12 C7 B6 117.8(4) . . ?
C12 C7 B11 118.2(4) . . ?
C7' B3' B1' 105.2(4) . . ?
C7' B3' B2' 58.9(3) . . ?
C7' B3' B4' 106.3(5) . . ?
C8' B3' C7' 57.3(3) . . ?
C8' B3' B1' 105.1(5) . . ?
C8' B3' B2' 104.9(4) . . ?
C8' B3' B4' 59.6(3) . . ?
B2' B3' B1' 60.1(3) . . ?
B4' B3' B1' 60.3(3) . . ?
B4' B3' B2' 109.0(4) . . ?
C8 B9 B4 105.1(3) . . ?
C8 B9 B5 59.5(3) . . ?
C8 B9 B10 107.3(3) . . ?
B4 B9 B5 59.0(2) . . ?
B4 B9 B10 58.7(2) . . ?
B5 B9 B10 107.2(3) . . ?
C8 C7A B4 105.1(3) . . ?
C8 C7A B5 59.5(3) . . ?
C8 C7A B10 107.3(3) . . ?
B4 C7A B5 59.0(2) . . ?
B4 C7A B10 58.7(2) . . ?
B5 C7A B10 107.2(3) . . ?
C12A C7A C8 123.9(9) . . ?
C12A C7A B4 122.3(9) . . ?
C12A C7A B5 121.3(9) . . ?
C12A C7A B10 121.6(9) . . ?
C7' B3A C8' 58.2(5) . . ?
C7' B3A B9' 106.5(7) . . ?
C7' B3A B10' 109.3(7) . . ?
C7' B3A B11' 61.5(5) . . ?
C8' B3A B9' 57.8(4) . . ?
C8' B3A B10' 105.5(6) . . ?
B9' B3A B10' 60.2(4) . . ?
B11' B3A C8' 108.3(7) . . ?
B11' B3A B9' 111.7(6) . . ?
B11' B3A B10' 63.0(5) . . ?
C8 B9A B2 110.6(3) . . ?
C8 B9A B6 61.6(2) . . ?
C8 B9A B11 114.3(3) . . ?
B6 B9A B2 60.1(2) . . ?
B11 B9A B2 63.5(2) . . ?
B11 B9A B6 114.0(3) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Cs1 O1 C14 Cs1 61.3(9) . . . 2_666 ?
Cs1 O1 C14 Cs2 -107.8(8) . . . . ?
Cs1 O1 C14 Cs2 -169.03(7) 2_666 . . . ?
Cs1 O1 C14 N1 -85.0(3) 2_666 . . . ?
Cs1 O1 C14 N1 -23.7(11) . . . . ?
Cs1 O1 C14 C15 94.7(3) 2_666 . . . ?
Cs1 O1 C14 C15 156.0(7) . . . . ?
Cs1 O1' C14' N1' -89.1(4) . . . . ?
Cs1 O1' C14' C15' 91.1(3) . . . . ?
Cs1 N1 C14 Cs2 155.07(11) 2_666 . . . ?
Cs1 N1 C14 O1 82.9(3) 2_666 . . . ?
Cs1 N1 C14 C15 -96.9(3) 2_666 . . . ?
Cs1 N1 B3 B1 -103.9(3) 2_666 . . . ?
Cs1 N1 B3 B2 -177.3(3) 2_666 . . . ?
Cs1 N1 B3 B4 -29.2(3) 2_666 . . . ?
Cs1 N1 B3 B10 40.1(3) 2_666 . . . ?
Cs1 N1 B3 B11 109.9(3) 2_666 . . . ?
Cs1 C14 C15 C16 -115.3(3) 2_666 . . . ?
Cs1 C14 C15 C20 66.9(3) 2_666 . . . ?
Cs1 C14' C15' C16' -124.1(3) . . . . ?
Cs1 C14' C15' C20' 56.5(4) . . . . ?
Cs1 B1 B2 B3 -55.8(6) . . . . ?
Cs1 B1 B2 B6 166.4(6) . . . . ?
Cs1 B1 B2 B11 -93.7(6) . . . . ?
Cs1 B1 B2 C7 -151.0(5) . . . . ?
Cs1 B1 B2 B9A -151.0(5) . . . . ?
Cs1 B1 B3 N1 49.9(4) . . . . ?
Cs1 B1 B3 B2 160.5(2) . . . . ?
Cs1 B1 B3 B4 -61.6(2) . . . . ?
Cs1 B1 B3 B10 -96.4(3) . . . . ?
Cs1 B1 B3 B11 -160.6(2) . . . . ?
Cs1 B1 B4 Cs1 64.4(3) . . . 2_666 ?
Cs1 B1 B4 B3 119.0(2) . . . . ?
Cs1 B1 B4 B5 -102.7(2) . . . . ?
Cs1 B1 B4 B10 154.0(3) . . . . ?
Cs1 B1 B4 B9 -141.2(3) . . . . ?
Cs1 B1 B4 C7A -141.2(3) . . . . ?
Cs1 B1 B5 C8 167.5(2) . . . . ?
Cs1 B1 B5 B4 70.7(2) . . . . ?
Cs1 B1 B5 B6 -152.0(2) . . . . ?
Cs1 B1 B5 B9 109.8(3) . . . . ?
Cs1 B1 B5 C7A 109.8(3) . . . . ?
Cs1 B1 B6 C8 90.1(4) . . . . ?
Cs1 B1 B6 B2 -171.5(4) . . . . ?
Cs1 B1 B6 B5 49.8(4) . . . . ?
Cs1 B1 B6 C7 145.8(3) . . . . ?
Cs1 B1 B6 B9A 145.8(3) . . . . ?
Cs1 B4 B5 C8 116.7(9) 2_666 . . . ?
Cs1 B4 B5 C8 -172.6(2) . . . . ?
Cs1 B4 B5 B1 -72.4(2) . . . . ?
Cs1 B4 B5 B1 -143.1(9) 2_666 . . . ?
Cs1 B4 B5 B6 178.3(8) 2_666 . . . ?
Cs1 B4 B5 B6 -111.0(3) . . . . ?
Cs1 B4 B5 B9 151.0(2) . . . . ?
Cs1 B4 B5 B9 80.2(9) 2_666 . . . ?
Cs1 B4 B5 C7A 80.2(9) 2_666 . . . ?
Cs1 B4 B5 C7A 151.0(2) . . . . ?
Cs1 B4 B10 Cs1 -32.5(5) . . . 2_666 ?
Cs1 B4 B10 B3 64.6(5) . . . . ?
Cs1 B4 B10 B3 97.09(19) 2_666 . . . ?
Cs1 B4 B10 B11 103.5(6) . . . . ?
Cs1 B4 B10 B11 135.9(2) 2_666 . . . ?
Cs1 B4 B10 B9 -129.2(2) 2_666 . . . ?
Cs1 B4 B10 B9 -161.7(6) . . . . ?
Cs1 B4 B10 C7A -129.2(2) 2_666 . . . ?
Cs1 B4 B10 C7A -161.7(6) . . . . ?
Cs1 B4 B9 C8 -91.6(4) . . . . ?
Cs1 B4 B9 C8 158.1(2) 2_666 . . . ?
Cs1 B4 B9 B5 -52.5(4) . . . . ?
Cs1 B4 B9 B5 -162.8(3) 2_666 . . . ?
Cs1 B4 B9 B10 56.8(2) 2_666 . . . ?
Cs1 B4 B9 B10 167.1(4) . . . . ?
Cs1 B4 C7A C8 -91.6(4) . . . . ?
Cs1 B4 C7A C8 158.1(2) 2_666 . . . ?
Cs1 B4 C7A B5 -52.5(4) . . . . ?
Cs1 B4 C7A B5 -162.8(3) 2_666 . . . ?
Cs1 B4 C7A B10 167.1(4) . . . . ?
Cs1 B4 C7A B10 56.8(2) 2_666 . . . ?
Cs1 B4 C7A C12A -53.1(11) 2_666 . . . ?
Cs1 B4 C7A C12A 57.2(12) . . . . ?
Cs1 B4' B5' N1' 12.8(4) . . . . ?
Cs1 B4' B5' B1' -94.4(2) . . . . ?
Cs1 B4' B5' B6' -132.7(2) . . . . ?
Cs1 B4' B5' B9' 127.7(3) . . . . ?
Cs1 B4' B5' B10' 164.8(3) . . . . ?
Cs1 B4' B9' Cs2 36.6(2) . . . . ?
Cs1 B4' B9' C8' 150.4(3) . . . . ?
Cs1 B4' B9' B5' -76.1(3) . . . . ?
Cs1 B4' B9' B10' -113.3(3) . . . . ?
Cs1 B4' B9' B3A -176.5(5) . . . . ?
Cs1 B4' B3' C7' 175.0(2) . . . . ?
Cs1 B4' B3' C8' -150.5(3) . . . . ?
Cs1 B4' B3' B1' 76.5(4) . . . . ?
Cs1 B4' B3' B2' 113.0(4) . . . . ?
Cs1 B10 B11 B2 83.1(4) 2_666 . . . ?
Cs1 B10 B11 B3 47.5(3) 2_666 . . . ?
Cs1 B10 B11 C7 147.9(3) 2_666 . . . ?
Cs1 B10 B11 B9A 147.9(3) 2_666 . . . ?
Cs1 B10 B9 C8 -153.3(2) 2_666 . . . ?
Cs1 B10 B9 B4 -55.8(2) 2_666 . . . ?
Cs1 B10 B9 B5 -90.7(3) 2_666 . . . ?
Cs1 B10 C7A C8 -153.3(2) 2_666 . . . ?
Cs1 B10 C7A B4 -55.8(2) 2_666 . . . ?
Cs1 B10 C7A B5 -90.7(3) 2_666 . . . ?
Cs1 B10 C7A C12A 55.3(11) 2_666 . . . ?
Cs2 O1 C14 Cs1 169.03(7) . . . 2_666 ?
Cs2 O1 C14 N1 84.0(3) . . . . ?
Cs2 O1 C14 C15 -96.2(3) . . . . ?
Cs2 O1' C14' Cs1 160.6(7) . . . . ?
Cs2 O1' C14' N1' 71.5(8) . . . . ?
Cs2 O1' C14' C15' -108.3(6) . . . . ?
Cs2 N1 C14 Cs1 -155.07(11) . . . 2_666 ?
Cs2 N1 C14 O1 -72.2(3) . . . . ?
Cs2 N1 C14 C15 108.1(3) . . . . ?
Cs2 N1 B3 B1 26.7(4) . . . . ?
Cs2 N1 B3 B2 -46.7(3) . . . . ?
Cs2 N1 B3 B4 101.5(3) . . . . ?
