#------------------------------------------------------------------------------
#$Date: 2020-10-04 06:26:30 +0300 (Sun, 04 Oct 2020) $
#$Revision: 257114 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/13/50/4135007.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_4135007
loop_
_publ_author_name
'Baek, Yonghyeon'
'Cheong, Kiun'
'Ko, Gi Hoon'
'Han, Gi Uk'
'Han, Sang Hoon'
'Kim, Dongwook'
'Lee, Kooyeon'
'Lee, Phil Ho'
_publ_section_title
;
 Iridium-Catalyzed Cyclative Indenylation and Dienylation through
 Sequential B(4)-C Bond Formation, Cyclization, and Elimination from
 o-Carboranes and Propargyl Alcohols.
;
_journal_issue                   22
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              9890
_journal_page_last               9895
_journal_paper_doi               10.1021/jacs.0c02121
_journal_volume                  142
_journal_year                    2020
_chemical_formula_sum            'C18 H32 B10'
_chemical_formula_weight         356.53
_space_group_crystal_system      orthorhombic
_space_group_IT_number           29
_space_group_name_Hall           'P 2c -2ac'
_space_group_name_H-M_alt        'P c a 21'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2018/3
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   20.027(3)
_cell_length_b                   12.0453(16)
_cell_length_c                   18.935(3)
_cell_measurement_reflns_used    9288
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      27.50
_cell_measurement_theta_min      2.74
_cell_volume                     4567.7(12)
_computing_cell_refinement       'Bruker APEXIII'
_computing_data_collection       'Bruker APEXIII'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    ORTEP
_computing_publication_material  CIFTAB
_computing_structure_refinement  SHELXL
_computing_structure_solution    SHELXS
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Bruker PHOTON II'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0813
_diffrn_reflns_av_unetI/netI     0.0419
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_limit_h_max       24
_diffrn_reflns_limit_h_min       -24
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            92796
_diffrn_reflns_point_group_measured_fraction_full 0.993
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.999
_diffrn_reflns_theta_min         2.736
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    0.051
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.6612
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.037
_exptl_crystal_description       block
_exptl_crystal_F_000             1520
_exptl_crystal_size_max          0.354
_exptl_crystal_size_mid          0.254
_exptl_crystal_size_min          0.214
_refine_diff_density_max         0.261
_refine_diff_density_min         -0.198
_refine_diff_density_rms         0.034
_refine_ls_abs_structure_details
;
 Flack x determined using 2509 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   -0.8(10)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.116
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     585
_refine_ls_number_reflns         8897
_refine_ls_number_restraints     935
_refine_ls_restrained_S_all      1.131
_refine_ls_R_factor_all          0.0902
_refine_ls_R_factor_gt           0.0728
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0649P)²+1.7304P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1547
_refine_ls_wR_factor_ref         0.1658
_reflns_Friedel_coverage         0.931
_reflns_Friedel_fraction_full    0.990
_reflns_Friedel_fraction_max     0.989
_reflns_number_gt                7381
_reflns_number_total             8897
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ja0c02121_si_002.cif
_cod_data_source_block           A19155O_029
_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/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas 

 Adding full bibliography for 4135005--4135007.cif.

 Adding full bibliography for 4135005--4135007.cif.
;
_cod_database_code               4135007
_shelx_shelxl_version_number     2018/3
_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_min   0.982
_shelx_estimated_absorpt_t_max   0.989
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z+1/2'
'x+1/2, -y, z'
'-x+1/2, y, z+1/2'
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
B1A B 0.5313(3) 0.2345(4) 0.4416(3) 0.0476(11) Uani 1 1 d . U . . .
B2A B 0.6200(3) 0.2398(4) 0.4331(3) 0.0482(11) Uani 1 1 d . U . . .
H2A H 0.652215 0.232637 0.479901 0.058 Uiso 1 1 calc R U . . .
B3A B 0.5760(3) 0.1264(4) 0.3981(3) 0.0563(12) Uani 1 1 d . U . . .
H3A H 0.578918 0.042984 0.421583 0.068 Uiso 1 1 calc R U . . .
B4A B 0.5014(4) 0.1783(6) 0.3603(3) 0.0707(15) Uani 1 1 d . U . . .
H4A H 0.455252 0.128784 0.358746 0.085 Uiso 1 1 calc R U . . .
B5A B 0.4996(3) 0.3234(6) 0.3736(3) 0.0681(14) Uani 1 1 d . U . . .
H5A H 0.452870 0.369815 0.381257 0.082 Uiso 1 1 calc R U . . .
C6A C 0.5735(3) 0.3523(4) 0.4148(2) 0.0544(11) Uani 1 1 d . U . . .
H6 H 0.579(2) 0.416(4) 0.447(3) 0.065 Uiso 1 1 d . U . . .
C7A C 0.6379(3) 0.3252(4) 0.3631(2) 0.0608(12) Uani 1 1 d . U . . .
B8A B 0.5696(4) 0.3793(6) 0.3264(3) 0.0717(15) Uani 1 1 d . U . . .
H8A H 0.568452 0.463423 0.303809 0.086 Uiso 1 1 calc R U . . .
B9A B 0.5244(4) 0.2692(6) 0.2897(3) 0.0837(17) Uani 1 1 d . U . . .
H9A H 0.493108 0.279582 0.242481 0.100 Uiso 1 1 calc R U . . .
B10A B 0.5700(4) 0.1468(6) 0.3051(3) 0.0749(16) Uani 1 1 d . U . . .
H10A H 0.568456 0.076633 0.267945 0.090 Uiso 1 1 calc R U . . .
B11A B 0.6447(4) 0.1837(5) 0.3507(3) 0.0657(14) Uani 1 1 d . U . . .
H11A H 0.692100 0.138787 0.343529 0.079 Uiso 1 1 calc R U . . .
B12A B 0.6114(4) 0.2730(5) 0.2843(3) 0.0744(16) Uani 1 1 d . U . . .
H12A H 0.637359 0.285797 0.233782 0.089 Uiso 1 1 calc R U . . .
C13A C 0.6978(3) 0.3956(6) 0.3705(4) 0.095(2) Uani 1 1 d . U . . .
H13A H 0.737007 0.352106 0.360915 0.142 Uiso 1 1 calc R U . . .
H13B H 0.700127 0.424276 0.417706 0.142 Uiso 1 1 calc R U . . .
H13C H 0.695392 0.456056 0.337578 0.142 Uiso 1 1 calc R U . . .
C14A C 0.49881(19) 0.2311(3) 0.5165(2) 0.0409(9) Uani 1 1 d . U . . .
C15A C 0.4439(2) 0.2864(4) 0.5373(2) 0.0496(10) Uani 1 1 d . U . . .
H15A H 0.419852 0.333124 0.507594 0.060 Uiso 1 1 calc R U . . .
C16A C 0.4250(2) 0.2656(4) 0.6134(3) 0.0504(10) Uani 1 1 d . U . . .
C17A C 0.4809(2) 0.1875(3) 0.6353(2) 0.0425(9) Uani 1 1 d . U . . .
C18A C 0.52288(18) 0.1669(3) 0.5781(2) 0.0356(8) Uani 1 1 d . U . . .
C19A C 0.57820(18) 0.0989(3) 0.5863(2) 0.0371(8) Uani 1 1 d . U . . .
H19A H 0.605799 0.085103 0.547776 0.044 Uiso 1 1 calc R U . . .
C20A C 0.5930(2) 0.0510(3) 0.6513(2) 0.0416(9) Uani 1 1 d . U . . .
C21A C 0.5502(2) 0.0731(4) 0.7071(2) 0.0525(11) Uani 1 1 d . U . . .
H21A H 0.559142 0.041781 0.751041 0.063 Uiso 1 1 calc R U . . .
C22A C 0.4947(2) 0.1404(4) 0.6994(2) 0.0534(11) Uani 1 1 d . U . . .
H22A H 0.466755 0.153610 0.737705 0.064 Uiso 1 1 calc R U . . .
C23A C 0.4239(3) 0.3717(4) 0.6572(3) 0.0744(15) Uani 1 1 d . U . . .
H23A H 0.415256 0.353688 0.705745 0.112 Uiso 1 1 calc R U . . .
H23B H 0.389488 0.420083 0.639960 0.112 Uiso 1 1 calc R U . . .
H23C H 0.466379 0.408312 0.653560 0.112 Uiso 1 1 calc R U . . .
C24A C 0.3567(2) 0.2082(5) 0.6185(3) 0.0706(15) Uani 1 1 d . U . . .
H24A H 0.348427 0.186881 0.666519 0.106 Uiso 1 1 calc R U . . .
H24B H 0.356493 0.143441 0.588944 0.106 Uiso 1 1 calc R U . . .
H24C H 0.322463 0.258520 0.603088 0.106 Uiso 1 1 calc R U . . .
C25A C 0.6555(2) -0.0209(4) 0.6614(2) 0.0496(10) Uani 1 1 d . U . . .
C26A C 0.6905(7) -0.0478(13) 0.5903(7) 0.101(4) Uani 0.553(9) 1 d . U P A 1
H26A H 0.727219 -0.097367 0.598688 0.152 Uiso 0.553(9) 1 calc R U P A 1
H26B H 0.706779 0.019580 0.569488 0.152 Uiso 0.553(9) 1 calc R U P A 1
H26C H 0.659170 -0.082378 0.558893 0.152 Uiso 0.553(9) 1 calc R U P A 1
C27A C 0.6378(6) -0.1319(10) 0.6939(9) 0.096(4) Uani 0.553(9) 1 d . U P A 1
H27A H 0.677552 -0.175430 0.699486 0.144 Uiso 0.553(9) 1 calc R U P A 1
H27B H 0.607116 -0.170320 0.663509 0.144 Uiso 0.553(9) 1 calc R U P A 1
H27C H 0.617393 -0.120222 0.739143 0.144 Uiso 0.553(9) 1 calc R U P A 1
C28A C 0.7050(5) 0.0373(11) 0.7089(8) 0.093(4) Uani 0.553(9) 1 d . U P A 1
H28A H 0.742895 -0.010066 0.716589 0.139 Uiso 0.553(9) 1 calc R U P A 1
H28B H 0.684235 0.053879 0.753340 0.139 Uiso 0.553(9) 1 calc R U P A 1
H28C H 0.719425 0.105003 0.686921 0.139 Uiso 0.553(9) 1 calc R U P A 1
C29A C 0.6489(7) -0.1246(12) 0.6159(10) 0.085(4) Uani 0.447(9) 1 d . U P A 2
H29A H 0.687107 -0.171412 0.622946 0.128 Uiso 0.447(9) 1 calc R U P A 2
H29B H 0.646145 -0.103648 0.567095 0.128 Uiso 0.447(9) 1 calc R U P A 2
H29C H 0.609158 -0.164253 0.629044 0.128 Uiso 0.447(9) 1 calc R U P A 2
C30A C 0.6634(8) -0.0604(17) 0.7377(8) 0.099(5) Uani 0.447(9) 1 d . U P A 2
H30A H 0.700319 -0.111029 0.740732 0.149 Uiso 0.447(9) 1 calc R U P A 2
H30B H 0.623288 -0.097232 0.752565 0.149 Uiso 0.447(9) 1 calc R U P A 2
H30C H 0.671606 0.002325 0.767801 0.149 Uiso 0.447(9) 1 calc R U P A 2
C31A C 0.7148(6) 0.0445(12) 0.6357(12) 0.095(4) Uani 0.447(9) 1 d . U P A 2
H31A H 0.754434 0.000400 0.640267 0.142 Uiso 0.447(9) 1 calc R U P A 2
H31B H 0.719271 0.110885 0.663326 0.142 Uiso 0.447(9) 1 calc R U P A 2
H31C H 0.708330 0.063987 0.586970 0.142 Uiso 0.447(9) 1 calc R U P A 2
B1B B 0.5175(2) 0.7407(4) 0.4536(3) 0.0430(10) Uani 1 1 d . U . . .
C2B C 0.4808(2) 0.8559(4) 0.4911(2) 0.0452(9) Uani 1 1 d . U . . .
H2B H 0.505(2) 0.920(4) 0.511(2) 0.054 Uiso 1 1 d . U . . .
B3B B 0.4669(3) 0.8348(5) 0.4039(3) 0.0521(11) Uani 1 1 d . U . . .
H3B H 0.488835 0.885047 0.361283 0.063 Uiso 1 1 calc R U . . .
B4B B 0.4541(3) 0.6894(5) 0.3961(3) 0.0588(12) Uani 1 1 d . U . . .
H4B H 0.467086 0.643436 0.347833 0.071 Uiso 1 1 calc R U . . .
B5B B 0.4640(2) 0.6295(4) 0.4816(3) 0.0523(12) Uani 1 1 d . U . . .
H5B H 0.483604 0.545038 0.489455 0.063 Uiso 1 1 calc R U . . .
B6B B 0.4821(2) 0.7391(4) 0.5408(3) 0.0477(11) Uani 1 1 d . U . . .
H6B H 0.513647 0.727751 0.587832 0.057 Uiso 1 1 calc R U . . .
C7B C 0.4140(2) 0.8258(4) 0.5386(3) 0.0554(11) Uani 1 1 d . U . . .
B8B B 0.3999(2) 0.6849(5) 0.5363(3) 0.0564(12) Uani 1 1 d . U . . .
H8B H 0.378003 0.636724 0.579880 0.068 Uiso 1 1 calc R U . . .
B9B B 0.3827(3) 0.6559(5) 0.4467(4) 0.0660(14) Uani 1 1 d . U . . .
H9B H 0.349195 0.587571 0.431370 0.079 Uiso 1 1 calc R U . . .
B10B B 0.3848(3) 0.7814(6) 0.3994(3) 0.0653(14) Uani 1 1 d . U . . .
H10B H 0.352883 0.795244 0.352973 0.078 Uiso 1 1 calc R U . . .
B11B B 0.4034(3) 0.8886(5) 0.4589(3) 0.0607(13) Uani 1 1 d . U . . .
H11B H 0.384321 0.973678 0.452640 0.073 Uiso 1 1 calc R U . . .
B12B B 0.3516(3) 0.7792(5) 0.4850(4) 0.0670(14) Uani 1 1 d . U . . .
H12B H 0.298144 0.792172 0.495430 0.080 Uiso 1 1 calc R U . . .
C13B C 0.4020(3) 0.8940(6) 0.6040(3) 0.0880(18) Uani 1 1 d . U . . .
H13D H 0.364321 0.941941 0.596620 0.132 Uiso 1 1 calc R U . . .
H13E H 0.440835 0.938059 0.613932 0.132 Uiso 1 1 calc R U . . .
H13F H 0.393172 0.845650 0.643217 0.132 Uiso 1 1 calc R U . . .
C14B C 0.5948(2) 0.7350(3) 0.4432(2) 0.0429(9) Uani 1 1 d . U . . .
C15B C 0.6302(2) 0.7901(4) 0.3942(2) 0.0521(10) Uani 1 1 d . U . . .
