#------------------------------------------------------------------------------
#$Date: 2016-03-26 02:23:48 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180137 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/34/7103478.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_7103478
loop_
_publ_author_name
'Hutton, Brian W'
'MacIntosh, Fraser'
'Ellis, David'
'Herisse, Fabien'
'Macgregor, Stuart A'
'McKay, David'
'Petrie-Armstrong, Victoria'
'Rosair, Georgina M'
'Perekalin, Dmitry S'
'Tricas, Hugo'
'Welch, Alan J'
_publ_section_title
;
 Unprecedented steric deformation of ortho-carborane.
;
_journal_issue                   42
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              5345
_journal_page_last               5347
_journal_paper_doi               10.1039/b810702e
_journal_year                    2008
_chemical_formula_sum            'C28 H40 B10 Fe2'
_chemical_formula_weight         596.40
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                96.618(8)
_cell_angle_beta                 112.070(7)
_cell_angle_gamma                112.308(8)
_cell_formula_units_Z            2
_cell_length_a                   10.187(2)
_cell_length_b                   12.513(3)
_cell_length_c                   13.387(2)
_cell_measurement_reflns_used    6033
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      27.4935
_cell_measurement_theta_min      2.277
_cell_volume                     1395.2(5)
_computing_cell_refinement       'Bruker APEX2'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker APEX2'
_computing_molecular_graphics    'Bruker APEX2'
_computing_publication_material  'Bruker APEX2'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.984
_diffrn_measured_fraction_theta_max 0.963
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0533
_diffrn_reflns_av_sigmaI/netI    0.0621
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            25611
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         28.03
_diffrn_reflns_theta_min         1.72
_exptl_absorpt_coefficient_mu    1.060
_exptl_absorpt_correction_T_max  0.9200
_exptl_absorpt_correction_T_min  0.6087
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker, 2002)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.420
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             620
_exptl_crystal_size_max          0.52
_exptl_crystal_size_mid          0.42
_exptl_crystal_size_min          0.08
_refine_diff_density_max         0.421
_refine_diff_density_min         -0.485
_refine_diff_density_rms         0.082
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.018
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     365
_refine_ls_number_reflns         6521
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.018
_refine_ls_R_factor_all          0.0761
_refine_ls_R_factor_gt           0.0411
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0401P)²+1.2188P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0893
_refine_ls_wR_factor_ref         0.1033
_reflns_number_gt                4549
_reflns_number_total             6521
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b810702e.txt
_cod_data_source_block           x81966_0m
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7103478
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Fe1 Fe 0.95338(5) 0.71782(3) 1.01507(3) 0.01753(11) Uani 1 1 d . . .
Fe2 Fe 0.68996(5) 0.81311(3) 0.45592(3) 0.01873(11) Uani 1 1 d . . .
C1 C 0.4928(3) 0.7501(2) 0.8517(2) 0.0155(5) Uani 1 1 d . . .
C2 C 0.6389(3) 0.7632(2) 0.9620(2) 0.0176(6) Uani 1 1 d . . .
C3 C 0.5791(4) 0.6818(3) 1.0287(2) 0.0272(7) Uani 1 1 d . . .
H3A H 0.5239 0.5968 0.9829 0.041 Uiso 1 1 calc R . .
H3B H 0.5051 0.7019 1.0471 0.041 Uiso 1 1 calc R . .
H3C H 0.6699 0.6947 1.0986 0.041 Uiso 1 1 calc R . .
C4 C 0.7342(3) 0.8944(3) 1.0397(2) 0.0262(7) Uani 1 1 d . . .
H4A H 0.8270 0.9023 1.1054 0.039 Uiso 1 1 calc R . .
H4B H 0.6663 0.9156 1.0651 0.039 Uiso 1 1 calc R . .
H4C H 0.7702 0.9490 0.9982 0.039 Uiso 1 1 calc R . .
C5 C 0.7450(3) 0.7272(2) 0.9257(2) 0.0161(5) Uani 1 1 d . . .
C6 C 0.8711(3) 0.8059(3) 0.9057(2) 0.0197(6) Uani 1 1 d . . .
H6 H 0.9133 0.8957 0.9221 0.024 Uiso 1 1 calc R . .
C7 C 0.3657(3) 0.7188(2) 0.6261(2) 0.0160(5) Uani 1 1 d . . .
C8 C 0.9277(3) 0.7346(3) 0.8598(2) 0.0241(7) Uani 1 1 d . . .
H8 H 1.0155 0.7655 0.8377 0.029 Uiso 1 1 calc R . .
C9 C 0.8385(3) 0.6130(3) 0.8515(2) 0.0249(7) Uani 1 1 d . . .
H9 H 0.8521 0.5427 0.8222 0.030 Uiso 1 1 calc R . .
C10 C 0.7267(3) 0.6073(2) 0.8925(2) 0.0194(6) Uani 1 1 d . . .
H10 H 0.6484 0.5325 0.8971 0.023 Uiso 1 1 calc R . .
C11 C 1.0046(3) 0.6359(3) 1.1379(2) 0.0247(6) Uani 1 1 d . . .
H11 H 0.9338 0.5531 1.1354 0.030 Uiso 1 1 calc R . .
C12 C 1.0069(4) 0.7457(3) 1.1828(2) 0.0253(7) Uani 1 1 d . . .
H12 H 0.9385 0.7542 1.2174 0.030 Uiso 1 1 calc R . .
C13 C 1.1247(4) 0.8418(3) 1.1688(2) 0.0273(7) Uani 1 1 d . . .
H13 H 1.1526 0.9295 1.1917 0.033 Uiso 1 1 calc R . .
C14 C 1.1940(3) 0.7913(3) 1.1160(2) 0.0254(7) Uani 1 1 d . . .
H14 H 1.2795 0.8372 1.0955 0.030 Uiso 1 1 calc R . .
C15 C 1.1201(3) 0.6641(3) 1.0967(2) 0.0231(6) Uani 1 1 d . . .
H15 H 1.1447 0.6047 1.0605 0.028 Uiso 1 1 calc R . .
C16 C 0.3905(3) 0.7030(2) 0.5158(2) 0.0177(6) Uani 1 1 d . . .
C17 C 0.2825(3) 0.7380(3) 0.4259(2) 0.0250(6) Uani 1 1 d . . .
H17A H 0.2999 0.8193 0.4586 0.038 Uiso 1 1 calc R . .
H17B H 0.1708 0.6798 0.3995 0.038 Uiso 1 1 calc R . .
H17C H 0.3077 0.7373 0.3621 0.038 Uiso 1 1 calc R . .
C18 C 0.3469(3) 0.5704(2) 0.4656(2) 0.0219(6) Uani 1 1 d . . .
H18A H 0.3731 0.5636 0.4026 0.033 Uiso 1 1 calc R . .
H18B H 0.2324 0.5197 0.4382 0.033 Uiso 1 1 calc R . .
H18C H 0.4072 0.5434 0.5240 0.033 Uiso 1 1 calc R . .
C19 C 0.5646(3) 0.7838(2) 0.5494(2) 0.0162(5) Uani 1 1 d . . .
C20 C 0.6341(3) 0.9082(2) 0.5544(2) 0.0193(6) Uani 1 1 d . . .
H20 H 0.5744 0.9556 0.5291 0.023 Uiso 1 1 calc R . .
C21 C 0.8016(3) 0.9535(3) 0.6002(2) 0.0236(6) Uani 1 1 d . . .
H21 H 0.8804 1.0381 0.6137 0.028 Uiso 1 1 calc R . .