Cs2 N1 B3 B10 170.8(3) . . . . ?
Cs2 N1 B3 B11 -119.4(3) . . . . ?
Cs2 N1' C14' Cs1 -175.73(8) 2_667 . . . ?
Cs2 N1' C14' O1' -112.6(3) 2_667 . . . ?
Cs2 N1' C14' C15' 67.1(3) 2_667 . . . ?
Cs2 N1' B5' B1' -143.7(3) 2_667 . . . ?
Cs2 N1' B5' B4' 143.1(3) 2_667 . . . ?
Cs2 N1' B5' B6' -74.6(3) 2_667 . . . ?
Cs2 N1' B5' B9' 64.8(4) 2_667 . . . ?
Cs2 N1' B5' B10' -6.9(4) 2_667 . . . ?
Cs2 C14 C15 C16 79.5(3) . . . . ?
Cs2 C14 C15 C20 -98.3(3) . . . . ?
Cs2 C16' C17' C18' -110.8(5) 2_667 . . . ?
Cs2 B1 B2 B3 -92.14(18) . . . . ?
Cs2 B1 B2 B6 130.1(2) . . . . ?
Cs2 B1 B2 B11 -130.0(2) . . . . ?
Cs2 B1 B2 C7 172.7(2) . . . . ?
Cs2 B1 B2 B9A 172.7(2) . . . . ?
Cs2 B1 B3 N1 -26.6(4) . . . . ?
Cs2 B1 B3 B2 84.03(19) . . . . ?
Cs2 B1 B3 B4 -138.0(2) . . . . ?
Cs2 B1 B3 B10 -172.9(3) . . . . ?
Cs2 B1 B3 B11 122.9(2) . . . . ?
Cs2 B1 B4 Cs1 -58.9(2) . . . . ?
Cs2 B1 B4 Cs1 5.5(5) . . . 2_666 ?
Cs2 B1 B4 B3 60.1(3) . . . . ?
Cs2 B1 B4 B5 -161.5(3) . . . . ?
Cs2 B1 B4 B10 95.1(3) . . . . ?
Cs2 B1 B4 B9 159.9(2) . . . . ?
Cs2 B1 B4 C7A 159.9(2) . . . . ?
Cs2 B1 B5 C8 -136.5(8) . . . . ?
Cs2 B1 B5 B4 126.6(9) . . . . ?
Cs2 B1 B5 B6 -96.1(9) . . . . ?
Cs2 B1 B5 B9 165.8(7) . . . . ?
Cs2 B1 B5 C7A 165.8(7) . . . . ?
Cs2 B1 B6 C8 -160.2(2) . . . . ?
Cs2 B1 B6 B2 -61.8(3) . . . . ?
Cs2 B1 B6 B5 159.5(3) . . . . ?
Cs2 B1 B6 C7 -104.5(3) . . . . ?
Cs2 B1 B6 B9A -104.5(3) . . . . ?
Cs2 B6' B10' Cs2 51.4(10) 1_455 . . 2_667 ?
Cs2 B6' B10' B5' 132.8(9) 1_455 . . . ?
Cs2 B6' B10' B9' 171.1(8) 1_455 . . . ?
Cs2 B6' B10' B11' -91.6(9) 1_455 . . . ?
Cs2 B6' B10' B3A -127.2(9) 1_455 . . . ?
Cs2 B6' B11' C7' -97.0(3) 1_455 . . . ?
Cs2 B6' B11' B2' -58.1(3) 1_455 . . . ?
Cs2 B6' B11' B10' 161.7(3) 1_455 . . . ?
Cs2 B6' B11' B3A -157.5(6) 1_455 . . . ?
Cs2 B9' B10' Cs2 -0.7(5) . . . 2_667 ?
Cs2 B9' B10' B5' -83.0(4) . . . . ?
Cs2 B9' B10' B6' -122.3(4) . . . . ?
Cs2 B9' B10' B11' 175.4(3) . . . . ?
Cs2 B9' B10' B3A 142.9(6) . . . . ?
Cs2 B9' B3A C7' 112.6(7) . . . . ?
Cs2 B9' B3A C8' 79.4(8) . . . . ?
Cs2 B9' B3A B10' -144.2(7) . . . . ?
Cs2 B9' B3A B11' 178.0(3) . . . . ?
Cs2 B10' B11' C7' 178.0(3) 2_667 . . . ?
Cs2 B10' B11' B2' -121.1(4) 2_667 . . . ?
Cs2 B10' B11' B6' -85.8(5) 2_667 . . . ?
Cs2 B10' B11' B3A 138.6(6) 2_667 . . . ?
Cs2 B10' B3A C7' 178.5(3) 2_667 . . . ?
Cs2 B10' B3A C8' 117.4(7) 2_667 . . . ?
Cs2 B10' B3A B9' 80.1(8) 2_667 . . . ?
Cs2 B10' B3A B11' -139.6(6) 2_667 . . . ?
O1 C14 C15 C16 157.0(3) . . . . ?
O1 C14 C15 C20 -20.8(5) . . . . ?
O1' C14' C15' C16' 173.0(4) . . . . ?
O1' C14' C15' C20' -6.4(5) . . . . ?
N1 C14 C15 C16 -23.2(5) . . . . ?
N1 C14 C15 C20 159.0(4) . . . . ?
N1 B3 B4 Cs1 28.8(3) . . . 2_666 ?
N1 B3 B4 Cs1 -51.9(4) . . . . ?
N1 B3 B4 B1 -114.9(4) . . . . ?
N1 B3 B4 B5 -151.1(3) . . . . ?
N1 B3 B4 B10 104.0(4) . . . . ?
N1 B3 B4 B9 145.4(3) . . . . ?
N1 B3 B4 C7A 145.4(3) . . . . ?
N1 B3 B10 Cs1 -39.5(3) . . . 2_666 ?
N1 B3 B10 B4 -114.2(4) . . . . ?
N1 B3 B10 B11 110.6(3) . . . . ?
N1 B3 B10 B9 -154.8(3) . . . . ?
N1 B3 B10 C7A -154.8(3) . . . . ?
N1 B3 B11 B2 113.3(4) . . . . ?
N1 B3 B11 B10 -106.0(4) . . . . ?
N1 B3 B11 C7 154.9(3) . . . . ?
N1 B3 B11 B9A 154.9(3) . . . . ?
N1' C14' C15' C16' -6.8(5) . . . . ?
N1' C14' C15' C20' 173.8(4) . . . . ?
N1' B5' B6' Cs2 -57.2(4) . . . 1_455 ?
N1' B5' B6' B1' -110.3(4) . . . . ?
N1' B5' B6' B2' -148.5(3) . . . . ?
N1' B5' B6' B10' 107.6(4) . . . . ?
N1' B5' B6' B11' 147.1(3) . . . . ?
N1' B5' B9' Cs2 38.0(4) . . . . ?
N1' B5' B9' C8' 155.3(3) . . . . ?
N1' B5' B9' B4' 115.9(4) . . . . ?
N1' B5' B9' B10' -104.9(4) . . . . ?
N1' B5' B9' B3A -145.4(6) . . . . ?
N1' B5' B10' Cs2 6.5(3) . . . 2_667 ?
N1' B5' B10' B6' -107.2(4) . . . . ?
N1' B5' B10' B9' 116.8(4) . . . . ?
N1' B5' B10' B11' -146.5(3) . . . . ?
N1' B5' B10' B3A 156.7(5) . . . . ?
C7' C8' B4' Cs1 148.5(6) . . . . ?
C7' C8' B4' B1' -3.2(4) . . . . ?
C7' C8' B4' B5' -66.4(4) . . . . ?
C7' C8' B4' B9' -106.2(4) . . . . ?
C7' C8' B4' B3' 38.4(4) . . . . ?
C7' C8' B9' Cs2 -177.2(2) . . . . ?
C7' C8' B9' B4' 105.7(4) . . . . ?
C7' C8' B9' B5' 66.0(4) . . . . ?
C7' C8' B9' B10' 2.7(4) . . . . ?
C7' C8' B9' B3A -35.5(5) . . . . ?
C7' C8' B3' B1' -98.6(4) . . . . ?
C7' C8' B3' B2' -36.2(3) . . . . ?
C7' C8' B3' B4' -139.8(3) . . . . ?
C7' C8' B3A B9' 141.8(5) . . . . ?
C7' C8' B3A B10' 103.4(7) . . . . ?
C7' C8' B3A B11' 37.2(5) . . . . ?
C7' B2' B6' Cs2 169.0(3) . . . 1_455 ?
C7' B2' B6' B1' -100.3(4) . . . . ?
C7' B2' B6' B5' -62.1(4) . . . . ?
C7' B2' B6' B10' 1.7(4) . . . . ?
C7' B2' B6' B11' 38.1(3) . . . . ?
C7' B2' B11' B6' -133.8(4) . . . . ?
C7' B2' B11' B10' -98.2(4) . . . . ?
C7' B2' B11' B3A -32.3(5) . . . . ?
C7' B2' B3' C8' 35.5(3) . . . . ?
C7' B2' B3' B1' 134.6(4) . . . . ?
C7' B2' B3' B4' 98.0(5) . . . . ?
C7' B11' B3A C8' -35.7(5) . . . . ?
C7' B11' B3A B9' -97.5(8) . . . . ?
C7' B11' B3A B10' -134.2(5) . . . . ?
C8 B5 B6 B1 133.1(3) . . . . ?
C8 B5 B6 B2 96.0(3) . . . . ?
C8 B5 B6 C7 33.9(2) . . . . ?
C8 B5 B6 B9A 33.9(2) . . . . ?
C8 B5 B9 B4 -135.1(3) . . . . ?
C8 B5 B9 B10 -100.3(3) . . . . ?
C8 B5 C7A B4 -135.1(3) . . . . ?
C8 B5 C7A B10 -100.3(3) . . . . ?
C8 B5 C7A C12A 113.6(11) . . . . ?
C8 B6 C7 B2 140.6(3) . . . . ?
C8 B6 C7 B11 105.7(4) . . . . ?
C8 B6 C7 C12 -109.1(4) . . . . ?
C8 B6 B9A B2 140.6(3) . . . . ?
C8 B6 B9A B11 105.7(4) . . . . ?
C8' C7' B2' B1' 1.6(4) . . . . ?
C8' C7' B2' B6' 64.2(4) . . . . ?
C8' C7' B2' B11' 103.8(4) . . . . ?
C8' C7' B2' B3' -38.7(4) . . . . ?
C8' C7' B11' B2' -104.9(3) . . . . ?
C8' C7' B11' B6' -65.3(4) . . . . ?
C8' C7' B11' B10' -3.3(4) . . . . ?
C8' C7' B11' B3A 38.2(5) . . . . ?