H15B H 0.611384 0.840710 0.362954 0.062 Uiso 1 1 calc R U . . .
C16B C 0.7038(2) 0.7617(4) 0.3949(2) 0.0515(10) Uani 1 1 d . U . . .
C17B C 0.70621(19) 0.6793(3) 0.4549(2) 0.0442(9) Uani 1 1 d . U . . .
C18B C 0.64237(18) 0.6652(3) 0.4836(2) 0.0394(8) Uani 1 1 d . U . . .
C19B C 0.63276(19) 0.5958(3) 0.5409(2) 0.0404(9) Uani 1 1 d . U . . .
H19B H 0.590070 0.586442 0.559326 0.049 Uiso 1 1 calc R U . . .
C20B C 0.6866(2) 0.5397(3) 0.5716(2) 0.0443(9) Uani 1 1 d . U . . .
C21B C 0.7490(2) 0.5523(4) 0.5405(3) 0.0541(11) Uani 1 1 d . U . . .
H21B H 0.785186 0.513673 0.558961 0.065 Uiso 1 1 calc R U . . .
C22B C 0.7586(2) 0.6207(4) 0.4827(3) 0.0540(11) Uani 1 1 d . U . . .
H22B H 0.800824 0.626866 0.462591 0.065 Uiso 1 1 calc R U . . .
C23B C 0.7468(3) 0.8644(5) 0.4093(3) 0.0760(15) Uani 1 1 d . U . . .
H23D H 0.792543 0.842394 0.414925 0.114 Uiso 1 1 calc R U . . .
H23E H 0.731614 0.900176 0.451678 0.114 Uiso 1 1 calc R U . . .
H23F H 0.743143 0.915061 0.370340 0.114 Uiso 1 1 calc R U . . .
C24B C 0.7245(3) 0.7101(5) 0.3240(3) 0.0711(15) Uani 1 1 d . U . . .
H24D H 0.770075 0.685977 0.326620 0.107 Uiso 1 1 calc R U . . .
H24E H 0.719957 0.764384 0.287161 0.107 Uiso 1 1 calc R U . . .
H24F H 0.696251 0.647646 0.313827 0.107 Uiso 1 1 calc R U . . .
C25B C 0.6763(2) 0.4698(4) 0.6382(2) 0.0525(11) Uani 1 1 d . U . . .
C26B C 0.6291(7) 0.3749(10) 0.6237(6) 0.080(3) Uani 0.543(11) 1 d . U P B 1
H26D H 0.615016 0.342627 0.667553 0.120 Uiso 0.543(11) 1 calc R U P B 1
H26E H 0.651366 0.319712 0.595694 0.120 Uiso 0.543(11) 1 calc R U P B 1
H26F H 0.590799 0.402046 0.598491 0.120 Uiso 0.543(11) 1 calc R U P B 1
C27B C 0.6401(9) 0.5422(11) 0.6960(6) 0.095(4) Uani 0.543(11) 1 d . U P B 1
H27D H 0.638867 0.502075 0.739769 0.143 Uiso 0.543(11) 1 calc R U P B 1
H27E H 0.595284 0.557928 0.680886 0.143 Uiso 0.543(11) 1 calc R U P B 1
H27F H 0.663924 0.610521 0.702447 0.143 Uiso 0.543(11) 1 calc R U P B 1
C28B C 0.7396(6) 0.4277(15) 0.6732(8) 0.107(4) Uani 0.543(11) 1 d . U P B 1
H28D H 0.728181 0.387758 0.715363 0.160 Uiso 0.543(11) 1 calc R U P B 1
H28E H 0.767726 0.489433 0.685003 0.160 Uiso 0.543(11) 1 calc R U P B 1
H28F H 0.762792 0.379195 0.641305 0.160 Uiso 0.543(11) 1 calc R U P B 1
C29B C 0.7174(10) 0.3600(13) 0.6322(9) 0.097(5) Uani 0.457(11) 1 d . U P B 2
H29D H 0.716412 0.321685 0.676612 0.145 Uiso 0.457(11) 1 calc R U P B 2
H29E H 0.762748 0.377171 0.619983 0.145 Uiso 0.457(11) 1 calc R U P B 2
H29F H 0.698202 0.313684 0.596254 0.145 Uiso 0.457(11) 1 calc R U P B 2
C30B C 0.6046(7) 0.4380(16) 0.6502(9) 0.090(4) Uani 0.457(11) 1 d . U P B 2
H30D H 0.602032 0.384479 0.687636 0.134 Uiso 0.457(11) 1 calc R U P B 2
H30E H 0.586520 0.406530 0.607710 0.134 Uiso 0.457(11) 1 calc R U P B 2
H30F H 0.579371 0.502824 0.662890 0.134 Uiso 0.457(11) 1 calc R U P B 2
C31B C 0.7022(11) 0.5345(14) 0.6980(7) 0.096(5) Uani 0.457(11) 1 d . U P B 2
H31D H 0.697149 0.492520 0.740721 0.144 Uiso 0.457(11) 1 calc R U P B 2
H31E H 0.677839 0.602816 0.701805 0.144 Uiso 0.457(11) 1 calc R U P B 2
H31F H 0.748677 0.550395 0.690432 0.144 Uiso 0.457(11) 1 calc R U P B 2
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'
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
C14A B1A C6A 119.5(4) . . ?
C14A B1A B3A 127.6(4) . . ?
C6A B1A B3A 102.6(4) . . ?
C14A B1A B4A 129.4(4) . . ?
C6A B1A B4A 102.8(4) . . ?
B3A B1A B4A 59.5(4) . . ?
C14A B1A B2A 119.8(4) . . ?
C6A B1A B2A 57.1(3) . . ?
B3A B1A B2A 58.9(3) . . ?
B4A B1A B2A 105.6(4) . . ?
C14A B1A B5A 121.5(4) . . ?
C6A B1A B5A 58.0(3) . . ?
B3A B1A B5A 106.4(4) . . ?
B4A B1A B5A 59.2(3) . . ?
B2A B1A B5A 105.4(4) . . ?
C6A B2A C7A 58.2(3) . . ?
C6A B2A B3A 105.8(4) . . ?
C7A B2A B3A 106.3(4) . . ?
C6A B2A B11A 106.3(4) . . ?
C7A B2A B11A 59.3(3) . . ?
B3A B2A B11A 60.7(3) . . ?
C6A B2A B1A 59.7(3) . . ?
C7A B2A B1A 107.4(4) . . ?
B3A B2A B1A 60.5(3) . . ?
B11A B2A B1A 110.2(4) . . ?
C6A B2A H2A 123.7 . . ?
C7A B2A H2A 123.2 . . ?
B3A B2A H2A 122.5 . . ?
B11A B2A H2A 121.1 . . ?
B1A B2A H2A 120.5 . . ?
B2A B3A B4A 107.5(4) . . ?
B2A B3A B1A 60.6(3) . . ?
B4A B3A B1A 60.3(3) . . ?
B2A B3A B11A 60.1(3) . . ?
B4A B3A B11A 108.1(4) . . ?
B1A B3A B11A 109.8(4) . . ?
B2A B3A B10A 107.4(4) . . ?
B4A B3A B10A 59.7(4) . . ?
B1A B3A B10A 108.8(4) . . ?
B11A B3A B10A 60.0(4) . . ?
B2A B3A H3A 122.1 . . ?
B4A B3A H3A 122.0 . . ?
B1A B3A H3A 120.5 . . ?
B11A B3A H3A 121.1 . . ?
B10A B3A H3A 122.0 . . ?
B5A B4A B10A 108.2(4) . . ?
B5A B4A B3A 108.0(4) . . ?
B10A B4A B3A 60.5(4) . . ?
B5A B4A B1A 60.5(3) . . ?
B10A B4A B1A 109.3(4) . . ?
B3A B4A B1A 60.2(3) . . ?
B5A B4A B9A 60.4(4) . . ?
B10A B4A B9A 59.2(4) . . ?
B3A B4A B9A 107.5(5) . . ?
B1A B4A B9A 109.0(4) . . ?
B5A B4A H4A 121.5 . . ?
B10A B4A H4A 121.4 . . ?
B3A B4A H4A 121.9 . . ?
B1A B4A H4A 120.7 . . ?
B9A B4A H4A 121.9 . . ?
C6A B5A B4A 104.4(5) . . ?
C6A B5A B9A 103.8(5) . . ?
B4A B5A B9A 60.4(4) . . ?
C6A B5A B1A 59.2(3) . . ?
B4A B5A B1A 60.3(3) . . ?
B9A B5A B1A 108.8(5) . . ?
C6A B5A B8A 58.3(3) . . ?
B4A B5A B8A 106.5(5) . . ?
B9A B5A B8A 58.5(4) . . ?
B1A B5A B8A 107.9(4) . . ?
C6A B5A H5A 125.0 . . ?
B4A B5A H5A 122.6 . . ?
B9A B5A H5A 122.6 . . ?
B1A B5A H5A 120.7 . . ?
B8A B5A H5A 122.6 . . ?
C7A C6A B2A 61.9(3) . . ?
C7A C6A B8A 59.5(3) . . ?
B2A C6A B8A 112.4(4) . . ?
C7A C6A B5A 111.5(4) . . ?
B2A C6A B5A 114.2(4) . . ?
B8A C6A B5A 63.4(3) . . ?
C7A C6A B1A 113.2(4) . . ?
B2A C6A B1A 63.2(3) . . ?
B8A C6A B1A 115.0(4) . . ?
B5A C6A B1A 62.8(3) . . ?
C7A C6A H6 115(3) . . ?
B2A C6A H6 116(3) . . ?
B8A C6A H6 118(3) . . ?
B5A C6A H6 123(3) . . ?
B1A C6A H6 121(3) . . ?
C13A C7A C6A 117.8(4) . . ?
C13A C7A B8A 118.8(5) . . ?
C6A C7A B8A 61.9(3) . . ?
C13A C7A B12A 123.2(5) . . ?
C6A C7A B12A 110.3(4) . . ?
B8A C7A B12A 61.5(4) . . ?
C13A C7A B2A 116.2(5) . . ?
C6A C7A B2A 59.9(3) . . ?
B8A C7A B2A 112.6(4) . . ?
B12A C7A B2A 113.0(4) . . ?
C13A C7A B11A 121.0(5) . . ?
C6A C7A B11A 109.8(4) . . ?
B8A C7A B11A 113.2(4) . . ?
B12A C7A B11A 62.7(4) . . ?
B2A C7A B11A 62.0(3) . . ?
C7A B8A C6A 58.6(3) . . ?
C7A B8A B12A 60.3(4) . . ?
C6A B8A B12A 106.8(5) . . ?
C7A B8A B9A 107.0(5) . . ?
C6A B8A B9A 105.6(4) . . ?
B12A B8A B9A 60.3(4) . . ?
C7A B8A B5A 106.6(4) . . ?
C6A B8A B5A 58.3(3) . . ?
B12A B8A B5A 109.3(5) . . ?
B9A B8A B5A 60.6(4) . . ?
C7A B8A H8A 122.6 . . ?
C6A B8A H8A 123.9 . . ?
B12A B8A H8A 120.9 . . ?
B9A B8A H8A 122.3 . . ?
B5A B8A H8A 121.6 . . ?
B12A B9A B8A 59.2(4) . . ?
B12A B9A B10A 60.9(4) . . ?
B8A B9A B10A 107.6(5) . . ?
B12A B9A B5A 108.7(5) . . ?
B8A B9A B5A 60.9(4) . . ?
B10A B9A B5A 107.7(4) . . ?
B12A B9A B4A 108.5(5) . . ?
B8A B9A B4A 107.5(4) . . ?
B10A B9A B4A 59.8(4) . . ?
B5A B9A B4A 59.2(4) . . ?
B12A B9A H9A 121.2 . . ?
B8A B9A H9A 122.1 . . ?
B10A B9A H9A 121.8 . . ?
B5A B9A H9A 121.5 . . ?
B4A B9A H9A 122.1 . . ?
B9A B10A B4A 60.9(4) . . ?
B9A B10A B12A 59.2(4) . . ?
B4A B10A B12A 108.1(5) . . ?
B9A B10A B3A 108.3(5) . . ?
B4A B10A B3A 59.8(3) . . ?
B12A B10A B3A 107.8(4) . . ?
B9A B10A B11A 107.9(4) . . ?
B4A B10A B11A 108.2(4) . . ?
B12A B10A B11A 60.2(4) . . ?
B3A B10A B11A 60.0(3) . . ?
B9A B10A H10A 121.6 . . ?
B4A B10A H10A 121.3 . . ?
B12A B10A H10A 122.0 . . ?
B3A B10A H10A 121.8 . . ?
B11A B10A H10A 121.6 . . ?
C7A B11A B2A 58.7(3) . . ?
C7A B11A B3A 104.6(4) . . ?
B2A B11A B3A 59.2(3) . . ?
C7A B11A B10A 104.2(5) . . ?
B2A B11A B10A 106.7(4) . . ?
B3A B11A B10A 60.0(3) . . ?
C7A B11A B12A 58.1(3) . . ?
B2A B11A B12A 106.6(5) . . ?
B3A B11A B12A 107.4(5) . . ?
B10A B11A B12A 59.7(4) . . ?
C7A B11A H11A 124.8 . . ?
B2A B11A H11A 122.5 . . ?
B3A B11A H11A 122.5 . . ?
B10A B11A H11A 122.8 . . ?
B12A B11A H11A 122.2 . . ?
C7A B12A B8A 58.2(3) . . ?
C7A B12A B9A 105.6(5) . . ?
B8A B12A B9A 60.5(4) . . ?
C7A B12A B10A 105.5(4) . . ?
B8A B12A B10A 107.9(5) . . ?
B9A B12A B10A 59.9(4) . . ?
C7A B12A B11A 59.3(3) . . ?
B8A B12A B11A 107.7(4) . . ?
B9A B12A B11A 108.4(4) . . ?
B10A B12A B11A 60.2(4) . . ?
C7A B12A H12A 124.2 . . ?
B8A B12A H12A 121.8 . . ?
B9A B12A H12A 121.8 . . ?
B10A B12A H12A 122.2 . . ?
B11A B12A H12A 121.3 . . ?
C7A C13A H13A 109.5 . . ?
C7A C13A H13B 109.5 . . ?
H13A C13A H13B 109.5 . . ?
C7A C13A H13C 109.5 . . ?
H13A C13A H13C 109.5 . . ?
H13B C13A H13C 109.5 . . ?
C15A C14A C18A 107.1(4) . . ?
C15A C14A B1A 126.4(4) . . ?
C18A C14A B1A 126.5(4) . . ?
C14A C15A C16A 113.7(4) . . ?
C14A C15A H15A 123.1 . . ?
C16A C15A H15A 123.1 . . ?
C15A C16A C17A 100.2(3) . . ?
C15A C16A C23A 112.5(4) . . ?
C17A C16A C23A 112.4(4) . . ?
C15A C16A C24A 111.0(4) . . ?
C17A C16A C24A 111.2(4) . . ?
