#------------------------------------------------------------------------------
#$Date: 2025-12-10 03:06:51 +0100 (Wed 10 de Dec de 2025) $
#$Revision: 304161 $
#$URL: svn://www.crystallography.net/cod/cif/7/06/41/7064197.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7064197
loop_
_publ_author_name
'Sokolov, Vladislav A.'
'Bakulina, Olga'
'Boyarskaya, Irina A.'
'Spiridonova, Dar'ya V.'
'Kryukova, Mariya A.'
'Vasilyev, Aleksander'
_publ_section_title
;
 Synthesis of CCl3-substituted amides, ketones, indenes by intermolecular
 reactions of β-CCl3-enones or β-CCl3-β-hydroxy ketones with various
 nucleophiles in CF3SO3H
;
_journal_name_full               'New Journal of Chemistry'
_journal_paper_doi               10.1039/D5NJ03928B
_journal_year                    2026
_chemical_formula_moiety         'C24 H39 B21 F3 P, C H2 Cl2'
_chemical_formula_sum            'C25 H41 B21 Cl2 F3 P'
_chemical_formula_weight         727.46
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_audit_block_doi                 10.5517/ccdc.csd.cc2pmwt1
_audit_creation_date             2025-01-23
_audit_creation_method
;
Olex2 1.5
(compiled 2024.01.12 svn.r2f8d729c for OlexSys, GUI svn.r6928)
;
_audit_update_record
;
2025-09-26 deposited with the CCDC.	2025-12-09 downloaded from the CCDC.
;
_cell_angle_alpha                94.433(2)
_cell_angle_beta                 106.841(3)
_cell_angle_gamma                97.095(2)
_cell_formula_units_Z            2
_cell_length_a                   10.6621(5)
_cell_length_b                   11.0433(5)
_cell_length_c                   16.7913(8)
_cell_measurement_reflns_used    9997
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      27.07
_cell_measurement_theta_min      2.55
_cell_volume                     1864.45(15)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL-2019/1 (Sheldrick, 2019)'
_computing_structure_solution    'SHELXS-97 (Sheldrick 2008)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0542
_diffrn_reflns_av_unetI/netI     0.0326
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            75123
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.122
_diffrn_reflns_theta_min         1.872
_exptl_absorpt_coefficient_mu    0.254
_exptl_absorpt_correction_T_max  0.918
_exptl_absorpt_correction_T_min  0.900
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADabs
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.296
_exptl_crystal_description       SLAB
_exptl_crystal_F_000             744
_exptl_crystal_size_max          0.143
_exptl_crystal_size_mid          0.112
_exptl_crystal_size_min          0.06
_refine_diff_density_max         0.487
_refine_diff_density_min         -0.679
_refine_diff_density_rms         0.065
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.088
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     471
_refine_ls_number_reflns         8219
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.088
_refine_ls_R_factor_all          0.0754
_refine_ls_R_factor_gt           0.0521
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0491P)²+2.4718P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1210
_refine_ls_wR_factor_ref         0.1448
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6447
_reflns_number_total             8219
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d5nj03928b2.cif
_cod_data_source_block           (p-F-C6H4)3P-HBMeoCb2
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_absorpt_correction_type' value 'Multi-scan' was
changed to 'multi-scan' in accordance with the
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

data item '_atom_sites_solution_primary' value 'DIRECT METHOD' was
changed to 'direct'.

Automatic conversion script
Id: cif_fix_values 8170 2020-07-09 18:12:32Z antanas 
;
_cod_database_code               7064197
_shelx_shelxl_version_number     2019/1
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined 
by the following loop, which should always be used as a source of 
symmetry information in preference to the above space-group names. 
They are only intended as comments. 
;
_shelx_estimated_absorpt_t_max   0.985
_shelx_estimated_absorpt_t_min   0.965
_olex2_refinement_description
;
1.a Riding coordinates:
 B1(H1)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_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
P1 P -2.15086(5) 0.29993(5) -0.28779(3) 0.01940(13) Uani 1 1 d . . . . .
F1 F -2.51202(17) 0.11516(16) -0.62921(10) 0.0495(4) Uani 1 1 d . . . . .
F2 F -2.47113(15) 0.06176(15) -0.09051(10) 0.0415(4) Uani 1 1 d . . . . .
F3 F -2.20734(16) 0.82665(13) -0.26571(12) 0.0489(4) Uani 1 1 d . . . . .
C1 C -1.8847(2) 0.28538(19) -0.32482(13) 0.0202(4) Uani 1 1 d . . . . .
C2 C -1.8047(2) 0.1814(2) -0.36708(14) 0.0238(4) Uani 1 1 d . . . . .
C3 C -1.7983(2) 0.0565(2) -0.33669(15) 0.0288(5) Uani 1 1 d . . . . .
H3A H -1.868388 0.037560 -0.310539 0.043 Uiso 1 1 calc R U . . .
H3B H -1.711661 0.056697 -0.295535 0.043 Uiso 1 1 calc R U . . .
H3C H -1.810753 -0.005820 -0.384256 0.043 Uiso 1 1 calc R U . . .
C4 C -1.8928(2) 0.26015(19) -0.15491(13) 0.0208(4) Uani 1 1 d . . . . .
C5 C -1.8631(2) 0.1340(2) -0.09907(14) 0.0254(5) Uani 1 1 d . . . . .
C6 C -1.9122(3) 0.0055(2) -0.14444(16) 0.0350(6) Uani 1 1 d . . . . .
H6A H -1.915802 -0.052636 -0.103635 0.052 Uiso 1 1 calc R U . . .
H6B H -1.851626 -0.016610 -0.175356 0.052 Uiso 1 1 calc R U . . .
H6C H -2.001067 0.002515 -0.183728 0.052 Uiso 1 1 calc R U . . .
C7 C -2.2526(2) 0.2447(2) -0.39571(13) 0.0220(4) Uani 1 1 d . . . . .
C8 C -2.2745(2) 0.1195(2) -0.42592(14) 0.0251(5) Uani 1 1 d . . . . .
H8 H -2.229472 0.063892 -0.391918 0.030 Uiso 1 1 calc R U . . .
C9 C -2.3610(2) 0.0760(2) -0.50464(15) 0.0295(5) Uani 1 1 d . . . . .
H9 H -2.376095 -0.008897 -0.524876 0.035 Uiso 1 1 calc R U . . .
C10 C -2.4246(2) 0.1583(2) -0.55297(15) 0.0337(5) Uani 1 1 d . . . . .
C11 C -2.4032(2) 0.2821(2) -0.52748(15) 0.0327(5) Uani 1 1 d . . . . .
H11 H -2.446757 0.337048 -0.562834 0.039 Uiso 1 1 calc R U . . .
C12 C -2.3157(2) 0.3247(2) -0.44829(14) 0.0259(5) Uani 1 1 d . . . . .
H12 H -2.298694 0.410309 -0.429723 0.031 Uiso 1 1 calc R U . . .
C13 C -2.1648(2) 0.4621(2) -0.27554(13) 0.0216(4) Uani 1 1 d . . . . .
C14 C -2.2905(2) 0.4977(2) -0.28817(14) 0.0248(4) Uani 1 1 d . . . . .
H14 H -2.366512 0.436572 -0.299755 0.030 Uiso 1 1 calc R U . . .
C15 C -2.3050(2) 0.6202(2) -0.28394(15) 0.0281(5) Uani 1 1 d . . . . .
H15 H -2.389789 0.644462 -0.291548 0.034 Uiso 1 1 calc R U . . .
C16 C -2.1930(3) 0.7066(2) -0.26836(16) 0.0308(5) Uani 1 1 d . . . . .
C17 C -2.0681(2) 0.6758(2) -0.25514(16) 0.0307(5) Uani 1 1 d . . . . .
H17 H -1.992877 0.737588 -0.244243 0.037 Uiso 1 1 calc R U . . .
C18 C -2.0547(2) 0.5525(2) -0.25810(14) 0.0253(5) Uani 1 1 d . . . . .
H18 H -1.969041 0.529533 -0.248050 0.030 Uiso 1 1 calc R U . . .
C19 C -2.2512(2) 0.2288(2) -0.22773(13) 0.0218(4) Uani 1 1 d . . . . .
C20 C -2.2875(2) 0.2982(2) -0.16729(14) 0.0262(5) Uani 1 1 d . . . . .
H20 H -2.260349 0.384679 -0.157299 0.031 Uiso 1 1 calc R U . . .
C21 C -2.3630(2) 0.2419(2) -0.12163(15) 0.0305(5) Uani 1 1 d . . . . .
H21 H -2.389865 0.289432 -0.081627 0.037 Uiso 1 1 calc R U . . .
C22 C -2.3980(2) 0.1169(2) -0.13524(15) 0.0293(5) Uani 1 1 d . . . . .
C23 C -2.3627(2) 0.0446(2) -0.19290(16) 0.0318(5) Uani 1 1 d . . . . .
H23A H -2.387953 -0.042127 -0.200826 0.038 Uiso 1 1 calc R U . . .
C24 C -2.2890(2) 0.1014(2) -0.23931(15) 0.0287(5) Uani 1 1 d . . . . .
H24A H -2.263921 0.052846 -0.279652 0.034 Uiso 1 1 calc R U . . .
B1 B -1.9685(2) 0.2400(2) -0.25808(15) 0.0188(4) Uani 1 1 d . . . . .
H1 H -2.007221 0.137933 -0.277178 0.023 Uiso 1 1 d R U . . .
B2 B -1.9549(3) 0.2101(2) -0.42622(16) 0.0251(5) Uani 1 1 d . . . . .
H2 H -2.046993 0.140502 -0.443116 0.030 Uiso 1 1 d R U . . .
B3 B -1.9553(2) 0.3694(2) -0.40416(16) 0.0232(5) Uani 1 1 d . . . . .
H3 H -2.048577 0.408107 -0.407463 0.028 Uiso 1 1 d R U . . .
B4 B -1.7118(2) 0.3089(2) -0.30273(16) 0.0232(5) Uani 1 1 d . . . . .
H4 H -1.643272 0.306072 -0.238429 0.028 Uiso 1 1 d R U . . .
B5 B -1.8042(2) 0.4302(2) -0.32733(16) 0.0233(5) Uani 1 1 d . . . . .
H5 H -1.796846 0.509153 -0.279327 0.028 Uiso 1 1 d R U . . .
B6 B -1.6742(3) 0.4127(2) -0.37100(17) 0.0271(5) Uani 1 1 d . . . . .
H6 H -1.580060 0.480084 -0.351697 0.033 Uiso 1 1 d R U . . .
B7 B -1.6745(3) 0.2533(2) -0.39409(17) 0.0271(5) Uani 1 1 d . . . . .
H7 H -1.581385 0.213674 -0.390191 0.033 Uiso 1 1 d R U . . .
B8 B -1.8259(3) 0.1926(3) -0.47147(16) 0.0291(6) Uani 1 1 d . . . . .
H8A H -1.833284 0.113419 -0.519269 0.035 Uiso 1 1 d R U . . .
B9 B -1.8261(3) 0.4501(3) -0.43447(18) 0.0287(5) Uani 1 1 d . . . . .
H9A H -1.832863 0.541947 -0.458066 0.034 Uiso 1 1 d R U . . .
B10 B -1.9215(3) 0.3128(3) -0.49656(17) 0.0290(5) Uani 1 1 d . . . . .
H10 H -1.992219 0.313398 -0.560459 0.035 Uiso 1 1 d R U . . .
B11 B -1.7454(3) 0.3409(3) -0.47600(18) 0.0309(6) Uani 1 1 d . . . . .
H11A H -1.698955 0.360726 -0.526399 0.037 Uiso 1 1 d R U . . .
B12 B -1.9156(3) 0.3733(2) -0.08708(16) 0.0278(5) Uani 1 1 d . . . . .
H12A H -1.983049 0.442212 -0.109084 0.033 Uiso 1 1 d R U . . .
B13 B -1.9783(3) 0.2182(3) -0.08357(16) 0.0268(5) Uani 1 1 d . . . . .
H13 H -2.087157 0.182051 -0.104471 0.032 Uiso 1 1 d R U . . .
B14 B -1.7352(3) 0.2200(2) -0.11951(16) 0.0254(5) Uani 1 1 d . . . . .
H14A H -1.683237 0.184980 -0.163711 0.030 Uiso 1 1 d R U . . .
B15 B -1.7624(3) 0.3751(2) -0.10914(16) 0.0258(5) Uani 1 1 d . . . . .
H15A H -1.726719 0.445491 -0.145441 0.031 Uiso 1 1 d R U . . .
B16 B -1.7635(3) 0.4128(3) -0.00485(17) 0.0330(6) Uani 1 1 d . . . . .
H16 H -1.728375 0.508289 0.028452 0.040 Uiso 1 1 d R U . . .