C8' C7' B3' B1' 98.4(5) . . . . ?
C8' C7' B3' B2' 138.1(4) . . . . ?
C8' C7' B3' B4' 35.5(3) . . . . ?
C8' C7' B3A B9' -33.1(5) . . . . ?
C8' C7' B3A B10' -96.6(6) . . . . ?
C8' C7' B3A B11' -139.3(5) . . . . ?
C8' B4' B5' N1' -153.3(4) . . . . ?
C8' B4' B5' B1' 99.4(4) . . . . ?
C8' B4' B5' B6' 61.1(4) . . . . ?
C8' B4' B5' B9' -38.4(3) . . . . ?
C8' B4' B5' B10' -1.3(5) . . . . ?
C8' B4' B9' Cs2 -113.8(2) . . . . ?
C8' B4' B9' B5' 133.5(3) . . . . ?
C8' B4' B9' B10' 96.3(3) . . . . ?
C8' B4' B9' B3A 33.1(5) . . . . ?
C8' B4' B3' C7' -34.5(3) . . . . ?
C8' B4' B3' B1' -133.0(4) . . . . ?
C8' B4' B3' B2' -96.5(4) . . . . ?
C8' B9' B10' Cs2 179.6(2) . . . 2_667 ?
C8' B9' B10' B5' 97.3(3) . . . . ?
C8' B9' B10' B6' 57.9(4) . . . . ?
C8' B9' B10' B11' -4.4(4) . . . . ?
C8' B9' B10' B3A -36.9(5) . . . . ?
C8' B9' B3A C7' 33.3(5) . . . . ?
C8' B9' B3A B10' 136.4(5) . . . . ?
C8' B9' B3A B11' 98.6(8) . . . . ?
C12' C7' C8' C13' 1.1(6) . . . . ?
C12' C7' C8' B4' -143.7(4) . . . . ?
C12' C7' C8' B9' 144.7(4) . . . . ?
C12' C7' C8' B3' -104.8(5) . . . . ?
C12' C7' C8' B3A 107.0(6) . . . . ?
C12' C7' B2' B1' 146.3(4) . . . . ?
C12' C7' B2' B6' -151.2(4) . . . . ?
C12' C7' B2' B11' -111.5(4) . . . . ?
C12' C7' B2' B3' 106.0(5) . . . . ?
C12' C7' B11' B2' 111.0(4) . . . . ?
C12' C7' B11' B6' 150.6(4) . . . . ?
C12' C7' B11' B10' -147.4(4) . . . . ?
C12' C7' B11' B3A -105.9(6) . . . . ?
C12' C7' B3' C8' 110.3(4) . . . . ?
C12' C7' B3' B1' -151.3(4) . . . . ?
C12' C7' B3' B2' -111.5(4) . . . . ?
C12' C7' B3' B4' 145.8(4) . . . . ?
C12' C7' B3A C8' -110.4(4) . . . . ?
C12' C7' B3A B9' -143.5(5) . . . . ?
C12' C7' B3A B10' 153.0(5) . . . . ?
C12' C7' B3A B11' 110.3(5) . . . . ?
C13 C8 B5 B1 146.8(3) . . . . ?
C13 C8 B5 B4 -149.3(3) . . . . ?
C13 C8 B5 B6 105.8(4) . . . . ?
C13 C8 B5 B9 -110.2(4) . . . . ?
C13 C8 B5 C7A -110.2(4) . . . . ?
C13 C8 B6 B1 -151.5(4) . . . . ?
C13 C8 B6 B2 146.1(4) . . . . ?
C13 C8 B6 B5 -110.9(4) . . . . ?
C13 C8 B6 C7 111.6(4) . . . . ?
C13 C8 B6 B9A 111.6(4) . . . . ?
C13 C8 C7 B2 -143.1(3) . . . . ?
C13 C8 C7 B6 -107.1(4) . . . . ?
C13 C8 C7 B11 147.6(4) . . . . ?
C13 C8 C7 C12 1.0(6) . . . . ?
C13 C8 B9 B4 150.3(4) . . . . ?
C13 C8 B9 B5 111.5(4) . . . . ?
C13 C8 B9 B10 -148.4(4) . . . . ?
C13 C8 C7A B4 150.3(4) . . . . ?
C13 C8 C7A B5 111.5(4) . . . . ?
C13 C8 C7A B10 -148.4(4) . . . . ?
C13 C8 C7A C12A 2.2(12) . . . . ?
C13 C8 B9A B2 -143.1(3) . . . . ?
C13 C8 B9A B6 -107.1(4) . . . . ?
C13 C8 B9A B11 147.6(4) . . . . ?
C13' C8' B4' Cs1 3.8(10) . . . . ?
C13' C8' B4' B1' -147.9(4) . . . . ?
C13' C8' B4' B5' 148.8(4) . . . . ?
C13' C8' B4' B9' 109.1(5) . . . . ?
C13' C8' B4' B3' -106.4(5) . . . . ?
C13' C8' B9' Cs2 -33.3(4) . . . . ?
C13' C8' B9' B4' -110.3(4) . . . . ?
C13' C8' B9' B5' -150.1(3) . . . . ?
C13' C8' B9' B10' 146.6(3) . . . . ?
C13' C8' B9' B3A 108.4(6) . . . . ?
C13' C8' B3' C7' -109.8(4) . . . . ?
C13' C8' B3' B1' 151.5(4) . . . . ?
C13' C8' B3' B2' -146.1(4) . . . . ?
C13' C8' B3' B4' 110.4(4) . . . . ?
C13' C8' B3A C7' 108.6(5) . . . . ?
C13' C8' B3A B9' -109.6(5) . . . . ?
C13' C8' B3A B10' -148.0(5) . . . . ?
C13' C8' B3A B11' 145.8(6) . . . . ?
C14 N1 B3 B1 -34.3(6) . . . . ?
C14 N1 B3 B2 -107.7(4) . . . . ?
C14 N1 B3 B4 40.5(5) . . . . ?
C14 N1 B3 B10 109.8(4) . . . . ?
C14 N1 B3 B11 179.6(4) . . . . ?
C14 C15 C16 C17 -178.6(3) . . . . ?
C14 C15 C20 C19 179.9(4) . . . . ?
C14' N1' B5' B1' 110.0(5) . . . . ?
C14' N1' B5' B4' 36.8(6) . . . . ?
C14' N1' B5' B6' 179.1(4) . . . . ?
C14' N1' B5' B9' -41.5(6) . . . . ?
C14' N1' B5' B10' -113.2(4) . . . . ?
C14' C15' C16' Cs2 -56.0(3) . . . 2_667 ?
C14' C15' C16' C17' -178.8(4) . . . . ?
C14' C15' C20' C19' 179.4(4) . . . . ?
C15 C16 C17 C18 -0.5(6) . . . . ?
C15' C16' C17' C18' -0.9(7) . . . . ?
C16 C15 C20 C19 2.1(7) . . . . ?
C16 C17 C18 C19 0.5(8) . . . . ?
C16' C15' C20' C19' -0.1(6) . . . . ?
C16' C17' C18' C19' 0.7(8) . . . . ?
C17 C18 C19 C20 0.7(8) . . . . ?
C17' C18' C19' C20' -0.2(9) . . . . ?
C18 C19 C20 C15 -2.0(8) . . . . ?
C18' C19' C20' C15' -0.1(8) . . . . ?
C20 C15 C16 C17 -0.8(6) . . . . ?
C20' C15' C16' Cs2 123.4(3) . . . 2_667 ?
C20' C15' C16' C17' 0.6(6) . . . . ?
B1 B2 B3 N1 114.6(4) . . . . ?
B1 B2 B3 B4 -37.7(3) . . . . ?
B1 B2 B3 B10 -100.8(3) . . . . ?
B1 B2 B3 B11 -136.8(3) . . . . ?
B1 B2 B6 C8 98.6(3) . . . . ?
B1 B2 B6 B5 36.8(3) . . . . ?
B1 B2 B6 C7 130.5(3) . . . . ?
B1 B2 B6 B9A 130.5(3) . . . . ?
B1 B2 B11 B3 38.7(3) . . . . ?
B1 B2 B11 B10 2.8(4) . . . . ?
B1 B2 B11 C7 -94.8(3) . . . . ?
B1 B2 B11 B9A -94.8(3) . . . . ?
B1 B2 C7 C8 -6.0(4) . . . . ?
B1 B2 C7 B6 -42.6(3) . . . . ?
B1 B2 C7 B11 101.7(3) . . . . ?
B1 B2 C7 C12 -149.5(4) . . . . ?
B1 B2 B9A C8 -6.0(4) . . . . ?
B1 B2 B9A B6 -42.6(3) . . . . ?
B1 B2 B9A B11 101.7(3) . . . . ?
B1 B3 B4 Cs1 63.1(2) . . . . ?
B1 B3 B4 Cs1 143.8(2) . . . 2_666 ?
B1 B3 B4 B5 -36.1(3) . . . . ?
B1 B3 B4 B10 -141.1(3) . . . . ?
B1 B3 B4 B9 -99.6(3) . . . . ?
B1 B3 B4 C7A -99.6(3) . . . . ?
B1 B3 B10 Cs1 110.0(3) . . . 2_666 ?
B1 B3 B10 B4 35.3(3) . . . . ?
B1 B3 B10 B11 -99.9(3) . . . . ?
B1 B3 B10 B9 -5.3(4) . . . . ?
B1 B3 B10 C7A -5.3(4) . . . . ?
B1 B3 B11 B2 -38.2(3) . . . . ?
B1 B3 B11 B10 102.5(3) . . . . ?
B1 B3 B11 C7 3.4(4) . . . . ?
B1 B3 B11 B9A 3.4(4) . . . . ?
B1 B4 B5 C8 -100.2(3) . . . . ?
B1 B4 B5 B6 -38.6(3) . . . . ?
B1 B4 B5 B9 -136.7(3) . . . . ?
B1 B4 B5 C7A -136.7(3) . . . . ?
B1 B4 B10 Cs1 -131.9(2) . . . 2_666 ?
B1 B4 B10 B3 -34.8(3) . . . . ?
B1 B4 B10 B11 4.0(4) . . . . ?
B1 B4 B10 B9 98.9(3) . . . . ?
B1 B4 B10 C7A 98.9(3) . . . . ?
B1 B4 B9 C8 -1.5(4) . . . . ?
B1 B4 B9 B5 37.5(3) . . . . ?
B1 B4 B9 B10 -102.8(3) . . . . ?
B1 B4 C7A C8 -1.5(4) . . . . ?
B1 B4 C7A B5 37.5(3) . . . . ?
B1 B4 C7A B10 -102.8(3) . . . . ?