C23A C16A C24A 109.3(4) . . ?
C22A C17A C18A 119.6(4) . . ?
C22A C17A C16A 130.3(4) . . ?
C18A C17A C16A 110.1(3) . . ?
C19A C18A C17A 120.0(4) . . ?
C19A C18A C14A 131.1(4) . . ?
C17A C18A C14A 108.8(3) . . ?
C18A C19A C20A 120.9(3) . . ?
C18A C19A H19A 119.5 . . ?
C20A C19A H19A 119.5 . . ?
C21A C20A C19A 117.7(4) . . ?
C21A C20A C25A 121.1(4) . . ?
C19A C20A C25A 121.2(4) . . ?
C22A C21A C20A 121.8(4) . . ?
C22A C21A H21A 119.1 . . ?
C20A C21A H21A 119.1 . . ?
C17A C22A C21A 120.0(4) . . ?
C17A C22A H22A 120.0 . . ?
C21A C22A H22A 120.0 . . ?
C16A C23A H23A 109.5 . . ?
C16A C23A H23B 109.5 . . ?
H23A C23A H23B 109.5 . . ?
C16A C23A H23C 109.5 . . ?
H23A C23A H23C 109.5 . . ?
H23B C23A H23C 109.5 . . ?
C16A C24A H24A 109.5 . . ?
C16A C24A H24B 109.5 . . ?
H24A C24A H24B 109.5 . . ?
C16A C24A H24C 109.5 . . ?
H24A C24A H24C 109.5 . . ?
H24B C24A H24C 109.5 . . ?
C28A C25A C27A 108.8(9) . . ?
C31A C25A C29A 108.3(10) . . ?
C31A C25A C30A 112.8(11) . . ?
C29A C25A C30A 106.7(10) . . ?
C31A C25A C20A 107.9(6) . . ?
C28A C25A C20A 110.4(5) . . ?
C27A C25A C20A 111.0(5) . . ?
C29A C25A C20A 108.7(6) . . ?
C30A C25A C20A 112.2(6) . . ?
C28A C25A C26A 108.4(8) . . ?
C27A C25A C26A 105.9(9) . . ?
C20A C25A C26A 112.2(5) . . ?
C25A C26A H26A 109.5 . . ?
C25A C26A H26B 109.5 . . ?
H26A C26A H26B 109.5 . . ?
C25A C26A H26C 109.5 . . ?
H26A C26A H26C 109.5 . . ?
H26B C26A H26C 109.5 . . ?
C25A C27A H27A 109.5 . . ?
C25A C27A H27B 109.5 . . ?
H27A C27A H27B 109.5 . . ?
C25A C27A H27C 109.5 . . ?
H27A C27A H27C 109.5 . . ?
H27B C27A H27C 109.5 . . ?
C25A C28A H28A 109.5 . . ?
C25A C28A H28B 109.5 . . ?
H28A C28A H28B 109.5 . . ?
C25A C28A H28C 109.5 . . ?
H28A C28A H28C 109.5 . . ?
H28B C28A H28C 109.5 . . ?
C25A C29A H29A 109.5 . . ?
C25A C29A H29B 109.5 . . ?
H29A C29A H29B 109.5 . . ?
C25A C29A H29C 109.5 . . ?
H29A C29A H29C 109.5 . . ?
H29B C29A H29C 109.5 . . ?
C25A C30A H30A 109.5 . . ?
C25A C30A H30B 109.5 . . ?
H30A C30A H30B 109.5 . . ?
C25A C30A H30C 109.5 . . ?
H30A C30A H30C 109.5 . . ?
H30B C30A H30C 109.5 . . ?
C25A C31A H31A 109.5 . . ?
C25A C31A H31B 109.5 . . ?
H31A C31A H31B 109.5 . . ?
C25A C31A H31C 109.5 . . ?
H31A C31A H31C 109.5 . . ?
H31B C31A H31C 109.5 . . ?
C14B B1B C2B 120.7(4) . . ?
C14B B1B B4B 127.8(4) . . ?
C2B B1B B4B 103.1(3) . . ?
C14B B1B B3B 121.5(4) . . ?
C2B B1B B3B 57.6(3) . . ?
B4B B1B B3B 59.6(3) . . ?
C14B B1B B5B 126.6(4) . . ?
C2B B1B B5B 103.0(3) . . ?
B4B B1B B5B 59.8(3) . . ?
B3B B1B B5B 106.9(3) . . ?
C14B B1B B6B 120.5(4) . . ?
C2B B1B B6B 57.4(3) . . ?
B4B B1B B6B 106.1(4) . . ?
B3B B1B B6B 105.5(3) . . ?
B5B B1B B6B 59.0(3) . . ?
C7B C2B B6B 61.8(3) . . ?
C7B C2B B3B 111.4(4) . . ?
B6B C2B B3B 114.9(4) . . ?
C7B C2B B11B 60.7(3) . . ?
B6B C2B B11B 113.8(4) . . ?
B3B C2B B11B 62.5(3) . . ?
C7B C2B B1B 113.2(3) . . ?
B6B C2B B1B 63.5(3) . . ?
B3B C2B B1B 63.1(3) . . ?
B11B C2B B1B 115.2(4) . . ?
C7B C2B H2B 111(3) . . ?
B6B C2B H2B 116(3) . . ?
B3B C2B H2B 124(3) . . ?
B11B C2B H2B 113(3) . . ?
B1B C2B H2B 125(3) . . ?
C2B B3B B11B 59.2(3) . . ?
C2B B3B B10B 104.7(4) . . ?
B11B B3B B10B 59.5(3) . . ?
C2B B3B B4B 104.6(4) . . ?
B11B B3B B4B 107.8(4) . . ?
B10B B3B B4B 60.1(3) . . ?
C2B B3B B1B 59.2(3) . . ?
B11B B3B B1B 109.3(4) . . ?
B10B B3B B1B 108.7(4) . . ?
B4B B3B B1B 60.1(3) . . ?
C2B B3B H3B 124.6 . . ?
B11B B3B H3B 121.2 . . ?
B10B B3B H3B 122.4 . . ?
B4B B3B H3B 122.6 . . ?
B1B B3B H3B 120.6 . . ?
B9B B4B B10B 59.5(4) . . ?
B9B B4B B3B 107.3(4) . . ?
B10B B4B B3B 59.7(3) . . ?
B9B B4B B1B 108.9(4) . . ?
B10B B4B B1B 108.6(4) . . ?
B3B B4B B1B 60.3(3) . . ?
B9B B4B B5B 60.4(3) . . ?
B10B B4B B5B 107.9(4) . . ?
B3B B4B B5B 107.9(4) . . ?
B1B B4B B5B 60.4(3) . . ?
B9B B4B H4B 121.8 . . ?
B10B B4B H4B 121.9 . . ?
B3B B4B H4B 122.1 . . ?
B1B B4B H4B 120.9 . . ?
B5B B4B H4B 121.6 . . ?
B6B B5B B8B 59.9(3) . . ?
B6B B5B B4B 107.2(4) . . ?
B8B B5B B4B 107.2(4) . . ?
B6B B5B B9B 106.7(4) . . ?
B8B B5B B9B 59.4(3) . . ?
B4B B5B B9B 59.4(3) . . ?
B6B B5B B1B 60.5(3) . . ?
B8B B5B B1B 108.8(4) . . ?
B4B B5B B1B 59.8(3) . . ?
B9B B5B B1B 107.6(4) . . ?
B6B B5B H5B 122.1 . . ?
B8B B5B H5B 121.7 . . ?
B4B B5B H5B 122.4 . . ?
B9B B5B H5B 122.6 . . ?
B1B B5B H5B 121.2 . . ?
C2B B6B C7B 58.0(3) . . ?
C2B B6B B5B 105.4(4) . . ?
C7B B6B B5B 106.0(4) . . ?
C2B B6B B8B 105.4(4) . . ?
C7B B6B B8B 59.0(3) . . ?
B5B B6B B8B 60.3(3) . . ?
C2B B6B B1B 59.1(3) . . ?
C7B B6B B1B 106.5(3) . . ?
B5B B6B B1B 60.4(3) . . ?
B8B B6B B1B 109.0(4) . . ?
C2B B6B H6B 124.2 . . ?
C7B B6B H6B 123.4 . . ?
B5B B6B H6B 122.5 . . ?
B8B B6B H6B 121.8 . . ?
B1B B6B H6B 121.2 . . ?
C13B C7B C2B 117.2(4) . . ?
C13B C7B B11B 117.8(4) . . ?
C2B C7B B11B 61.3(3) . . ?
C13B C7B B12B 123.6(4) . . ?
C2B C7B B12B 110.0(4) . . ?
B11B C7B B12B 61.8(3) . . ?
C13B C7B B6B 116.0(4) . . ?
C2B C7B B6B 60.2(3) . . ?
B11B C7B B6B 113.0(4) . . ?
B12B C7B B6B 113.3(4) . . ?
C13B C7B B8B 122.3(5) . . ?
C2B C7B B8B 109.5(3) . . ?
B11B C7B B8B 113.3(4) . . ?
B12B C7B B8B 62.6(3) . . ?
B6B C7B B8B 62.0(3) . . ?
C7B B8B B9B 104.6(4) . . ?
C7B B8B B6B 58.9(3) . . ?
B9B B8B B6B 107.5(4) . . ?
C7B B8B B5B 105.5(4) . . ?
B9B B8B B5B 60.5(3) . . ?
B6B B8B B5B 59.8(3) . . ?
C7B B8B B12B 58.2(3) . . ?
B9B B8B B12B 59.7(4) . . ?
B6B B8B B12B 107.2(4) . . ?
B5B B8B B12B 108.3(4) . . ?
C7B B8B H8B 124.5 . . ?
B9B B8B H8B 122.5 . . ?
B6B B8B H8B 122.0 . . ?
B5B B8B H8B 121.8 . . ?
B12B B8B H8B 121.9 . . ?
B10B B9B B12B 59.7(4) . . ?
B10B B9B B8B 108.3(5) . . ?
B12B B9B B8B 60.5(4) . . ?
B10B B9B B4B 60.5(4) . . ?
B12B B9B B4B 108.4(4) . . ?
B8B B9B B4B 108.5(4) . . ?
B10B B9B B5B 108.6(4) . . ?
B12B B9B B5B 108.6(4) . . ?
B8B B9B B5B 60.1(3) . . ?
B4B B9B B5B 60.2(3) . . ?
B10B B9B H9B 121.6 . . ?
B12B B9B H9B 121.5 . . ?
B8B B9B H9B 121.4 . . ?
B4B B9B H9B 121.4 . . ?
B5B B9B H9B 121.4 . . ?
B12B B10B B11B 59.8(4) . . ?
B12B B10B B9B 60.4(4) . . ?
B11B B10B B9B 108.1(4) . . ?
B12B B10B B3B 108.3(4) . . ?
B11B B10B B3B 60.2(3) . . ?
B9B B10B B3B 108.1(4) . . ?
B12B B10B B4B 108.6(4) . . ?
B11B B10B B4B 108.4(4) . . ?
B9B B10B B4B 60.1(3) . . ?
B3B B10B B4B 60.1(3) . . ?
B12B B10B H10B 121.4 . . ?
B11B B10B H10B 121.7 . . ?
B9B B10B H10B 121.6 . . ?
B3B B10B H10B 121.6 . . ?
B4B B10B H10B 121.4 . . ?
C7B B11B C2B 57.9(3) . . ?
C7B B11B B12B 59.2(3) . . ?
C2B B11B B12B 105.2(4) . . ?
C7B B11B B10B 105.6(4) . . ?
C2B B11B B10B 104.6(4) . . ?
B12B B11B B10B 60.0(4) . . ?
C7B B11B B3B 105.7(4) . . ?
C2B B11B B3B 58.2(3) . . ?
B12B B11B B3B 108.5(4) . . ?
B10B B11B B3B 60.3(3) . . ?
C7B B11B H11B 123.6 . . ?
C2B B11B H11B 124.6 . . ?
B12B B11B H11B 121.8 . . ?
B10B B11B H11B 122.9 . . ?
B3B B11B H11B 121.8 . . ?
C7B B12B B11B 59.0(3) . . ?
C7B B12B B10B 105.6(4) . . ?
B11B B12B B10B 60.1(4) . . ?
C7B B12B B9B 105.3(4) . . ?
B11B B12B B9B 108.0(4) . . ?
B10B B12B B9B 59.9(4) . . ?
C7B B12B B8B 59.1(3) . . ?
B11B B12B B8B 108.2(4) . . ?
B10B B12B B8B 108.0(4) . . ?
B9B B12B B8B 59.8(4) . . ?
C7B B12B H12B 124.0 . . ?
B11B B12B H12B 121.4 . . ?
B10B B12B H12B 122.2 . . ?
B9B B12B H12B 122.4 . . ?
B8B B12B H12B 121.5 . . ?
C7B C13B H13D 109.5 . . ?
C7B C13B H13E 109.5 . . ?
H13D C13B H13E 109.5 . . ?
C7B C13B H13F 109.5 . . ?
H13D C13B H13F 109.5 . . ?
H13E C13B H13F 109.5 . . ?
C15B C14B C18B 107.3(4) . . ?
C15B C14B B1B 126.1(4) . . ?
C18B C14B B1B 126.6(4) . . ?
C14B C15B C16B 113.4(4) . . ?
C14B C15B H15B 123.3 . . ?
C16B C15B H15B 123.3 . . ?
C17B C16B C15B 100.7(3) . . ?
C17B C16B C23B 112.2(4) . . ?
C15B C16B C23B 111.5(4) . . ?
C17B C16B C24B 112.5(4) . . ?
C15B C16B C24B 110.3(4) . . ?
C23B C16B C24B 109.3(4) . . ?
C22B C17B C18B 119.2(4) . . ?
C22B C17B C16B 130.8(4) . . ?
C18B C17B C16B 110.0(4) . . ?
C19B C18B C17B 120.3(4) . . ?
C19B C18B C14B 131.1(4) . . ?
C17B C18B C14B 108.5(4) . . ?
C18B C19B C20B 120.7(4) . . ?
C18B C19B H19B 119.7 . . ?
C20B C19B H19B 119.7 . . ?
C21B C20B C19B 117.7(4) . . ?
C21B C20B C25B 122.0(4) . . ?
C19B C20B C25B 120.2(4) . . ?
C22B C21B C20B 121.7(4) . . ?
C22B C21B H21B 119.1 . . ?
C20B C21B H21B 119.1 . . ?
C17B C22B C21B 120.3(4) . . ?
C17B C22B H22B 119.9 . . ?
C21B C22B H22B 119.9 . . ?
C16B C23B H23D 109.5 . . ?
C16B C23B H23E 109.5 . . ?
H23D C23B H23E 109.5 . . ?
C16B C23B H23F 109.5 . . ?
H23D C23B H23F 109.5 . . ?
H23E C23B H23F 109.5 . . ?
C16B C24B H24D 109.5 . . ?
C16B C24B H24E 109.5 . . ?