B17 B -1.8993(3) 0.3166(3) 0.01109(17) 0.0307(6) Uani 1 1 d . . . . .
H17A H -1.955938 0.348030 0.053490 0.037 Uiso 1 1 d R U . . .
B18 B -1.8676(3) 0.1641(3) 0.00152(16) 0.0292(5) Uani 1 1 d . . . . .
H18A H -1.901774 0.093662 0.038323 0.035 Uiso 1 1 d R U . . .
B19 B -1.7158(3) 0.1637(3) -0.02154(17) 0.0302(6) Uani 1 1 d . . . . .
H19 H -1.649599 0.093251 -0.000937 0.036 Uiso 1 1 d R U . . .
B20 B -1.6508(3) 0.3176(3) -0.02576(17) 0.0315(6) Uani 1 1 d . . . . .
H20A H -1.541300 0.349799 -0.007056 0.038 Uiso 1 1 d R U . . .
B21 B -1.7342(3) 0.2830(3) 0.04978(17) 0.0321(6) Uani 1 1 d . . . . .
H21A H -1.680843 0.292640 0.118578 0.038 Uiso 1 1 d R U . . .
Cl1 Cl -1.32214(11) 0.21477(9) -0.74940(6) 0.0743(3) Uani 1 1 d . . . . .
Cl2 Cl -1.24908(8) 0.27543(8) -0.89684(5) 0.0549(2) Uani 1 1 d . . . . .
C49 C -1.3776(4) 0.2499(4) -0.8520(3) 0.0775(13) Uani 1 1 d . . . . .
H49A H -1.420815 0.324247 -0.852503 0.093 Uiso 1 1 calc R U . . .
H49B H -1.444795 0.181251 -0.886454 0.093 Uiso 1 1 calc R U . . .
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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_citation_id
_citation_doi
_citation_year
1 10.1021/acs.inorgchem.5c04710 2025
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
C7 P1 B1 112.40(10) . . ?
C13 P1 C7 104.41(10) . . ?
C13 P1 C19 104.67(10) . . ?
C13 P1 B1 121.58(10) . . ?
C19 P1 C7 101.75(10) . . ?
C19 P1 B1 110.00(9) . . ?
C2 C1 B2 58.64(13) . . ?
C2 C1 B4 58.75(13) . . ?
B1 C1 C2 119.47(16) . . ?
B1 C1 B2 112.99(16) . . ?
B1 C1 B3 119.99(16) . . ?
B1 C1 B4 125.68(17) . . ?
B1 C1 B5 128.36(17) . . ?
B2 C1 B4 108.43(16) . . ?
B3 C1 C2 106.65(16) . . ?
B3 C1 B2 61.33(14) . . ?
B3 C1 B4 110.00(16) . . ?
B3 C1 B5 61.30(14) . . ?
B5 C1 C2 106.47(16) . . ?
B5 C1 B2 110.24(16) . . ?
B5 C1 B4 60.90(13) . . ?
C3 C2 C1 119.52(17) . . ?
C3 C2 B2 117.55(19) . . ?
C3 C2 B4 119.53(19) . . ?
C3 C2 B7 119.74(18) . . ?
C3 C2 B8 118.67(19) . . ?
B2 C2 C1 60.88(13) . . ?
B2 C2 B4 112.28(17) . . ?
B2 C2 B7 113.47(17) . . ?
B2 C2 B8 62.55(14) . . ?
B4 C2 C1 61.11(13) . . ?
B4 C2 B8 113.35(18) . . ?
B7 C2 C1 111.97(17) . . ?
B7 C2 B4 62.64(15) . . ?
B7 C2 B8 62.18(15) . . ?
B8 C2 C1 111.68(16) . . ?
C2 C3 H3A 109.5 . . ?
C2 C3 H3B 109.5 . . ?
C2 C3 H3C 109.5 . . ?
H3A C3 H3B 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C5 C4 B13 57.73(13) . . ?
B1 C4 C5 120.75(16) . . ?
B1 C4 B12 124.14(17) . . ?
B1 C4 B13 121.32(17) . . ?
B1 C4 B14 117.78(17) . . ?
B1 C4 B15 121.90(17) . . ?
B12 C4 C5 106.43(16) . . ?
B12 C4 B13 61.38(15) . . ?
B12 C4 B14 111.48(17) . . ?
B14 C4 C5 58.26(13) . . ?
B14 C4 B13 107.73(16) . . ?
B15 C4 C5 107.00(16) . . ?
B15 C4 B12 62.44(15) . . ?
B15 C4 B13 111.07(17) . . ?
B15 C4 B14 61.98(14) . . ?
C6 C5 C4 119.32(18) . . ?
C6 C5 B13 117.4(2) . . ?
C6 C5 B14 118.7(2) . . ?
C6 C5 B18 119.37(19) . . ?
C6 C5 B19 119.7(2) . . ?
B13 C5 C4 61.43(13) . . ?
B13 C5 B14 112.79(18) . . ?
B13 C5 B18 62.50(15) . . ?
B13 C5 B19 114.01(19) . . ?
B14 C5 C4 60.54(13) . . ?
B14 C5 B18 113.69(19) . . ?
B14 C5 B19 62.75(15) . . ?
B18 C5 C4 111.59(17) . . ?
B19 C5 C4 111.50(17) . . ?
B19 C5 B18 62.50(15) . . ?
C5 C6 H6A 109.5 . . ?
C5 C6 H6B 109.5 . . ?
C5 C6 H6C 109.5 . . ?
H6A C6 H6B 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C8 C7 P1 120.74(17) . . ?
C12 C7 P1 120.89(17) . . ?
C12 C7 C8 118.3(2) . . ?
C7 C8 H8 119.6 . . ?
C9 C8 C7 120.8(2) . . ?
C9 C8 H8 119.6 . . ?
C8 C9 H9 120.7 . . ?
C10 C9 C8 118.6(2) . . ?
C10 C9 H9 120.7 . . ?
F1 C10 C9 118.6(2) . . ?
F1 C10 C11 118.6(2) . . ?
C11 C10 C9 122.8(2) . . ?
C10 C11 H11 121.0 . . ?
C10 C11 C12 118.0(2) . . ?
C12 C11 H11 121.0 . . ?
C7 C12 H12 119.3 . . ?
C11 C12 C7 121.4(2) . . ?
C11 C12 H12 119.3 . . ?
C14 C13 P1 119.52(16) . . ?
C18 C13 P1 121.57(16) . . ?
C18 C13 C14 118.8(2) . . ?
C13 C14 H14 119.6 . . ?
C15 C14 C13 120.8(2) . . ?
C15 C14 H14 119.6 . . ?
C14 C15 H15 120.9 . . ?
C16 C15 C14 118.2(2) . . ?
C16 C15 H15 120.9 . . ?
F3 C16 C15 118.2(2) . . ?
F3 C16 C17 118.9(2) . . ?
C17 C16 C15 122.9(2) . . ?
C16 C17 H17 120.8 . . ?
C16 C17 C18 118.3(2) . . ?
C18 C17 H17 120.8 . . ?
C13 C18 H18 119.5 . . ?
C17 C18 C13 120.9(2) . . ?
C17 C18 H18 119.5 . . ?
C20 C19 P1 121.50(17) . . ?
C20 C19 C24 118.5(2) . . ?
C24 C19 P1 119.95(17) . . ?
C19 C20 H20 119.7 . . ?
C21 C20 C19 120.5(2) . . ?
C21 C20 H20 119.7 . . ?
C20 C21 H21 120.6 . . ?
C22 C21 C20 118.9(2) . . ?
C22 C21 H21 120.6 . . ?
F2 C22 C21 119.0(2) . . ?
F2 C22 C23 118.3(2) . . ?
C21 C22 C23 122.7(2) . . ?
C22 C23 H23A 120.9 . . ?
C22 C23 C24 118.2(2) . . ?
C24 C23 H23A 120.9 . . ?
C19 C24 H24A 119.4 . . ?
C23 C24 C19 121.1(2) . . ?
C23 C24 H24A 119.4 . . ?
P1 B1 H1 97.0 . . ?
C1 B1 P1 110.52(14) . . ?
C1 B1 H1 106.9 . . ?
C4 B1 P1 111.89(14) . . ?
C4 B1 C1 120.11(17) . . ?
C4 B1 H1 107.7 . . ?
C1 B2 H2 121.5 . . ?
C1 B2 B3 58.90(13) . . ?
C1 B2 B8 108.59(18) . . ?
C1 B2 B10 107.58(18) . . ?
C2 B2 C1 60.48(13) . . ?
C2 B2 H2 122.7 . . ?
C2 B2 B3 106.19(18) . . ?
C2 B2 B8 59.10(14) . . ?
C2 B2 B10 106.16(18) . . ?
B3 B2 H2 122.8 . . ?
B3 B2 B8 107.88(18) . . ?
B3 B2 B10 60.11(15) . . ?
B8 B2 H2 121.3 . . ?
B8 B2 B10 59.93(15) . . ?
B10 B2 H2 122.4 . . ?
C1 B3 B2 59.77(13) . . ?
C1 B3 H3 122.0 . . ?
C1 B3 B5 59.35(13) . . ?
C1 B3 B9 107.96(17) . . ?
C1 B3 B10 108.30(17) . . ?
B2 B3 H3 122.1 . . ?
B2 B3 B10 60.14(15) . . ?
B5 B3 B2 107.46(17) . . ?
B5 B3 H3 121.5 . . ?
B5 B3 B9 60.60(14) . . ?
B5 B3 B10 108.92(18) . . ?
B9 B3 B2 108.07(18) . . ?
B9 B3 H3 121.3 . . ?
B9 B3 B10 60.44(15) . . ?
B10 B3 H3 121.1 . . ?
C1 B4 H4 122.2 . . ?
C1 B4 B5 58.84(13) . . ?
C1 B4 B6 106.76(17) . . ?
C1 B4 B7 107.89(17) . . ?
C2 B4 C1 60.14(13) . . ?
C2 B4 H4 123.9 . . ?
C2 B4 B5 105.95(17) . . ?
C2 B4 B6 105.18(18) . . ?
C2 B4 B7 58.52(14) . . ?
B5 B4 H4 122.1 . . ?
B5 B4 B6 60.04(14) . . ?
B5 B4 B7 108.08(18) . . ?
B6 B4 H4 122.4 . . ?
B6 B4 B7 59.90(15) . . ?
B7 B4 H4 121.6 . . ?
C1 B5 B3 59.35(13) . . ?
C1 B5 B4 60.26(13) . . ?
C1 B5 H5 122.0 . . ?
C1 B5 B6 108.05(17) . . ?
C1 B5 B9 107.38(18) . . ?
B3 B5 B4 107.95(18) . . ?
B3 B5 H5 121.7 . . ?
B3 B5 B6 107.98(18) . . ?
B3 B5 B9 59.87(14) . . ?
B4 B5 H5 121.6 . . ?
B4 B5 B6 60.24(14) . . ?
B4 B5 B9 108.28(18) . . ?
B6 B5 H5 121.8 . . ?
B6 B5 B9 60.13(14) . . ?
B9 B5 H5 121.8 . . ?
B4 B6 H6 121.5 . . ?
B4 B6 B9 107.95(17) . . ?
B4 B6 B11 108.34(19) . . ?
B5 B6 B4 59.72(14) . . ?
B5 B6 H6 121.5 . . ?
B5 B6 B7 108.02(18) . . ?
B5 B6 B9 60.24(14) . . ?
B5 B6 B11 108.24(18) . . ?
B7 B6 B4 60.14(14) . . ?
B7 B6 H6 121.6 . . ?
B7 B6 B9 108.05(19) . . ?
B7 B6 B11 60.28(16) . . ?
B9 B6 H6 121.9 . . ?
B9 B6 B11 59.87(15) . . ?
B11 B6 H6 121.7 . . ?
C2 B7 B4 58.84(14) . . ?
C2 B7 B6 105.46(17) . . ?
C2 B7 H7 123.8 . . ?
C2 B7 B8 59.23(14) . . ?
C2 B7 B11 105.69(18) . . ?
B4 B7 H7 121.6 . . ?
B4 B7 B11 108.05(18) . . ?
B6 B7 B4 59.96(14) . . ?
B6 B7 H7 122.4 . . ?
B6 B7 B11 60.10(16) . . ?
B8 B7 B4 107.88(18) . . ?
B8 B7 B6 107.80(18) . . ?
B8 B7 H7 121.5 . . ?
B8 B7 B11 59.79(16) . . ?
B11 B7 H7 122.2 . . ?
C2 B8 B2 58.35(14) . . ?
C2 B8 B7 58.59(14) . . ?
C2 B8 H8A 124.5 . . ?
C2 B8 B10 105.69(18) . . ?
C2 B8 B11 105.80(19) . . ?
B2 B8 H8A 122.1 . . ?
B7 B8 B2 107.13(18) . . ?