C22 C 0.8378(3) 0.8576(3) 0.6235(2) 0.0232(6) Uani 1 1 d . . .
H22 H 0.9467 0.8627 0.6565 0.028 Uiso 1 1 calc R . .
C23 C 0.6925(3) 0.7533(2) 0.5922(2) 0.0182(6) Uani 1 1 d . . .
H23 H 0.6815 0.6718 0.5985 0.022 Uiso 1 1 calc R . .
C24 C 0.6728(4) 0.6816(3) 0.3378(2) 0.0296(7) Uani 1 1 d . . .
H16 H 0.6645 0.6008 0.3445 0.036 Uiso 1 1 calc R . .
C25 C 0.5425(4) 0.7084(3) 0.2898(2) 0.0279(7) Uani 1 1 d . . .
H17 H 0.4268 0.6498 0.2571 0.033 Uiso 1 1 calc R . .
C26 C 0.6065(4) 0.8330(3) 0.2978(2) 0.0272(7) Uani 1 1 d . . .
H18 H 0.5435 0.8778 0.2714 0.033 Uiso 1 1 calc R . .
C27 C 0.7755(4) 0.8837(3) 0.3500(2) 0.0269(7) Uani 1 1 d . . .
H19 H 0.8521 0.9700 0.3662 0.032 Uiso 1 1 calc R . .
C28 C 0.8162(4) 0.7898(3) 0.3750(3) 0.0292(7) Uani 1 1 d . . .
H28 H 0.9267 0.7984 0.4121 0.035 Uiso 1 1 calc R . .
B2 B 0.4412(3) 0.6555(3) 0.7245(2) 0.0145(6) Uani 1 1 d . . .
H2 H 0.5050 0.6026 0.7142 0.017 Uiso 1 1 calc R . .
B3 B 0.5316(4) 0.8153(3) 0.7541(2) 0.0159(6) Uani 1 1 d . . .
H3 H 0.6551 0.8685 0.7648 0.019 Uiso 1 1 calc R . .
B4 B 0.4591(4) 0.8748(3) 0.8339(3) 0.0191(7) Uani 1 1 d . . .
H4 H 0.5336 0.9673 0.8970 0.023 Uiso 1 1 calc R . .
B5 B 0.3285(4) 0.7522(3) 0.8594(3) 0.0224(7) Uani 1 1 d . . .
H5 H 0.3177 0.7635 0.9397 0.027 Uiso 1 1 calc R . .
B6 B 0.3165(4) 0.6154(3) 0.7907(3) 0.0190(7) Uani 1 1 d . . .
H6A H 0.2979 0.5364 0.8253 0.023 Uiso 1 1 calc R . .
B8 B 0.3771(4) 0.8536(3) 0.6863(3) 0.0205(7) Uani 1 1 d . . .
H8A H 0.3968 0.9309 0.6496 0.025 Uiso 1 1 calc R . .
B9 B 0.2523(4) 0.8166(3) 0.7537(3) 0.0240(7) Uani 1 1 d . . .
H9A H 0.1895 0.8706 0.7635 0.029 Uiso 1 1 calc R . .
B10 B 0.1617(4) 0.6559(3) 0.7268(3) 0.0238(7) Uani 1 1 d . . .
H10A H 0.0395 0.6038 0.7189 0.029 Uiso 1 1 calc R . .
B11 B 0.2329(4) 0.5966(3) 0.6443(3) 0.0194(7) Uani 1 1 d . . .
H11A H 0.1571 0.5046 0.5804 0.023 Uiso 1 1 calc R . .
B12 B 0.1934(4) 0.7194(3) 0.6207(3) 0.0227(7) Uani 1 1 d . . .
H12A H 0.0918 0.7089 0.5415 0.027 Uiso 1 1 calc R . .
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'
Fe Fe 0.3463 0.8444 '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
C9 Fe1 C10 40.92(11) . . ?
C9 Fe1 C8 40.51(12) . . ?
C10 Fe1 C8 68.63(12) . . ?
C9 Fe1 C15 105.06(11) . . ?
C10 Fe1 C15 125.96(12) . . ?
C8 Fe1 C15 115.77(11) . . ?
C9 Fe1 C11 117.52(12) . . ?
C10 Fe1 C11 108.11(12) . . ?
C8 Fe1 C11 150.44(12) . . ?
C15 Fe1 C11 40.81(11) . . ?
C9 Fe1 C14 124.49(12) . . ?
C10 Fe1 C14 162.91(11) . . ?
C8 Fe1 C14 105.61(12) . . ?
C15 Fe1 C14 40.63(12) . . ?
C11 Fe1 C14 68.48(12) . . ?
C9 Fe1 C13 162.97(13) . . ?
C10 Fe1 C13 155.46(12) . . ?
C8 Fe1 C13 126.81(13) . . ?
C15 Fe1 C13 68.26(12) . . ?
C11 Fe1 C13 68.38(12) . . ?
C14 Fe1 C13 40.47(12) . . ?
C9 Fe1 C6 68.39(11) . . ?
C10 Fe1 C6 68.55(11) . . ?
C8 Fe1 C6 40.81(11) . . ?
C15 Fe1 C6 150.89(12) . . ?
C11 Fe1 C6 167.58(11) . . ?
C14 Fe1 C6 118.33(12) . . ?
C13 Fe1 C6 109.36(12) . . ?
C9 Fe1 C12 153.13(13) . . ?
C10 Fe1 C12 120.58(12) . . ?
C8 Fe1 C12 166.15(13) . . ?
C15 Fe1 C12 68.56(11) . . ?
C11 Fe1 C12 40.66(12) . . ?
C14 Fe1 C12 68.52(12) . . ?
C13 Fe1 C12 40.81(12) . . ?
C6 Fe1 C12 129.77(12) . . ?
C9 Fe1 C5 68.75(11) . . ?
C10 Fe1 C5 40.90(10) . . ?
C8 Fe1 C5 68.75(11) . . ?
C15 Fe1 C5 165.37(12) . . ?
C11 Fe1 C5 129.09(11) . . ?
C14 Fe1 C5 153.75(12) . . ?
C13 Fe1 C5 121.35(11) . . ?
C6 Fe1 C5 40.72(10) . . ?
C12 Fe1 C5 110.60(11) . . ?
C22 Fe2 C21 40.70(12) . . ?
C22 Fe2 C28 105.11(12) . . ?
C21 Fe2 C28 119.61(13) . . ?
C22 Fe2 C23 40.66(11) . . ?
C21 Fe2 C23 68.30(11) . . ?
C28 Fe2 C23 122.72(12) . . ?
C22 Fe2 C27 120.82(12) . . ?
C21 Fe2 C27 105.20(12) . . ?
C28 Fe2 C27 40.71(12) . . ?
C23 Fe2 C27 157.97(12) . . ?
C22 Fe2 C20 68.30(11) . . ?
C21 Fe2 C20 40.60(11) . . ?
C28 Fe2 C20 156.19(12) . . ?
C23 Fe2 C20 68.05(11) . . ?
C27 Fe2 C20 121.54(12) . . ?
C22 Fe2 C26 157.99(12) . . ?
C21 Fe2 C26 122.83(12) . . ?
C28 Fe2 C26 68.27(13) . . ?
C23 Fe2 C26 160.38(12) . . ?
C27 Fe2 C26 40.62(12) . . ?
C20 Fe2 C26 108.81(12) . . ?
C22 Fe2 C24 121.42(13) . . ?
C21 Fe2 C24 156.09(13) . . ?