H24D C24B H24E 109.5 . . ?
C16B C24B H24F 109.5 . . ?
H24D C24B H24F 109.5 . . ?
H24E C24B H24F 109.5 . . ?
C31B C25B C30B 110.8(11) . . ?
C26B C25B C28B 110.5(9) . . ?
C31B C25B C20B 107.2(6) . . ?
C30B C25B C20B 113.2(6) . . ?
C26B C25B C20B 110.6(5) . . ?
C28B C25B C20B 115.6(6) . . ?
C31B C25B C29B 108.6(10) . . ?
C30B C25B C29B 107.4(10) . . ?
C20B C25B C29B 109.6(7) . . ?
C26B C25B C27B 104.8(9) . . ?
C28B C25B C27B 105.4(9) . . ?
C20B C25B C27B 109.3(5) . . ?
C25B C26B H26D 109.5 . . ?
C25B C26B H26E 109.5 . . ?
H26D C26B H26E 109.5 . . ?
C25B C26B H26F 109.5 . . ?
H26D C26B H26F 109.5 . . ?
H26E C26B H26F 109.5 . . ?
C25B C27B H27D 109.5 . . ?
C25B C27B H27E 109.5 . . ?
H27D C27B H27E 109.5 . . ?
C25B C27B H27F 109.5 . . ?
H27D C27B H27F 109.5 . . ?
H27E C27B H27F 109.5 . . ?
C25B C28B H28D 109.5 . . ?
C25B C28B H28E 109.5 . . ?
H28D C28B H28E 109.5 . . ?
C25B C28B H28F 109.5 . . ?
H28D C28B H28F 109.5 . . ?
H28E C28B H28F 109.5 . . ?
C25B C29B H29D 109.5 . . ?
C25B C29B H29E 109.5 . . ?
H29D C29B H29E 109.5 . . ?
C25B C29B H29F 109.5 . . ?
H29D C29B H29F 109.5 . . ?
H29E C29B H29F 109.5 . . ?
C25B C30B H30D 109.5 . . ?
C25B C30B H30E 109.5 . . ?
H30D C30B H30E 109.5 . . ?
C25B C30B H30F 109.5 . . ?
H30D C30B H30F 109.5 . . ?
H30E C30B H30F 109.5 . . ?
C25B C31B H31D 109.5 . . ?
C25B C31B H31E 109.5 . . ?
H31D C31B H31E 109.5 . . ?
C25B C31B H31F 109.5 . . ?
H31D C31B H31F 109.5 . . ?
H31E C31B H31F 109.5 . . ?
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
B1A C14A 1.560(6) . ?
B1A C6A 1.728(7) . ?
B1A B3A 1.783(8) . ?
B1A B4A 1.785(7) . ?
B1A B2A 1.786(7) . ?
B1A B5A 1.790(7) . ?
B2A C6A 1.680(8) . ?
B2A C7A 1.714(7) . ?
B2A B3A 1.756(7) . ?
B2A B11A 1.772(7) . ?
B2A H2A 1.1000 . ?
B3A B4A 1.770(10) . ?
B3A B11A 1.783(8) . ?
B3A B10A 1.783(8) . ?
B3A H3A 1.1000 . ?
B4A B5A 1.767(10) . ?
B4A B10A 1.768(10) . ?
B4A B9A 1.788(9) . ?
B4A H4A 1.1000 . ?
B5A C6A 1.708(8) . ?
B5A B9A 1.788(10) . ?
B5A B8A 1.793(9) . ?
B5A H5A 1.1000 . ?
C6A C7A 1.652(7) . ?
C6A B8A 1.707(7) . ?
C6A H6 0.98(5) . ?
C7A C13A 1.476(7) . ?
C7A B8A 1.668(9) . ?
C7A B12A 1.705(8) . ?
C7A B11A 1.726(8) . ?
B8A B12A 1.725(10) . ?
B8A B9A 1.749(9) . ?
B8A H8A 1.1000 . ?
B9A B12A 1.745(11) . ?
B9A B10A 1.757(11) . ?
B9A H9A 1.1000 . ?
B10A B12A 1.774(8) . ?
B10A B11A 1.783(10) . ?
B10A H10A 1.1000 . ?
B11A B12A 1.784(10) . ?
B11A H11A 1.1000 . ?
B12A H12A 1.1000 . ?
C13A H13A 0.9600 . ?
C13A H13B 0.9600 . ?
C13A H13C 0.9600 . ?
C14A C15A 1.344(6) . ?
C14A C18A 1.480(5) . ?
C15A C16A 1.512(6) . ?
C15A H15A 0.9300 . ?
C16A C17A 1.520(6) . ?
C16A C23A 1.524(7) . ?
C16A C24A 1.535(6) . ?
C17A C22A 1.368(6) . ?
C17A C18A 1.393(5) . ?
C18A C19A 1.387(5) . ?
C19A C20A 1.391(5) . ?
C19A H19A 0.9300 . ?
C20A C21A 1.387(6) . ?
C20A C25A 1.534(5) . ?
C21A C22A 1.385(6) . ?
C21A H21A 0.9300 . ?
C22A H22A 0.9300 . ?
C23A H23A 0.9600 . ?
C23A H23B 0.9600 . ?
C23A H23C 0.9600 . ?
C24A H24A 0.9600 . ?
C24A H24B 0.9600 . ?
C24A H24C 0.9600 . ?
C25A C31A 1.506(14) . ?
C25A C28A 1.511(11) . ?
C25A C27A 1.513(12) . ?
C25A C29A 1.524(14) . ?
C25A C30A 1.530(14) . ?
C25A C26A 1.552(12) . ?
C26A H26A 0.9600 . ?
C26A H26B 0.9600 . ?
C26A H26C 0.9600 . ?
C27A H27A 0.9600 . ?
C27A H27B 0.9600 . ?
C27A H27C 0.9600 . ?
C28A H28A 0.9600 . ?
C28A H28B 0.9600 . ?
C28A H28C 0.9600 . ?
C29A H29A 0.9600 . ?
C29A H29B 0.9600 . ?
C29A H29C 0.9600 . ?
C30A H30A 0.9600 . ?
C30A H30B 0.9600 . ?
C30A H30C 0.9600 . ?
C31A H31A 0.9600 . ?
C31A H31B 0.9600 . ?
C31A H31C 0.9600 . ?
B1B C14B 1.563(6) . ?
B1B C2B 1.723(6) . ?
B1B B4B 1.784(7) . ?
B1B B3B 1.788(7) . ?
B1B B5B 1.795(7) . ?
B1B B6B 1.797(7) . ?
C2B C7B 1.653(6) . ?
C2B B6B 1.692(6) . ?
C2B B3B 1.694(7) . ?
C2B B11B 1.712(7) . ?
C2B H2B 0.99(5) . ?
B3B B11B 1.767(8) . ?
B3B B10B 1.768(8) . ?
B3B B4B 1.776(8) . ?
B3B H3B 1.1000 . ?
B4B B9B 1.769(9) . ?
B4B B10B 1.776(8) . ?
B4B B5B 1.785(8) . ?
B4B H4B 1.1000 . ?
B5B B6B 1.769(8) . ?
B5B B8B 1.780(8) . ?
B5B B9B 1.787(8) . ?
B5B H5B 1.1000 . ?
B6B C7B 1.719(6) . ?
B6B B8B 1.772(7) . ?
B6B H6B 1.1000 . ?
C7B C13B 1.505(7) . ?
C7B B11B 1.702(8) . ?
C7B B12B 1.704(8) . ?
C7B B8B 1.720(7) . ?
B8B B9B 1.767(9) . ?
B8B B12B 1.780(8) . ?
B8B H8B 1.1000 . ?
B9B B10B 1.758(9) . ?
B9B B12B 1.766(9) . ?
B9B H9B 1.1000 . ?
B10B B12B 1.753(9) . ?
B10B B11B 1.754(9) . ?
B10B H10B 1.1000 . ?
B11B B12B 1.749(9) . ?
B11B H11B 1.1000 . ?
B12B H12B 1.1000 . ?
C13B H13D 0.9600 . ?
C13B H13E 0.9600 . ?
C13B H13F 0.9600 . ?
C14B C15B 1.343(6) . ?
C14B C18B 1.482(6) . ?
C15B C16B 1.512(6) . ?
C15B H15B 0.9300 . ?
C16B C17B 1.510(6) . ?
C16B C23B 1.532(7) . ?
C16B C24B 1.537(6) . ?
C17B C22B 1.370(6) . ?
C17B C18B 1.400(5) . ?
C18B C19B 1.384(6) . ?
C19B C20B 1.399(5) . ?
C19B H19B 0.9300 . ?
C20B C21B 1.389(6) . ?
C20B C25B 1.530(6) . ?
C21B C22B 1.383(6) . ?
C21B H21B 0.9300 . ?
C22B H22B 0.9300 . ?
C23B H23D 0.9600 . ?
C23B H23E 0.9600 . ?
C23B H23F 0.9600 . ?
C24B H24D 0.9600 . ?
C24B H24E 0.9600 . ?
C24B H24F 0.9600 . ?
C25B C31B 1.469(13) . ?
C25B C30B 1.505(15) . ?
C25B C26B 1.509(11) . ?
C25B C28B 1.516(12) . ?
C25B C29B 1.561(14) . ?
C25B C27B 1.577(13) . ?
C26B H26D 0.9600 . ?
C26B H26E 0.9600 . ?
C26B H26F 0.9600 . ?
C27B H27D 0.9600 . ?
C27B H27E 0.9600 . ?
C27B H27F 0.9600 . ?
C28B H28D 0.9600 . ?
C28B H28E 0.9600 . ?
C28B H28F 0.9600 . ?
C29B H29D 0.9600 . ?
C29B H29E 0.9600 . ?
C29B H29F 0.9600 . ?
C30B H30D 0.9600 . ?
C30B H30E 0.9600 . ?
C30B H30F 0.9600 . ?
C31B H31D 0.9600 . ?
C31B H31E 0.9600 . ?
C31B H31F 0.9600 . ?
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
C14A B1A B2A C6A -107.8(5) . . . . ?
B3A B1A B2A C6A 133.8(4) . . . . ?
B4A B1A B2A C6A 95.4(4) . . . . ?
B5A B1A B2A C6A 33.7(4) . . . . ?
C14A B1A B2A C7A -142.4(4) . . . . ?
C6A B1A B2A C7A -34.6(3) . . . . ?
B3A B1A B2A C7A 99.2(4) . . . . ?
B4A B1A B2A C7A 60.8(4) . . . . ?
B5A B1A B2A C7A -0.9(5) . . . . ?
C14A B1A B2A B3A 118.4(5) . . . . ?
C6A B1A B2A B3A -133.8(4) . . . . ?
B4A B1A B2A B3A -38.4(4) . . . . ?
B5A B1A B2A B3A -100.1(4) . . . . ?
C14A B1A B2A B11A 154.6(4) . . . . ?
C6A B1A B2A B11A -97.6(4) . . . . ?
B3A B1A B2A B11A 36.2(4) . . . . ?
B4A B1A B2A B11A -2.2(5) . . . . ?
B5A B1A B2A B11A -63.9(5) . . . . ?
C6A B2A B3A B4A -1.1(5) . . . . ?
C7A B2A B3A B4A -61.9(5) . . . . ?
B11A B2A B3A B4A -101.2(5) . . . . ?
B1A B2A B3A B4A 39.3(4) . . . . ?
C6A B2A B3A B1A -40.3(3) . . . . ?
C7A B2A B3A B1A -101.2(4) . . . . ?
B11A B2A B3A B1A -140.5(4) . . . . ?
C6A B2A B3A B11A 100.2(4) . . . . ?
C7A B2A B3A B11A 39.4(4) . . . . ?
B1A B2A B3A B11A 140.5(4) . . . . ?
C6A B2A B3A B10A 61.8(5) . . . . ?
C7A B2A B3A B10A 1.0(6) . . . . ?
B11A B2A B3A B10A -38.3(5) . . . . ?
B1A B2A B3A B10A 102.2(5) . . . . ?
C14A B1A B3A B2A -105.6(5) . . . . ?
C6A B1A B3A B2A 38.4(3) . . . . ?
B4A B1A B3A B2A 136.0(4) . . . . ?
B5A B1A B3A B2A 98.4(4) . . . . ?
C14A B1A B3A B4A 118.4(5) . . . . ?
C6A B1A B3A B4A -97.6(4) . . . . ?
B2A B1A B3A B4A -136.0(4) . . . . ?
B5A B1A B3A B4A -37.6(4) . . . . ?
C14A B1A B3A B11A -141.5(5) . . . . ?
C6A B1A B3A B11A 2.5(5) . . . . ?
B4A B1A B3A B11A 100.1(5) . . . . ?
B2A B1A B3A B11A -35.8(4) . . . . ?
B5A B1A B3A B11A 62.6(5) . . . . ?
C14A B1A B3A B10A 154.5(4) . . . . ?
C6A B1A B3A B10A -61.4(5) . . . . ?
B4A B1A B3A B10A 36.2(4) . . . . ?
B2A B1A B3A B10A -99.8(4) . . . . ?
B5A B1A B3A B10A -1.4(5) . . . . ?
B2A B3A B4A B5A -0.9(5) . . . . ?
B1A B3A B4A B5A 38.5(4) . . . . ?
B11A B3A B4A B5A -64.3(5) . . . . ?
B10A B3A B4A B5A -101.1(5) . . . . ?
B2A B3A B4A B10A 100.3(4) . . . . ?
B1A B3A B4A B10A 139.7(4) . . . . ?
B11A B3A B4A B10A 36.8(4) . . . . ?
B2A B3A B4A B1A -39.4(3) . . . . ?
B11A B3A B4A B1A -102.9(4) . . . . ?
B10A B3A B4A B1A -139.7(4) . . . . ?
B2A B3A B4A B9A 62.9(5) . . . . ?
B1A B3A B4A B9A 102.3(5) . . . . ?
B11A B3A B4A B9A -0.6(6) . . . . ?
B10A B3A B4A B9A -37.4(4) . . . . ?
C14A B1A B4A B5A 107.3(6) . . . . ?
C6A B1A B4A B5A -39.9(4) . . . . ?
B3A B1A B4A B5A -137.1(4) . . . . ?
B2A B1A B4A B5A -98.9(4) . . . . ?
C14A B1A B4A B10A -152.3(5) . . . . ?
C6A B1A B4A B10A 60.6(5) . . . . ?
B3A B1A B4A B10A -36.6(4) . . . . ?
B2A B1A B4A B10A 1.5(5) . . . . ?
B5A B1A B4A B10A 100.4(5) . . . . ?
C14A B1A B4A B3A -115.6(5) . . . . ?
C6A B1A B4A B3A 97.2(4) . . . . ?
B2A B1A B4A B3A 38.2(3) . . . . ?
B5A B1A B4A B3A 137.1(4) . . . . ?
C14A B1A B4A B9A 144.7(5) . . . . ?
C6A B1A B4A B9A -2.5(6) . . . . ?