B7 B8 H8A 121.7 . . ?
B7 B8 B10 108.9(2) . . ?
B7 B8 B11 60.56(16) . . ?
B10 B8 B2 60.06(15) . . ?
B10 B8 H8A 121.3 . . ?
B11 B8 B2 108.14(19) . . ?
B11 B8 H8A 121.5 . . ?
B11 B8 B10 60.68(16) . . ?
B3 B9 B5 59.53(14) . . ?
B3 B9 B6 107.32(18) . . ?
B3 B9 H9A 122.2 . . ?
B3 B9 B10 60.03(15) . . ?
B3 B9 B11 108.21(19) . . ?
B5 B9 H9A 122.4 . . ?
B5 B9 B10 107.74(18) . . ?
B6 B9 B5 59.63(14) . . ?
B6 B9 H9A 121.9 . . ?
B6 B9 B10 108.09(19) . . ?
B10 B9 H9A 121.4 . . ?
B11 B9 B5 107.96(18) . . ?
B11 B9 B6 60.14(15) . . ?
B11 B9 H9A 121.0 . . ?
B11 B9 B10 60.39(16) . . ?
B2 B10 B9 107.05(18) . . ?
B2 B10 H10 122.2 . . ?
B2 B10 B11 107.20(18) . . ?
B3 B10 B2 59.75(14) . . ?
B3 B10 B9 59.53(15) . . ?
B3 B10 H10 122.0 . . ?
B3 B10 B11 107.18(19) . . ?
B8 B10 B2 60.01(15) . . ?
B8 B10 B3 107.66(18) . . ?
B8 B10 B9 107.17(19) . . ?
B8 B10 H10 122.1 . . ?
B8 B10 B11 59.54(15) . . ?
B9 B10 H10 122.3 . . ?
B9 B10 B11 59.59(16) . . ?
B11 B10 H10 122.3 . . ?
B6 B11 B7 59.62(15) . . ?
B6 B11 B10 107.68(18) . . ?
B6 B11 H11A 122.0 . . ?
B7 B11 B10 107.44(18) . . ?
B7 B11 H11A 122.1 . . ?
B8 B11 B6 107.29(18) . . ?
B8 B11 B7 59.64(15) . . ?
B8 B11 B9 107.70(18) . . ?
B8 B11 B10 59.78(15) . . ?
B8 B11 H11A 122.1 . . ?
B9 B11 B6 59.99(15) . . ?
B9 B11 B7 107.63(19) . . ?
B9 B11 B10 60.01(15) . . ?
B9 B11 H11A 121.7 . . ?
B10 B11 H11A 121.9 . . ?
C4 B12 H12A 122.0 . . ?
C4 B12 B13 60.59(14) . . ?
C4 B12 B15 58.74(14) . . ?
C4 B12 B16 106.70(18) . . ?
C4 B12 B17 108.42(18) . . ?
B13 B12 H12A 121.8 . . ?
B13 B12 B15 107.53(18) . . ?
B13 B12 B16 107.52(19) . . ?
B13 B12 B17 59.98(15) . . ?
B15 B12 H12A 122.0 . . ?
B15 B12 B16 59.82(15) . . ?
B15 B12 B17 108.38(19) . . ?
B16 B12 H12A 122.3 . . ?
B17 B12 H12A 121.3 . . ?
B17 B12 B16 60.26(16) . . ?
C4 B13 B12 58.03(13) . . ?
C4 B13 H13 122.0 . . ?
C4 B13 B17 106.51(18) . . ?
C4 B13 B18 108.54(18) . . ?
C5 B13 C4 60.83(13) . . ?
C5 B13 B12 106.23(18) . . ?
C5 B13 H13 122.9 . . ?
C5 B13 B17 105.94(18) . . ?
C5 B13 B18 59.25(14) . . ?
B12 B13 H13 122.4 . . ?
B12 B13 B17 60.15(15) . . ?
B17 B13 H13 122.6 . . ?
B18 B13 B12 108.02(19) . . ?
B18 B13 H13 121.4 . . ?
B18 B13 B17 59.74(15) . . ?
C4 B14 H14A 122.0 . . ?
C4 B14 B15 58.29(13) . . ?
C4 B14 B19 108.81(18) . . ?
C4 B14 B20 106.62(18) . . ?
C5 B14 C4 61.20(13) . . ?
C5 B14 H14A 123.0 . . ?
C5 B14 B15 106.41(18) . . ?
C5 B14 B19 58.72(14) . . ?
C5 B14 B20 105.54(18) . . ?
B15 B14 H14A 122.5 . . ?
B19 B14 H14A 121.0 . . ?
B19 B14 B15 108.31(19) . . ?
B20 B14 H14A 122.6 . . ?
B20 B14 B15 59.97(15) . . ?
B20 B14 B19 60.04(16) . . ?
C4 B15 B12 58.82(14) . . ?
C4 B15 B14 59.73(14) . . ?
C4 B15 H15A 122.4 . . ?
C4 B15 B16 107.05(18) . . ?
C4 B15 B20 107.63(18) . . ?
B12 B15 B14 106.85(18) . . ?
B12 B15 H15A 122.1 . . ?
B14 B15 H15A 122.3 . . ?
B16 B15 B12 60.19(15) . . ?
B16 B15 B14 107.55(19) . . ?
B16 B15 H15A 121.8 . . ?
B20 B15 B12 108.22(19) . . ?
B20 B15 B14 59.80(15) . . ?
B20 B15 H15A 121.5 . . ?
B20 B15 B16 60.33(16) . . ?
B12 B16 H16 122.3 . . ?
B12 B16 B17 59.84(16) . . ?
B12 B16 B20 107.65(19) . . ?
B15 B16 B12 59.99(15) . . ?
B15 B16 H16 121.8 . . ?
B15 B16 B17 108.18(19) . . ?
B15 B16 B20 59.82(15) . . ?
B17 B16 H16 121.5 . . ?
B20 B16 H16 121.6 . . ?
B20 B16 B17 108.3(2) . . ?
B21 B16 B12 108.2(2) . . ?
B21 B16 B15 108.52(19) . . ?
B21 B16 H16 120.9 . . ?
B21 B16 B17 60.33(16) . . ?
B21 B16 B20 60.37(16) . . ?
B12 B17 B16 59.90(16) . . ?
B12 B17 H17A 121.5 . . ?
B12 B17 B21 107.56(19) . . ?
B13 B17 B12 59.86(15) . . ?
B13 B17 B16 107.15(18) . . ?
B13 B17 H17A 121.8 . . ?
B13 B17 B21 107.14(19) . . ?
B16 B17 H17A 122.6 . . ?
B16 B17 B21 59.47(16) . . ?
B18 B17 B12 107.92(18) . . ?
B18 B17 B13 59.90(15) . . ?
B18 B17 B16 107.12(19) . . ?
B18 B17 H17A 121.9 . . ?
B18 B17 B21 59.56(16) . . ?
B21 B17 H17A 122.6 . . ?
C5 B18 B13 58.25(14) . . ?
C5 B18 B17 105.65(18) . . ?
C5 B18 H18A 124.5 . . ?
C5 B18 B19 58.44(14) . . ?
C5 B18 B21 105.56(18) . . ?
B13 B18 H18A 122.3 . . ?
B13 B18 B19 107.20(18) . . ?
B17 B18 B13 60.36(15) . . ?
B17 B18 H18A 121.7 . . ?
B17 B18 B19 109.0(2) . . ?
B17 B18 B21 60.89(16) . . ?
B19 B18 H18A 121.1 . . ?
B21 B18 B13 108.5(2) . . ?
B21 B18 H18A 121.3 . . ?
B21 B18 B19 60.48(16) . . ?
C5 B19 B14 58.53(14) . . ?
C5 B19 B18 59.05(14) . . ?
C5 B19 H19 124.2 . . ?
C5 B19 B20 105.35(18) . . ?
C5 B19 B21 105.33(18) . . ?
B14 B19 B18 107.48(18) . . ?
B14 B19 H19 121.3 . . ?
B14 B19 B20 59.97(15) . . ?
B14 B19 B21 107.98(19) . . ?
B18 B19 H19 122.3 . . ?
B18 B19 B21 59.58(16) . . ?
B20 B19 B18 107.9(2) . . ?
B20 B19 H19 121.7 . . ?
B20 B19 B21 60.43(16) . . ?
B21 B19 H19 122.5 . . ?
B14 B20 B15 60.22(14) . . ?
B14 B20 B16 107.49(19) . . ?
B14 B20 B19 59.99(15) . . ?
B14 B20 H20A 122.0 . . ?
B14 B20 B21 107.71(19) . . ?
B15 B20 B16 59.85(15) . . ?
B15 B20 H20A 121.5 . . ?
B15 B20 B21 107.90(19) . . ?
B16 B20 H20A 122.2 . . ?
B16 B20 B21 59.57(16) . . ?
B19 B20 B15 108.48(19) . . ?
B19 B20 B16 107.7(2) . . ?
B19 B20 H20A 121.5 . . ?
B19 B20 B21 60.06(16) . . ?
B21 B20 H20A 121.8 . . ?
B16 B21 B17 60.20(16) . . ?
B16 B21 B19 107.62(19) . . ?
B16 B21 B20 60.06(16) . . ?
B16 B21 H21A 121.8 . . ?
B17 B21 H21A 121.6 . . ?
B18 B21 B16 107.69(19) . . ?
B18 B21 B17 59.55(16) . . ?
B18 B21 B19 59.94(16) . . ?
B18 B21 B20 107.47(19) . . ?
B18 B21 H21A 121.8 . . ?
B19 B21 B17 107.54(19) . . ?
B19 B21 B20 59.51(16) . . ?
B19 B21 H21A 122.2 . . ?
B20 B21 B17 107.92(19) . . ?
B20 B21 H21A 122.3 . . ?
Cl1 C49 Cl2 112.5(2) . . ?
Cl1 C49 H49A 109.1 . . ?
Cl1 C49 H49B 109.1 . . ?
Cl2 C49 H49A 109.1 . . ?
Cl2 C49 H49B 109.1 . . ?
H49A C49 H49B 107.8 . . ?
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
P1 C7 1.833(2) . ?
P1 C13 1.816(2) . ?
P1 C19 1.822(2) . ?
P1 B1 2.067(2) . ?
F1 C10 1.356(3) . ?
F2 C22 1.355(3) . ?
F3 C16 1.351(3) . ?
C1 C2 1.737(3) . ?
C1 B1 1.692(3) . ?
C1 B2 1.743(3) . ?
C1 B3 1.728(3) . ?
C1 B4 1.753(3) . ?
C1 B5 1.728(3) . ?
C2 C3 1.510(3) . ?
C2 B2 1.704(3) . ?
C2 B4 1.712(3) . ?
C2 B7 1.706(3) . ?
C2 B8 1.718(3) . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 C5 1.749(3) . ?
C4 B1 1.670(3) . ?
C4 B12 1.713(3) . ?
C4 B13 1.759(3) . ?
C4 B14 1.738(3) . ?
C4 B15 1.711(3) . ?
C5 C6 1.512(3) . ?
C5 B13 1.693(3) . ?
C5 B14 1.697(3) . ?
C5 B18 1.711(3) . ?
C5 B19 1.700(4) . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
C7 C8 1.402(3) . ?
C7 C12 1.392(3) . ?
C8 H8 0.9500 . ?
C8 C9 1.383(3) . ?
C9 H9 0.9500 . ?
C9 C10 1.375(4) . ?
C10 C11 1.371(4) . ?
C11 H11 0.9500 . ?
C11 C12 1.391(3) . ?
C12 H12 0.9500 . ?
C13 C14 1.405(3) . ?
C13 C18 1.388(3) . ?
C14 H14 0.9500 . ?
C14 C15 1.380(3) . ?
C15 H15 0.9500 . ?
C15 C16 1.380(3) . ?
C16 C17 1.375(3) . ?
C17 H17 0.9500 . ?
C17 C18 1.385(3) . ?
C18 H18 0.9500 . ?
C19 C20 1.395(3) . ?
C19 C24 1.397(3) . ?
C20 H20 0.9500 . ?
C20 C21 1.389(3) . ?
C21 H21 0.9500 . ?
C21 C22 1.368(3) . ?
C22 C23 1.373(3) . ?
C23 H23A 0.9500 . ?
C23 C24 1.388(3) . ?
C24 H24A 0.9500 . ?
B1 H1 1.1388 . ?
B2 H2 1.1198 . ?
B2 B3 1.770(4) . ?
B2 B8 1.776(4) . ?
B2 B10 1.777(4) . ?
B3 H3 1.1189 . ?
B3 B5 1.762(4) . ?
B3 B9 1.768(3) . ?
B3 B10 1.777(4) . ?
B4 H4 1.1198 . ?
B4 B5 1.764(3) . ?
B4 B6 1.773(4) . ?