C28 Fe2 C24 40.53(13) . . ?
C23 Fe2 C24 108.70(11) . . ?
C27 Fe2 C24 68.25(12) . . ?
C20 Fe2 C24 162.29(12) . . ?
C26 Fe2 C24 68.02(12) . . ?
C22 Fe2 C25 158.67(12) . . ?
C21 Fe2 C25 160.34(12) . . ?
C28 Fe2 C25 68.29(13) . . ?
C23 Fe2 C25 124.61(12) . . ?
C27 Fe2 C25 68.23(12) . . ?
C20 Fe2 C25 125.80(12) . . ?
C26 Fe2 C25 40.33(12) . . ?
C24 Fe2 C25 40.56(12) . . ?
C22 Fe2 C19 68.55(11) . . ?
C21 Fe2 C19 68.46(11) . . ?
C28 Fe2 C19 160.37(12) . . ?
C23 Fe2 C19 40.61(10) . . ?
C27 Fe2 C19 158.55(12) . . ?
C20 Fe2 C19 40.53(10) . . ?
C26 Fe2 C19 124.41(12) . . ?
C24 Fe2 C19 125.72(11) . . ?
C25 Fe2 C19 110.51(12) . . ?
C2 C1 B3 118.4(2) . . ?
C2 C1 B2 118.6(2) . . ?
B3 C1 B2 62.30(16) . . ?
C2 C1 B5 120.3(2) . . ?
B3 C1 B5 111.9(2) . . ?
B2 C1 B5 111.8(2) . . ?
C2 C1 B6 119.0(2) . . ?
B3 C1 B6 112.8(2) . . ?
B2 C1 B6 61.37(16) . . ?
B5 C1 B6 62.09(17) . . ?
C2 C1 B4 120.4(2) . . ?
B3 C1 B4 60.93(17) . . ?
B2 C1 B4 111.4(2) . . ?
B5 C1 B4 61.57(18) . . ?
B6 C1 B4 112.1(2) . . ?
C5 C2 C3 110.1(2) . . ?
C5 C2 C4 110.1(2) . . ?
C3 C2 C4 107.6(2) . . ?
C5 C2 C1 108.4(2) . . ?
C3 C2 C1 110.4(2) . . ?
C4 C2 C1 110.2(2) . . ?
C2 C3 H3A 109.5 . . ?
C2 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
C2 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C2 C4 H4A 109.5 . . ?
C2 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
C2 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
C6 C5 C10 106.9(2) . . ?
C6 C5 C2 125.7(2) . . ?
C10 C5 C2 127.0(2) . . ?
C6 C5 Fe1 69.19(15) . . ?
C10 C5 Fe1 68.44(15) . . ?
C2 C5 Fe1 132.77(18) . . ?
C8 C6 C5 108.3(3) . . ?
C8 C6 Fe1 69.17(16) . . ?
C5 C6 Fe1 70.09(15) . . ?
C8 C6 H6 125.8 . . ?
C5 C6 H6 125.8 . . ?
Fe1 C6 H6 125.8 . . ?
C16 C7 B2 117.9(2) . . ?
C16 C7 B8 119.6(2) . . ?
B2 C7 B8 112.3(2) . . ?
C16 C7 B11 120.2(2) . . ?
B2 C7 B11 61.91(17) . . ?
B8 C7 B11 111.8(2) . . ?
C16 C7 B12 121.5(2) . . ?
B2 C7 B12 111.8(2) . . ?
B8 C7 B12 61.57(17) . . ?
B11 C7 B12 61.19(18) . . ?
C16 C7 B3 118.2(2) . . ?
B2 C7 B3 61.94(16) . . ?
B8 C7 B3 61.24(17) . . ?
B11 C7 B3 112.0(2) . . ?
B12 C7 B3 111.2(2) . . ?
C9 C8 C6 108.0(3) . . ?
C9 C8 Fe1 69.44(16) . . ?
C6 C8 Fe1 70.02(16) . . ?
C9 C8 H8 126.0 . . ?
C6 C8 H8 126.0 . . ?
Fe1 C8 H8 126.0 . . ?
C8 C9 C10 108.4(2) . . ?
C8 C9 Fe1 70.05(16) . . ?
C10 C9 Fe1 69.61(15) . . ?
C8 C9 H9 125.8 . . ?
C10 C9 H9 125.8 . . ?
Fe1 C9 H9 125.8 . . ?
C9 C10 C5 108.3(2) . . ?
C9 C10 Fe1 69.47(16) . . ?
C5 C10 Fe1 70.65(15) . . ?
C9 C10 H10 125.9 . . ?
C5 C10 H10 125.9 . . ?
Fe1 C10 H10 125.9 . . ?
C12 C11 C15 108.2(3) . . ?
C12 C11 Fe1 70.02(16) . . ?
C15 C11 Fe1 69.56(16) . . ?
C12 C11 H11 125.9 . . ?
C15 C11 H11 125.9 . . ?
Fe1 C11 H11 125.9 . . ?
C11 C12 C13 107.4(3) . . ?
C11 C12 Fe1 69.31(15) . . ?
C13 C12 Fe1 69.43(16) . . ?
C11 C12 H12 126.3 . . ?
C13 C12 H12 126.3 . . ?
Fe1 C12 H12 126.3 . . ?
C14 C13 C12 108.4(3) . . ?
C14 C13 Fe1 69.74(16) . . ?
C12 C13 Fe1 69.75(16) . . ?
C14 C13 H13 125.8 . . ?
C12 C13 H13 125.8 . . ?
Fe1 C13 H13 125.8 . . ?
C13 C14 C15 108.0(3) . . ?
C13 C14 Fe1 69.79(16) . . ?
C15 C14 Fe1 69.48(16) . . ?
C13 C14 H14 126.0 . . ?
C15 C14 H14 126.0 . . ?
Fe1 C14 H14 126.0 . . ?
C14 C15 C11 108.0(3) . . ?
C14 C15 Fe1 69.89(16) . . ?
C11 C15 Fe1 69.63(16) . . ?
C14 C15 H15 126.0 . . ?
C11 C15 H15 126.0 . . ?
Fe1 C15 H15 126.0 . . ?
C19 C16 C17 110.6(2) . . ?
C19 C16 C18 109.9(2) . . ?
C17 C16 C18 107.9(2) . . ?
C19 C16 C7 107.9(2) . . ?
C17 C16 C7 110.1(2) . . ?
C18 C16 C7 110.4(2) . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C16 C18 H18A 109.5 . . ?
C16 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C16 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C20 C19 C23 106.7(2) . . ?
C20 C19 C16 126.5(2) . . ?
C23 C19 C16 126.6(2) . . ?
C20 C19 Fe2 68.91(15) . . ?
C23 C19 Fe2 68.76(15) . . ?
C16 C19 Fe2 131.44(18) . . ?
C21 C20 C19 108.7(2) . . ?
C21 C20 Fe2 69.37(15) . . ?
C19 C20 Fe2 70.56(15) . . ?
C21 C20 H20 125.6 . . ?
C19 C20 H20 125.6 . . ?
Fe2 C20 H20 125.6 . . ?
C22 C21 C20 107.9(2) . . ?
C22 C21 Fe2 69.54(16) . . ?
C20 C21 Fe2 70.04(15) . . ?
C22 C21 H21 126.0 . . ?
C20 C21 H21 126.0 . . ?
Fe2 C21 H21 126.0 . . ?
C21 C22 C23 107.9(3) . . ?
C21 C22 Fe2 69.76(16) . . ?