B3A B1A B4A B9A -99.7(5) . . . . ?
B2A B1A B4A B9A -61.6(6) . . . . ?
B5A B1A B4A B9A 37.4(5) . . . . ?
B10A B4A B5A C6A -61.6(5) . . . . ?
B3A B4A B5A C6A 2.4(5) . . . . ?
B1A B4A B5A C6A 40.8(4) . . . . ?
B9A B4A B5A C6A -97.9(5) . . . . ?
B10A B4A B5A B9A 36.3(5) . . . . ?
B3A B4A B5A B9A 100.3(5) . . . . ?
B1A B4A B5A B9A 138.7(5) . . . . ?
B10A B4A B5A B1A -102.4(5) . . . . ?
B3A B4A B5A B1A -38.4(4) . . . . ?
B9A B4A B5A B1A -138.7(5) . . . . ?
B10A B4A B5A B8A -0.9(6) . . . . ?
B3A B4A B5A B8A 63.1(5) . . . . ?
B1A B4A B5A B8A 101.5(4) . . . . ?
B9A B4A B5A B8A -37.2(4) . . . . ?
C14A B1A B5A C6A 107.4(5) . . . . ?
B3A B1A B5A C6A -94.8(4) . . . . ?
B4A B1A B5A C6A -132.5(5) . . . . ?
B2A B1A B5A C6A -33.3(4) . . . . ?
C14A B1A B5A B4A -120.1(5) . . . . ?
C6A B1A B5A B4A 132.5(5) . . . . ?
B3A B1A B5A B4A 37.7(4) . . . . ?
B2A B1A B5A B4A 99.2(4) . . . . ?
C14A B1A B5A B9A -157.4(4) . . . . ?
C6A B1A B5A B9A 95.2(5) . . . . ?
B3A B1A B5A B9A 0.4(5) . . . . ?
B4A B1A B5A B9A -37.3(4) . . . . ?
B2A B1A B5A B9A 61.9(5) . . . . ?
C14A B1A B5A B8A 140.7(4) . . . . ?
C6A B1A B5A B8A 33.3(4) . . . . ?
B3A B1A B5A B8A -61.5(5) . . . . ?
B4A B1A B5A B8A -99.2(5) . . . . ?
B2A B1A B5A B8A 0.0(5) . . . . ?
B3A B2A C6A C7A -99.7(4) . . . . ?
B11A B2A C6A C7A -36.2(4) . . . . ?
B1A B2A C6A C7A -140.4(4) . . . . ?
C7A B2A C6A B8A 32.7(4) . . . . ?
B3A B2A C6A B8A -67.0(5) . . . . ?
B11A B2A C6A B8A -3.5(5) . . . . ?
B1A B2A C6A B8A -107.7(4) . . . . ?
C7A B2A C6A B5A 102.5(4) . . . . ?
B3A B2A C6A B5A 2.8(5) . . . . ?
B11A B2A C6A B5A 66.2(5) . . . . ?
B1A B2A C6A B5A -37.9(4) . . . . ?
C7A B2A C6A B1A 140.4(4) . . . . ?
B3A B2A C6A B1A 40.7(3) . . . . ?
B11A B2A C6A B1A 104.2(4) . . . . ?
B4A B5A C6A C7A 64.5(5) . . . . ?
B9A B5A C6A C7A 2.0(5) . . . . ?
B1A B5A C6A C7A 105.9(4) . . . . ?
B8A B5A C6A C7A -36.2(4) . . . . ?
B4A B5A C6A B2A -3.3(5) . . . . ?
B9A B5A C6A B2A -65.8(5) . . . . ?
B1A B5A C6A B2A 38.1(4) . . . . ?
B8A B5A C6A B2A -104.0(5) . . . . ?
B4A B5A C6A B8A 100.7(5) . . . . ?
B9A B5A C6A B8A 38.3(4) . . . . ?
B1A B5A C6A B8A 142.1(5) . . . . ?
B4A B5A C6A B1A -41.4(4) . . . . ?
B9A B5A C6A B1A -103.8(5) . . . . ?
B8A B5A C6A B1A -142.1(5) . . . . ?
C14A B1A C6A C7A 146.1(4) . . . . ?
B3A B1A C6A C7A -1.5(5) . . . . ?
B4A B1A C6A C7A -62.7(5) . . . . ?
B2A B1A C6A C7A 37.8(4) . . . . ?
B5A B1A C6A C7A -103.2(5) . . . . ?
C14A B1A C6A B2A 108.4(4) . . . . ?
B3A B1A C6A B2A -39.3(3) . . . . ?
B4A B1A C6A B2A -100.4(4) . . . . ?
B5A B1A C6A B2A -140.9(4) . . . . ?
C14A B1A C6A B8A -148.0(5) . . . . ?
B3A B1A C6A B8A 64.4(5) . . . . ?
B4A B1A C6A B8A 3.2(6) . . . . ?
B2A B1A C6A B8A 103.6(5) . . . . ?
B5A B1A C6A B8A -37.3(5) . . . . ?
C14A B1A C6A B5A -110.7(5) . . . . ?
B3A B1A C6A B5A 101.6(4) . . . . ?
B4A B1A C6A B5A 40.5(4) . . . . ?
B2A B1A C6A B5A 140.9(4) . . . . ?
B2A C6A C7A C13A -105.8(5) . . . . ?
B8A C6A C7A C13A 109.6(6) . . . . ?
B5A C6A C7A C13A 147.4(5) . . . . ?
B1A C6A C7A C13A -144.0(5) . . . . ?
B2A C6A C7A B8A 144.6(4) . . . . ?
B5A C6A C7A B8A 37.8(4) . . . . ?
B1A C6A C7A B8A 106.3(4) . . . . ?
B2A C6A C7A B12A 105.4(4) . . . . ?
B8A C6A C7A B12A -39.2(4) . . . . ?
B5A C6A C7A B12A -1.4(5) . . . . ?
B1A C6A C7A B12A 67.1(5) . . . . ?
B8A C6A C7A B2A -144.6(4) . . . . ?
B5A C6A C7A B2A -106.8(4) . . . . ?
B1A C6A C7A B2A -38.3(4) . . . . ?
B2A C6A C7A B11A 38.2(4) . . . . ?
B8A C6A C7A B11A -106.4(5) . . . . ?
B5A C6A C7A B11A -68.6(5) . . . . ?
B1A C6A C7A B11A -0.1(5) . . . . ?
C6A B2A C7A C13A 108.3(5) . . . . ?
B3A B2A C7A C13A -152.9(5) . . . . ?
B11A B2A C7A C13A -112.9(6) . . . . ?
B1A B2A C7A C13A 143.6(5) . . . . ?
B3A B2A C7A C6A 98.7(4) . . . . ?
B11A B2A C7A C6A 138.8(4) . . . . ?
B1A B2A C7A C6A 35.3(3) . . . . ?
C6A B2A C7A B8A -33.6(4) . . . . ?
B3A B2A C7A B8A 65.1(5) . . . . ?
B11A B2A C7A B8A 105.2(5) . . . . ?
B1A B2A C7A B8A 1.7(5) . . . . ?
C6A B2A C7A B12A -101.0(5) . . . . ?
B3A B2A C7A B12A -2.3(6) . . . . ?
B11A B2A C7A B12A 37.8(5) . . . . ?
B1A B2A C7A B12A -65.7(5) . . . . ?
C6A B2A C7A B11A -138.8(4) . . . . ?
B3A B2A C7A B11A -40.0(4) . . . . ?
B1A B2A C7A B11A -103.5(4) . . . . ?
C13A C7A B8A C6A -108.0(5) . . . . ?
B12A C7A B8A C6A 137.6(4) . . . . ?
B2A C7A B8A C6A 32.9(4) . . . . ?
B11A C7A B8A C6A 100.8(4) . . . . ?
C13A C7A B8A B12A 114.4(5) . . . . ?
C6A C7A B8A B12A -137.6(4) . . . . ?
B2A C7A B8A B12A -104.8(4) . . . . ?
B11A C7A B8A B12A -36.8(4) . . . . ?
C13A C7A B8A B9A 153.9(5) . . . . ?
C6A C7A B8A B9A -98.1(4) . . . . ?
B12A C7A B8A B9A 39.5(4) . . . . ?
B2A C7A B8A B9A -65.3(5) . . . . ?
B11A C7A B8A B9A 2.7(5) . . . . ?
C13A C7A B8A B5A -142.5(5) . . . . ?
C6A C7A B8A B5A -34.5(4) . . . . ?
B12A C7A B8A B5A 103.1(5) . . . . ?
B2A C7A B8A B5A -1.6(6) . . . . ?
B11A C7A B8A B5A 66.3(5) . . . . ?
B2A C6A B8A C7A -33.6(4) . . . . ?
B5A C6A B8A C7A -140.4(5) . . . . ?
B1A C6A B8A C7A -103.3(5) . . . . ?
C7A C6A B8A B12A 37.7(4) . . . . ?
B2A C6A B8A B12A 4.1(6) . . . . ?
B5A C6A B8A B12A -102.7(5) . . . . ?
B1A C6A B8A B12A -65.6(6) . . . . ?
C7A C6A B8A B9A 100.7(5) . . . . ?
B2A C6A B8A B9A 67.2(6) . . . . ?
B5A C6A B8A B9A -39.6(5) . . . . ?
B1A C6A B8A B9A -2.6(7) . . . . ?
C7A C6A B8A B5A 140.4(5) . . . . ?
B2A C6A B8A B5A 106.8(5) . . . . ?
B1A C6A B8A B5A 37.1(5) . . . . ?
C6A B5A B8A C7A 34.6(4) . . . . ?
B4A B5A B8A C7A -62.4(5) . . . . ?
B9A B5A B8A C7A -100.5(5) . . . . ?
B1A B5A B8A C7A 1.0(6) . . . . ?
B4A B5A B8A C6A -97.0(5) . . . . ?
B9A B5A B8A C6A -135.1(5) . . . . ?
B1A B5A B8A C6A -33.6(4) . . . . ?
C6A B5A B8A B12A 98.3(5) . . . . ?
B4A B5A B8A B12A 1.2(6) . . . . ?
B9A B5A B8A B12A -36.9(5) . . . . ?
B1A B5A B8A B12A 64.6(5) . . . . ?
C6A B5A B8A B9A 135.1(5) . . . . ?
B4A B5A B8A B9A 38.1(4) . . . . ?
B1A B5A B8A B9A 101.5(5) . . . . ?
C7A B8A B9A B12A -39.5(4) . . . . ?
C6A B8A B9A B12A -100.8(5) . . . . ?
B5A B8A B9A B12A -139.3(5) . . . . ?
C7A B8A B9A B10A -1.1(6) . . . . ?
C6A B8A B9A B10A -62.3(6) . . . . ?
B12A B8A B9A B10A 38.4(4) . . . . ?
B5A B8A B9A B10A -100.9(5) . . . . ?
C7A B8A B9A B5A 99.8(4) . . . . ?
C6A B8A B9A B5A 38.6(5) . . . . ?
B12A B8A B9A B5A 139.3(5) . . . . ?
C7A B8A B9A B4A 62.0(6) . . . . ?
C6A B8A B9A B4A 0.7(7) . . . . ?
B12A B8A B9A B4A 101.5(6) . . . . ?
B5A B8A B9A B4A -37.8(5) . . . . ?
C6A B5A B9A B12A -1.9(6) . . . . ?
B4A B5A B9A B12A -100.9(5) . . . . ?
B1A B5A B9A B12A -63.7(5) . . . . ?
B8A B5A B9A B12A 36.2(4) . . . . ?
C6A B5A B9A B8A -38.2(4) . . . . ?
B4A B5A B9A B8A -137.1(5) . . . . ?
B1A B5A B9A B8A -99.9(5) . . . . ?
C6A B5A B9A B10A 62.5(5) . . . . ?
B4A B5A B9A B10A -36.5(4) . . . . ?
B1A B5A B9A B10A 0.8(6) . . . . ?
B8A B5A B9A B10A 100.7(5) . . . . ?
C6A B5A B9A B4A 98.9(5) . . . . ?
B1A B5A B9A B4A 37.2(4) . . . . ?
B8A B5A B9A B4A 137.1(5) . . . . ?
B5A B4A B9A B12A 101.1(5) . . . . ?
B10A B4A B9A B12A -38.0(4) . . . . ?
B3A B4A B9A B12A 0.0(6) . . . . ?
B1A B4A B9A B12A 63.7(6) . . . . ?
B5A B4A B9A B8A 38.6(5) . . . . ?
B10A B4A B9A B8A -100.5(6) . . . . ?
B3A B4A B9A B8A -62.5(6) . . . . ?
B1A B4A B9A B8A 1.2(7) . . . . ?
B5A B4A B9A B10A 139.1(5) . . . . ?
B3A B4A B9A B10A 38.0(4) . . . . ?
B1A B4A B9A B10A 101.7(5) . . . . ?
B10A B4A B9A B5A -139.1(5) . . . . ?
B3A B4A B9A B5A -101.1(5) . . . . ?
B1A B4A B9A B5A -37.4(5) . . . . ?
B12A B9A B10A B4A 138.1(4) . . . . ?
B8A B9A B10A B4A 100.5(5) . . . . ?
B5A B9A B10A B4A 36.2(4) . . . . ?
B8A B9A B10A B12A -37.7(4) . . . . ?
B5A B9A B10A B12A -101.9(5) . . . . ?
B4A B9A B10A B12A -138.1(4) . . . . ?
B12A B9A B10A B3A 100.3(5) . . . . ?
B8A B9A B10A B3A 62.6(6) . . . . ?
B5A B9A B10A B3A -1.7(6) . . . . ?
B4A B9A B10A B3A -37.8(4) . . . . ?
B12A B9A B10A B11A 36.8(4) . . . . ?
B8A B9A B10A B11A -0.9(6) . . . . ?
B5A B9A B10A B11A -65.1(5) . . . . ?
B4A B9A B10A B11A -101.3(4) . . . . ?
B5A B4A B10A B9A -36.8(4) . . . . ?
B3A B4A B10A B9A -137.6(4) . . . . ?
B1A B4A B10A B9A -101.1(5) . . . . ?
B5A B4A B10A B12A 0.3(6) . . . . ?
B3A B4A B10A B12A -100.5(5) . . . . ?
B1A B4A B10A B12A -64.0(6) . . . . ?
B9A B4A B10A B12A 37.1(4) . . . . ?
B5A B4A B10A B3A 100.8(4) . . . . ?
B1A B4A B10A B3A 36.5(4) . . . . ?
B9A B4A B10A B3A 137.6(4) . . . . ?
B5A B4A B10A B11A 64.0(6) . . . . ?
B3A B4A B10A B11A -36.8(4) . . . . ?
B1A B4A B10A B11A -0.3(6) . . . . ?
B9A B4A B10A B11A 100.8(5) . . . . ?
B2A B3A B10A B9A -62.2(6) . . . . ?
B4A B3A B10A B9A 38.4(4) . . . . ?