B4 B7 1.777(4) . ?
B5 H5 1.1200 . ?
B5 B6 1.770(4) . ?
B5 B9 1.781(4) . ?
B6 H6 1.1205 . ?
B6 B7 1.772(4) . ?
B6 B9 1.779(4) . ?
B6 B11 1.781(4) . ?
B7 H7 1.1202 . ?
B7 B8 1.768(4) . ?
B7 B11 1.784(4) . ?
B8 H8A 1.1194 . ?
B8 B10 1.775(4) . ?
B8 B11 1.771(4) . ?
B9 H9A 1.1197 . ?
B9 B10 1.784(4) . ?
B9 B11 1.776(4) . ?
B10 H10 1.1195 . ?
B10 B11 1.791(4) . ?
B11 H11A 1.1195 . ?
B12 H12A 1.1210 . ?
B12 B13 1.772(4) . ?
B12 B15 1.775(4) . ?
B12 B16 1.779(4) . ?
B12 B17 1.778(4) . ?
B13 H13 1.1216 . ?
B13 B17 1.775(4) . ?
B13 B18 1.766(4) . ?
B14 H14A 1.1201 . ?
B14 B15 1.776(4) . ?
B14 B19 1.769(4) . ?
B14 B20 1.769(4) . ?
B15 H15A 1.1204 . ?
B15 B16 1.772(4) . ?
B15 B20 1.772(4) . ?
B16 H16 1.1203 . ?
B16 B17 1.785(4) . ?
B16 B20 1.781(4) . ?
B16 B21 1.772(4) . ?
B17 H17A 1.1197 . ?
B17 B18 1.763(4) . ?
B17 B21 1.787(4) . ?
B18 H18A 1.1198 . ?
B18 B19 1.770(4) . ?
B18 B21 1.764(4) . ?
B19 H19 1.1216 . ?
B19 B20 1.770(4) . ?
B19 B21 1.780(4) . ?
B20 H20A 1.1206 . ?
B20 B21 1.786(4) . ?
B21 H21A 1.1203 . ?
Cl1 C49 1.743(4) . ?
Cl2 C49 1.748(4) . ?
C49 H49A 0.9900 . ?
C49 H49B 0.9900 . ?
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
P1 C7 C8 C9 174.01(17) . . . . ?
P1 C7 C12 C11 -173.80(18) . . . . ?
P1 C13 C14 C15 -176.33(18) . . . . ?
P1 C13 C18 C17 175.11(18) . . . . ?
P1 C19 C20 C21 -179.36(18) . . . . ?
P1 C19 C24 C23 178.37(19) . . . . ?
F1 C10 C11 C12 178.4(2) . . . . ?
F2 C22 C23 C24 179.3(2) . . . . ?
F3 C16 C17 C18 -179.9(2) . . . . ?
C1 C2 B2 B3 38.52(15) . . . . ?
C1 C2 B2 B8 139.98(18) . . . . ?
C1 C2 B2 B10 101.38(18) . . . . ?
C1 C2 B4 B5 -38.32(15) . . . . ?
C1 C2 B4 B6 -100.89(17) . . . . ?
C1 C2 B4 B7 -140.06(17) . . . . ?
C1 C2 B7 B4 37.31(16) . . . . ?
C1 C2 B7 B6 -1.9(2) . . . . ?
C1 C2 B7 B8 -103.74(19) . . . . ?
C1 C2 B7 B11 -64.6(2) . . . . ?
C1 C2 B8 B2 -37.19(17) . . . . ?
C1 C2 B8 B7 104.21(19) . . . . ?
C1 C2 B8 B10 1.4(2) . . . . ?
C1 C2 B8 B11 64.7(2) . . . . ?
C1 B2 B3 B5 36.70(15) . . . . ?
C1 B2 B3 B9 100.68(18) . . . . ?
C1 B2 B3 B10 138.90(18) . . . . ?
C1 B2 B8 C2 36.18(16) . . . . ?
C1 B2 B8 B7 2.3(2) . . . . ?
C1 B2 B8 B10 -100.0(2) . . . . ?
C1 B2 B8 B11 -61.6(2) . . . . ?
C1 B2 B10 B3 -36.19(16) . . . . ?
C1 B2 B10 B8 101.71(19) . . . . ?
C1 B2 B10 B9 1.4(2) . . . . ?
C1 B2 B10 B11 64.0(2) . . . . ?
C1 B3 B5 B4 37.05(15) . . . . ?
C1 B3 B5 B6 100.73(18) . . . . ?
C1 B3 B5 B9 138.19(18) . . . . ?
C1 B3 B9 B5 -37.08(16) . . . . ?
C1 B3 B9 B6 0.0(2) . . . . ?
C1 B3 B9 B10 101.28(19) . . . . ?
C1 B3 B9 B11 63.5(2) . . . . ?
C1 B3 B10 B2 36.75(16) . . . . ?
C1 B3 B10 B8 -0.8(2) . . . . ?
C1 B3 B10 B9 -100.71(19) . . . . ?
C1 B3 B10 B11 -63.5(2) . . . . ?
C1 B4 B5 B3 -36.66(15) . . . . ?
C1 B4 B5 B6 -137.53(18) . . . . ?
C1 B4 B5 B9 -100.00(18) . . . . ?
C1 B4 B6 B5 37.12(16) . . . . ?
C1 B4 B6 B7 -101.31(19) . . . . ?
C1 B4 B6 B9 -0.4(2) . . . . ?
C1 B4 B6 B11 -63.7(2) . . . . ?
C1 B4 B7 C2 -35.81(15) . . . . ?
C1 B4 B7 B6 99.40(18) . . . . ?
C1 B4 B7 B8 -1.2(2) . . . . ?
C1 B4 B7 B11 62.0(2) . . . . ?
C1 B5 B6 B4 -38.07(16) . . . . ?
C1 B5 B6 B7 -0.8(2) . . . . ?
C1 B5 B6 B9 100.09(19) . . . . ?
C1 B5 B6 B11 62.9(2) . . . . ?
C1 B5 B9 B3 36.94(16) . . . . ?
C1 B5 B9 B6 -101.22(19) . . . . ?
C1 B5 B9 B10 -0.2(2) . . . . ?
C1 B5 B9 B11 -64.0(2) . . . . ?
C2 C1 B1 P1 -135.12(15) . . . . ?
C2 C1 B1 C4 92.2(2) . . . . ?
C2 C1 B2 B3 -135.70(17) . . . . ?
C2 C1 B2 B8 -35.60(16) . . . . ?
C2 C1 B2 B10 -98.98(18) . . . . ?
C2 C1 B3 B2 38.50(15) . . . . ?
C2 C1 B3 B5 -100.00(17) . . . . ?
C2 C1 B3 B9 -62.4(2) . . . . ?
C2 C1 B3 B10 1.6(2) . . . . ?
C2 C1 B4 B5 135.84(17) . . . . ?
C2 C1 B4 B6 98.18(19) . . . . ?
C2 C1 B4 B7 35.12(16) . . . . ?
C2 C1 B5 B3 100.29(17) . . . . ?
C2 C1 B5 B4 -38.39(15) . . . . ?
C2 C1 B5 B6 -0.3(2) . . . . ?
C2 C1 B5 B9 63.1(2) . . . . ?
C2 B2 B3 C1 -39.26(15) . . . . ?
C2 B2 B3 B5 -2.6(2) . . . . ?
C2 B2 B3 B9 61.4(2) . . . . ?
C2 B2 B3 B10 99.64(19) . . . . ?
C2 B2 B8 B7 -33.86(17) . . . . ?
C2 B2 B8 B10 -136.2(2) . . . . ?
C2 B2 B8 B11 -97.7(2) . . . . ?
C2 B2 B10 B3 -99.68(18) . . . . ?
C2 B2 B10 B8 38.22(17) . . . . ?
C2 B2 B10 B9 -62.1(2) . . . . ?
C2 B2 B10 B11 0.5(2) . . . . ?
C2 B4 B5 C1 38.93(15) . . . . ?
C2 B4 B5 B3 2.3(2) . . . . ?
C2 B4 B5 B6 -98.60(19) . . . . ?
C2 B4 B5 B9 -61.1(2) . . . . ?
C2 B4 B6 B5 99.92(18) . . . . ?
C2 B4 B6 B7 -38.51(16) . . . . ?
C2 B4 B6 B9 62.4(2) . . . . ?
C2 B4 B6 B11 -0.9(2) . . . . ?
C2 B4 B7 B6 135.20(18) . . . . ?
C2 B4 B7 B8 34.58(17) . . . . ?
C2 B4 B7 B11 97.78(19) . . . . ?
C2 B7 B8 B2 33.76(17) . . . . ?
C2 B7 B8 B10 97.24(19) . . . . ?
C2 B7 B8 B11 135.31(19) . . . . ?
C2 B7 B11 B6 99.09(19) . . . . ?
C2 B7 B11 B8 -38.88(17) . . . . ?
C2 B7 B11 B9 61.7(2) . . . . ?
C2 B7 B11 B10 -1.6(2) . . . . ?
C2 B8 B10 B2 -37.76(17) . . . . ?
C2 B8 B10 B3 -0.3(2) . . . . ?
C2 B8 B10 B9 62.4(2) . . . . ?
C2 B8 B10 B11 99.6(2) . . . . ?
C2 B8 B11 B6 1.4(2) . . . . ?
C2 B8 B11 B7 38.60(16) . . . . ?
C2 B8 B11 B9 -61.9(2) . . . . ?
C2 B8 B11 B10 -99.40(19) . . . . ?
C3 C2 B2 C1 110.2(2) . . . . ?
C3 C2 B2 B3 148.74(19) . . . . ?
C3 C2 B2 B8 -109.8(2) . . . . ?
C3 C2 B2 B10 -148.41(19) . . . . ?
C3 C2 B4 C1 -109.5(2) . . . . ?
C3 C2 B4 B5 -147.85(19) . . . . ?
C3 C2 B4 B6 149.59(19) . . . . ?
C3 C2 B4 B7 110.4(2) . . . . ?
C3 C2 B7 B4 -110.1(2) . . . . ?
C3 C2 B7 B6 -149.3(2) . . . . ?
C3 C2 B7 B8 108.9(2) . . . . ?
C3 C2 B7 B11 148.0(2) . . . . ?
C3 C2 B8 B2 108.1(2) . . . . ?
C3 C2 B8 B7 -110.5(2) . . . . ?
C3 C2 B8 B10 146.6(2) . . . . ?
C3 C2 B8 B11 -150.1(2) . . . . ?
C4 C5 B13 B12 -37.45(16) . . . . ?
C4 C5 B13 B17 -100.32(19) . . . . ?
C4 C5 B13 B18 -139.09(18) . . . . ?
C4 C5 B14 B15 38.07(15) . . . . ?
C4 C5 B14 B19 139.86(18) . . . . ?
C4 C5 B14 B20 100.71(19) . . . . ?
C4 C5 B18 B13 38.21(17) . . . . ?
C4 C5 B18 B17 -0.8(2) . . . . ?
C4 C5 B18 B19 -103.80(19) . . . . ?
C4 C5 B18 B21 -64.3(2) . . . . ?
C4 C5 B19 B14 -37.11(17) . . . . ?
C4 C5 B19 B18 103.93(19) . . . . ?
C4 C5 B19 B20 2.0(2) . . . . ?
C4 C5 B19 B21 64.9(2) . . . . ?
C4 B12 B13 C5 38.74(16) . . . . ?
C4 B12 B13 B17 138.11(19) . . . . ?
C4 B12 B13 B18 101.01(19) . . . . ?
C4 B12 B15 B14 -36.97(16) . . . . ?
C4 B12 B15 B16 -137.89(19) . . . . ?
C4 B12 B15 B20 -100.00(19) . . . . ?
C4 B12 B16 B15 36.76(17) . . . . ?
C4 B12 B16 B17 -102.0(2) . . . . ?
C4 B12 B16 B20 -0.8(3) . . . . ?
C4 B12 B16 B21 -64.6(2) . . . . ?
C4 B12 B17 B13 -37.81(17) . . . . ?
C4 B12 B17 B16 99.1(2) . . . . ?
C4 B12 B17 B18 -0.7(3) . . . . ?
C4 B12 B17 B21 62.2(2) . . . . ?
C4 B13 B17 B12 36.22(16) . . . . ?
C4 B13 B17 B16 -2.0(2) . . . . ?
C4 B13 B17 B18 -102.18(19) . . . . ?
C4 B13 B17 B21 -64.5(2) . . . . ?
C4 B13 B18 C5 -37.10(17) . . . . ?
C4 B13 B18 B17 98.7(2) . . . . ?
C4 B13 B18 B19 -3.8(3) . . . . ?
C4 B13 B18 B21 60.1(2) . . . . ?
C4 B14 B15 B12 36.56(16) . . . . ?
C4 B14 B15 B16 99.88(19) . . . . ?