B1 B4 C7A C12A 147.2(11) . . . . ?
B1 B5 B6 C8 -133.1(3) . . . . ?
B1 B5 B6 B2 -37.1(3) . . . . ?
B1 B5 B6 C7 -99.2(3) . . . . ?
B1 B5 B6 B9A -99.2(3) . . . . ?
B1 B5 B9 C8 95.3(3) . . . . ?
B1 B5 B9 B4 -39.8(3) . . . . ?
B1 B5 B9 B10 -5.0(4) . . . . ?
B1 B5 C7A C8 95.3(3) . . . . ?
B1 B5 C7A B4 -39.8(3) . . . . ?
B1 B5 C7A B10 -5.0(4) . . . . ?
B1 B5 C7A C12A -151.1(11) . . . . ?
B1 B6 C7 C8 -97.8(3) . . . . ?
B1 B6 C7 B2 42.9(3) . . . . ?
B1 B6 C7 B11 8.0(4) . . . . ?
B1 B6 C7 C12 153.1(4) . . . . ?
B1 B6 B9A C8 -97.8(3) . . . . ?
B1 B6 B9A B2 42.9(3) . . . . ?
B1 B6 B9A B11 8.0(4) . . . . ?
B1' B2' B6' Cs2 -90.7(2) . . . 1_455 ?
B1' B2' B6' B5' 38.2(3) . . . . ?
B1' B2' B6' B10' 101.9(4) . . . . ?
B1' B2' B6' B11' 138.3(4) . . . . ?
B1' B2' B11' C7' 96.2(4) . . . . ?
B1' B2' B11' B6' -37.6(3) . . . . ?
B1' B2' B11' B10' -2.0(4) . . . . ?
B1' B2' B11' B3A 63.9(6) . . . . ?
B1' B2' B3' C7' -134.6(4) . . . . ?
B1' B2' B3' C8' -99.1(5) . . . . ?
B1' B2' B3' B4' -36.6(4) . . . . ?
B1' B4' B5' N1' 107.3(4) . . . . ?
B1' B4' B5' B6' -38.3(3) . . . . ?
B1' B4' B5' B9' -137.9(3) . . . . ?
B1' B4' B5' B10' -100.8(4) . . . . ?
B1' B4' B9' Cs2 151.1(3) . . . . ?
B1' B4' B9' C8' -95.1(4) . . . . ?
B1' B4' B9' B5' 38.4(3) . . . . ?
B1' B4' B9' B10' 1.2(4) . . . . ?
B1' B4' B9' B3A -62.0(6) . . . . ?
B1' B4' B3' C7' 98.5(4) . . . . ?
B1' B4' B3' C8' 133.0(4) . . . . ?
B1' B4' B3' B2' 36.5(4) . . . . ?
B1' B5' B6' Cs2 53.1(3) . . . 1_455 ?
B1' B5' B6' B2' -38.3(3) . . . . ?
B1' B5' B6' B10' -142.1(3) . . . . ?
B1' B5' B6' B11' -102.7(3) . . . . ?
B1' B5' B9' Cs2 -116.1(3) . . . . ?
B1' B5' B9' C8' 1.3(4) . . . . ?
B1' B5' B9' B4' -38.1(3) . . . . ?
B1' B5' B9' B10' 101.1(4) . . . . ?
B1' B5' B9' B3A 60.6(6) . . . . ?
B1' B5' B10' Cs2 147.6(2) . . . 2_667 ?
B1' B5' B10' B6' 34.0(3) . . . . ?
B1' B5' B10' B9' -102.0(3) . . . . ?
B1' B5' B10' B11' -5.3(4) . . . . ?
B1' B5' B10' B3A -62.2(6) . . . . ?
B1' B6' B10' Cs2 -115.8(3) . . . 2_667 ?
B1' B6' B10' B5' -34.4(3) . . . . ?
B1' B6' B10' B9' 3.9(4) . . . . ?
B1' B6' B10' B11' 101.2(3) . . . . ?
B1' B6' B10' B3A 65.6(5) . . . . ?
B1' B6' B11' C7' -1.4(5) . . . . ?
B1' B6' B11' B2' 37.6(3) . . . . ?
B1' B6' B11' B10' -102.6(4) . . . . ?
B1' B6' B11' B3A -61.9(7) . . . . ?
B2 B1 B3 N1 -110.6(4) . . . . ?
B2 B1 B3 B4 138.0(3) . . . . ?
B2 B1 B3 B10 103.1(3) . . . . ?
B2 B1 B3 B11 38.9(3) . . . . ?
B2 B1 B4 Cs1 -92.0(4) . . . 2_666 ?
B2 B1 B4 Cs1 -156.4(2) . . . . ?
B2 B1 B4 B3 -37.4(3) . . . . ?
B2 B1 B4 B5 101.0(3) . . . . ?
B2 B1 B4 B10 -2.4(4) . . . . ?
B2 B1 B4 B9 62.4(3) . . . . ?
B2 B1 B4 C7A 62.4(3) . . . . ?
B2 B1 B5 C8 -3.6(4) . . . . ?
B2 B1 B5 B4 -100.5(3) . . . . ?
B2 B1 B5 B6 36.8(3) . . . . ?
B2 B1 B5 B9 -61.4(4) . . . . ?
B2 B1 B5 C7A -61.4(4) . . . . ?
B2 B1 B6 C8 -98.4(3) . . . . ?
B2 B1 B6 B5 -138.7(3) . . . . ?
B2 B1 B6 C7 -42.7(3) . . . . ?
B2 B1 B6 B9A -42.7(3) . . . . ?
B2 B3 B4 Cs1 100.4(3) . . . . ?
B2 B3 B4 Cs1 -178.9(2) . . . 2_666 ?
B2 B3 B4 B1 37.3(3) . . . . ?
B2 B3 B4 B5 1.1(4) . . . . ?
B2 B3 B4 B10 -103.8(3) . . . . ?
B2 B3 B4 B9 -62.4(3) . . . . ?
B2 B3 B4 C7A -62.4(3) . . . . ?
B2 B3 B10 Cs1 173.6(2) . . . 2_666 ?
B2 B3 B10 B4 99.0(3) . . . . ?
B2 B3 B10 B11 -36.3(3) . . . . ?
B2 B3 B10 B9 58.3(4) . . . . ?
B2 B3 B10 C7A 58.3(4) . . . . ?
B2 B3 B11 B10 140.7(3) . . . . ?
B2 B3 B11 C7 41.6(3) . . . . ?
B2 B3 B11 B9A 41.6(3) . . . . ?
B2 B6 C7 C8 -140.6(3) . . . . ?
B2 B6 C7 B11 -34.9(3) . . . . ?
B2 B6 C7 C12 110.2(4) . . . . ?
B2 B6 B9A C8 -140.6(3) . . . . ?
B2 B6 B9A B11 -34.9(3) . . . . ?
B2 B11 C7 C8 102.0(4) . . . . ?
B2 B11 C7 B6 33.7(3) . . . . ?
B2 B11 C7 C12 -111.3(4) . . . . ?
B2 B11 B9A C8 102.0(4) . . . . ?
B2 B11 B9A B6 33.7(3) . . . . ?
B2' C7' C8' C13' 145.8(4) . . . . ?
B2' C7' C8' B4' 1.1(5) . . . . ?
B2' C7' C8' B9' -70.6(4) . . . . ?
B2' C7' C8' B3' 40.0(4) . . . . ?
B2' C7' C8' B3A -108.3(6) . . . . ?
B2' C7' B11' B6' 39.6(3) . . . . ?
B2' C7' B11' B10' 101.6(3) . . . . ?
B2' C7' B11' B3A 143.1(5) . . . . ?
B2' C7' B3' C8' -138.1(4) . . . . ?
B2' C7' B3' B1' -39.8(4) . . . . ?
B2' C7' B3' B4' -102.6(4) . . . . ?
B2' C7' B3A C8' 102.0(5) . . . . ?
B2' C7' B3A B9' 68.9(8) . . . . ?
B2' C7' B3A B10' 5.4(9) . . . . ?
B2' C7' B3A B11' -37.3(5) . . . . ?
B2' B1' B4' Cs1 -164.7(3) . . . . ?
B2' B1' B4' C8' 3.9(4) . . . . ?
B2' B1' B4' B5' 100.6(3) . . . . ?
B2' B1' B4' B9' 63.2(4) . . . . ?
B2' B1' B4' B3' -35.3(4) . . . . ?
B2' B1' B5' N1' 144.3(3) . . . . ?
B2' B1' B5' B4' -98.7(3) . . . . ?
B2' B1' B5' B6' 37.8(3) . . . . ?
B2' B1' B5' B9' -60.0(4) . . . . ?
B2' B1' B5' B10' 4.1(4) . . . . ?
B2' B1' B6' Cs2 80.9(2) . . . 1_455 ?
B2' B1' B6' B5' -137.0(3) . . . . ?
B2' B1' B6' B10' -102.6(3) . . . . ?
B2' B1' B6' B11' -38.1(3) . . . . ?
B2' B1' B3' C7' 39.2(4) . . . . ?
B2' B1' B3' C8' 98.7(4) . . . . ?
B2' B1' B3' B4' 139.6(4) . . . . ?
B2' B6' B10' Cs2 179.7(2) . . . 2_667 ?
B2' B6' B10' B5' -98.9(3) . . . . ?
B2' B6' B10' B9' -60.6(4) . . . . ?
B2' B6' B10' B11' 36.7(3) . . . . ?
B2' B6' B10' B3A 1.1(6) . . . . ?
B2' B6' B11' C7' -39.0(3) . . . . ?
B2' B6' B11' B10' -140.2(3) . . . . ?
B2' B6' B11' B3A -99.5(6) . . . . ?
B2' B11' B3A C7' 32.2(4) . . . . ?
B2' B11' B3A C8' -3.5(8) . . . . ?
B2' B11' B3A B9' -65.3(9) . . . . ?
B2' B11' B3A B10' -102.0(4) . . . . ?
B3 N1 C14 Cs1 -81.1(4) . . . 2_666 ?
B3 N1 C14 Cs2 74.0(4) . . . . ?
B3 N1 C14 O1 1.8(6) . . . . ?
B3 N1 C14 C15 -177.9(3) . . . . ?
B3 B1 B2 B6 -137.7(3) . . . . ?
B3 B1 B2 B11 -37.9(3) . . . . ?
B3 B1 B2 C7 -95.1(3) . . . . ?
B3 B1 B2 B9A -95.1(3) . . . . ?
B3 B1 B4 Cs1 -119.0(2) . . . . ?
B3 B1 B4 Cs1 -54.6(3) . . . 2_666 ?
B3 B1 B4 B5 138.3(3) . . . . ?