B1A B3A B10A B9A 1.9(6) . . . . ?
B11A B3A B10A B9A -100.5(5) . . . . ?
B2A B3A B10A B4A -100.5(4) . . . . ?
B1A B3A B10A B4A -36.4(4) . . . . ?
B11A B3A B10A B4A -138.9(5) . . . . ?
B2A B3A B10A B12A 0.4(7) . . . . ?
B4A B3A B10A B12A 101.0(6) . . . . ?
B1A B3A B10A B12A 64.5(6) . . . . ?
B11A B3A B10A B12A -37.9(5) . . . . ?
B2A B3A B10A B11A 38.4(4) . . . . ?
B4A B3A B10A B11A 138.9(5) . . . . ?
B1A B3A B10A B11A 102.5(4) . . . . ?
C13A C7A B11A B2A 105.3(5) . . . . ?
C6A C7A B11A B2A -37.3(4) . . . . ?
B8A C7A B11A B2A -104.2(4) . . . . ?
B12A C7A B11A B2A -140.6(4) . . . . ?
C13A C7A B11A B3A 144.2(5) . . . . ?
C6A C7A B11A B3A 1.6(6) . . . . ?
B8A C7A B11A B3A -65.3(5) . . . . ?
B12A C7A B11A B3A -101.6(5) . . . . ?
B2A C7A B11A B3A 38.9(4) . . . . ?
C13A C7A B11A B10A -153.6(5) . . . . ?
C6A C7A B11A B10A 63.8(5) . . . . ?
B8A C7A B11A B10A -3.2(5) . . . . ?
B12A C7A B11A B10A -39.5(4) . . . . ?
B2A C7A B11A B10A 101.1(4) . . . . ?
C13A C7A B11A B12A -114.1(6) . . . . ?
C6A C7A B11A B12A 103.3(5) . . . . ?
B8A C7A B11A B12A 36.3(4) . . . . ?
B2A C7A B11A B12A 140.6(4) . . . . ?
C6A B2A B11A C7A 35.7(4) . . . . ?
B3A B2A B11A C7A 134.9(5) . . . . ?
B1A B2A B11A C7A 98.8(4) . . . . ?
C6A B2A B11A B3A -99.2(4) . . . . ?
C7A B2A B11A B3A -134.9(5) . . . . ?
B1A B2A B11A B3A -36.1(4) . . . . ?
C6A B2A B11A B10A -61.0(5) . . . . ?
C7A B2A B11A B10A -96.8(5) . . . . ?
B3A B2A B11A B10A 38.2(4) . . . . ?
B1A B2A B11A B10A 2.1(5) . . . . ?
C6A B2A B11A B12A 1.5(5) . . . . ?
C7A B2A B11A B12A -34.2(4) . . . . ?
B3A B2A B11A B12A 100.7(5) . . . . ?
B1A B2A B11A B12A 64.6(5) . . . . ?
B2A B3A B11A C7A -38.7(4) . . . . ?
B4A B3A B11A C7A 61.5(5) . . . . ?
B1A B3A B11A C7A -2.6(6) . . . . ?
B10A B3A B11A C7A 98.2(5) . . . . ?
B4A B3A B11A B2A 100.2(4) . . . . ?
B1A B3A B11A B2A 36.1(4) . . . . ?
B10A B3A B11A B2A 136.9(5) . . . . ?
B2A B3A B11A B10A -136.9(5) . . . . ?
B4A B3A B11A B10A -36.7(4) . . . . ?
B1A B3A B11A B10A -100.8(5) . . . . ?
B2A B3A B11A B12A -99.3(4) . . . . ?
B4A B3A B11A B12A 0.9(5) . . . . ?
B1A B3A B11A B12A -63.2(5) . . . . ?
B10A B3A B11A B12A 37.6(4) . . . . ?
B9A B10A B11A C7A 2.3(5) . . . . ?
B4A B10A B11A C7A -62.1(5) . . . . ?
B12A B10A B11A C7A 38.7(4) . . . . ?
B3A B10A B11A C7A -98.9(4) . . . . ?
B9A B10A B11A B2A 63.4(5) . . . . ?
B4A B10A B11A B2A -1.1(6) . . . . ?
B12A B10A B11A B2A 99.8(5) . . . . ?
B3A B10A B11A B2A -37.8(4) . . . . ?
B9A B10A B11A B3A 101.2(5) . . . . ?
B4A B10A B11A B3A 36.7(4) . . . . ?
B12A B10A B11A B3A 137.6(5) . . . . ?
B9A B10A B11A B12A -36.4(4) . . . . ?
B4A B10A B11A B12A -100.8(5) . . . . ?
B3A B10A B11A B12A -137.6(5) . . . . ?
C13A C7A B12A B8A -107.5(6) . . . . ?
C6A C7A B12A B8A 39.3(4) . . . . ?
B2A C7A B12A B8A 104.2(5) . . . . ?
B11A C7A B12A B8A 141.7(4) . . . . ?
C13A C7A B12A B9A -146.7(6) . . . . ?
C6A C7A B12A B9A 0.1(6) . . . . ?
B8A C7A B12A B9A -39.3(4) . . . . ?
B2A C7A B12A B9A 65.0(6) . . . . ?
B11A C7A B12A B9A 102.5(5) . . . . ?
C13A C7A B12A B10A 150.8(6) . . . . ?
C6A C7A B12A B10A -62.4(6) . . . . ?
B8A C7A B12A B10A -101.7(5) . . . . ?
B2A C7A B12A B10A 2.5(6) . . . . ?
B11A C7A B12A B10A 40.0(5) . . . . ?
C13A C7A B12A B11A 110.8(7) . . . . ?
C6A C7A B12A B11A -102.4(4) . . . . ?
B8A C7A B12A B11A -141.7(4) . . . . ?
B2A C7A B12A B11A -37.5(4) . . . . ?
C6A B8A B12A C7A -36.9(4) . . . . ?
B9A B8A B12A C7A -135.6(4) . . . . ?
B5A B8A B12A C7A -98.6(4) . . . . ?
C7A B8A B12A B9A 135.6(4) . . . . ?
C6A B8A B12A B9A 98.6(4) . . . . ?
B5A B8A B12A B9A 37.0(4) . . . . ?
C7A B8A B12A B10A 97.5(5) . . . . ?
C6A B8A B12A B10A 60.6(6) . . . . ?
B9A B8A B12A B10A -38.1(4) . . . . ?
B5A B8A B12A B10A -1.1(6) . . . . ?
C7A B8A B12A B11A 34.0(4) . . . . ?
C6A B8A B12A B11A -3.0(6) . . . . ?
B9A B8A B12A B11A -101.6(5) . . . . ?
B5A B8A B12A B11A -64.6(5) . . . . ?
B8A B9A B12A C7A 38.2(4) . . . . ?
B10A B9A B12A C7A -99.1(4) . . . . ?
B5A B9A B12A C7A 1.2(6) . . . . ?
B4A B9A B12A C7A -61.6(6) . . . . ?
B10A B9A B12A B8A -137.3(4) . . . . ?
B5A B9A B12A B8A -37.0(4) . . . . ?
B4A B9A B12A B8A -99.8(5) . . . . ?
B8A B9A B12A B10A 137.3(4) . . . . ?
B5A B9A B12A B10A 100.3(5) . . . . ?
B4A B9A B12A B10A 37.5(4) . . . . ?
B8A B9A B12A B11A 100.4(4) . . . . ?
B10A B9A B12A B11A -36.9(4) . . . . ?
B5A B9A B12A B11A 63.4(6) . . . . ?
B4A B9A B12A B11A 0.6(6) . . . . ?
B9A B10A B12A C7A 99.3(5) . . . . ?
B4A B10A B12A C7A 61.5(6) . . . . ?
B3A B10A B12A C7A -1.7(7) . . . . ?
B11A B10A B12A C7A -39.6(4) . . . . ?
B9A B10A B12A B8A 38.4(4) . . . . ?
B4A B10A B12A B8A 0.5(6) . . . . ?
B3A B10A B12A B8A -62.7(6) . . . . ?
B11A B10A B12A B8A -100.6(5) . . . . ?
B4A B10A B12A B9A -37.9(4) . . . . ?
B3A B10A B12A B9A -101.1(5) . . . . ?
B11A B10A B12A B9A -138.9(5) . . . . ?
B9A B10A B12A B11A 138.9(5) . . . . ?
B4A B10A B12A B11A 101.0(5) . . . . ?
B3A B10A B12A B11A 37.8(5) . . . . ?
B2A B11A B12A C7A 34.5(4) . . . . ?
B3A B11A B12A C7A 96.7(4) . . . . ?
B10A B11A B12A C7A 134.4(5) . . . . ?
C7A B11A B12A B8A -33.6(4) . . . . ?
B2A B11A B12A B8A 0.9(5) . . . . ?
B3A B11A B12A B8A 63.1(5) . . . . ?
B10A B11A B12A B8A 100.9(5) . . . . ?
C7A B11A B12A B9A -97.6(5) . . . . ?
B2A B11A B12A B9A -63.1(5) . . . . ?
B3A B11A B12A B9A -0.9(6) . . . . ?
B10A B11A B12A B9A 36.8(4) . . . . ?
C7A B11A B12A B10A -134.4(5) . . . . ?
B2A B11A B12A B10A -99.9(5) . . . . ?
B3A B11A B12A B10A -37.7(4) . . . . ?
C6A B1A C14A C15A 72.3(6) . . . . ?
B3A B1A C14A C15A -148.9(5) . . . . ?
B4A B1A C14A C15A -70.3(7) . . . . ?
B2A B1A C14A C15A 139.1(4) . . . . ?
B5A B1A C14A C15A 3.8(7) . . . . ?
C6A B1A C14A C18A -107.3(5) . . . . ?
B3A B1A C14A C18A 31.5(7) . . . . ?
B4A B1A C14A C18A 110.1(6) . . . . ?
B2A B1A C14A C18A -40.6(6) . . . . ?
B5A B1A C14A C18A -175.8(4) . . . . ?
C18A C14A C15A C16A -0.4(5) . . . . ?
B1A C14A C15A C16A 180.0(4) . . . . ?
C14A C15A C16A C17A 1.2(5) . . . . ?
C14A C15A C16A C23A 120.7(4) . . . . ?
C14A C15A C16A C24A -116.4(4) . . . . ?
C15A C16A C17A C22A 177.2(5) . . . . ?
C23A C16A C17A C22A 57.5(6) . . . . ?
C24A C16A C17A C22A -65.4(7) . . . . ?
C15A C16A C17A C18A -1.5(5) . . . . ?
C23A C16A C17A C18A -121.2(4) . . . . ?
C24A C16A C17A C18A 115.8(4) . . . . ?
C22A C17A C18A C19A 0.1(6) . . . . ?
C16A C17A C18A C19A 179.0(4) . . . . ?
C22A C17A C18A C14A -177.5(4) . . . . ?
C16A C17A C18A C14A 1.4(5) . . . . ?
C15A C14A C18A C19A -177.9(4) . . . . ?
B1A C14A C18A C19A 1.8(7) . . . . ?
C15A C14A C18A C17A -0.7(4) . . . . ?
B1A C14A C18A C17A 179.0(4) . . . . ?
C17A C18A C19A C20A -0.5(6) . . . . ?
C14A C18A C19A C20A 176.5(4) . . . . ?
C18A C19A C20A C21A 0.5(6) . . . . ?
C18A C19A C20A C25A -177.7(4) . . . . ?
C19A C20A C21A C22A -0.1(7) . . . . ?
C25A C20A C21A C22A 178.1(4) . . . . ?
C18A C17A C22A C21A 0.3(7) . . . . ?
C16A C17A C22A C21A -178.4(5) . . . . ?
C20A C21A C22A C17A -0.2(7) . . . . ?
C21A C20A C25A C31A -125.6(10) . . . . ?
C19A C20A C25A C31A 52.5(10) . . . . ?
C21A C20A C25A C28A -66.7(8) . . . . ?
C19A C20A C25A C28A 111.4(8) . . . . ?
C21A C20A C25A C27A 54.0(9) . . . . ?
C19A C20A C25A C27A -127.8(8) . . . . ?
C21A C20A C25A C29A 117.1(9) . . . . ?
C19A C20A C25A C29A -64.8(9) . . . . ?
C21A C20A C25A C30A -0.8(11) . . . . ?
C19A C20A C25A C30A 177.4(10) . . . . ?
C21A C20A C25A C26A 172.2(8) . . . . ?
C19A C20A C25A C26A -9.6(9) . . . . ?
C14B B1B C2B C7B -146.7(4) . . . . ?
B4B B1B C2B C7B 62.8(4) . . . . ?
B3B B1B C2B C7B 103.2(4) . . . . ?
B5B B1B C2B C7B 1.2(5) . . . . ?
B6B B1B C2B C7B -38.0(3) . . . . ?
C14B B1B C2B B6B -108.7(4) . . . . ?
B4B B1B C2B B6B 100.9(4) . . . . ?
B3B B1B C2B B6B 141.2(4) . . . . ?
B5B B1B C2B B6B 39.3(3) . . . . ?
C14B B1B C2B B3B 110.1(5) . . . . ?
B4B B1B C2B B3B -40.4(3) . . . . ?
B5B B1B C2B B3B -102.0(4) . . . . ?
B6B B1B C2B B3B -141.2(4) . . . . ?
C14B B1B C2B B11B 146.0(4) . . . . ?
B4B B1B C2B B11B -4.5(5) . . . . ?
B3B B1B C2B B11B 35.9(4) . . . . ?
B5B B1B C2B B11B -66.0(4) . . . . ?
B6B B1B C2B B11B -105.3(4) . . . . ?
C7B C2B B3B B11B 37.3(4) . . . . ?
B6B C2B B3B B11B 105.1(4) . . . . ?
B1B C2B B3B B11B 143.2(4) . . . . ?
C7B C2B B3B B10B -2.6(5) . . . . ?
B6B C2B B3B B10B 65.2(5) . . . . ?
B11B C2B B3B B10B -39.9(4) . . . . ?
B1B C2B B3B B10B 103.3(4) . . . . ?
C7B C2B B3B B4B -65.0(4) . . . . ?
B6B C2B B3B B4B 2.8(5) . . . . ?
B11B C2B B3B B4B -102.3(4) . . . . ?
B1B C2B B3B B4B 40.9(3) . . . . ?
C7B C2B B3B B1B -105.9(4) . . . . ?
B6B C2B B3B B1B -38.1(3) . . . . ?
B11B C2B B3B B1B -143.2(4) . . . . ?
C14B B1B B3B C2B -108.7(4) . . . . ?
B4B B1B B3B C2B 133.0(4) . . . . ?
B5B B1B B3B C2B 94.9(4) . . . . ?
B6B B1B B3B C2B 33.2(3) . . . . ?
C14B B1B B3B B11B -141.7(4) . . . . ?
C2B B1B B3B B11B -33.0(3) . . . . ?
B4B B1B B3B B11B 100.0(4) . . . . ?
B5B B1B B3B B11B 61.9(5) . . . . ?