C23 C22 Fe2 70.00(16) . . ?
C21 C22 H22 126.0 . . ?
C23 C22 H22 126.0 . . ?
Fe2 C22 H22 126.0 . . ?
C22 C23 C19 108.7(2) . . ?
C22 C23 Fe2 69.33(16) . . ?
C19 C23 Fe2 70.63(15) . . ?
C22 C23 H23 125.7 . . ?
C19 C23 H23 125.7 . . ?
Fe2 C23 H23 125.7 . . ?
C28 C24 C25 108.1(3) . . ?
C28 C24 Fe2 69.34(16) . . ?
C25 C24 Fe2 69.97(16) . . ?
C28 C24 H16 126.0 . . ?
C25 C24 H16 126.0 . . ?
Fe2 C24 H16 126.0 . . ?
C26 C25 C24 107.7(3) . . ?
C26 C25 Fe2 69.42(16) . . ?
C24 C25 Fe2 69.46(16) . . ?
C26 C25 H17 126.2 . . ?
C24 C25 H17 126.2 . . ?
Fe2 C25 H17 126.2 . . ?
C25 C26 C27 108.5(3) . . ?
C25 C26 Fe2 70.25(17) . . ?
C27 C26 Fe2 69.58(16) . . ?
C25 C26 H18 125.8 . . ?
C27 C26 H18 125.8 . . ?
Fe2 C26 H18 125.8 . . ?
C26 C27 C28 107.7(3) . . ?
C26 C27 Fe2 69.81(17) . . ?
C28 C27 Fe2 69.53(17) . . ?
C26 C27 H19 126.1 . . ?
C28 C27 H19 126.1 . . ?
Fe2 C27 H19 126.1 . . ?
C24 C28 C27 108.1(3) . . ?
C24 C28 Fe2 70.12(17) . . ?
C27 C28 Fe2 69.76(17) . . ?
C24 C28 H28 126.0 . . ?
C27 C28 H28 126.0 . . ?
Fe2 C28 H28 126.0 . . ?
C7 B2 C1 104.8(2) . . ?
C7 B2 B6 107.1(2) . . ?
C1 B2 B6 59.71(16) . . ?
C7 B2 B11 59.82(17) . . ?
C1 B2 B11 106.3(2) . . ?
B6 B2 B11 59.94(17) . . ?
C7 B2 B3 60.25(16) . . ?
C1 B2 B3 58.48(16) . . ?
B6 B2 B3 108.3(2) . . ?
B11 B2 B3 108.9(2) . . ?
C7 B2 H2 122.9 . . ?
C1 B2 H2 124.0 . . ?
B6 B2 H2 121.6 . . ?
B11 B2 H2 121.6 . . ?
B3 B2 H2 121.2 . . ?
C1 B3 C7 103.5(2) . . ?
C1 B3 B4 60.54(17) . . ?
C7 B3 B4 106.1(2) . . ?
C1 B3 B8 107.1(2) . . ?
C7 B3 B8 58.80(16) . . ?
B4 B3 B8 60.46(18) . . ?
C1 B3 B2 59.22(16) . . ?
C7 B3 B2 57.80(16) . . ?
B4 B3 B2 108.6(2) . . ?
B8 B3 B2 106.9(2) . . ?
C1 B3 H3 123.2 . . ?
C7 B3 H3 124.9 . . ?
B4 B3 H3 121.0 . . ?
B8 B3 H3 121.9 . . ?
B2 B3 H3 122.2 . . ?
C1 B4 B3 58.53(16) . . ?
C1 B4 B9 105.9(2) . . ?
B3 B4 B9 108.8(2) . . ?
C1 B4 B8 105.4(2) . . ?
B3 B4 B8 60.25(17) . . ?
B9 B4 B8 60.52(18) . . ?
C1 B4 B5 58.67(17) . . ?
B3 B4 B5 107.6(2) . . ?
B9 B4 B5 60.51(19) . . ?
B8 B4 B5 108.4(2) . . ?
C1 B4 H4 124.3 . . ?
B3 B4 H4 121.6 . . ?
B9 B4 H4 121.4 . . ?
B8 B4 H4 121.9 . . ?
B5 B4 H4 121.6 . . ?
C1 B5 B4 59.77(17) . . ?
C1 B5 B9 105.7(2) . . ?
B4 B5 B9 59.15(18) . . ?
C1 B5 B10 106.1(2) . . ?
B4 B5 B10 107.9(2) . . ?
B9 B5 B10 60.32(19) . . ?
C1 B5 B6 59.28(16) . . ?
B4 B5 B6 108.4(2) . . ?
B9 B5 B6 108.0(2) . . ?
B10 B5 B6 59.87(18) . . ?
C1 B5 H5 123.4 . . ?
B4 B5 H5 121.6 . . ?
B9 B5 H5 122.4 . . ?
B10 B5 H5 122.1 . . ?
B6 B5 H5 121.4 . . ?
C1 B6 B11 105.8(2) . . ?
C1 B6 B2 58.92(16) . . ?
B11 B6 B2 60.04(17) . . ?
C1 B6 B10 105.6(2) . . ?
B11 B6 B10 59.78(18) . . ?
B2 B6 B10 107.6(2) . . ?
C1 B6 B5 58.63(16) . . ?
B11 B6 B5 107.5(2) . . ?
B2 B6 B5 107.1(2) . . ?
B10 B6 B5 59.98(18) . . ?
C1 B6 H6A 123.9 . . ?
B11 B6 H6A 122.2 . . ?
B2 B6 H6A 121.9 . . ?
B10 B6 H6A 122.2 . . ?
B5 B6 H6A 122.1 . . ?
C7 B8 B3 59.96(16) . . ?
C7 B8 B12 59.43(17) . . ?
B3 B8 B12 108.4(2) . . ?
C7 B8 B4 106.0(2) . . ?
B3 B8 B4 59.29(17) . . ?
B12 B8 B4 107.6(2) . . ?
C7 B8 B9 106.1(2) . . ?
B3 B8 B9 107.0(2) . . ?
B12 B8 B9 60.08(19) . . ?
B4 B8 B9 59.24(18) . . ?
C7 B8 H8A 123.0 . . ?
B3 B8 H8A 121.7 . . ?
B12 B8 H8A 121.3 . . ?
B4 B8 H8A 122.7 . . ?
B9 B8 H8A 122.7 . . ?
B4 B9 B12 108.1(2) . . ?
B4 B9 B8 60.24(18) . . ?
B12 B9 B8 59.77(18) . . ?
B4 B9 B5 60.34(18) . . ?
B12 B9 B5 107.6(2) . . ?
B8 B9 B5 108.1(2) . . ?
B4 B9 B10 108.5(2) . . ?
B12 B9 B10 59.85(19) . . ?
B8 B9 B10 107.9(2) . . ?
B5 B9 B10 59.93(19) . . ?
B4 B9 H9A 121.2 . . ?
B12 B9 H9A 122.0 . . ?
B8 B9 H9A 121.8 . . ?
B5 B9 H9A 121.8 . . ?
B10 B9 H9A 121.7 . . ?
B11 B10 B12 59.64(18) . . ?
B11 B10 B6 59.65(18) . . ?
B12 B10 B6 107.4(2) . . ?
B11 B10 B5 107.5(2) . . ?
B12 B10 B5 107.4(2) . . ?
B6 B10 B5 60.15(18) . . ?
B11 B10 B9 107.4(2) . . ?
B12 B10 B9 59.71(19) . . ?
B6 B10 B9 107.7(2) . . ?