B3 B1 B4 B10 35.0(3) . . . . ?
B3 B1 B4 B9 99.8(3) . . . . ?
B3 B1 B4 C7A 99.8(3) . . . . ?
B3 B1 B5 C8 59.5(4) . . . . ?
B3 B1 B5 B4 -37.4(3) . . . . ?
B3 B1 B5 B6 99.9(3) . . . . ?
B3 B1 B5 B9 1.7(4) . . . . ?
B3 B1 B5 C7A 1.7(4) . . . . ?
B3 B1 B6 C8 -61.0(3) . . . . ?
B3 B1 B6 B2 37.5(3) . . . . ?
B3 B1 B6 B5 -101.3(3) . . . . ?
B3 B1 B6 C7 -5.2(4) . . . . ?
B3 B1 B6 B9A -5.2(4) . . . . ?
B3 B2 B6 C8 60.3(4) . . . . ?
B3 B2 B6 B1 -38.3(3) . . . . ?
B3 B2 B6 B5 -1.4(4) . . . . ?
B3 B2 B6 C7 92.3(3) . . . . ?
B3 B2 B6 B9A 92.3(3) . . . . ?
B3 B2 B11 B10 -35.9(3) . . . . ?
B3 B2 B11 C7 -133.6(3) . . . . ?
B3 B2 B11 B9A -133.6(3) . . . . ?
B3 B2 C7 C8 -68.4(4) . . . . ?
B3 B2 C7 B6 -105.0(3) . . . . ?
B3 B2 C7 B11 39.3(3) . . . . ?
B3 B2 C7 C12 148.1(4) . . . . ?
B3 B2 B9A C8 -68.4(4) . . . . ?
B3 B2 B9A B6 -105.0(3) . . . . ?
B3 B2 B9A B11 39.3(3) . . . . ?
B3 B4 B5 C8 -63.6(3) . . . . ?
B3 B4 B5 B1 36.6(3) . . . . ?
B3 B4 B5 B6 -2.0(4) . . . . ?
B3 B4 B5 B9 -100.1(3) . . . . ?
B3 B4 B5 C7A -100.1(3) . . . . ?
B3 B4 B10 Cs1 -97.09(19) . . . 2_666 ?
B3 B4 B10 B11 38.9(3) . . . . ?
B3 B4 B10 B9 133.7(3) . . . . ?
B3 B4 B10 C7A 133.7(3) . . . . ?
B3 B4 B9 C8 60.7(4) . . . . ?
B3 B4 B9 B5 99.7(3) . . . . ?
B3 B4 B9 B10 -40.6(3) . . . . ?
B3 B4 C7A C8 60.7(4) . . . . ?
B3 B4 C7A B5 99.7(3) . . . . ?
B3 B4 C7A B10 -40.6(3) . . . . ?
B3 B4 C7A C12A -150.6(11) . . . . ?
B3 B10 B11 B2 35.6(3) . . . . ?
B3 B10 B11 C7 100.4(3) . . . . ?
B3 B10 B11 B9A 100.4(3) . . . . ?
B3 B10 B9 C8 -56.3(4) . . . . ?
B3 B10 B9 B4 41.1(3) . . . . ?
B3 B10 B9 B5 6.2(4) . . . . ?
B3 B10 C7A C8 -56.3(4) . . . . ?
B3 B10 C7A B4 41.1(3) . . . . ?
B3 B10 C7A B5 6.2(4) . . . . ?
B3 B10 C7A C12A 152.3(11) . . . . ?
B3 B11 C7 C8 61.1(4) . . . . ?
B3 B11 C7 B2 -40.8(3) . . . . ?
B3 B11 C7 B6 -7.2(4) . . . . ?
B3 B11 C7 C12 -152.2(4) . . . . ?
B3 B11 B9A C8 61.1(4) . . . . ?
B3 B11 B9A B2 -40.8(3) . . . . ?
B3 B11 B9A B6 -7.2(4) . . . . ?
B4 B1 B2 B3 37.6(3) . . . . ?
B4 B1 B2 B6 -100.1(3) . . . . ?
B4 B1 B2 B11 -0.3(4) . . . . ?
B4 B1 B2 C7 -57.5(3) . . . . ?
B4 B1 B2 B9A -57.5(3) . . . . ?
B4 B1 B3 N1 111.4(4) . . . . ?
B4 B1 B3 B2 -138.0(3) . . . . ?
B4 B1 B3 B10 -34.9(3) . . . . ?
B4 B1 B3 B11 -99.1(3) . . . . ?
B4 B1 B5 C8 96.8(3) . . . . ?
B4 B1 B5 B6 137.3(3) . . . . ?
B4 B1 B5 B9 39.1(3) . . . . ?
B4 B1 B5 C7A 39.1(3) . . . . ?
B4 B1 B6 C8 2.4(4) . . . . ?
B4 B1 B6 B2 100.9(3) . . . . ?
B4 B1 B6 B5 -37.9(3) . . . . ?
B4 B1 B6 C7 58.2(3) . . . . ?
B4 B1 B6 B9A 58.2(3) . . . . ?
B4 B3 B10 Cs1 74.7(2) . . . 2_666 ?
B4 B3 B10 B11 -135.2(3) . . . . ?
B4 B3 B10 B9 -40.6(3) . . . . ?
B4 B3 B10 C7A -40.6(3) . . . . ?
B4 B3 B11 B2 -101.6(3) . . . . ?
B4 B3 B11 B10 39.1(3) . . . . ?
B4 B3 B11 C7 -60.0(4) . . . . ?
B4 B3 B11 B9A -60.0(4) . . . . ?
B4 B5 B6 C8 -93.8(3) . . . . ?
B4 B5 B6 B1 39.3(3) . . . . ?
B4 B5 B6 B2 2.2(4) . . . . ?
B4 B5 B6 C7 -59.9(4) . . . . ?
B4 B5 B6 B9A -59.9(4) . . . . ?
B4 B5 B9 C8 135.1(3) . . . . ?
B4 B5 B9 B10 34.8(3) . . . . ?
B4 B5 C7A C8 135.1(3) . . . . ?
B4 B5 C7A B10 34.8(3) . . . . ?
B4 B5 C7A C12A -111.4(11) . . . . ?
B4 B10 B11 B2 -4.3(4) . . . . ?
B4 B10 B11 B3 -39.9(3) . . . . ?
B4 B10 B11 C7 60.5(4) . . . . ?
B4 B10 B11 B9A 60.5(4) . . . . ?
B4 B10 B9 C8 -97.5(3) . . . . ?
B4 B10 B9 B5 -34.9(3) . . . . ?
B4 B10 C7A C8 -97.5(3) . . . . ?
B4 B10 C7A B5 -34.9(3) . . . . ?
B4 B10 C7A C12A 111.1(11) . . . . ?
B4' C8' B9' Cs2 77.1(2) . . . . ?
B4' C8' B9' B5' -39.8(3) . . . . ?
B4' C8' B9' B10' -103.1(3) . . . . ?
B4' C8' B9' B3A -141.3(6) . . . . ?
B4' C8' B3' C7' 139.8(3) . . . . ?
B4' C8' B3' B1' 41.1(4) . . . . ?
B4' C8' B3' B2' 103.5(4) . . . . ?
B4' C8' B3A C7' -102.0(5) . . . . ?
B4' C8' B3A B9' 39.7(5) . . . . ?
B4' C8' B3A B10' 1.3(9) . . . . ?
B4' C8' B3A B11' -64.9(9) . . . . ?
B4' B1' B2' C7' -3.4(4) . . . . ?
B4' B1' B2' B6' -99.6(4) . . . . ?
B4' B1' B2' B11' -62.5(4) . . . . ?
B4' B1' B2' B3' 35.0(4) . . . . ?
B4' B1' B5' N1' -116.9(4) . . . . ?
B4' B1' B5' B6' 136.6(3) . . . . ?
B4' B1' B5' B9' 38.7(3) . . . . ?
B4' B1' B5' B10' 102.8(3) . . . . ?
B4' B1' B6' Cs2 -179.6(3) . . . 1_455 ?
B4' B1' B6' B2' 99.4(3) . . . . ?
B4' B1' B6' B5' -37.6(3) . . . . ?
B4' B1' B6' B10' -3.1(4) . . . . ?
B4' B1' B6' B11' 61.4(4) . . . . ?
B4' B1' B3' C7' -100.4(5) . . . . ?
B4' B1' B3' C8' -40.8(4) . . . . ?
B4' B1' B3' B2' -139.6(4) . . . . ?
B4' B5' B6' Cs2 91.7(3) . . . 1_455 ?
B4' B5' B6' B1' 38.6(3) . . . . ?
B4' B5' B6' B2' 0.3(4) . . . . ?
B4' B5' B6' B10' -103.5(3) . . . . ?
B4' B5' B6' B11' -64.1(4) . . . . ?
B4' B5' B9' Cs2 -78.0(3) . . . . ?
B4' B5' B9' C8' 39.4(3) . . . . ?
B4' B5' B9' B10' 139.2(4) . . . . ?
B4' B5' B9' B3A 98.7(6) . . . . ?
B4' B5' B10' Cs2 -148.1(3) . . . 2_667 ?
B4' B5' B10' B6' 98.2(4) . . . . ?
B4' B5' B10' B9' -37.7(3) . . . . ?
B4' B5' B10' B11' 59.0(4) . . . . ?
B4' B5' B10' B3A 2.1(6) . . . . ?
B4' B9' B10' Cs2 118.6(3) . . . 2_667 ?
B4' B9' B10' B5' 36.3(3) . . . . ?
B4' B9' B10' B6' -3.1(4) . . . . ?
B4' B9' B10' B11' -65.3(4) . . . . ?
B4' B9' B10' B3A -97.9(6) . . . . ?
B4' B9' B3A C7' -0.3(8) . . . . ?
B4' B9' B3A C8' -33.5(4) . . . . ?
B4' B9' B3A B10' 102.9(4) . . . . ?
B4' B9' B3A B11' 65.1(9) . . . . ?
B5 C8 B6 B1 -40.6(3) . . . . ?
B5 C8 B6 B2 -103.0(3) . . . . ?
B5 C8 B6 C7 -137.6(3) . . . . ?
B5 C8 B6 B9A -137.6(3) . . . . ?
B5 C8 C7 B2 4.0(4) . . . . ?
B5 C8 C7 B6 39.9(3) . . . . ?
B5 C8 C7 B11 -65.4(4) . . . . ?
B5 C8 C7 C12 148.0(4) . . . . ?
B5 C8 B9 B4 38.8(3) . . . . ?
B5 C8 B9 B10 100.1(3) . . . . ?
B5 C8 C7A B4 38.8(3) . . . . ?