B6B B1B B3B B11B 0.2(5) . . . . ?
C14B B1B B3B B10B 155.0(4) . . . . ?
C2B B1B B3B B10B -96.3(4) . . . . ?
B4B B1B B3B B10B 36.7(4) . . . . ?
B5B B1B B3B B10B -1.4(5) . . . . ?
B6B B1B B3B B10B -63.1(5) . . . . ?
C14B B1B B3B B4B 118.3(5) . . . . ?
C2B B1B B3B B4B -133.0(4) . . . . ?
B5B B1B B3B B4B -38.1(4) . . . . ?
B6B B1B B3B B4B -99.8(4) . . . . ?
C2B B3B B4B B9B 61.8(5) . . . . ?
B11B B3B B4B B9B -0.1(5) . . . . ?
B10B B3B B4B B9B -37.0(4) . . . . ?
B1B B3B B4B B9B 102.3(4) . . . . ?
C2B B3B B4B B10B 98.8(4) . . . . ?
B11B B3B B4B B10B 36.9(4) . . . . ?
B1B B3B B4B B10B 139.3(4) . . . . ?
C2B B3B B4B B1B -40.5(3) . . . . ?
B11B B3B B4B B1B -102.4(4) . . . . ?
B10B B3B B4B B1B -139.3(4) . . . . ?
C2B B3B B4B B5B -1.9(5) . . . . ?
B11B B3B B4B B5B -63.8(5) . . . . ?
B10B B3B B4B B5B -100.7(4) . . . . ?
B1B B3B B4B B5B 38.6(3) . . . . ?
C14B B1B B4B B9B 152.2(5) . . . . ?
C2B B1B B4B B9B -60.2(5) . . . . ?
B3B B1B B4B B9B -99.6(4) . . . . ?
B5B B1B B4B B9B 37.3(4) . . . . ?
B6B B1B B4B B9B -0.8(5) . . . . ?
C14B B1B B4B B10B -144.6(5) . . . . ?
C2B B1B B4B B10B 2.9(5) . . . . ?
B3B B1B B4B B10B -36.5(4) . . . . ?
B5B B1B B4B B10B 100.5(5) . . . . ?
B6B B1B B4B B10B 62.4(5) . . . . ?
C14B B1B B4B B3B -108.2(5) . . . . ?
C2B B1B B4B B3B 39.4(3) . . . . ?
B5B B1B B4B B3B 136.9(4) . . . . ?
B6B B1B B4B B3B 98.8(4) . . . . ?
C14B B1B B4B B5B 114.9(5) . . . . ?
C2B B1B B4B B5B -97.6(4) . . . . ?
B3B B1B B4B B5B -136.9(4) . . . . ?
B6B B1B B4B B5B -38.1(3) . . . . ?
B9B B4B B5B B6B -99.6(4) . . . . ?
B10B B4B B5B B6B -62.6(5) . . . . ?
B3B B4B B5B B6B 0.5(5) . . . . ?
B1B B4B B5B B6B 39.1(3) . . . . ?
B9B B4B B5B B8B -36.6(4) . . . . ?
B10B B4B B5B B8B 0.5(5) . . . . ?
B3B B4B B5B B8B 63.5(5) . . . . ?
B1B B4B B5B B8B 102.1(4) . . . . ?
B10B B4B B5B B9B 37.1(4) . . . . ?
B3B B4B B5B B9B 100.1(4) . . . . ?
B1B B4B B5B B9B 138.7(4) . . . . ?
B9B B4B B5B B1B -138.7(4) . . . . ?
B10B B4B B5B B1B -101.6(4) . . . . ?
B3B B4B B5B B1B -38.6(3) . . . . ?
C14B B1B B5B B6B 106.9(5) . . . . ?
C2B B1B B5B B6B -38.5(3) . . . . ?
B4B B1B B5B B6B -136.2(4) . . . . ?
B3B B1B B5B B6B -98.2(4) . . . . ?
C14B B1B B5B B8B 143.7(4) . . . . ?
C2B B1B B5B B8B -1.7(5) . . . . ?
B4B B1B B5B B8B -99.4(4) . . . . ?
B3B B1B B5B B8B -61.4(5) . . . . ?
B6B B1B B5B B8B 36.8(4) . . . . ?
C14B B1B B5B B4B -116.8(5) . . . . ?
C2B B1B B5B B4B 97.8(4) . . . . ?
B3B B1B B5B B4B 38.0(4) . . . . ?
B6B B1B B5B B4B 136.2(4) . . . . ?
C14B B1B B5B B9B -153.4(5) . . . . ?
C2B B1B B5B B9B 61.2(4) . . . . ?
B4B B1B B5B B9B -36.6(4) . . . . ?
B3B B1B B5B B9B 1.4(5) . . . . ?
B6B B1B B5B B9B 99.7(4) . . . . ?
B3B C2B B6B C7B -102.0(4) . . . . ?
B11B C2B B6B C7B -32.6(4) . . . . ?
B1B C2B B6B C7B -140.0(4) . . . . ?
C7B C2B B6B B5B 99.5(4) . . . . ?
B3B C2B B6B B5B -2.5(5) . . . . ?
B11B C2B B6B B5B 66.9(4) . . . . ?
B1B C2B B6B B5B -40.5(3) . . . . ?
C7B C2B B6B B8B 36.7(4) . . . . ?
B3B C2B B6B B8B -65.3(5) . . . . ?
B11B C2B B6B B8B 4.1(5) . . . . ?
B1B C2B B6B B8B -103.3(4) . . . . ?
C7B C2B B6B B1B 140.0(4) . . . . ?
B3B C2B B6B B1B 38.0(3) . . . . ?
B11B C2B B6B B1B 107.4(4) . . . . ?
B8B B5B B6B C2B -99.2(4) . . . . ?
B4B B5B B6B C2B 1.1(4) . . . . ?
B9B B5B B6B C2B -61.3(4) . . . . ?
B1B B5B B6B C2B 39.8(3) . . . . ?
B8B B5B B6B C7B -38.8(3) . . . . ?
B4B B5B B6B C7B 61.5(4) . . . . ?
B9B B5B B6B C7B -0.9(5) . . . . ?
B1B B5B B6B C7B 100.2(4) . . . . ?
B4B B5B B6B B8B 100.3(4) . . . . ?
B9B B5B B6B B8B 37.9(4) . . . . ?
B1B B5B B6B B8B 139.0(4) . . . . ?
B8B B5B B6B B1B -139.0(4) . . . . ?
B4B B5B B6B B1B -38.7(3) . . . . ?
B9B B5B B6B B1B -101.1(4) . . . . ?
C14B B1B B6B C2B 109.1(4) . . . . ?
B4B B1B B6B C2B -95.5(4) . . . . ?
B3B B1B B6B C2B -33.3(3) . . . . ?
B5B B1B B6B C2B -134.0(4) . . . . ?
C14B B1B B6B C7B 143.7(4) . . . . ?
C2B B1B B6B C7B 34.6(3) . . . . ?
B4B B1B B6B C7B -60.9(4) . . . . ?
B3B B1B B6B C7B 1.4(4) . . . . ?
B5B B1B B6B C7B -99.3(4) . . . . ?
C14B B1B B6B B5B -116.9(4) . . . . ?
C2B B1B B6B B5B 134.0(4) . . . . ?
B4B B1B B6B B5B 38.5(3) . . . . ?
B3B B1B B6B B5B 100.7(4) . . . . ?
C14B B1B B6B B8B -154.0(4) . . . . ?
C2B B1B B6B B8B 96.9(4) . . . . ?
B4B B1B B6B B8B 1.4(5) . . . . ?
B3B B1B B6B B8B 63.6(4) . . . . ?
B5B B1B B6B B8B -37.1(3) . . . . ?
B6B C2B C7B C13B 105.9(5) . . . . ?
B3B C2B C7B C13B -146.5(5) . . . . ?
B11B C2B C7B C13B -108.5(5) . . . . ?
B1B C2B C7B C13B 144.6(4) . . . . ?
B6B C2B C7B B11B -145.6(4) . . . . ?
B3B C2B C7B B11B -38.0(4) . . . . ?
B1B C2B C7B B11B -106.9(4) . . . . ?
B6B C2B C7B B12B -106.1(4) . . . . ?
B3B C2B C7B B12B 1.5(5) . . . . ?
B11B C2B C7B B12B 39.5(4) . . . . ?
B1B C2B C7B B12B -67.4(5) . . . . ?
B3B C2B C7B B6B 107.6(4) . . . . ?
B11B C2B C7B B6B 145.6(4) . . . . ?
B1B C2B C7B B6B 38.7(3) . . . . ?
B6B C2B C7B B8B -39.1(4) . . . . ?
B3B C2B C7B B8B 68.5(5) . . . . ?
B11B C2B C7B B8B 106.5(5) . . . . ?
B1B C2B C7B B8B -0.3(5) . . . . ?
C2B B6B C7B C13B -107.8(5) . . . . ?
B5B B6B C7B C13B 153.8(4) . . . . ?
B8B B6B C7B C13B 114.4(5) . . . . ?
B1B B6B C7B C13B -143.0(4) . . . . ?
B5B B6B C7B C2B -98.4(4) . . . . ?
B8B B6B C7B C2B -137.8(4) . . . . ?
B1B B6B C7B C2B -35.1(3) . . . . ?
C2B B6B C7B B11B 32.6(4) . . . . ?
B5B B6B C7B B11B -65.8(5) . . . . ?
B8B B6B C7B B11B -105.2(5) . . . . ?
B1B B6B C7B B11B -2.5(5) . . . . ?
C2B B6B C7B B12B 100.5(4) . . . . ?
B5B B6B C7B B12B 2.1(5) . . . . ?
B8B B6B C7B B12B -37.3(4) . . . . ?
B1B B6B C7B B12B 65.3(4) . . . . ?
C2B B6B C7B B8B 137.8(4) . . . . ?
B5B B6B C7B B8B 39.4(4) . . . . ?
B1B B6B C7B B8B 102.6(4) . . . . ?
C13B C7B B8B B9B 153.5(5) . . . . ?
C2B C7B B8B B9B -63.6(4) . . . . ?
B11B C7B B8B B9B 2.7(5) . . . . ?
B12B C7B B8B B9B 39.3(4) . . . . ?
B6B C7B B8B B9B -101.9(4) . . . . ?
C13B C7B B8B B6B -104.6(5) . . . . ?
C2B C7B B8B B6B 38.3(4) . . . . ?
B11B C7B B8B B6B 104.6(4) . . . . ?
B12B C7B B8B B6B 141.2(4) . . . . ?
C13B C7B B8B B5B -143.6(5) . . . . ?
C2B C7B B8B B5B -0.7(5) . . . . ?
B11B C7B B8B B5B 65.6(5) . . . . ?
B12B C7B B8B B5B 102.2(4) . . . . ?
B6B C7B B8B B5B -39.0(4) . . . . ?
C13B C7B B8B B12B 114.2(5) . . . . ?
C2B C7B B8B B12B -103.0(4) . . . . ?
B11B C7B B8B B12B -36.6(4) . . . . ?
B6B C7B B8B B12B -141.2(4) . . . . ?
C2B B6B B8B C7B -36.2(4) . . . . ?
B5B B6B B8B C7B -135.4(4) . . . . ?
B1B B6B B8B C7B -98.3(4) . . . . ?
C2B B6B B8B B9B 60.6(5) . . . . ?
C7B B6B B8B B9B 96.8(4) . . . . ?
B5B B6B B8B B9B -38.6(4) . . . . ?
B1B B6B B8B B9B -1.5(5) . . . . ?
C2B B6B B8B B5B 99.2(4) . . . . ?
C7B B6B B8B B5B 135.4(4) . . . . ?
B1B B6B B8B B5B 37.1(3) . . . . ?
C2B B6B B8B B12B -2.3(5) . . . . ?
C7B B6B B8B B12B 33.9(4) . . . . ?
B5B B6B B8B B12B -101.5(4) . . . . ?
B1B B6B B8B B12B -64.4(5) . . . . ?
B6B B5B B8B C7B 38.6(3) . . . . ?
B4B B5B B8B C7B -61.7(5) . . . . ?
B9B B5B B8B C7B -98.3(4) . . . . ?
B1B B5B B8B C7B 1.5(5) . . . . ?
B6B B5B B8B B9B 136.9(4) . . . . ?
B4B B5B B8B B9B 36.6(4) . . . . ?
B1B B5B B8B B9B 99.8(4) . . . . ?
B4B B5B B8B B6B -100.3(4) . . . . ?
B9B B5B B8B B6B -136.9(4) . . . . ?
B1B B5B B8B B6B -37.1(3) . . . . ?
B6B B5B B8B B12B 99.7(4) . . . . ?
B4B B5B B8B B12B -0.6(5) . . . . ?
B9B B5B B8B B12B -37.2(4) . . . . ?
B1B B5B B8B B12B 62.6(5) . . . . ?
C7B B8B B9B B10B -1.6(5) . . . . ?
B6B B8B B9B B10B -63.1(5) . . . . ?
B5B B8B B9B B10B -101.4(4) . . . . ?
B12B B8B B9B B10B 37.0(4) . . . . ?
C7B B8B B9B B12B -38.6(3) . . . . ?
B6B B8B B9B B12B -100.1(4) . . . . ?
B5B B8B B9B B12B -138.4(4) . . . . ?
C7B B8B B9B B4B 62.5(5) . . . . ?
B6B B8B B9B B4B 1.0(5) . . . . ?
B5B B8B B9B B4B -37.3(4) . . . . ?
B12B B8B B9B B4B 101.1(5) . . . . ?
C7B B8B B9B B5B 99.8(4) . . . . ?
B6B B8B B9B B5B 38.3(3) . . . . ?
B12B B8B B9B B5B 138.4(4) . . . . ?
B3B B4B B9B B10B 37.1(4) . . . . ?
B1B B4B B9B B10B 100.9(4) . . . . ?
B5B B4B B9B B10B 138.3(4) . . . . ?
B10B B4B B9B B12B -36.9(4) . . . . ?
B3B B4B B9B B12B 0.2(6) . . . . ?
B1B B4B B9B B12B 64.0(5) . . . . ?
B5B B4B B9B B12B 101.4(5) . . . . ?
B10B B4B B9B B8B -101.0(5) . . . . ?
B3B B4B B9B B8B -63.9(5) . . . . ?
B1B B4B B9B B8B -0.1(6) . . . . ?
B5B B4B B9B B8B 37.2(4) . . . . ?
B10B B4B B9B B5B -138.3(4) . . . . ?
B3B B4B B9B B5B -101.1(4) . . . . ?
B1B B4B B9B B5B -37.3(4) . . . . ?
B6B B5B B9B B10B 62.7(5) . . . . ?
B8B B5B B9B B10B 100.9(5) . . . . ?
B4B B5B B9B B10B -37.7(4) . . . . ?
B1B B5B B9B B10B -0.9(6) . . . . ?
B6B B5B B9B B12B -0.6(5) . . . . ?