B5 B10 B9 59.75(19) . . ?
B11 B10 H10A 122.2 . . ?
B12 B10 H10A 122.2 . . ?
B6 B10 H10A 121.9 . . ?
B5 B10 H10A 121.9 . . ?
B9 B10 H10A 122.0 . . ?
C7 B11 B12 59.50(17) . . ?
C7 B11 B6 106.0(2) . . ?
B12 B11 B6 108.8(2) . . ?
C7 B11 B2 58.27(16) . . ?
B12 B11 B2 107.5(2) . . ?
B6 B11 B2 60.02(17) . . ?
C7 B11 B10 106.7(2) . . ?
B12 B11 B10 60.53(19) . . ?
B6 B11 B10 60.57(18) . . ?
B2 B11 B10 108.2(2) . . ?
C7 B11 H11A 123.7 . . ?
B12 B11 H11A 121.3 . . ?
B6 B11 H11A 121.7 . . ?
B2 B11 H11A 122.2 . . ?
B10 B11 H11A 121.4 . . ?
C7 B12 B11 59.31(17) . . ?
C7 B12 B8 59.00(17) . . ?
B11 B12 B8 108.2(2) . . ?
C7 B12 B9 105.8(2) . . ?
B11 B12 B9 108.1(2) . . ?
B8 B12 B9 60.15(18) . . ?
C7 B12 B10 106.0(2) . . ?
B11 B12 B10 59.83(19) . . ?
B8 B12 B10 108.7(2) . . ?
B9 B12 B10 60.44(19) . . ?
C7 B12 H12A 123.8 . . ?
B11 B12 H12A 121.6 . . ?
B8 B12 H12A 121.3 . . ?
B9 B12 H12A 122.0 . . ?
B10 B12 H12A 121.8 . . ?
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
Fe1 C9 2.033(3) . ?
Fe1 C10 2.035(3) . ?
Fe1 C8 2.041(3) . ?
Fe1 C15 2.043(3) . ?
Fe1 C11 2.044(3) . ?
Fe1 C14 2.048(3) . ?
Fe1 C13 2.049(3) . ?
Fe1 C6 2.052(3) . ?
Fe1 C12 2.053(3) . ?
Fe1 C5 2.064(3) . ?
Fe2 C22 2.036(3) . ?
Fe2 C21 2.039(3) . ?
Fe2 C28 2.042(3) . ?
Fe2 C23 2.045(3) . ?
Fe2 C27 2.045(3) . ?
Fe2 C20 2.048(3) . ?
Fe2 C26 2.048(3) . ?
Fe2 C24 2.053(3) . ?
Fe2 C25 2.059(3) . ?
Fe2 C19 2.070(3) . ?
C1 C2 1.590(4) . ?
C1 B3 1.709(4) . ?
C1 B2 1.722(4) . ?
C1 B5 1.725(4) . ?
C1 B6 1.736(4) . ?
C1 B4 1.744(4) . ?
C2 C5 1.524(4) . ?
C2 C3 1.535(4) . ?
C2 C4 1.535(4) . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
C5 C6 1.432(4) . ?
C5 C10 1.433(4) . ?
C6 C8 1.427(4) . ?
C6 H6 1.0000 . ?
C7 C16 1.591(4) . ?
C7 B2 1.702(4) . ?
C7 B8 1.726(4) . ?
C7 B11 1.730(4) . ?
C7 B12 1.733(4) . ?
C7 B3 1.746(4) . ?
C8 C9 1.411(4) . ?
C8 H8 1.0000 . ?
C9 C10 1.422(4) . ?
C9 H9 1.0000 . ?
C10 H10 1.0000 . ?
C11 C12 1.423(4) . ?
C11 C15 1.425(4) . ?
C11 H11 1.0000 . ?
C12 C13 1.430(4) . ?
C12 H12 1.0000 . ?
C13 C14 1.417(4) . ?
C13 H13 1.0000 . ?
C14 C15 1.420(4) . ?
C14 H14 1.0000 . ?
C15 H15 1.0000 . ?
C16 C19 1.518(4) . ?
C16 C17 1.530(4) . ?
C16 C18 1.536(4) . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 C20 1.426(4) . ?
C19 C23 1.428(4) . ?
C20 C21 1.418(4) . ?
C20 H20 1.0000 . ?
C21 C22 1.417(4) . ?
C21 H21 1.0000 . ?
C22 C23 1.418(4) . ?
C22 H22 1.0000 . ?
C23 H23 1.0000 . ?
C24 C28 1.418(4) . ?
C24 C25 1.425(4) . ?
C24 H16 1.0000 . ?
C25 C26 1.416(4) . ?
C25 H17 1.0000 . ?
C26 C27 1.421(4) . ?
C26 H18 1.0000 . ?
C27 C28 1.422(4) . ?
C27 H19 1.0000 . ?
C28 H28 1.0000 . ?
B2 B6 1.765(4) . ?
B2 B11 1.765(4) . ?
B2 B3 1.775(4) . ?
B2 H2 1.1200 . ?
B3 B4 1.751(4) . ?
B3 B8 1.768(4) . ?
B3 H3 1.1200 . ?
B4 B9 1.754(5) . ?
B4 B8 1.772(4) . ?
B4 B5 1.775(5) . ?
B4 H4 1.1200 . ?
B5 B9 1.779(5) . ?
B5 B10 1.782(5) . ?
B5 B6 1.785(4) . ?
B5 H5 1.1200 . ?
B6 B11 1.764(4) . ?
B6 B10 1.780(5) . ?
B6 H6A 1.1200 . ?
B8 B12 1.770(5) . ?
B8 B9 1.777(5) . ?
B8 H8A 1.1200 . ?
B9 B12 1.776(5) . ?
B9 B10 1.789(5) . ?
B9 H9A 1.1200 . ?
B10 B11 1.766(4) . ?
B10 B12 1.778(5) . ?
B10 H10A 1.1200 . ?
B11 B12 1.763(5) . ?
B11 H11A 1.1200 . ?
B12 H12A 1.1200 . ?
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
B3 C1 C2 C5 -50.0(3) . . . . ?
B2 C1 C2 C5 22.1(3) . . . . ?
B5 C1 C2 C5 166.1(2) . . . . ?
B6 C1 C2 C5 93.4(3) . . . . ?
B4 C1 C2 C5 -121.2(2) . . . . ?
B3 C1 C2 C3 -170.6(2) . . . . ?
B2 C1 C2 C3 -98.5(3) . . . . ?
B5 C1 C2 C3 45.5(3) . . . . ?
B6 C1 C2 C3 -27.3(3) . . . . ?
B4 C1 C2 C3 118.2(3) . . . . ?
B3 C1 C2 C4 70.5(3) . . . . ?
B2 C1 C2 C4 142.7(2) . . . . ?
B5 C1 C2 C4 -73.4(3) . . . . ?
B6 C1 C2 C4 -146.1(2) . . . . ?
B4 C1 C2 C4 -0.6(3) . . . . ?
C3 C2 C5 C6 -152.5(3) . . . . ?
C4 C2 C5 C6 -34.0(4) . . . . ?
C1 C2 C5 C6 86.7(3) . . . . ?
C3 C2 C5 C10 35.5(4) . . . . ?
C4 C2 C5 C10 154.0(3) . . . . ?
C1 C2 C5 C10 -85.4(3) . . . . ?
C3 C2 C5 Fe1 -58.5(3) . . . . ?
C4 C2 C5 Fe1 59.9(3) . . . . ?
C1 C2 C5 Fe1 -179.41(19) . . . . ?