B5 C8 C7A B10 100.1(3) . . . . ?
B5 C8 C7A C12A -109.3(11) . . . . ?
B5 C8 B9A B2 4.0(4) . . . . ?
B5 C8 B9A B6 39.9(3) . . . . ?
B5 C8 B9A B11 -65.4(4) . . . . ?
B5 B1 B2 B3 100.8(3) . . . . ?
B5 B1 B2 B6 -36.9(3) . . . . ?
B5 B1 B2 B11 62.9(4) . . . . ?
B5 B1 B2 C7 5.7(4) . . . . ?
B5 B1 B2 B9A 5.7(4) . . . . ?
B5 B1 B3 N1 148.6(4) . . . . ?
B5 B1 B3 B2 -100.8(3) . . . . ?
B5 B1 B3 B4 37.2(3) . . . . ?
B5 B1 B3 B10 2.3(4) . . . . ?
B5 B1 B3 B11 -61.9(4) . . . . ?
B5 B1 B4 Cs1 102.7(2) . . . . ?
B5 B1 B4 Cs1 167.1(4) . . . 2_666 ?
B5 B1 B4 B3 -138.3(3) . . . . ?
B5 B1 B4 B10 -103.4(3) . . . . ?
B5 B1 B4 B9 -38.6(3) . . . . ?
B5 B1 B4 C7A -38.6(3) . . . . ?
B5 B1 B6 C8 40.3(3) . . . . ?
B5 B1 B6 B2 138.7(3) . . . . ?
B5 B1 B6 C7 96.1(3) . . . . ?
B5 B1 B6 B9A 96.1(3) . . . . ?
B5 B4 B10 Cs1 165.7(3) . . . 2_666 ?
B5 B4 B10 B3 -97.2(3) . . . . ?
B5 B4 B10 B11 -58.4(3) . . . . ?
B5 B4 B10 B9 36.5(3) . . . . ?
B5 B4 B10 C7A 36.5(3) . . . . ?
B5 B4 B9 C8 -39.1(3) . . . . ?
B5 B4 B9 B10 -140.4(3) . . . . ?
B5 B4 C7A C8 -39.1(3) . . . . ?
B5 B4 C7A B10 -140.4(3) . . . . ?
B5 B4 C7A C12A 109.7(11) . . . . ?
B5 B6 C7 C8 -36.3(3) . . . . ?
B5 B6 C7 B2 104.3(3) . . . . ?
B5 B6 C7 B11 69.4(4) . . . . ?
B5 B6 C7 C12 -145.5(4) . . . . ?
B5 B6 B9A C8 -36.3(3) . . . . ?
B5 B6 B9A B2 104.3(3) . . . . ?
B5 B6 B9A B11 69.4(4) . . . . ?
B5' N1' C14' Cs1 -64.0(4) . . . . ?
B5' N1' C14' O1' -0.9(6) . . . . ?
B5' N1' C14' C15' 178.9(3) . . . . ?
B5' B1' B2' C7' 57.8(4) . . . . ?
B5' B1' B2' B6' -38.4(3) . . . . ?
B5' B1' B2' B11' -1.3(4) . . . . ?
B5' B1' B2' B3' 96.2(4) . . . . ?
B5' B1' B4' Cs1 94.7(2) . . . . ?
B5' B1' B4' C8' -96.7(3) . . . . ?
B5' B1' B4' B9' -37.4(3) . . . . ?
B5' B1' B4' B3' -135.9(4) . . . . ?
B5' B1' B6' Cs2 -142.0(2) . . . 1_455 ?
B5' B1' B6' B2' 137.0(3) . . . . ?
B5' B1' B6' B10' 34.5(3) . . . . ?
B5' B1' B6' B11' 98.9(3) . . . . ?
B5' B1' B3' C7' -62.7(5) . . . . ?
B5' B1' B3' C8' -3.2(5) . . . . ?
B5' B1' B3' B2' -101.9(4) . . . . ?
B5' B1' B3' B4' 37.7(3) . . . . ?
B5' B4' B9' Cs2 112.8(2) . . . . ?
B5' B4' B9' C8' -133.5(3) . . . . ?
B5' B4' B9' B10' -37.2(3) . . . . ?
B5' B4' B9' B3A -100.4(6) . . . . ?
B5' B4' B3' C7' 58.2(5) . . . . ?
B5' B4' B3' C8' 92.7(4) . . . . ?
B5' B4' B3' B1' -40.3(3) . . . . ?
B5' B4' B3' B2' -3.8(5) . . . . ?
B5' B6' B10' Cs2 -81.4(2) . . . 2_667 ?
B5' B6' B10' B9' 38.3(3) . . . . ?
B5' B6' B10' B11' 135.6(3) . . . . ?
B5' B6' B10' B3A 100.0(5) . . . . ?
B5' B6' B11' C7' 61.9(4) . . . . ?
B5' B6' B11' B2' 100.9(3) . . . . ?
B5' B6' B11' B10' -39.3(3) . . . . ?
B5' B6' B11' B3A 1.4(7) . . . . ?
B5' B9' B10' Cs2 82.3(2) . . . 2_667 ?
B5' B9' B10' B6' -39.4(3) . . . . ?
B5' B9' B10' B11' -101.6(3) . . . . ?
B5' B9' B10' B3A -134.1(6) . . . . ?
B5' B9' B3A C7' -62.1(8) . . . . ?
B5' B9' B3A C8' -95.4(4) . . . . ?
B5' B9' B3A B10' 41.0(5) . . . . ?
B5' B9' B3A B11' 3.2(10) . . . . ?
B5' B10' B11' C7' -56.4(4) . . . . ?
B5' B10' B11' B2' 4.5(4) . . . . ?
B5' B10' B11' B6' 39.8(3) . . . . ?
B5' B10' B11' B3A -95.8(6) . . . . ?
B5' B10' B3A C7' 59.1(8) . . . . ?
B5' B10' B3A C8' -2.0(8) . . . . ?
B5' B10' B3A B9' -39.3(4) . . . . ?
B5' B10' B3A B11' 101.0(4) . . . . ?
B6 C8 B5 B1 41.0(3) . . . . ?
B6 C8 B5 B4 104.9(3) . . . . ?
B6 C8 B5 B9 144.0(3) . . . . ?
B6 C8 B5 C7A 144.0(3) . . . . ?
B6 C8 C7 B2 -36.0(3) . . . . ?
B6 C8 C7 B11 -105.3(4) . . . . ?
B6 C8 C7 C12 108.1(5) . . . . ?
B6 C8 B9 B4 3.4(4) . . . . ?
B6 C8 B9 B5 -35.4(3) . . . . ?
B6 C8 B9 B10 64.7(4) . . . . ?
B6 C8 C7A B4 3.4(4) . . . . ?
B6 C8 C7A B5 -35.4(3) . . . . ?
B6 C8 C7A B10 64.7(4) . . . . ?
B6 C8 C7A C12A -144.7(11) . . . . ?
B6 C8 B9A B2 -36.0(3) . . . . ?
B6 C8 B9A B11 -105.3(4) . . . . ?
B6 B1 B2 B3 137.7(3) . . . . ?
B6 B1 B2 B11 99.8(3) . . . . ?
B6 B1 B2 C7 42.6(3) . . . . ?
B6 B1 B2 B9A 42.6(3) . . . . ?
B6 B1 B3 N1 -148.1(3) . . . . ?
B6 B1 B3 B2 -37.5(3) . . . . ?
B6 B1 B3 B4 100.5(3) . . . . ?
B6 B1 B3 B10 65.6(4) . . . . ?
B6 B1 B3 B11 1.4(4) . . . . ?
B6 B1 B4 Cs1 -155.0(3) . . . 2_666 ?
B6 B1 B4 Cs1 140.6(3) . . . . ?
B6 B1 B4 B3 -100.4(3) . . . . ?
B6 B1 B4 B5 37.9(3) . . . . ?
B6 B1 B4 B10 -65.4(4) . . . . ?
B6 B1 B4 B9 -0.6(4) . . . . ?
B6 B1 B4 C7A -0.6(4) . . . . ?
B6 B1 B5 C8 -40.5(3) . . . . ?
B6 B1 B5 B4 -137.3(3) . . . . ?
B6 B1 B5 B9 -98.2(4) . . . . ?
B6 B1 B5 C7A -98.2(4) . . . . ?
B6 B2 B3 N1 152.5(3) . . . . ?
B6 B2 B3 B1 37.8(3) . . . . ?
B6 B2 B3 B4 0.2(4) . . . . ?
B6 B2 B3 B10 -62.9(4) . . . . ?
B6 B2 B3 B11 -99.0(3) . . . . ?
B6 B2 B11 B3 101.7(3) . . . . ?
B6 B2 B11 B10 65.8(4) . . . . ?
B6 B2 B11 C7 -31.9(3) . . . . ?
B6 B2 B11 B9A -31.9(3) . . . . ?
B6 B2 C7 C8 36.6(3) . . . . ?
B6 B2 C7 B11 144.3(3) . . . . ?
B6 B2 C7 C12 -106.9(5) . . . . ?
B6 B2 B9A C8 36.6(3) . . . . ?
B6 B2 B9A B11 144.3(3) . . . . ?
B6 B5 B9 C8 31.8(3) . . . . ?
B6 B5 B9 B4 -103.3(3) . . . . ?
B6 B5 B9 B10 -68.6(4) . . . . ?
B6 B5 C7A C8 31.8(3) . . . . ?
B6 B5 C7A B4 -103.3(3) . . . . ?
B6 B5 C7A B10 -68.6(4) . . . . ?
B6 B5 C7A C12A 145.3(11) . . . . ?
B6' B1' B2' C7' 96.2(3) . . . . ?
B6' B1' B2' B11' 37.2(3) . . . . ?
B6' B1' B2' B3' 134.6(4) . . . . ?
B6' B1' B4' Cs1 133.3(3) . . . . ?
B6' B1' B4' C8' -58.0(4) . . . . ?
B6' B1' B4' B5' 38.6(3) . . . . ?
B6' B1' B4' B9' 1.2(4) . . . . ?
B6' B1' B4' B3' -97.2(4) . . . . ?
B6' B1' B5' N1' 106.5(4) . . . . ?
B6' B1' B5' B4' -136.6(3) . . . . ?
B6' B1' B5' B9' -97.8(3) . . . . ?
B6' B1' B5' B10' -33.8(3) . . . . ?
B6' B1' B3' C7' 0.0(6) . . . . ?
B6' B1' B3' C8' 59.6(5) . . . . ?
B6' B1' B3' B2' -39.2(4) . . . . ?
B6' B1' B3' B4' 100.4(4) . . . . ?