C4 B14 B15 B20 138.20(18) . . . . ?
C4 B14 B19 C5 36.64(17) . . . . ?
C4 B14 B19 B18 2.2(3) . . . . ?
C4 B14 B19 B20 -98.8(2) . . . . ?
C4 B14 B19 B21 -60.7(2) . . . . ?
C4 B14 B20 B15 -36.28(16) . . . . ?
C4 B14 B20 B16 1.8(2) . . . . ?
C4 B14 B20 B19 102.49(19) . . . . ?
C4 B14 B20 B21 64.6(2) . . . . ?
C4 B15 B16 B12 -36.87(17) . . . . ?
C4 B15 B16 B17 0.0(2) . . . . ?
C4 B15 B16 B20 100.9(2) . . . . ?
C4 B15 B16 B21 63.9(2) . . . . ?
C4 B15 B20 B14 37.16(16) . . . . ?
C4 B15 B20 B16 -100.0(2) . . . . ?
C4 B15 B20 B19 0.2(2) . . . . ?
C4 B15 B20 B21 -63.4(2) . . . . ?
C5 C4 B1 P1 114.68(17) . . . . ?
C5 C4 B1 C1 -113.3(2) . . . . ?
C5 C4 B12 B13 -37.35(16) . . . . ?
C5 C4 B12 B15 100.95(17) . . . . ?
C5 C4 B12 B16 63.7(2) . . . . ?
C5 C4 B12 B17 0.2(2) . . . . ?
C5 C4 B13 B12 136.51(18) . . . . ?
C5 C4 B13 B17 99.35(19) . . . . ?
C5 C4 B13 B18 36.42(17) . . . . ?
C5 C4 B14 B15 -135.95(18) . . . . ?
C5 C4 B14 B19 -35.60(17) . . . . ?
C5 C4 B14 B20 -98.92(19) . . . . ?
C5 C4 B15 B12 -100.02(18) . . . . ?
C5 C4 B15 B14 38.19(15) . . . . ?
C5 C4 B15 B16 -62.5(2) . . . . ?
C5 C4 B15 B20 1.0(2) . . . . ?
C5 B13 B17 B12 99.86(19) . . . . ?
C5 B13 B17 B16 61.7(2) . . . . ?
C5 B13 B17 B18 -38.53(17) . . . . ?
C5 B13 B17 B21 -0.9(2) . . . . ?
C5 B13 B18 B17 135.81(19) . . . . ?
C5 B13 B18 B19 33.30(18) . . . . ?
C5 B13 B18 B21 97.2(2) . . . . ?
C5 B14 B15 C4 -39.44(16) . . . . ?
C5 B14 B15 B12 -2.9(2) . . . . ?
C5 B14 B15 B16 60.4(2) . . . . ?
C5 B14 B15 B20 98.76(19) . . . . ?
C5 B14 B19 B18 -34.43(18) . . . . ?
C5 B14 B19 B20 -135.41(19) . . . . ?
C5 B14 B19 B21 -97.3(2) . . . . ?
C5 B14 B20 B15 -100.26(19) . . . . ?
C5 B14 B20 B16 -62.2(2) . . . . ?
C5 B14 B20 B19 38.52(17) . . . . ?
C5 B14 B20 B21 0.6(2) . . . . ?
C5 B18 B19 B14 34.21(17) . . . . ?
C5 B18 B19 B20 97.50(19) . . . . ?
C5 B18 B19 B21 135.19(19) . . . . ?
C5 B18 B21 B16 61.9(2) . . . . ?
C5 B18 B21 B17 99.52(19) . . . . ?
C5 B18 B21 B19 -38.56(17) . . . . ?
C5 B18 B21 B20 -1.4(2) . . . . ?
C5 B19 B20 B14 -38.38(17) . . . . ?
C5 B19 B20 B15 -1.3(2) . . . . ?
C5 B19 B20 B16 62.0(2) . . . . ?
C5 B19 B20 B21 99.2(2) . . . . ?
C5 B19 B21 B16 -61.8(2) . . . . ?
C5 B19 B21 B17 1.6(2) . . . . ?
C5 B19 B21 B18 38.81(17) . . . . ?
C5 B19 B21 B20 -99.21(19) . . . . ?
C6 C5 B13 C4 -110.2(2) . . . . ?
C6 C5 B13 B12 -147.7(2) . . . . ?
C6 C5 B13 B17 149.4(2) . . . . ?
C6 C5 B13 B18 110.7(2) . . . . ?
C6 C5 B14 C4 109.4(2) . . . . ?
C6 C5 B14 B15 147.5(2) . . . . ?
C6 C5 B14 B19 -110.8(2) . . . . ?
C6 C5 B14 B20 -149.9(2) . . . . ?
C6 C5 B18 B13 -107.6(2) . . . . ?
C6 C5 B18 B17 -146.6(2) . . . . ?
C6 C5 B18 B19 110.4(2) . . . . ?
C6 C5 B18 B21 150.0(2) . . . . ?
C6 C5 B19 B14 109.1(2) . . . . ?
C6 C5 B19 B18 -109.8(2) . . . . ?
C6 C5 B19 B20 148.2(2) . . . . ?
C6 C5 B19 B21 -148.9(2) . . . . ?
C7 P1 C13 C14 58.30(19) . . . . ?
C7 P1 C13 C18 -118.38(19) . . . . ?
C7 P1 C19 C20 -126.50(19) . . . . ?
C7 P1 C19 C24 56.1(2) . . . . ?
C7 C8 C9 C10 0.4(3) . . . . ?
C8 C7 C12 C11 2.9(3) . . . . ?
C8 C9 C10 F1 -178.2(2) . . . . ?
C8 C9 C10 C11 1.9(4) . . . . ?
C9 C10 C11 C12 -1.7(4) . . . . ?
C10 C11 C12 C7 -0.8(4) . . . . ?
C12 C7 C8 C9 -2.7(3) . . . . ?
C13 P1 C7 C8 -174.74(17) . . . . ?
C13 P1 C7 C12 1.9(2) . . . . ?
C13 P1 C19 C20 -18.0(2) . . . . ?
C13 P1 C19 C24 164.62(18) . . . . ?
C13 C14 C15 C16 1.0(3) . . . . ?
C14 C13 C18 C17 -1.6(3) . . . . ?
C14 C15 C16 F3 178.8(2) . . . . ?
C14 C15 C16 C17 -1.5(4) . . . . ?
C15 C16 C17 C18 0.4(4) . . . . ?
C16 C17 C18 C13 1.2(4) . . . . ?
C18 C13 C14 C15 0.4(3) . . . . ?
C19 P1 C7 C8 -66.04(19) . . . . ?
C19 P1 C7 C12 110.56(18) . . . . ?
C19 P1 C13 C14 -48.23(19) . . . . ?
C19 P1 C13 C18 135.08(18) . . . . ?
C19 C20 C21 C22 1.8(4) . . . . ?
C20 C19 C24 C23 0.9(3) . . . . ?
C20 C21 C22 F2 179.7(2) . . . . ?
C20 C21 C22 C23 -0.7(4) . . . . ?
C21 C22 C23 C24 -0.3(4) . . . . ?
C22 C23 C24 C19 0.2(4) . . . . ?
C24 C19 C20 C21 -2.0(3) . . . . ?
B1 P1 C7 C8 51.6(2) . . . . ?
B1 P1 C7 C12 -131.82(18) . . . . ?
B1 P1 C13 C14 -173.40(16) . . . . ?
B1 P1 C13 C18 9.9(2) . . . . ?
B1 P1 C19 C20 114.16(19) . . . . ?
B1 P1 C19 C24 -63.2(2) . . . . ?
B1 C1 C2 C3 -6.6(3) . . . . ?
B1 C1 C2 B2 100.4(2) . . . . ?
B1 C1 C2 B4 -116.2(2) . . . . ?
B1 C1 C2 B7 -154.10(18) . . . . ?
B1 C1 C2 B8 138.31(19) . . . . ?
B1 C1 B2 C2 -111.55(18) . . . . ?
B1 C1 B2 B3 112.76(18) . . . . ?
B1 C1 B2 B8 -147.14(18) . . . . ?
B1 C1 B2 B10 149.47(17) . . . . ?
B1 C1 B3 B2 -101.4(2) . . . . ?
B1 C1 B3 B5 120.1(2) . . . . ?
B1 C1 B3 B9 157.69(18) . . . . ?
B1 C1 B3 B10 -138.35(19) . . . . ?
B1 C1 B4 C2 105.8(2) . . . . ?
B1 C1 B4 B5 -118.3(2) . . . . ?
B1 C1 B4 B6 -156.00(19) . . . . ?
B1 C1 B4 B7 140.95(19) . . . . ?
B1 C1 B5 B3 -107.1(2) . . . . ?
B1 C1 B5 B4 114.3(2) . . . . ?
B1 C1 B5 B6 152.32(19) . . . . ?
B1 C1 B5 B9 -144.23(19) . . . . ?
B1 C4 C5 C6 -2.7(3) . . . . ?
B1 C4 C5 B13 -109.9(2) . . . . ?
B1 C4 C5 B14 105.6(2) . . . . ?
B1 C4 C5 B18 -148.52(19) . . . . ?
B1 C4 C5 B19 143.68(19) . . . . ?
B1 C4 B12 B13 110.2(2) . . . . ?
B1 C4 B12 B15 -111.5(2) . . . . ?
B1 C4 B12 B16 -148.74(19) . . . . ?
B1 C4 B12 B17 147.8(2) . . . . ?
B1 C4 B13 C5 108.9(2) . . . . ?
B1 C4 B13 B12 -114.6(2) . . . . ?
B1 C4 B13 B17 -151.77(18) . . . . ?
B1 C4 B13 B18 145.30(19) . . . . ?
B1 C4 B14 C5 -110.71(19) . . . . ?
B1 C4 B14 B15 113.3(2) . . . . ?
B1 C4 B14 B19 -146.30(19) . . . . ?
B1 C4 B14 B20 150.38(18) . . . . ?
B1 C4 B15 B12 114.9(2) . . . . ?
B1 C4 B15 B14 -106.9(2) . . . . ?
B1 C4 B15 B16 152.38(19) . . . . ?
B1 C4 B15 B20 -144.10(19) . . . . ?
B2 C1 C2 C3 -107.0(2) . . . . ?
B2 C1 C2 B4 143.42(18) . . . . ?
B2 C1 C2 B7 105.48(19) . . . . ?
B2 C1 C2 B8 37.88(17) . . . . ?
B2 C1 B1 P1 -69.30(19) . . . . ?
B2 C1 B1 C4 158.06(17) . . . . ?
B2 C1 B3 B5 -138.50(17) . . . . ?
B2 C1 B3 B9 -100.87(19) . . . . ?
B2 C1 B3 B10 -36.91(17) . . . . ?
B2 C1 B4 C2 -32.44(16) . . . . ?
B2 C1 B4 B5 103.40(18) . . . . ?
B2 C1 B4 B6 65.7(2) . . . . ?
B2 C1 B4 B7 2.7(2) . . . . ?
B2 C1 B5 B3 38.29(16) . . . . ?
B2 C1 B5 B4 -100.40(18) . . . . ?
B2 C1 B5 B6 -62.3(2) . . . . ?
B2 C1 B5 B9 1.1(2) . . . . ?
B2 C2 B4 C1 34.24(16) . . . . ?
B2 C2 B4 B5 -4.1(2) . . . . ?
B2 C2 B4 B6 -66.6(2) . . . . ?
B2 C2 B4 B7 -105.82(19) . . . . ?
B2 C2 B7 B4 103.93(19) . . . . ?
B2 C2 B7 B6 64.7(2) . . . . ?
B2 C2 B7 B8 -37.12(18) . . . . ?
B2 C2 B7 B11 2.0(2) . . . . ?
B2 C2 B8 B7 141.40(19) . . . . ?
B2 C2 B8 B10 38.56(17) . . . . ?
B2 C2 B8 B11 101.9(2) . . . . ?
B2 B3 B5 C1 -36.88(15) . . . . ?
B2 B3 B5 B4 0.2(2) . . . . ?
B2 B3 B5 B6 63.9(2) . . . . ?
B2 B3 B5 B9 101.30(19) . . . . ?
B2 B3 B9 B5 -100.28(19) . . . . ?
B2 B3 B9 B6 -63.2(2) . . . . ?
B2 B3 B9 B10 38.08(17) . . . . ?
B2 B3 B9 B11 0.3(2) . . . . ?
B2 B3 B10 B8 -37.54(18) . . . . ?
B2 B3 B10 B9 -137.46(19) . . . . ?
B2 B3 B10 B11 -100.3(2) . . . . ?
B2 B8 B10 B3 37.43(17) . . . . ?
B2 B8 B10 B9 100.13(19) . . . . ?
B2 B8 B10 B11 137.36(19) . . . . ?