C9 Fe1 C5 C6 -81.14(17) . . . . ?
C10 Fe1 C5 C6 -119.0(2) . . . . ?
C8 Fe1 C5 C6 -37.53(16) . . . . ?
C15 Fe1 C5 C6 -148.4(4) . . . . ?
C11 Fe1 C5 C6 170.03(16) . . . . ?
C14 Fe1 C5 C6 44.7(3) . . . . ?
C13 Fe1 C5 C6 83.52(18) . . . . ?
C12 Fe1 C5 C6 127.65(17) . . . . ?
C9 Fe1 C5 C10 37.87(16) . . . . ?
C8 Fe1 C5 C10 81.49(17) . . . . ?
C15 Fe1 C5 C10 -29.4(5) . . . . ?
C11 Fe1 C5 C10 -71.0(2) . . . . ?
C14 Fe1 C5 C10 163.7(2) . . . . ?
C13 Fe1 C5 C10 -157.46(17) . . . . ?
C6 Fe1 C5 C10 119.0(2) . . . . ?
C12 Fe1 C5 C10 -113.33(17) . . . . ?
C9 Fe1 C5 C2 158.9(3) . . . . ?
C10 Fe1 C5 C2 121.1(3) . . . . ?
C8 Fe1 C5 C2 -157.4(3) . . . . ?
C15 Fe1 C5 C2 91.7(5) . . . . ?
C11 Fe1 C5 C2 50.1(3) . . . . ?
C14 Fe1 C5 C2 -75.2(4) . . . . ?
C13 Fe1 C5 C2 -36.4(3) . . . . ?
C6 Fe1 C5 C2 -119.9(3) . . . . ?
C12 Fe1 C5 C2 7.7(3) . . . . ?
C10 C5 C6 C8 0.6(3) . . . . ?
C2 C5 C6 C8 -172.8(2) . . . . ?
Fe1 C5 C6 C8 58.79(18) . . . . ?
C10 C5 C6 Fe1 -58.23(18) . . . . ?
C2 C5 C6 Fe1 128.4(3) . . . . ?
C9 Fe1 C6 C8 -37.58(18) . . . . ?
C10 Fe1 C6 C8 -81.72(18) . . . . ?
C15 Fe1 C6 C8 44.5(3) . . . . ?
C11 Fe1 C6 C8 -158.4(5) . . . . ?
C14 Fe1 C6 C8 81.0(2) . . . . ?
C13 Fe1 C6 C8 124.39(18) . . . . ?
C12 Fe1 C6 C8 165.69(18) . . . . ?
C5 Fe1 C6 C8 -119.7(2) . . . . ?
C9 Fe1 C6 C5 82.10(17) . . . . ?
C10 Fe1 C6 C5 37.96(15) . . . . ?
C8 Fe1 C6 C5 119.7(2) . . . . ?
C15 Fe1 C6 C5 164.2(2) . . . . ?
C11 Fe1 C6 C5 -38.7(6) . . . . ?
C14 Fe1 C6 C5 -159.31(15) . . . . ?
C13 Fe1 C6 C5 -115.92(16) . . . . ?
C12 Fe1 C6 C5 -74.6(2) . . . . ?
C5 C6 C8 C9 -0.1(3) . . . . ?
Fe1 C6 C8 C9 59.25(19) . . . . ?
C5 C6 C8 Fe1 -59.36(18) . . . . ?
C10 Fe1 C8 C9 -37.70(16) . . . . ?
C15 Fe1 C8 C9 83.06(19) . . . . ?
C11 Fe1 C8 C9 51.5(3) . . . . ?
C14 Fe1 C8 C9 125.32(17) . . . . ?
C13 Fe1 C8 C9 164.28(17) . . . . ?
C6 Fe1 C8 C9 -119.2(2) . . . . ?
C12 Fe1 C8 C9 -171.7(4) . . . . ?
C5 Fe1 C8 C9 -81.75(17) . . . . ?
C9 Fe1 C8 C6 119.2(2) . . . . ?
C10 Fe1 C8 C6 81.51(18) . . . . ?
C15 Fe1 C8 C6 -157.74(16) . . . . ?
C11 Fe1 C8 C6 170.7(2) . . . . ?
C14 Fe1 C8 C6 -115.48(18) . . . . ?
C13 Fe1 C8 C6 -76.5(2) . . . . ?
C12 Fe1 C8 C6 -52.5(5) . . . . ?
C5 Fe1 C8 C6 37.45(16) . . . . ?
C6 C8 C9 C10 -0.4(3) . . . . ?
Fe1 C8 C9 C10 59.22(19) . . . . ?
C6 C8 C9 Fe1 -59.62(19) . . . . ?
C10 Fe1 C9 C8 119.6(2) . . . . ?
C15 Fe1 C9 C8 -112.22(17) . . . . ?
C11 Fe1 C9 C8 -154.18(17) . . . . ?
C14 Fe1 C9 C8 -72.5(2) . . . . ?
C13 Fe1 C9 C8 -47.8(5) . . . . ?
C6 Fe1 C9 C8 37.85(16) . . . . ?
C12 Fe1 C9 C8 175.6(2) . . . . ?
C5 Fe1 C9 C8 81.74(17) . . . . ?
C8 Fe1 C9 C10 -119.6(2) . . . . ?
C15 Fe1 C9 C10 128.18(17) . . . . ?
C11 Fe1 C9 C10 86.21(19) . . . . ?
C14 Fe1 C9 C10 167.94(16) . . . . ?
C13 Fe1 C9 C10 -167.4(4) . . . . ?
C6 Fe1 C9 C10 -81.76(17) . . . . ?
C12 Fe1 C9 C10 56.0(3) . . . . ?
C5 Fe1 C9 C10 -37.86(16) . . . . ?
C8 C9 C10 C5 0.8(3) . . . . ?
Fe1 C9 C10 C5 60.24(18) . . . . ?
C8 C9 C10 Fe1 -59.49(19) . . . . ?
C6 C5 C10 C9 -0.8(3) . . . . ?
C2 C5 C10 C9 172.4(2) . . . . ?
Fe1 C5 C10 C9 -59.51(18) . . . . ?
C6 C5 C10 Fe1 58.70(18) . . . . ?
C2 C5 C10 Fe1 -128.1(3) . . . . ?
C8 Fe1 C10 C9 37.33(17) . . . . ?
C15 Fe1 C10 C9 -69.7(2) . . . . ?
C11 Fe1 C10 C9 -111.40(18) . . . . ?
C14 Fe1 C10 C9 -35.9(5) . . . . ?
C13 Fe1 C10 C9 171.1(3) . . . . ?
C6 Fe1 C10 C9 81.32(18) . . . . ?
C12 Fe1 C10 C9 -154.20(17) . . . . ?
C5 Fe1 C10 C9 119.1(2) . . . . ?
C9 Fe1 C10 C5 -119.1(2) . . . . ?
C8 Fe1 C10 C5 -81.78(17) . . . . ?
C15 Fe1 C10 C5 171.18(15) . . . . ?
C11 Fe1 C10 C5 129.48(16) . . . . ?
C14 Fe1 C10 C5 -155.0(4) . . . . ?
C13 Fe1 C10 C5 52.0(3) . . . . ?
C6 Fe1 C10 C5 -37.80(15) . . . . ?
C12 Fe1 C10 C5 86.68(18) . . . . ?
C9 Fe1 C11 C12 -159.59(17) . . . . ?
C10 Fe1 C11 C12 -116.15(18) . . . . ?