B8B B5B B9B B12B 37.6(4) . . . . ?
B4B B5B B9B B12B -101.0(5) . . . . ?
B1B B5B B9B B12B -64.2(5) . . . . ?
B6B B5B B9B B8B -38.2(4) . . . . ?
B4B B5B B9B B8B -138.6(4) . . . . ?
B1B B5B B9B B8B -101.8(4) . . . . ?
B6B B5B B9B B4B 100.4(4) . . . . ?
B8B B5B B9B B4B 138.6(4) . . . . ?
B1B B5B B9B B4B 36.7(4) . . . . ?
B8B B9B B10B B12B -37.4(4) . . . . ?
B4B B9B B10B B12B -138.7(4) . . . . ?
B5B B9B B10B B12B -101.1(5) . . . . ?
B12B B9B B10B B11B 37.4(4) . . . . ?
B8B B9B B10B B11B 0.0(5) . . . . ?
B4B B9B B10B B11B -101.3(4) . . . . ?
B5B B9B B10B B11B -63.7(5) . . . . ?
B12B B9B B10B B3B 101.1(5) . . . . ?
B8B B9B B10B B3B 63.8(5) . . . . ?
B4B B9B B10B B3B -37.5(4) . . . . ?
B5B B9B B10B B3B 0.1(6) . . . . ?
B12B B9B B10B B4B 138.7(4) . . . . ?
B8B B9B B10B B4B 101.3(4) . . . . ?
B5B B9B B10B B4B 37.6(4) . . . . ?
C2B B3B B10B B12B 2.8(5) . . . . ?
B11B B3B B10B B12B -37.0(4) . . . . ?
B4B B3B B10B B12B 101.5(5) . . . . ?
B1B B3B B10B B12B 64.8(5) . . . . ?
C2B B3B B10B B11B 39.8(4) . . . . ?
B4B B3B B10B B11B 138.4(4) . . . . ?
B1B B3B B10B B11B 101.8(4) . . . . ?
C2B B3B B10B B9B -61.2(5) . . . . ?
B11B B3B B10B B9B -100.9(5) . . . . ?
B4B B3B B10B B9B 37.5(4) . . . . ?
B1B B3B B10B B9B 0.9(6) . . . . ?
C2B B3B B10B B4B -98.6(4) . . . . ?
B11B B3B B10B B4B -138.4(4) . . . . ?
B1B B3B B10B B4B -36.6(4) . . . . ?
B9B B4B B10B B12B 37.3(4) . . . . ?
B3B B4B B10B B12B -100.8(5) . . . . ?
B1B B4B B10B B12B -64.1(5) . . . . ?
B5B B4B B10B B12B -0.2(6) . . . . ?
B9B B4B B10B B11B 100.8(5) . . . . ?
B3B B4B B10B B11B -37.4(4) . . . . ?
B1B B4B B10B B11B -0.7(6) . . . . ?
B5B B4B B10B B11B 63.3(5) . . . . ?
B3B B4B B10B B9B -138.1(5) . . . . ?
B1B B4B B10B B9B -101.4(5) . . . . ?
B5B B4B B10B B9B -37.5(4) . . . . ?
B9B B4B B10B B3B 138.1(5) . . . . ?
B1B B4B B10B B3B 36.7(4) . . . . ?
B5B B4B B10B B3B 100.7(4) . . . . ?
C13B C7B B11B C2B 107.5(5) . . . . ?
B12B C7B B11B C2B -137.3(4) . . . . ?
B6B C7B B11B C2B -32.2(4) . . . . ?
B8B C7B B11B C2B -100.3(4) . . . . ?
C13B C7B B11B B12B -115.2(5) . . . . ?
C2B C7B B11B B12B 137.3(4) . . . . ?
B6B C7B B11B B12B 105.1(4) . . . . ?
B8B C7B B11B B12B 36.9(4) . . . . ?
C13B C7B B11B B10B -154.9(5) . . . . ?
C2B C7B B11B B10B 97.7(4) . . . . ?
B12B C7B B11B B10B -39.6(4) . . . . ?
B6B C7B B11B B10B 65.5(5) . . . . ?
B8B C7B B11B B10B -2.7(5) . . . . ?
C13B C7B B11B B3B 142.3(5) . . . . ?
C2B C7B B11B B3B 34.8(3) . . . . ?
B12B C7B B11B B3B -102.5(4) . . . . ?
B6B C7B B11B B3B 2.6(5) . . . . ?
B8B C7B B11B B3B -65.5(5) . . . . ?
B6B C2B B11B C7B 33.0(4) . . . . ?
B3B C2B B11B C7B 139.7(4) . . . . ?
B1B C2B B11B C7B 103.6(4) . . . . ?
C7B C2B B11B B12B -37.1(4) . . . . ?
B6B C2B B11B B12B -4.1(5) . . . . ?
B3B C2B B11B B12B 102.6(5) . . . . ?
B1B C2B B11B B12B 66.5(5) . . . . ?
C7B C2B B11B B10B -99.5(4) . . . . ?
B6B C2B B11B B10B -66.5(5) . . . . ?
B3B C2B B11B B10B 40.3(4) . . . . ?
B1B C2B B11B B10B 4.1(5) . . . . ?
C7B C2B B11B B3B -139.7(4) . . . . ?
B6B C2B B11B B3B -106.8(4) . . . . ?
B1B C2B B11B B3B -36.2(4) . . . . ?
B12B B10B B11B C7B 39.2(4) . . . . ?
B9B B10B B11B C7B 1.5(5) . . . . ?
B3B B10B B11B C7B -99.4(4) . . . . ?
B4B B10B B11B C7B -62.1(5) . . . . ?
B12B B10B B11B C2B 99.4(4) . . . . ?
B9B B10B B11B C2B 61.7(5) . . . . ?
B3B B10B B11B C2B -39.3(3) . . . . ?
B4B B10B B11B C2B -1.9(5) . . . . ?
B9B B10B B11B B12B -37.7(4) . . . . ?
B3B B10B B11B B12B -138.7(4) . . . . ?
B4B B10B B11B B12B -101.3(5) . . . . ?
B12B B10B B11B B3B 138.7(4) . . . . ?
B9B B10B B11B B3B 101.0(4) . . . . ?
B4B B10B B11B B3B 37.3(4) . . . . ?
C2B B3B B11B C7B -34.7(3) . . . . ?
B10B B3B B11B C7B 99.3(4) . . . . ?
B4B B3B B11B C7B 62.1(5) . . . . ?
B1B B3B B11B C7B -1.6(5) . . . . ?
B10B B3B B11B C2B 133.9(4) . . . . ?
B4B B3B B11B C2B 96.7(4) . . . . ?
B1B B3B B11B C2B 33.0(3) . . . . ?
C2B B3B B11B B12B -96.8(4) . . . . ?
B10B B3B B11B B12B 37.1(4) . . . . ?
B4B B3B B11B B12B -0.1(5) . . . . ?
B1B B3B B11B B12B -63.8(5) . . . . ?
C2B B3B B11B B10B -133.9(4) . . . . ?
B4B B3B B11B B10B -37.2(4) . . . . ?
B1B B3B B11B B10B -100.9(4) . . . . ?
C13B C7B B12B B11B 106.2(5) . . . . ?
C2B C7B B12B B11B -39.3(4) . . . . ?
B6B C7B B12B B11B -104.5(4) . . . . ?
B8B C7B B12B B11B -141.6(4) . . . . ?
C13B C7B B12B B10B 145.9(5) . . . . ?
C2B C7B B12B B10B 0.4(5) . . . . ?
B11B C7B B12B B10B 39.7(4) . . . . ?
B6B C7B B12B B10B -64.8(5) . . . . ?
B8B C7B B12B B10B -101.9(5) . . . . ?
C13B C7B B12B B9B -151.7(5) . . . . ?
C2B C7B B12B B9B 62.8(5) . . . . ?
B11B C7B B12B B9B 102.1(5) . . . . ?
B6B C7B B12B B9B -2.4(5) . . . . ?
B8B C7B B12B B9B -39.5(4) . . . . ?
C13B C7B B12B B8B -112.2(6) . . . . ?
C2B C7B B12B B8B 102.3(4) . . . . ?
B11B C7B B12B B8B 141.6(4) . . . . ?
B6B C7B B12B B8B 37.1(4) . . . . ?
C2B B11B B12B C7B 36.6(3) . . . . ?
B10B B11B B12B C7B 134.8(4) . . . . ?
B3B B11B B12B C7B 97.6(4) . . . . ?
C7B B11B B12B B10B -134.8(4) . . . . ?
C2B B11B B12B B10B -98.3(4) . . . . ?
B3B B11B B12B B10B -37.2(4) . . . . ?
C7B B11B B12B B9B -97.4(4) . . . . ?
C2B B11B B12B B9B -60.8(5) . . . . ?
B10B B11B B12B B9B 37.4(4) . . . . ?
B3B B11B B12B B9B 0.2(6) . . . . ?
C7B B11B B12B B8B -34.2(4) . . . . ?
C2B B11B B12B B8B 2.4(6) . . . . ?
B10B B11B B12B B8B 100.7(5) . . . . ?
B3B B11B B12B B8B 63.4(5) . . . . ?
B11B B10B B12B C7B -39.1(4) . . . . ?
B9B B10B B12B C7B 98.9(4) . . . . ?
B3B B10B B12B C7B -2.0(6) . . . . ?
B4B B10B B12B C7B 61.8(5) . . . . ?
B9B B10B B12B B11B 138.1(4) . . . . ?
B3B B10B B12B B11B 37.1(4) . . . . ?
B4B B10B B12B B11B 100.9(4) . . . . ?
B11B B10B B12B B9B -138.1(4) . . . . ?
B3B B10B B12B B9B -100.9(4) . . . . ?
B4B B10B B12B B9B -37.2(4) . . . . ?
B11B B10B B12B B8B -101.1(4) . . . . ?
B9B B10B B12B B8B 37.0(4) . . . . ?
B3B B10B B12B B8B -64.0(5) . . . . ?
B4B B10B B12B B8B -0.2(6) . . . . ?
B10B B9B B12B C7B -99.4(4) . . . . ?
B8B B9B B12B C7B 39.2(4) . . . . ?
B4B B9B B12B C7B -62.1(5) . . . . ?
B5B B9B B12B C7B 1.8(6) . . . . ?
B10B B9B B12B B11B -37.5(4) . . . . ?
B8B B9B B12B B11B 101.0(4) . . . . ?
B4B B9B B12B B11B -0.3(6) . . . . ?
B5B B9B B12B B11B 63.6(5) . . . . ?
B8B B9B B12B B10B 138.5(4) . . . . ?
B4B B9B B12B B10B 37.3(4) . . . . ?
B5B B9B B12B B10B 101.1(4) . . . . ?
B10B B9B B12B B8B -138.5(4) . . . . ?
B4B B9B B12B B8B -101.3(4) . . . . ?
B5B B9B B12B B8B -37.4(4) . . . . ?
B9B B8B B12B C7B -134.8(4) . . . . ?
B6B B8B B12B C7B -34.2(4) . . . . ?
B5B B8B B12B C7B -97.3(4) . . . . ?
C7B B8B B12B B11B 34.1(4) . . . . ?
B9B B8B B12B B11B -100.7(5) . . . . ?
B6B B8B B12B B11B -0.1(6) . . . . ?
B5B B8B B12B B11B -63.1(5) . . . . ?
C7B B8B B12B B10B 97.7(4) . . . . ?
B9B B8B B12B B10B -37.0(4) . . . . ?
B6B B8B B12B B10B 63.6(5) . . . . ?
B5B B8B B12B B10B 0.5(5) . . . . ?
C7B B8B B12B B9B 134.8(4) . . . . ?
B6B B8B B12B B9B 100.6(4) . . . . ?
B5B B8B B12B B9B 37.5(4) . . . . ?
C2B B1B C14B C15B -74.2(6) . . . . ?
B4B B1B C14B C15B 68.3(6) . . . . ?
B3B B1B C14B C15B -5.7(7) . . . . ?
B5B B1B C14B C15B 145.8(5) . . . . ?
B6B B1B C14B C15B -142.1(5) . . . . ?
C2B B1B C14B C18B 108.0(5) . . . . ?
B4B B1B C14B C18B -109.4(5) . . . . ?
B3B B1B C14B C18B 176.6(4) . . . . ?
B5B B1B C14B C18B -31.9(7) . . . . ?
B6B B1B C14B C18B 40.2(6) . . . . ?
C18B C14B C15B C16B 1.5(5) . . . . ?
B1B C14B C15B C16B -176.6(4) . . . . ?
C14B C15B C16B C17B -0.7(5) . . . . ?
C14B C15B C16B C23B -120.0(5) . . . . ?
C14B C15B C16B C24B 118.3(5) . . . . ?
C15B C16B C17B C22B 179.3(4) . . . . ?
C23B C16B C17B C22B -61.9(6) . . . . ?
C24B C16B C17B C22B 61.9(6) . . . . ?
C15B C16B C17B C18B -0.4(4) . . . . ?
C23B C16B C17B C18B 118.4(4) . . . . ?
C24B C16B C17B C18B -117.8(4) . . . . ?
C22B C17B C18B C19B 2.3(6) . . . . ?
C16B C17B C18B C19B -177.9(4) . . . . ?
C22B C17B C18B C14B -178.5(4) . . . . ?
C16B C17B C18B C14B 1.3(4) . . . . ?
C15B C14B C18B C19B 177.4(4) . . . . ?
B1B C14B C18B C19B -4.6(7) . . . . ?
C15B C14B C18B C17B -1.7(5) . . . . ?
B1B C14B C18B C17B 176.3(4) . . . . ?
C17B C18B C19B C20B 0.6(6) . . . . ?
C14B C18B C19B C20B -178.4(4) . . . . ?
C18B C19B C20B C21B -2.8(6) . . . . ?
C18B C19B C20B C25B 175.6(4) . . . . ?
C19B C20B C21B C22B 2.2(6) . . . . ?
C25B C20B C21B C22B -176.2(4) . . . . ?
C18B C17B C22B C21B -3.0(6) . . . . ?
C16B C17B C22B C21B 177.3(4) . . . . ?
C20B C21B C22B C17B 0.7(7) . . . . ?
C21B C20B C25B C31B 75.3(10) . . . . ?
C19B C20B C25B C31B -103.1(10) . . . . ?
C21B C20B C25B C30B -162.2(10) . . . . ?
C19B C20B C25B C30B 19.4(10) . . . . ?
C21B C20B C25B C26B -118.8(8) . . . . ?
C19B C20B C25B C26B 62.8(8) . . . . ?
C21B C20B C25B C28B 7.6(10) . . . . ?
C19B C20B C25B C28B -170.8(9) . . . . ?
C21B C20B C25B C29B -42.4(10) . . . . ?
C19B C20B C25B C29B 139.2(9) . . . . ?
C21B C20B C25B C27B 126.3(8) . . . . ?
C19B C20B C25B C27B -52.1(8) . . . . ?