B6' B2' B11' C7' 133.8(4) . . . . ?
B6' B2' B11' B10' 35.6(3) . . . . ?
B6' B2' B11' B3A 101.5(6) . . . . ?
B6' B2' B3' C7' -94.0(4) . . . . ?
B6' B2' B3' C8' -58.5(5) . . . . ?
B6' B2' B3' B1' 40.5(3) . . . . ?
B6' B2' B3' B4' 4.0(5) . . . . ?
B6' B5' B9' Cs2 -178.8(2) . . . . ?
B6' B5' B9' C8' -61.5(4) . . . . ?
B6' B5' B9' B4' -100.9(3) . . . . ?
B6' B5' B9' B10' 38.4(3) . . . . ?
B6' B5' B9' B3A -2.1(6) . . . . ?
B6' B5' B10' Cs2 113.7(2) . . . 2_667 ?
B6' B5' B10' B9' -135.9(3) . . . . ?
B6' B5' B10' B11' -39.3(3) . . . . ?
B6' B5' B10' B3A -96.1(5) . . . . ?
B6' B10' B11' C7' -96.3(3) . . . . ?
B6' B10' B11' B2' -35.3(3) . . . . ?
B6' B10' B11' B3A -135.6(6) . . . . ?
B6' B10' B3A C7' -3.7(8) . . . . ?
B6' B10' B3A C8' -64.8(7) . . . . ?
B6' B10' B3A B9' -102.1(4) . . . . ?
B6' B10' B3A B11' 38.2(4) . . . . ?
B6' B11' B3A C7' 94.7(4) . . . . ?
B6' B11' B3A C8' 58.9(8) . . . . ?
B6' B11' B3A B9' -2.9(10) . . . . ?
B6' B11' B3A B10' -39.5(5) . . . . ?
B9' C8' B4' Cs1 -105.3(7) . . . . ?
B9' C8' B4' B1' 103.0(3) . . . . ?
B9' C8' B4' B5' 39.7(3) . . . . ?
B9' C8' B4' B3' 144.5(4) . . . . ?
B9' C8' B3' C7' 103.2(4) . . . . ?
B9' C8' B3' B1' 4.5(6) . . . . ?
B9' C8' B3' B2' 67.0(5) . . . . ?
B9' C8' B3' B4' -36.6(4) . . . . ?
B9' C8' B3A C7' -141.8(5) . . . . ?
B9' C8' B3A B10' -38.4(5) . . . . ?
B9' C8' B3A B11' -104.6(7) . . . . ?
B9' B4' B5' N1' -114.9(4) . . . . ?
B9' B4' B5' B1' 137.9(3) . . . . ?
B9' B4' B5' B6' 99.6(3) . . . . ?
B9' B4' B5' B10' 37.1(3) . . . . ?
B9' B4' B3' C7' -4.2(5) . . . . ?
B9' B4' B3' C8' 30.3(3) . . . . ?
B9' B4' B3' B1' -102.7(3) . . . . ?
B9' B4' B3' B2' -66.2(5) . . . . ?
B9' B5' B6' Cs2 156.3(2) . . . 1_455 ?
B9' B5' B6' B1' 103.2(3) . . . . ?
B9' B5' B6' B2' 64.9(4) . . . . ?
B9' B5' B6' B10' -38.9(3) . . . . ?
B9' B5' B6' B11' 0.5(4) . . . . ?
B9' B5' B10' Cs2 -110.4(3) . . . 2_667 ?
B9' B5' B10' B6' 135.9(3) . . . . ?
B9' B5' B10' B11' 96.7(3) . . . . ?
B9' B5' B10' B3A 39.8(5) . . . . ?
B9' B10' B11' C7' 4.7(4) . . . . ?
B9' B10' B11' B2' 65.6(4) . . . . ?
B9' B10' B11' B6' 100.9(3) . . . . ?
B9' B10' B11' B3A -34.7(5) . . . . ?
B9' B10' B3A C7' 98.4(7) . . . . ?
B9' B10' B3A C8' 37.3(5) . . . . ?
B9' B10' B3A B11' 140.3(6) . . . . ?
B10 B3 B4 Cs1 -155.8(3) . . . . ?
B10 B3 B4 Cs1 -75.1(2) . . . 2_666 ?
B10 B3 B4 B1 141.1(3) . . . . ?
B10 B3 B4 B5 105.0(3) . . . . ?
B10 B3 B4 B9 41.5(3) . . . . ?
B10 B3 B4 C7A 41.5(3) . . . . ?
B10 B3 B11 B2 -140.7(3) . . . . ?
B10 B3 B11 C7 -99.2(3) . . . . ?
B10 B3 B11 B9A -99.2(3) . . . . ?
B10 B4 B5 C8 -0.4(4) . . . . ?
B10 B4 B5 B1 99.8(3) . . . . ?
B10 B4 B5 B6 61.2(4) . . . . ?
B10 B4 B5 B9 -36.8(3) . . . . ?
B10 B4 B5 C7A -36.8(3) . . . . ?
B10 B4 B9 C8 101.3(3) . . . . ?
B10 B4 B9 B5 140.4(3) . . . . ?
B10 B4 C7A C8 101.3(3) . . . . ?
B10 B4 C7A B5 140.4(3) . . . . ?
B10 B4 C7A C12A -109.9(11) . . . . ?
B10 B11 C7 C8 -2.3(4) . . . . ?
B10 B11 C7 B2 -104.3(3) . . . . ?
B10 B11 C7 B6 -70.6(4) . . . . ?
B10 B11 C7 C12 144.4(4) . . . . ?
B10 B11 B9A C8 -2.3(4) . . . . ?
B10 B11 B9A B2 -104.3(3) . . . . ?
B10 B11 B9A B6 -70.6(4) . . . . ?
B10' B5' B6' Cs2 -164.7(3) . . . 1_455 ?
B10' B5' B6' B1' 142.1(3) . . . . ?
B10' B5' B6' B2' 103.9(3) . . . . ?
B10' B5' B6' B11' 39.5(3) . . . . ?
B10' B5' B9' Cs2 142.8(3) . . . . ?
B10' B5' B9' C8' -99.9(3) . . . . ?
B10' B5' B9' B4' -139.2(4) . . . . ?
B10' B5' B9' B3A -40.5(6) . . . . ?
B10' B6' B11' C7' 101.2(4) . . . . ?
B10' B6' B11' B2' 140.2(3) . . . . ?
B10' B6' B11' B3A 40.7(6) . . . . ?
B10' B9' B3A C7' -103.1(7) . . . . ?
B10' B9' B3A C8' -136.4(5) . . . . ?
B10' B9' B3A B11' -37.8(6) . . . . ?
B10' B11' B3A C7' 134.2(5) . . . . ?
B10' B11' B3A C8' 98.4(7) . . . . ?
B10' B11' B3A B9' 36.6(6) . . . . ?
B11 B2 B3 N1 -108.5(4) . . . . ?
B11 B2 B3 B1 136.8(3) . . . . ?
B11 B2 B3 B4 99.2(3) . . . . ?
B11 B2 B3 B10 36.1(3) . . . . ?
B11 B2 B6 C8 -1.9(4) . . . . ?
B11 B2 B6 B1 -100.5(3) . . . . ?
B11 B2 B6 B5 -63.7(4) . . . . ?
B11 B2 B6 C7 30.0(3) . . . . ?
B11 B2 B6 B9A 30.0(3) . . . . ?
B11 B2 C7 C8 -107.6(4) . . . . ?
B11 B2 C7 B6 -144.3(3) . . . . ?
B11 B2 C7 C12 108.9(5) . . . . ?
B11 B2 B9A C8 -107.6(4) . . . . ?
B11 B2 B9A B6 -144.3(3) . . . . ?
B11 B3 B4 Cs1 164.5(2) . . . . ?
B11 B3 B4 Cs1 -114.8(2) . . . 2_666 ?
B11 B3 B4 B1 101.4(3) . . . . ?
B11 B3 B4 B5 65.3(3) . . . . ?
B11 B3 B4 B10 -39.7(3) . . . . ?
B11 B3 B4 B9 1.8(4) . . . . ?
B11 B3 B4 C7A 1.8(4) . . . . ?
B11 B3 B10 Cs1 -150.1(2) . . . 2_666 ?
B11 B3 B10 B4 135.2(3) . . . . ?
B11 B3 B10 B9 94.6(3) . . . . ?
B11 B3 B10 C7A 94.6(3) . . . . ?
B11 B10 B9 C8 4.4(4) . . . . ?
B11 B10 B9 B4 101.9(3) . . . . ?
B11 B10 B9 B5 67.0(4) . . . . ?
B11 B10 C7A C8 4.4(4) . . . . ?
B11 B10 C7A B4 101.9(3) . . . . ?
B11 B10 C7A B5 67.0(4) . . . . ?
B11 B10 C7A C12A -147.0(11) . . . . ?
B11' C7' C8' C13' -143.2(4) . . . . ?
B11' C7' C8' B4' 72.0(4) . . . . ?
B11' C7' C8' B9' 0.4(4) . . . . ?
B11' C7' C8' B3' 110.9(4) . . . . ?
B11' C7' C8' B3A -37.3(5) . . . . ?
B11' C7' B2' B1' -102.3(4) . . . . ?
B11' C7' B2' B6' -39.7(3) . . . . ?
B11' C7' B2' B3' -142.5(4) . . . . ?
B11' C7' B3' C8' -99.4(4) . . . . ?
B11' C7' B3' B1' -1.0(7) . . . . ?
B11' C7' B3' B2' 38.8(4) . . . . ?
B11' C7' B3' B4' -63.9(6) . . . . ?
B11' C7' B3A C8' 139.3(5) . . . . ?
B11' C7' B3A B9' 106.2(7) . . . . ?
B11' C7' B3A B10' 42.6(6) . . . . ?
B11' B2' B6' Cs2 131.0(2) . . . 1_455 ?
B11' B2' B6' B1' -138.3(4) . . . . ?
B11' B2' B6' B5' -100.2(3) . . . . ?
B11' B2' B6' B10' -36.4(3) . . . . ?
B11' B2' B3' C7' -31.7(3) . . . . ?
B11' B2' B3' C8' 3.8(5) . . . . ?
B11' B2' B3' B1' 102.9(4) . . . . ?
B11' B2' B3' B4' 66.3(5) . . . . ?
B11' B6' B10' Cs2 143.0(3) . . . 2_667 ?
B11' B6' B10' B5' -135.6(3) . . . . ?
B11' B6' B10' B9' -97.4(3) . . . . ?
B11' B6' B10' B3A -35.6(5) . . . . ?
B11' B10' B3A C7' -41.9(5) . . . . ?
B11' B10' B3A C8' -103.0(8) . . . . ?