B2 B8 B11 B6 62.6(2) . . . . ?
B2 B8 B11 B7 99.84(19) . . . . ?
B2 B8 B11 B9 -0.6(2) . . . . ?
B2 B8 B11 B10 -38.15(17) . . . . ?
B2 B10 B11 B6 -62.2(2) . . . . ?
B2 B10 B11 B7 0.6(3) . . . . ?
B2 B10 B11 B8 37.89(18) . . . . ?
B2 B10 B11 B9 -100.0(2) . . . . ?
B3 C1 C2 C3 -146.8(2) . . . . ?
B3 C1 C2 B2 -39.76(16) . . . . ?
B3 C1 C2 B4 103.66(17) . . . . ?
B3 C1 C2 B7 65.7(2) . . . . ?
B3 C1 C2 B8 -1.9(2) . . . . ?
B3 C1 B1 P1 -0.2(2) . . . . ?
B3 C1 B1 C4 -132.85(19) . . . . ?
B3 C1 B2 C2 135.70(17) . . . . ?
B3 C1 B2 B8 100.10(19) . . . . ?
B3 C1 B2 B10 36.72(16) . . . . ?
B3 C1 B4 C2 -97.80(17) . . . . ?
B3 C1 B4 B5 38.04(17) . . . . ?
B3 C1 B4 B6 0.4(2) . . . . ?
B3 C1 B4 B7 -62.7(2) . . . . ?
B3 C1 B5 B4 -138.69(18) . . . . ?
B3 C1 B5 B6 -100.62(19) . . . . ?
B3 C1 B5 B9 -37.17(16) . . . . ?
B3 B2 B8 C2 98.53(19) . . . . ?
B3 B2 B8 B7 64.7(2) . . . . ?
B3 B2 B8 B10 -37.64(18) . . . . ?
B3 B2 B8 B11 0.8(2) . . . . ?
B3 B2 B10 B8 137.90(19) . . . . ?
B3 B2 B10 B9 37.55(17) . . . . ?
B3 B2 B10 B11 100.2(2) . . . . ?
B3 B5 B6 B4 -100.82(19) . . . . ?
B3 B5 B6 B7 -63.6(2) . . . . ?
B3 B5 B6 B9 37.34(17) . . . . ?
B3 B5 B6 B11 0.2(2) . . . . ?
B3 B5 B9 B6 -138.16(19) . . . . ?
B3 B5 B9 B10 -37.18(17) . . . . ?
B3 B5 B9 B11 -101.0(2) . . . . ?
B3 B9 B10 B2 -37.65(16) . . . . ?
B3 B9 B10 B8 -100.75(19) . . . . ?
B3 B9 B10 B11 -137.95(19) . . . . ?
B3 B9 B11 B6 -99.9(2) . . . . ?
B3 B9 B11 B7 -62.7(2) . . . . ?
B3 B9 B11 B8 0.2(2) . . . . ?
B3 B9 B11 B10 37.65(17) . . . . ?
B3 B10 B11 B6 0.6(2) . . . . ?
B3 B10 B11 B7 63.5(2) . . . . ?
B3 B10 B11 B8 100.7(2) . . . . ?
B3 B10 B11 B9 -37.17(17) . . . . ?
B4 C1 C2 C3 109.5(2) . . . . ?
B4 C1 C2 B2 -143.42(18) . . . . ?
B4 C1 C2 B7 -37.94(17) . . . . ?
B4 C1 C2 B8 -105.54(19) . . . . ?
B4 C1 B1 P1 154.01(16) . . . . ?
B4 C1 B1 C4 21.4(3) . . . . ?
B4 C1 B2 C2 32.48(16) . . . . ?
B4 C1 B2 B3 -103.22(17) . . . . ?
B4 C1 B2 B8 -3.1(2) . . . . ?
B4 C1 B2 B10 -66.5(2) . . . . ?
B4 C1 B3 B2 100.63(18) . . . . ?
B4 C1 B3 B5 -37.87(17) . . . . ?
B4 C1 B3 B9 -0.2(2) . . . . ?
B4 C1 B3 B10 63.7(2) . . . . ?
B4 C1 B5 B3 138.69(18) . . . . ?
B4 C1 B5 B6 38.06(17) . . . . ?
B4 C1 B5 B9 101.52(19) . . . . ?
B4 C2 B2 C1 -34.33(16) . . . . ?
B4 C2 B2 B3 4.2(2) . . . . ?
B4 C2 B2 B8 105.7(2) . . . . ?
B4 C2 B2 B10 67.0(2) . . . . ?
B4 C2 B7 B6 -39.26(17) . . . . ?
B4 C2 B7 B8 -141.05(18) . . . . ?
B4 C2 B7 B11 -101.9(2) . . . . ?
B4 C2 B8 B2 -103.95(19) . . . . ?
B4 C2 B8 B7 37.45(18) . . . . ?
B4 C2 B8 B10 -65.4(2) . . . . ?
B4 C2 B8 B11 -2.1(2) . . . . ?
B4 B5 B6 B7 37.24(17) . . . . ?
B4 B5 B6 B9 138.16(19) . . . . ?
B4 B5 B6 B11 101.0(2) . . . . ?
B4 B5 B9 B3 100.58(19) . . . . ?
B4 B5 B9 B6 -37.58(17) . . . . ?
B4 B5 B9 B10 63.4(2) . . . . ?
B4 B5 B9 B11 -0.4(2) . . . . ?
B4 B6 B7 C2 38.72(16) . . . . ?
B4 B6 B7 B8 100.77(19) . . . . ?
B4 B6 B7 B11 138.20(18) . . . . ?
B4 B6 B9 B3 0.2(3) . . . . ?
B4 B6 B9 B5 37.27(17) . . . . ?
B4 B6 B9 B10 -63.1(2) . . . . ?
B4 B6 B9 B11 -101.2(2) . . . . ?
B4 B6 B11 B7 -37.52(17) . . . . ?
B4 B6 B11 B8 -0.3(2) . . . . ?
B4 B6 B11 B9 100.55(19) . . . . ?
B4 B6 B11 B10 62.7(2) . . . . ?
B4 B7 B8 C2 -34.42(16) . . . . ?
B4 B7 B8 B2 -0.7(2) . . . . ?
B4 B7 B8 B10 62.8(2) . . . . ?
B4 B7 B8 B11 100.9(2) . . . . ?
B4 B7 B11 B6 37.36(17) . . . . ?
B4 B7 B11 B8 -100.60(19) . . . . ?
B4 B7 B11 B9 0.0(2) . . . . ?
B4 B7 B11 B10 -63.3(2) . . . . ?
B5 C1 C2 C3 148.9(2) . . . . ?
B5 C1 C2 B2 -104.02(18) . . . . ?
B5 C1 C2 B4 39.40(16) . . . . ?
B5 C1 C2 B7 1.5(2) . . . . ?
B5 C1 C2 B8 -66.1(2) . . . . ?
B5 C1 B1 P1 75.3(2) . . . . ?
B5 C1 B1 C4 -57.4(3) . . . . ?
B5 C1 B2 C2 97.42(17) . . . . ?
B5 C1 B2 B3 -38.28(16) . . . . ?
B5 C1 B2 B8 61.8(2) . . . . ?
B5 C1 B2 B10 -1.6(2) . . . . ?
B5 C1 B3 B2 138.50(17) . . . . ?
B5 C1 B3 B9 37.63(17) . . . . ?
B5 C1 B3 B10 101.59(19) . . . . ?
B5 C1 B4 C2 -135.84(17) . . . . ?
B5 C1 B4 B6 -37.66(17) . . . . ?
B5 C1 B4 B7 -100.72(19) . . . . ?
B5 B3 B9 B6 37.08(18) . . . . ?
B5 B3 B9 B10 138.36(19) . . . . ?
B5 B3 B9 B11 100.6(2) . . . . ?
B5 B3 B10 B2 99.73(19) . . . . ?
B5 B3 B10 B8 62.2(2) . . . . ?
B5 B3 B10 B9 -37.73(17) . . . . ?
B5 B3 B10 B11 -0.5(2) . . . . ?
B5 B4 B6 B7 -138.43(19) . . . . ?
B5 B4 B6 B9 -37.50(18) . . . . ?
B5 B4 B6 B11 -100.85(19) . . . . ?
B5 B4 B7 C2 -98.00(18) . . . . ?
B5 B4 B7 B6 37.21(17) . . . . ?
B5 B4 B7 B8 -63.4(2) . . . . ?
B5 B4 B7 B11 -0.2(2) . . . . ?
B5 B6 B7 C2 1.7(2) . . . . ?
B5 B6 B7 B4 -37.05(17) . . . . ?
B5 B6 B7 B8 63.7(2) . . . . ?
B5 B6 B7 B11 101.15(19) . . . . ?
B5 B6 B9 B3 -37.03(17) . . . . ?
B5 B6 B9 B10 -100.37(19) . . . . ?
B5 B6 B9 B11 -138.47(19) . . . . ?
B5 B6 B11 B7 -100.77(19) . . . . ?
B5 B6 B11 B8 -63.5(2) . . . . ?
B5 B6 B11 B9 37.30(17) . . . . ?
B5 B6 B11 B10 -0.5(2) . . . . ?
B5 B9 B10 B2 -0.7(2) . . . . ?
B5 B9 B10 B3 36.96(16) . . . . ?
B5 B9 B10 B8 -63.8(2) . . . . ?
B5 B9 B10 B11 -100.99(19) . . . . ?
B5 B9 B11 B6 -36.96(17) . . . . ?
B5 B9 B11 B7 0.3(2) . . . . ?
B5 B9 B11 B8 63.2(2) . . . . ?
B5 B9 B11 B10 100.61(19) . . . . ?
B6 B4 B5 C1 137.53(18) . . . . ?
B6 B4 B5 B3 100.87(19) . . . . ?
B6 B4 B5 B9 37.53(17) . . . . ?
B6 B4 B7 C2 -135.20(18) . . . . ?
B6 B4 B7 B8 -100.6(2) . . . . ?
B6 B4 B7 B11 -37.43(18) . . . . ?
B6 B5 B9 B3 138.16(19) . . . . ?
B6 B5 B9 B10 101.0(2) . . . . ?
B6 B5 B9 B11 37.18(18) . . . . ?
B6 B7 B8 C2 -97.74(19) . . . . ?
B6 B7 B8 B2 -64.0(2) . . . . ?
B6 B7 B8 B10 -0.5(2) . . . . ?
B6 B7 B8 B11 37.57(17) . . . . ?
B6 B7 B11 B8 -137.96(18) . . . . ?
B6 B7 B11 B9 -37.39(18) . . . . ?
B6 B7 B11 B10 -100.7(2) . . . . ?
B6 B9 B10 B2 62.3(2) . . . . ?
B6 B9 B10 B3 99.97(19) . . . . ?
B6 B9 B10 B8 -0.8(2) . . . . ?
B6 B9 B10 B11 -37.99(17) . . . . ?
B6 B9 B11 B7 37.22(17) . . . . ?
B6 B9 B11 B8 100.1(2) . . . . ?
B6 B9 B11 B10 137.57(19) . . . . ?
B7 C2 B2 C1 -103.01(19) . . . . ?
B7 C2 B2 B3 -64.5(2) . . . . ?
B7 C2 B2 B8 36.98(19) . . . . ?
B7 C2 B2 B10 -1.6(2) . . . . ?
B7 C2 B4 C1 140.06(17) . . . . ?
B7 C2 B4 B5 101.74(18) . . . . ?
B7 C2 B4 B6 39.17(16) . . . . ?
B7 C2 B8 B2 -141.40(19) . . . . ?
B7 C2 B8 B10 -102.8(2) . . . . ?
B7 C2 B8 B11 -39.53(17) . . . . ?
B7 B4 B5 C1 100.38(19) . . . . ?
B7 B4 B5 B3 63.7(2) . . . . ?
B7 B4 B5 B6 -37.15(17) . . . . ?
B7 B4 B5 B9 0.4(2) . . . . ?
B7 B4 B6 B5 138.43(19) . . . . ?
B7 B4 B6 B9 100.9(2) . . . . ?
B7 B4 B6 B11 37.58(17) . . . . ?
B7 B6 B9 B3 63.8(2) . . . . ?
B7 B6 B9 B5 100.86(19) . . . . ?
B7 B6 B9 B10 0.5(2) . . . . ?
B7 B6 B9 B11 -37.62(17) . . . . ?
B7 B6 B11 B8 37.24(17) . . . . ?
B7 B6 B11 B9 138.07(19) . . . . ?
B7 B6 B11 B10 100.2(2) . . . . ?
B7 B8 B10 B2 -99.34(19) . . . . ?
B7 B8 B10 B3 -61.9(2) . . . . ?
B7 B8 B10 B9 0.8(2) . . . . ?
B7 B8 B10 B11 38.02(18) . . . . ?