C8 Fe1 C11 C12 165.4(2) . . . . ?
C15 Fe1 C11 C12 119.3(2) . . . . ?
C14 Fe1 C11 C12 81.67(19) . . . . ?
C13 Fe1 C11 C12 38.00(18) . . . . ?
C6 Fe1 C11 C12 -43.8(6) . . . . ?
C5 Fe1 C11 C12 -75.5(2) . . . . ?
C9 Fe1 C11 C15 81.08(19) . . . . ?
C10 Fe1 C11 C15 124.52(17) . . . . ?
C8 Fe1 C11 C15 46.1(3) . . . . ?
C14 Fe1 C11 C15 -37.67(17) . . . . ?
C13 Fe1 C11 C15 -81.33(18) . . . . ?
C6 Fe1 C11 C15 -163.2(5) . . . . ?
C12 Fe1 C11 C15 -119.3(2) . . . . ?
C5 Fe1 C11 C15 165.15(16) . . . . ?
C15 C11 C12 C13 0.1(3) . . . . ?
Fe1 C11 C12 C13 -59.22(19) . . . . ?
C15 C11 C12 Fe1 59.29(19) . . . . ?
C9 Fe1 C12 C11 43.2(3) . . . . ?
C10 Fe1 C12 C11 82.3(2) . . . . ?
C8 Fe1 C12 C11 -148.8(4) . . . . ?
C15 Fe1 C12 C11 -37.74(17) . . . . ?
C14 Fe1 C12 C11 -81.55(19) . . . . ?
C13 Fe1 C12 C11 -118.9(2) . . . . ?
C6 Fe1 C12 C11 168.82(17) . . . . ?
C5 Fe1 C12 C11 126.60(17) . . . . ?
C9 Fe1 C12 C13 162.1(2) . . . . ?
C10 Fe1 C12 C13 -158.82(17) . . . . ?
C8 Fe1 C12 C13 -29.9(6) . . . . ?
C15 Fe1 C12 C13 81.13(19) . . . . ?
C11 Fe1 C12 C13 118.9(2) . . . . ?
C14 Fe1 C12 C13 37.32(18) . . . . ?
C6 Fe1 C12 C13 -72.3(2) . . . . ?
C5 Fe1 C12 C13 -114.53(18) . . . . ?
C11 C12 C13 C14 -0.1(3) . . . . ?
Fe1 C12 C13 C14 -59.24(19) . . . . ?
C11 C12 C13 Fe1 59.15(19) . . . . ?
C9 Fe1 C13 C14 -32.0(5) . . . . ?
C10 Fe1 C13 C14 168.1(3) . . . . ?
C8 Fe1 C13 C14 -68.9(2) . . . . ?
C15 Fe1 C13 C14 37.68(18) . . . . ?
C11 Fe1 C13 C14 81.75(19) . . . . ?
C6 Fe1 C13 C14 -111.29(18) . . . . ?
C12 Fe1 C13 C14 119.6(3) . . . . ?
C5 Fe1 C13 C14 -154.69(17) . . . . ?
C9 Fe1 C13 C12 -151.6(4) . . . . ?
C10 Fe1 C13 C12 48.5(4) . . . . ?
C8 Fe1 C13 C12 171.43(17) . . . . ?
C15 Fe1 C13 C12 -81.94(19) . . . . ?
C11 Fe1 C13 C12 -37.87(17) . . . . ?
C14 Fe1 C13 C12 -119.6(3) . . . . ?
C6 Fe1 C13 C12 129.09(17) . . . . ?
C5 Fe1 C13 C12 85.69(19) . . . . ?
C12 C13 C14 C15 0.1(3) . . . . ?
Fe1 C13 C14 C15 -59.17(19) . . . . ?
C12 C13 C14 Fe1 59.25(19) . . . . ?
C9 Fe1 C14 C13 169.15(18) . . . . ?
C10 Fe1 C14 C13 -163.1(4) . . . . ?
C8 Fe1 C14 C13 129.12(19) . . . . ?
C15 Fe1 C14 C13 -119.3(3) . . . . ?
C11 Fe1 C14 C13 -81.49(19) . . . . ?
C6 Fe1 C14 C13 87.0(2) . . . . ?
C12 Fe1 C14 C13 -37.63(18) . . . . ?
C5 Fe1 C14 C13 55.6(3) . . . . ?
C9 Fe1 C14 C15 -71.5(2) . . . . ?
C10 Fe1 C14 C15 -43.8(5) . . . . ?
C8 Fe1 C14 C15 -111.56(18) . . . . ?
C11 Fe1 C14 C15 37.83(17) . . . . ?
C13 Fe1 C14 C15 119.3(3) . . . . ?
C6 Fe1 C14 C15 -153.64(16) . . . . ?
C12 Fe1 C14 C15 81.69(18) . . . . ?
C5 Fe1 C14 C15 175.0(2) . . . . ?
C13 C14 C15 C11 0.0(3) . . . . ?
Fe1 C14 C15 C11 -59.40(19) . . . . ?
C13 C14 C15 Fe1 59.4(2) . . . . ?
C12 C11 C15 C14 0.0(3) . . . . ?
Fe1 C11 C15 C14 59.56(19) . . . . ?
C12 C11 C15 Fe1 -59.58(19) . . . . ?
C9 Fe1 C15 C14 125.95(18) . . . . ?
C10 Fe1 C15 C14 165.45(16) . . . . ?
C8 Fe1 C15 C14 84.05(19) . . . . ?
C11 Fe1 C15 C14 -119.2(2) . . . . ?
C13 Fe1 C15 C14 -37.53(17) . . . . ?
C6 Fe1 C15 C14 53.5(3) . . . . ?
C12 Fe1 C15 C14 -81.58(18) . . . . ?
C5 Fe1 C15 C14 -171.1(4) . . . . ?
C9 Fe1 C15 C11 -114.86(18) . . . . ?
C10 Fe1 C15 C11 -75.4(2) . . . . ?
C8 Fe1 C15 C11 -156.76(17) . . . . ?
C14 Fe1 C15 C11 119.2(2) . . . . ?
C13 Fe1 C15 C11 81.66(18) . . . . ?
C6 Fe1 C15 C11 172.6(2) . . . . ?
C12 Fe1 C15 C11 37.61(17) . . . . ?
C5 Fe1 C15 C11 -52.0(5) . . . . ?
B2 C7 C16 C19 -72.8(3) . . . . ?
B8 C7 C16 C19 69.7(3) . . . . ?
B11 C7 C16 C19 -144.8(2) . . . . ?
B12 C7 C16 C19 142.5(2) . . . . ?
B3 C7 C16 C19 -1.4(3) . . . . ?
B2 C7 C16 C17 166.4(2) . . . . ?
B8 C7 C16 C17 -51.1(3) . . . . ?
B11 C7 C16 C17 94.4(3) . . . . ?
B12 C7 C16 C17 21.7(3) . . . . ?
B3 C7 C16 C17 -122.2(2) . . . . ?
B2 C7 C16 C18 47.4(3) . . . . ?
B8 C7 C16 C18 -170.2(2) . . . . ?
B11 C7 C16 C18 -24.7(3) . . . . ?
B12 C7 C16 C18 -97.3(3) . . . . ?
B3 C7 C16 C18 118.7(2) . . . . ?
C17 C16 C19 C20 33.3(4) . . . . ?
C18 C16 C19 C20 152.4(3) . . . . ?
C7 C16 C19 C20 -87.2(3) . . . . ?
C17 C16 C19 C23 -153.0(2) . . . . ?