B11' B10' B3A B9' -140.3(6) . . . . ?
C7 C8 B5 B1 -0.1(4) . . . . ?
C7 C8 B5 B4 63.8(4) . . . . ?
C7 C8 B5 B6 -41.2(3) . . . . ?
C7 C8 B5 B9 102.8(3) . . . . ?
C7 C8 B6 B1 97.0(3) . . . . ?
C7 C8 B6 B2 34.5(3) . . . . ?
C7 C8 B6 B5 137.6(3) . . . . ?
C7 C8 B9 B4 -67.3(4) . . . . ?
C7 C8 B9 B5 -106.1(3) . . . . ?
C7 C8 B9 B10 -6.0(4) . . . . ?
C7 B2 B3 N1 -145.8(3) . . . . ?
C7 B2 B3 B1 99.6(3) . . . . ?
C7 B2 B3 B4 61.9(3) . . . . ?
C7 B2 B3 B10 -1.2(4) . . . . ?
C7 B2 B3 B11 -37.2(3) . . . . ?
C7 B2 B6 C8 -31.9(3) . . . . ?
C7 B2 B6 B1 -130.5(3) . . . . ?
C7 B2 B6 B5 -93.7(3) . . . . ?
C7 B2 B11 B3 133.6(3) . . . . ?
C7 B2 B11 B10 97.7(3) . . . . ?
B3' C7' C8' C13' 105.8(5) . . . . ?
B3' C7' C8' B4' -38.9(4) . . . . ?
B3' C7' C8' B9' -110.5(4) . . . . ?
B3' C7' B2' B1' 40.2(4) . . . . ?
B3' C7' B2' B6' 102.8(4) . . . . ?
B3' C7' B2' B11' 142.5(4) . . . . ?
B3' C7' B11' B2' -38.1(5) . . . . ?
B3' C7' B11' B6' 1.5(6) . . . . ?
B3' C7' B11' B10' 63.5(5) . . . . ?
B3' C8' B4' Cs1 110.2(8) . . . . ?
B3' C8' B4' B1' -41.6(4) . . . . ?
B3' C8' B4' B5' -104.8(4) . . . . ?
B3' C8' B4' B9' -144.5(4) . . . . ?
B3' C8' B9' Cs2 113.1(4) . . . . ?
B3' C8' B9' B4' 36.0(4) . . . . ?
B3' C8' B9' B5' -3.8(5) . . . . ?
B3' C8' B9' B10' -67.0(5) . . . . ?
B3' B1' B2' C7' -38.4(4) . . . . ?
B3' B1' B2' B6' -134.6(4) . . . . ?
B3' B1' B2' B11' -97.5(4) . . . . ?
B3' B1' B4' Cs1 -129.4(3) . . . . ?
B3' B1' B4' C8' 39.2(3) . . . . ?
B3' B1' B4' B5' 135.9(4) . . . . ?
B3' B1' B4' B9' 98.4(4) . . . . ?
B3' B1' B5' N1' -154.5(4) . . . . ?
B3' B1' B5' B4' -37.5(3) . . . . ?
B3' B1' B5' B6' 99.0(4) . . . . ?
B3' B1' B5' B9' 1.2(5) . . . . ?
B3' B1' B5' B10' 65.2(4) . . . . ?
B3' B1' B6' Cs2 119.9(4) . . . 1_455 ?
B3' B1' B6' B2' 38.9(4) . . . . ?
B3' B1' B6' B5' -98.1(4) . . . . ?
B3' B1' B6' B10' -63.6(5) . . . . ?
B3' B1' B6' B11' 0.9(5) . . . . ?
B3' B2' B6' Cs2 -131.5(3) . . . 1_455 ?
B3' B2' B6' B1' -40.8(4) . . . . ?
B3' B2' B6' B5' -2.6(4) . . . . ?
B3' B2' B6' B10' 61.1(4) . . . . ?
B3' B2' B6' B11' 97.5(4) . . . . ?
B3' B2' B11' C7' 32.1(4) . . . . ?
B3' B2' B11' B6' -101.7(4) . . . . ?
B3' B2' B11' B10' -66.1(4) . . . . ?
B3' B4' B5' N1' 147.7(4) . . . . ?
B3' B4' B5' B1' 40.4(4) . . . . ?
B3' B4' B5' B6' 2.1(4) . . . . ?
B3' B4' B5' B9' -97.4(4) . . . . ?
B3' B4' B5' B10' -60.3(5) . . . . ?
B3' B4' B9' Cs2 -144.1(3) . . . . ?
B3' B4' B9' C8' -30.4(3) . . . . ?
B3' B4' B9' B5' 103.1(4) . . . . ?
B3' B4' B9' B10' 65.9(4) . . . . ?
B9 C8 B5 B1 -102.9(3) . . . . ?
B9 C8 B5 B4 -39.0(3) . . . . ?
B9 C8 B5 B6 -144.0(3) . . . . ?
B9 C8 B6 B1 -3.8(4) . . . . ?
B9 C8 B6 B2 -66.3(4) . . . . ?
B9 C8 B6 B5 36.8(3) . . . . ?
B9 C8 B6 C7 -100.8(4) . . . . ?
B9 C8 C7 B2 74.8(4) . . . . ?
B9 C8 C7 B6 110.8(3) . . . . ?
B9 C8 C7 B11 5.4(4) . . . . ?
B9 C8 C7 C12 -141.2(4) . . . . ?
B9 B4 B5 C8 36.5(3) . . . . ?
B9 B4 B5 B1 136.7(3) . . . . ?
B9 B4 B5 B6 98.0(4) . . . . ?
B9 B4 B10 Cs1 129.2(2) . . . 2_666 ?
B9 B4 B10 B3 -133.7(3) . . . . ?
B9 B4 B10 B11 -94.9(3) . . . . ?
B9 B5 B6 C8 -30.2(3) . . . . ?
B9 B5 B6 B1 102.9(3) . . . . ?
B9 B5 B6 B2 65.8(4) . . . . ?
B9 B5 B6 C7 3.7(4) . . . . ?
B9 B10 B11 B2 -66.1(4) . . . . ?
B9 B10 B11 B3 -101.7(3) . . . . ?
B9 B10 B11 C7 -1.4(4) . . . . ?
C7A C8 B5 B1 -102.9(3) . . . . ?
C7A C8 B5 B4 -39.0(3) . . . . ?
C7A C8 B5 B6 -144.0(3) . . . . ?
C7A C8 B6 B1 -3.8(4) . . . . ?
C7A C8 B6 B2 -66.3(4) . . . . ?
C7A C8 B6 B5 36.8(3) . . . . ?
C7A C8 B6 B9A -100.8(4) . . . . ?
C7A C8 B9A B2 74.8(4) . . . . ?
C7A C8 B9A B6 110.8(3) . . . . ?
C7A C8 B9A B11 5.4(4) . . . . ?
C7A B4 B5 C8 36.5(3) . . . . ?
C7A B4 B5 B1 136.7(3) . . . . ?
C7A B4 B5 B6 98.0(4) . . . . ?
C7A B4 B10 Cs1 129.2(2) . . . 2_666 ?
C7A B4 B10 B3 -133.7(3) . . . . ?
C7A B4 B10 B11 -94.9(3) . . . . ?
C7A B5 B6 C8 -30.2(3) . . . . ?
C7A B5 B6 B1 102.9(3) . . . . ?
C7A B5 B6 B2 65.8(4) . . . . ?
C7A B5 B6 B9A 3.7(4) . . . . ?
C7A B10 B11 B2 -66.1(4) . . . . ?
C7A B10 B11 B3 -101.7(3) . . . . ?
C7A B10 B11 B9A -1.4(4) . . . . ?
B3A C7' C8' C13' -105.9(6) . . . . ?
B3A C7' C8' B4' 109.3(6) . . . . ?
B3A C7' C8' B9' 37.7(5) . . . . ?
B3A C7' B2' B1' -67.0(6) . . . . ?
B3A C7' B2' B6' -4.4(7) . . . . ?
B3A C7' B2' B11' 35.3(6) . . . . ?
B3A C7' B11' B2' -143.1(5) . . . . ?
B3A C7' B11' B6' -103.5(5) . . . . ?
B3A C7' B11' B10' -41.5(5) . . . . ?
B3A C8' B4' Cs1 -145.0(7) . . . . ?
B3A C8' B4' B1' 63.2(7) . . . . ?
B3A C8' B4' B5' 0.0(7) . . . . ?
B3A C8' B4' B9' -39.7(6) . . . . ?
B3A C8' B9' Cs2 -141.6(5) . . . . ?
B3A C8' B9' B4' 141.3(6) . . . . ?
B3A C8' B9' B5' 101.5(6) . . . . ?
B3A C8' B9' B10' 38.2(5) . . . . ?
B3A B9' B10' Cs2 -143.6(5) . . . 2_667 ?
B3A B9' B10' B5' 134.1(6) . . . . ?
B3A B9' B10' B6' 94.8(5) . . . . ?
B3A B9' B10' B11' 32.5(5) . . . . ?
B3A B10' B11' C7' 39.4(5) . . . . ?
B3A B10' B11' B2' 100.3(6) . . . . ?
B3A B10' B11' B6' 135.6(6) . . . . ?
B9A C8 B5 B1 -0.1(4) . . . . ?
B9A C8 B5 B4 63.8(4) . . . . ?
B9A C8 B5 B6 -41.2(3) . . . . ?
B9A C8 B5 C7A 102.8(3) . . . . ?
B9A C8 B6 B1 97.0(3) . . . . ?
B9A C8 B6 B2 34.5(3) . . . . ?
B9A C8 B6 B5 137.6(3) . . . . ?
B9A C8 C7A B4 -67.3(4) . . . . ?
B9A C8 C7A B5 -106.1(3) . . . . ?
B9A C8 C7A B10 -6.0(4) . . . . ?
B9A C8 C7A C12A 144.6(11) . . . . ?
B9A B2 B3 N1 -145.8(3) . . . . ?
B9A B2 B3 B1 99.6(3) . . . . ?
B9A B2 B3 B4 61.9(3) . . . . ?
B9A B2 B3 B10 -1.2(4) . . . . ?
B9A B2 B3 B11 -37.2(3) . . . . ?
B9A B2 B6 C8 -31.9(3) . . . . ?
B9A B2 B6 B1 -130.5(3) . . . . ?
B9A B2 B6 B5 -93.7(3) . . . . ?
B9A B2 B11 B3 133.6(3) . . . . ?
B9A B2 B11 B10 97.7(3) . . . . ?


_olex2_date_sample_data_collection 2018-02-02
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.147
_oxdiff_exptl_absorpt_empirical_full_min 0.879