B7 B8 B11 B6 -37.23(17) . . . . ?
B7 B8 B11 B9 -100.5(2) . . . . ?
B7 B8 B11 B10 -137.99(19) . . . . ?
B8 C2 B2 C1 -139.98(18) . . . . ?
B8 C2 B2 B3 -101.47(19) . . . . ?
B8 C2 B2 B10 -38.61(18) . . . . ?
B8 C2 B4 C1 102.79(18) . . . . ?
B8 C2 B4 B5 64.5(2) . . . . ?
B8 C2 B4 B6 1.9(2) . . . . ?
B8 C2 B4 B7 -37.27(18) . . . . ?
B8 C2 B7 B4 141.05(18) . . . . ?
B8 C2 B7 B6 101.8(2) . . . . ?
B8 C2 B7 B11 39.15(18) . . . . ?
B8 B2 B3 C1 -101.34(18) . . . . ?
B8 B2 B3 B5 -64.6(2) . . . . ?
B8 B2 B3 B9 -0.7(2) . . . . ?
B8 B2 B3 B10 37.56(17) . . . . ?
B8 B2 B10 B3 -137.90(19) . . . . ?
B8 B2 B10 B9 -100.3(2) . . . . ?
B8 B2 B10 B11 -37.68(18) . . . . ?
B8 B7 B11 B6 137.96(18) . . . . ?
B8 B7 B11 B9 100.6(2) . . . . ?
B8 B7 B11 B10 37.31(18) . . . . ?
B8 B10 B11 B6 -100.1(2) . . . . ?
B8 B10 B11 B7 -37.25(18) . . . . ?
B8 B10 B11 B9 -137.92(19) . . . . ?
B9 B3 B5 C1 -138.19(18) . . . . ?
B9 B3 B5 B4 -101.13(19) . . . . ?
B9 B3 B5 B6 -37.45(17) . . . . ?
B9 B3 B10 B2 137.46(19) . . . . ?
B9 B3 B10 B8 99.9(2) . . . . ?
B9 B3 B10 B11 37.20(17) . . . . ?
B9 B5 B6 B4 -138.16(19) . . . . ?
B9 B5 B6 B7 -100.9(2) . . . . ?
B9 B5 B6 B11 -37.14(18) . . . . ?
B9 B6 B7 C2 -62.0(2) . . . . ?
B9 B6 B7 B4 -100.76(19) . . . . ?
B9 B6 B7 B8 0.0(2) . . . . ?
B9 B6 B7 B11 37.44(17) . . . . ?
B9 B6 B11 B7 -138.07(19) . . . . ?
B9 B6 B11 B8 -100.83(19) . . . . ?
B9 B6 B11 B10 -37.83(18) . . . . ?
B9 B10 B11 B6 37.82(18) . . . . ?
B9 B10 B11 B7 100.7(2) . . . . ?
B9 B10 B11 B8 137.92(19) . . . . ?
B10 B2 B3 C1 -138.90(18) . . . . ?
B10 B2 B3 B5 -102.20(19) . . . . ?
B10 B2 B3 B9 -38.22(17) . . . . ?
B10 B2 B8 C2 136.17(19) . . . . ?
B10 B2 B8 B7 102.3(2) . . . . ?
B10 B2 B8 B11 38.43(18) . . . . ?
B10 B3 B5 C1 -100.53(19) . . . . ?
B10 B3 B5 B4 -63.5(2) . . . . ?
B10 B3 B5 B6 0.2(2) . . . . ?
B10 B3 B5 B9 37.66(18) . . . . ?
B10 B3 B9 B5 -138.36(19) . . . . ?
B10 B3 B9 B6 -101.3(2) . . . . ?
B10 B3 B9 B11 -37.81(18) . . . . ?
B10 B8 B11 B6 100.8(2) . . . . ?
B10 B8 B11 B7 137.99(19) . . . . ?
B10 B8 B11 B9 37.54(18) . . . . ?
B10 B9 B11 B6 -137.57(19) . . . . ?
B10 B9 B11 B7 -100.4(2) . . . . ?
B10 B9 B11 B8 -37.43(18) . . . . ?
B11 B6 B7 C2 -99.48(19) . . . . ?
B11 B6 B7 B4 -138.20(18) . . . . ?
B11 B6 B7 B8 -37.43(17) . . . . ?
B11 B6 B9 B3 101.4(2) . . . . ?
B11 B6 B9 B5 138.47(19) . . . . ?
B11 B6 B9 B10 38.10(18) . . . . ?
B11 B7 B8 C2 -135.31(19) . . . . ?
B11 B7 B8 B2 -101.5(2) . . . . ?
B11 B7 B8 B10 -38.07(18) . . . . ?
B11 B8 B10 B2 -137.36(19) . . . . ?
B11 B8 B10 B3 -99.9(2) . . . . ?
B11 B8 B10 B9 -37.22(18) . . . . ?
B11 B9 B10 B2 100.30(19) . . . . ?
B11 B9 B10 B3 137.95(19) . . . . ?
B11 B9 B10 B8 37.20(17) . . . . ?
B12 C4 C5 C6 146.2(2) . . . . ?
B12 C4 C5 B13 39.03(17) . . . . ?
B12 C4 C5 B14 -105.46(19) . . . . ?
B12 C4 C5 B18 0.4(2) . . . . ?
B12 C4 C5 B19 -67.4(2) . . . . ?
B12 C4 B1 P1 -28.5(2) . . . . ?
B12 C4 B1 C1 103.5(2) . . . . ?
B12 C4 B13 C5 -136.51(18) . . . . ?
B12 C4 B13 B17 -37.16(17) . . . . ?
B12 C4 B13 B18 -100.1(2) . . . . ?
B12 C4 B14 C5 96.54(18) . . . . ?
B12 C4 B14 B15 -39.41(17) . . . . ?
B12 C4 B14 B19 60.9(2) . . . . ?
B12 C4 B14 B20 -2.4(2) . . . . ?
B12 C4 B15 B14 138.21(18) . . . . ?
B12 C4 B15 B16 37.49(18) . . . . ?
B12 C4 B15 B20 101.0(2) . . . . ?
B12 B13 B17 B16 -38.19(18) . . . . ?
B12 B13 B17 B18 -138.4(2) . . . . ?
B12 B13 B17 B21 -100.7(2) . . . . ?
B12 B13 B18 C5 -98.53(19) . . . . ?
B12 B13 B18 B17 37.28(18) . . . . ?
B12 B13 B18 B19 -65.2(2) . . . . ?
B12 B13 B18 B21 -1.3(2) . . . . ?
B12 B15 B16 B17 36.84(18) . . . . ?
B12 B15 B16 B20 137.8(2) . . . . ?
B12 B15 B16 B21 100.8(2) . . . . ?
B12 B15 B20 B14 99.30(19) . . . . ?
B12 B15 B20 B16 -37.83(18) . . . . ?
B12 B15 B20 B19 62.3(2) . . . . ?
B12 B15 B20 B21 -1.3(3) . . . . ?
B12 B16 B17 B13 38.17(18) . . . . ?
B12 B16 B17 B18 101.2(2) . . . . ?
B12 B16 B17 B21 138.3(2) . . . . ?
B12 B16 B20 B14 -0.7(3) . . . . ?
B12 B16 B20 B15 37.60(18) . . . . ?
B12 B16 B20 B19 -63.9(2) . . . . ?
B12 B16 B20 B21 -101.3(2) . . . . ?
B12 B16 B21 B17 -37.26(18) . . . . ?
B12 B16 B21 B18 0.0(3) . . . . ?
B12 B16 B21 B19 63.3(2) . . . . ?
B12 B16 B21 B20 100.4(2) . . . . ?
B12 B17 B18 C5 0.9(2) . . . . ?
B12 B17 B18 B13 -37.12(18) . . . . ?
B12 B17 B18 B19 62.3(2) . . . . ?
B12 B17 B18 B21 100.2(2) . . . . ?
B12 B17 B21 B16 37.13(18) . . . . ?
B12 B17 B21 B18 -100.9(2) . . . . ?
B12 B17 B21 B19 -63.5(2) . . . . ?
B12 B17 B21 B20 -0.7(3) . . . . ?
B13 C4 C5 C6 107.1(2) . . . . ?
B13 C4 C5 B14 -144.50(19) . . . . ?
B13 C4 C5 B18 -38.66(18) . . . . ?
B13 C4 C5 B19 -106.5(2) . . . . ?
B13 C4 B1 P1 46.1(2) . . . . ?
B13 C4 B1 C1 178.15(17) . . . . ?
B13 C4 B12 B15 138.30(18) . . . . ?
B13 C4 B12 B16 101.1(2) . . . . ?
B13 C4 B12 B17 37.54(18) . . . . ?
B13 C4 B14 C5 31.03(16) . . . . ?
B13 C4 B14 B15 -104.91(18) . . . . ?
B13 C4 B14 B19 -4.6(2) . . . . ?
B13 C4 B14 B20 -67.9(2) . . . . ?
B13 C4 B15 B12 -38.74(17) . . . . ?
B13 C4 B15 B14 99.48(18) . . . . ?
B13 C4 B15 B16 -1.2(2) . . . . ?
B13 C4 B15 B20 62.3(2) . . . . ?
B13 C5 B14 C4 -33.59(17) . . . . ?
B13 C5 B14 B15 4.5(2) . . . . ?
B13 C5 B14 B19 106.3(2) . . . . ?
B13 C5 B14 B20 67.1(2) . . . . ?
B13 C5 B18 B17 -38.99(18) . . . . ?
B13 C5 B18 B19 -142.0(2) . . . . ?
B13 C5 B18 B21 -102.5(2) . . . . ?
B13 C5 B19 B14 -104.3(2) . . . . ?
B13 C5 B19 B18 36.71(19) . . . . ?
B13 C5 B19 B20 -65.3(2) . . . . ?
B13 C5 B19 B21 -2.4(3) . . . . ?
B13 B12 B15 C4 37.43(16) . . . . ?
B13 B12 B15 B14 0.5(2) . . . . ?
B13 B12 B15 B16 -100.5(2) . . . . ?
B13 B12 B15 B20 -62.6(2) . . . . ?
B13 B12 B16 B15 100.47(19) . . . . ?
B13 B12 B16 B17 -38.32(18) . . . . ?
B13 B12 B16 B20 63.0(2) . . . . ?
B13 B12 B16 B21 -0.8(2) . . . . ?
B13 B12 B17 B16 136.9(2) . . . . ?
B13 B12 B17 B18 37.14(18) . . . . ?
B13 B12 B17 B21 100.0(2) . . . . ?
B13 B17 B18 C5 37.99(17) . . . . ?
B13 B17 B18 B19 99.4(2) . . . . ?
B13 B17 B18 B21 137.36(19) . . . . ?
B13 B17 B21 B16 100.2(2) . . . . ?
B13 B17 B21 B18 -37.82(18) . . . . ?
B13 B17 B21 B19 -0.5(3) . . . . ?
B13 B17 B21 B20 62.3(2) . . . . ?
B13 B18 B19 C5 -33.23(17) . . . . ?
B13 B18 B19 B14 1.0(3) . . . . ?
B13 B18 B19 B20 64.3(2) . . . . ?
B13 B18 B19 B21 102.0(2) . . . . ?
B13 B18 B21 B16 0.8(3) . . . . ?
B13 B18 B21 B17 38.38(18) . . . . ?
B13 B18 B21 B19 -99.7(2) . . . . ?
B13 B18 B21 B20 -62.5(2) . . . . ?
B14 C4 C5 C6 -108.4(2) . . . . ?
B14 C4 C5 B13 144.50(19) . . . . ?
B14 C4 C5 B18 105.8(2) . . . . ?
B14 C4 C5 B19 38.03(18) . . . . ?
B14 C4 B1 P1 -177.56(14) . . . . ?
B14 C4 B1 C1 -45.5(3) . . . . ?
B14 C4 B12 B13 -99.09(18) . . . . ?
B14 C4 B12 B15 39.21(17) . . . . ?
B14 C4 B12 B16 2.0(2) . . . . ?
B14 C4 B12 B17 -61.5(2) . . . . ?
B14 C4 B13 C5 -31.23(17) . . . . ?
B14 C4 B13 B12 105.28(19) . . . . ?
B14 C4 B13 B17 68.1(2) . . . . ?
B14 C4 B13 B18 5.2(2) . . . . ?
B14 C4 B15 B12 -138.21(18) . . . . ?
B14 C4 B15 B16 -100.7(2) . . . . ?
B14 C4 B15 B20 -37.19(17) . . . . ?
B14 C5 B13 C4 33.26(17) . . . . ?
B14 C5 B13 B12 -4.2(2) . . . . ?
B14 C5 B13 B17 -67.1(2) . . . . ?
B14 C5 B13 B18 -105.8(2) . . . . ?
B14 C5 B18 B13 104.4(2) . . . . ?
B14 C5 B18 B17 65.4(2) . . . . ?
B14 C5 B18 B19 -37.62(19) . . . . ?
B14 C5 B18 B21 1.9(2) . . . . ?
B14 C5 B19 B18 141.0(2) . . . . ?
B14 C5 B19 B20 39.07(17) . . . . ?
B14 C5 B19 B21 102.0(2) . . . . ?
B14 B15 B16 B12 -99.75(19) . . . . ?
B14 B15 B16 B17 -62.9(2) . . . . ?
B14 B15 B16 B20 38.08(18) . . . . ?
B14 B15 B16 B21 1.0(3) . . . . ?
B14 B15 B20 B16 -137.1(2) . . . . ?
B14 B15 B20 B19 -36.99(18) . . . . ?
B14 B15 B20 B21 -100.6(2) . . . . ?
B14 B19 B20 B15 37.09(17) . . . . ?
B14 B19 B20 B16 100.4(2) . . . . ?
B14 B19 B20 B21 137.56(19) . . . . ?
B14 B19 B21 B16 -0.5(3) . . . . ?
B14 B19 B21 B17 63.0(2) . . . . ?
B14 B19 B21 B18 100.1(2) . . . . ?
B14 B19 B21 B20 -37.90(18) . . . . ?
B14 B20 B21 B16 -100.3(2) . . . . ?
B14 B20 B21 B17 -62.4(2) . . . . ?
B14 B20 B21 B18 0.5(3) . . . . ?
B14 B20 B21 B19 37.84(18) . . . . ?
B15 C4 C5 C6 -148.3(2) . . . . ?
B15 C4 C5 B13 104.56(18) . . . . ?
B15 C4 C5 B14 -39.93(17) . . . . ?
B15 C4 C5 B18 65.9(2) . . . . ?
B15 C4 C5 B19 -1.9(2) . . . . ?
B15 C4 B1 P1 -104.87(19) . . . . ?
B15 C4 B1 C1 27.2(3) . . . . ?
B15 C4 B12 B13 -138.30(18) . . . . ?
B15 C4 B12 B16 -37.24(18) . . . . ?
B15 C4 B12 B17 -100.8(2) . . . . ?
B15 C4 B13 C5 -97.32(18) . . . . ?
B15 C4 B13 B12 39.20(17) . . . . ?
B15 C4 B13 B17 2.0(2) . . . . ?
B15 C4 B13 B18 -60.9(2) . . . . ?
B15 C4 B14 C5 135.95(18) . . . . ?
B15 C4 B14 B19 100.4(2) . . . . ?
B15 C4 B14 B20 37.03(17) . . . . ?
B15 B12 B13 C4 -36.61(16) . . . . ?
B15 B12 B13 C5 2.1(2) . . . . ?
B15 B12 B13 B17 101.5(2) . . . . ?
B15 B12 B13 B18 64.4(2) . . . . ?
B15 B12 B16 B17 -138.8(2) . . . . ?
B15 B12 B16 B20 -37.52(18) . . . . ?
B15 B12 B16 B21 -101.3(2) . . . . ?
B15 B12 B17 B13 -100.06(19) . . . . ?
B15 B12 B17 B16 36.88(18) . . . . ?
B15 B12 B17 B18 -62.9(2) . . . . ?
B15 B12 B17 B21 -0.1(3) . . . . ?
B15 B14 B19 C5 98.47(19) . . . . ?
B15 B14 B19 B18 64.0(2) . . . . ?
B15 B14 B19 B20 -36.94(18) . . . . ?
B15 B14 B19 B21 1.2(2) . . . . ?
B15 B14 B20 B16 38.08(18) . . . . ?
B15 B14 B20 B19 138.77(19) . . . . ?
B15 B14 B20 B21 100.9(2) . . . . ?
B15 B16 B17 B12 -36.90(18) . . . . ?
B15 B16 B17 B13 1.3(3) . . . . ?
B15 B16 B17 B18 64.3(2) . . . . ?
B15 B16 B17 B21 101.4(2) . . . . ?
B15 B16 B20 B14 -38.25(18) . . . . ?
B15 B16 B20 B19 -101.5(2) . . . . ?
B15 B16 B20 B21 -138.9(2) . . . . ?
B15 B16 B21 B17 -100.8(2) . . . . ?
B15 B16 B21 B18 -63.5(2) . . . . ?
B15 B16 B21 B19 -0.3(3) . . . . ?
B15 B16 B21 B20 36.82(18) . . . . ?
B15 B20 B21 B16 -36.68(18) . . . . ?
B15 B20 B21 B17 1.2(3) . . . . ?
B15 B20 B21 B18 64.1(2) . . . . ?
B15 B20 B21 B19 101.4(2) . . . . ?
B16 B12 B13 C4 -99.67(19) . . . . ?
B16 B12 B13 C5 -60.9(2) . . . . ?
B16 B12 B13 B17 38.44(18) . . . . ?
B16 B12 B13 B18 1.3(2) . . . . ?
B16 B12 B15 C4 137.89(19) . . . . ?
B16 B12 B15 B14 100.9(2) . . . . ?
B16 B12 B15 B20 37.89(18) . . . . ?
B16 B12 B17 B13 -136.9(2) . . . . ?
B16 B12 B17 B18 -99.8(2) . . . . ?
B16 B12 B17 B21 -36.94(19) . . . . ?
B16 B15 B20 B14 137.1(2) . . . . ?
B16 B15 B20 B19 100.1(2) . . . . ?
B16 B15 B20 B21 36.56(19) . . . . ?
B16 B17 B18 C5 -62.3(2) . . . . ?
B16 B17 B18 B13 -100.3(2) . . . . ?
B16 B17 B18 B19 -0.8(2) . . . . ?
B16 B17 B18 B21 37.11(18) . . . . ?
B16 B17 B21 B18 -137.98(19) . . . . ?
B16 B17 B21 B19 -100.6(2) . . . . ?
B16 B17 B21 B20 -37.85(19) . . . . ?
B16 B20 B21 B17 37.91(19) . . . . ?
B16 B20 B21 B18 100.7(2) . . . . ?
B16 B20 B21 B19 138.1(2) . . . . ?
B17 B12 B13 C4 -138.11(19) . . . . ?
B17 B12 B13 C5 -99.36(19) . . . . ?
B17 B12 B13 B18 -37.09(18) . . . . ?
B17 B12 B15 C4 100.82(19) . . . . ?
B17 B12 B15 B14 63.9(2) . . . . ?
B17 B12 B15 B16 -37.07(18) . . . . ?
B17 B12 B15 B20 0.8(2) . . . . ?
B17 B12 B16 B15 138.8(2) . . . . ?
B17 B12 B16 B20 101.3(2) . . . . ?
B17 B12 B16 B21 37.47(18) . . . . ?
B17 B13 B18 C5 -135.81(19) . . . . ?
B17 B13 B18 B19 -102.5(2) . . . . ?
B17 B13 B18 B21 -38.62(18) . . . . ?
B17 B16 B20 B14 62.6(2) . . . . ?
B17 B16 B20 B15 100.8(2) . . . . ?
B17 B16 B20 B19 -0.7(2) . . . . ?
B17 B16 B20 B21 -38.06(18) . . . . ?
B17 B16 B21 B18 37.28(18) . . . . ?
B17 B16 B21 B19 100.5(2) . . . . ?
B17 B16 B21 B20 137.6(2) . . . . ?
B17 B18 B19 C5 -97.1(2) . . . . ?
B17 B18 B19 B14 -62.9(2) . . . . ?
B17 B18 B19 B20 0.4(2) . . . . ?
B17 B18 B19 B21 38.13(18) . . . . ?
B17 B18 B21 B16 -37.57(18) . . . . ?
B17 B18 B21 B19 -138.08(19) . . . . ?
B17 B18 B21 B20 -100.9(2) . . . . ?
B18 C5 B13 C4 139.09(18) . . . . ?
B18 C5 B13 B12 101.6(2) . . . . ?
B18 C5 B13 B17 38.77(18) . . . . ?
B18 C5 B14 C4 -102.33(19) . . . . ?
B18 C5 B14 B15 -64.3(2) . . . . ?
B18 C5 B14 B19 37.52(19) . . . . ?
B18 C5 B14 B20 -1.6(2) . . . . ?
B18 C5 B19 B14 -141.0(2) . . . . ?
B18 C5 B19 B20 -102.0(2) . . . . ?
B18 C5 B19 B21 -39.06(18) . . . . ?
B18 B13 B17 B12 138.4(2) . . . . ?
B18 B13 B17 B16 100.2(2) . . . . ?
B18 B13 B17 B21 37.67(18) . . . . ?
B18 B17 B21 B16 137.98(19) . . . . ?
B18 B17 B21 B19 37.33(18) . . . . ?
B18 B17 B21 B20 100.1(2) . . . . ?
B18 B19 B20 B14 -100.2(2) . . . . ?
B18 B19 B20 B15 -63.1(2) . . . . ?
B18 B19 B20 B16 0.2(2) . . . . ?
B18 B19 B20 B21 37.32(18) . . . . ?
B18 B19 B21 B16 -100.6(2) . . . . ?
B18 B19 B21 B17 -37.16(18) . . . . ?
B18 B19 B21 B20 -138.01(19) . . . . ?
B19 C5 B13 C4 102.38(19) . . . . ?
B19 C5 B13 B12 64.9(2) . . . . ?
B19 C5 B13 B17 2.1(2) . . . . ?
B19 C5 B13 B18 -36.71(19) . . . . ?
B19 C5 B14 C4 -139.86(18) . . . . ?
B19 C5 B14 B15 -101.8(2) . . . . ?
B19 C5 B14 B20 -39.14(18) . . . . ?
B19 C5 B18 B13 142.0(2) . . . . ?
B19 C5 B18 B17 103.0(2) . . . . ?
B19 C5 B18 B21 39.54(18) . . . . ?
B19 B14 B15 C4 -101.23(19) . . . . ?
B19 B14 B15 B12 -64.7(2) . . . . ?
B19 B14 B15 B16 -1.3(2) . . . . ?
B19 B14 B15 B20 36.97(18) . . . . ?
B19 B14 B20 B15 -138.77(19) . . . . ?
B19 B14 B20 B16 -100.7(2) . . . . ?
B19 B14 B20 B21 -37.87(18) . . . . ?
B19 B18 B21 B16 100.5(2) . . . . ?
B19 B18 B21 B17 138.08(19) . . . . ?
B19 B18 B21 B20 37.18(18) . . . . ?
B19 B20 B21 B16 -138.1(2) . . . . ?
B19 B20 B21 B17 -100.2(2) . . . . ?
B19 B20 B21 B18 -37.37(18) . . . . ?
B20 B14 B15 C4 -138.20(19) . . . . ?
B20 B14 B15 B12 -101.6(2) . . . . ?
B20 B14 B15 B16 -38.32(18) . . . . ?
B20 B14 B19 C5 135.41(19) . . . . ?
B20 B14 B19 B18 101.0(2) . . . . ?
B20 B14 B19 B21 38.10(19) . . . . ?
B20 B15 B16 B12 -137.8(2) . . . . ?
B20 B15 B16 B17 -101.0(2) . . . . ?
B20 B15 B16 B21 -37.06(19) . . . . ?
B20 B16 B17 B12 -100.2(2) . . . . ?
B20 B16 B17 B13 -62.1(2) . . . . ?
B20 B16 B17 B18 0.9(2) . . . . ?
B20 B16 B17 B21 38.08(18) . . . . ?
B20 B16 B21 B17 -137.6(2) . . . . ?
B20 B16 B21 B18 -100.4(2) . . . . ?
B20 B16 B21 B19 -37.13(18) . . . . ?
B20 B19 B21 B16 37.37(19) . . . . ?
B20 B19 B21 B17 100.9(2) . . . . ?
B20 B19 B21 B18 138.01(19) . . . . ?
B21 B16 B17 B12 -138.3(2) . . . . ?
B21 B16 B17 B13 -100.1(2) . . . . ?
B21 B16 B17 B18 -37.15(18) . . . . ?
B21 B16 B20 B14 100.6(2) . . . . ?
B21 B16 B20 B15 138.9(2) . . . . ?
B21 B16 B20 B19 37.39(18) . . . . ?
B21 B17 B18 C5 -99.4(2) . . . . ?
B21 B17 B18 B13 -137.36(19) . . . . ?
B21 B17 B18 B19 -37.95(18) . . . . ?
B21 B18 B19 C5 -135.19(19) . . . . ?
B21 B18 B19 B14 -101.0(2) . . . . ?
B21 B18 B19 B20 -37.70(18) . . . . ?
B21 B19 B20 B14 -137.56(19) . . . . ?
B21 B19 B20 B15 -100.5(2) . . . . ?
B21 B19 B20 B16 -37.17(18) . . . . ?