C18 C16 C19 C23 -33.9(3) . . . . ?
C7 C16 C19 C23 86.5(3) . . . . ?
C17 C16 C19 Fe2 -59.9(3) . . . . ?
C18 C16 C19 Fe2 59.2(3) . . . . ?
C7 C16 C19 Fe2 179.57(19) . . . . ?
C22 Fe2 C19 C20 81.28(17) . . . . ?
C21 Fe2 C19 C20 37.38(16) . . . . ?
C28 Fe2 C19 C20 155.7(3) . . . . ?
C23 Fe2 C19 C20 118.7(2) . . . . ?
C27 Fe2 C19 C20 -39.1(4) . . . . ?
C26 Fe2 C19 C20 -78.48(19) . . . . ?
C24 Fe2 C19 C20 -164.68(17) . . . . ?
C25 Fe2 C19 C20 -121.57(17) . . . . ?
C22 Fe2 C19 C23 -37.46(16) . . . . ?
C21 Fe2 C19 C23 -81.35(17) . . . . ?
C28 Fe2 C19 C23 37.0(4) . . . . ?
C27 Fe2 C19 C23 -157.8(3) . . . . ?
C20 Fe2 C19 C23 -118.7(2) . . . . ?
C26 Fe2 C19 C23 162.79(16) . . . . ?
C24 Fe2 C19 C23 76.6(2) . . . . ?
C25 Fe2 C19 C23 119.70(17) . . . . ?
C22 Fe2 C19 C16 -158.1(3) . . . . ?
C21 Fe2 C19 C16 158.0(3) . . . . ?
C28 Fe2 C19 C16 -83.6(4) . . . . ?
C23 Fe2 C19 C16 -120.6(3) . . . . ?
C27 Fe2 C19 C16 81.6(4) . . . . ?
C20 Fe2 C19 C16 120.6(3) . . . . ?
C26 Fe2 C19 C16 42.2(3) . . . . ?
C24 Fe2 C19 C16 -44.0(3) . . . . ?
C25 Fe2 C19 C16 -0.9(3) . . . . ?
C23 C19 C20 C21 -0.5(3) . . . . ?
C16 C19 C20 C21 174.3(2) . . . . ?
Fe2 C19 C20 C21 -59.06(19) . . . . ?
C23 C19 C20 Fe2 58.58(17) . . . . ?
C16 C19 C20 Fe2 -126.7(3) . . . . ?
C22 Fe2 C20 C21 37.85(17) . . . . ?
C28 Fe2 C20 C21 -40.2(4) . . . . ?
C23 Fe2 C20 C21 81.81(18) . . . . ?
C27 Fe2 C20 C21 -75.9(2) . . . . ?
C26 Fe2 C20 C21 -118.87(18) . . . . ?
C24 Fe2 C20 C21 164.6(4) . . . . ?
C25 Fe2 C20 C21 -160.52(17) . . . . ?
C19 Fe2 C20 C21 119.8(2) . . . . ?
C22 Fe2 C20 C19 -81.93(17) . . . . ?
C21 Fe2 C20 C19 -119.8(2) . . . . ?
C28 Fe2 C20 C19 -160.0(3) . . . . ?
C23 Fe2 C20 C19 -37.97(15) . . . . ?
C27 Fe2 C20 C19 164.31(16) . . . . ?
C26 Fe2 C20 C19 121.35(17) . . . . ?
C24 Fe2 C20 C19 44.8(4) . . . . ?
C25 Fe2 C20 C19 79.7(2) . . . . ?
C19 C20 C21 C22 0.4(3) . . . . ?
Fe2 C20 C21 C22 -59.43(19) . . . . ?
C19 C20 C21 Fe2 59.79(18) . . . . ?
C28 Fe2 C21 C22 -78.4(2) . . . . ?
C23 Fe2 C21 C22 37.88(16) . . . . ?
C27 Fe2 C21 C22 -119.90(18) . . . . ?
C20 Fe2 C21 C22 119.0(2) . . . . ?
C26 Fe2 C21 C22 -160.36(17) . . . . ?
C24 Fe2 C21 C22 -49.5(4) . . . . ?
C25 Fe2 C21 C22 172.6(3) . . . . ?
C19 Fe2 C21 C22 81.71(18) . . . . ?
C22 Fe2 C21 C20 -119.0(2) . . . . ?
C28 Fe2 C21 C20 162.56(17) . . . . ?
C23 Fe2 C21 C20 -81.15(17) . . . . ?
C27 Fe2 C21 C20 121.06(18) . . . . ?
C26 Fe2 C21 C20 80.6(2) . . . . ?
C24 Fe2 C21 C20 -168.5(3) . . . . ?
C25 Fe2 C21 C20 53.5(4) . . . . ?
C19 Fe2 C21 C20 -37.32(16) . . . . ?
C20 C21 C22 C23 -0.1(3) . . . . ?
Fe2 C21 C22 C23 -59.85(19) . . . . ?
C20 C21 C22 Fe2 59.74(19) . . . . ?
C28 Fe2 C22 C21 118.09(18) . . . . ?
C23 Fe2 C22 C21 -118.9(2) . . . . ?
C27 Fe2 C22 C21 77.0(2) . . . . ?
C20 Fe2 C22 C21 -37.76(16) . . . . ?
C26 Fe2 C22 C21 48.9(4) . . . . ?
C24 Fe2 C22 C21 158.84(17) . . . . ?
C25 Fe2 C22 C21 -173.1(3) . . . . ?
C19 Fe2 C22 C21 -81.49(17) . . . . ?
C21 Fe2 C22 C23 118.9(2) . . . . ?
C28 Fe2 C22 C23 -123.01(17) . . . . ?
C27 Fe2 C22 C23 -164.15(16) . . . . ?
C20 Fe2 C22 C23 81.14(17) . . . . ?
C26 Fe2 C22 C23 167.8(3) . . . . ?
C24 Fe2 C22 C23 -82.26(19) . . . . ?
C25 Fe2 C22 C23 -54.2(4) . . . . ?
C19 Fe2 C22 C23 37.40(15) . . . . ?
C21 C22 C23 C19 -0.2(3) . . . . ?
Fe2 C22 C23 C19 -59.89(18) . . . . ?
C21 C22 C23 Fe2 59.70(19) . . . . ?
C20 C19 C23 C22 0.4(3) . . . . ?
C16 C19 C23 C22 -174.3(2) . . . . ?
Fe2 C19 C23 C22 59.08(19) . . . . ?
C20 C19 C23 Fe2 -58.68(18) . . . . ?
C16 C19 C23 Fe2 126.6(3) . . . . ?
C21 Fe2 C23 C22 -37.91(17) . . . . ?
C28 Fe2 C23 C22 74.2(2) . . . . ?
C27 Fe2 C23 C22 38.7(4) . . . . ?
C20 Fe2 C23 C22 -81.80(18) . . . . ?
C26 Fe2 C23 C22 -166.3(3) . . . . ?
C24 Fe2 C23 C22 116.79(18) . . . . ?
C25 Fe2 C23 C22 158.98(18) . . . . ?
C19 Fe2 C23 C22 -119.7(2) . . . . ?
C22 Fe2 C23 C19 119.7(2) . . . . ?
C21 Fe2 C23 C19 81.79(17) . . . . ?
C28 Fe2 C23 C19 -166.10(16) . . . . ?
C27 Fe2 C23 C19 158.4(3) . . . . ?
C20 Fe2 C23 C19 37.90(15) . . . . ?
C26 Fe2 C23 C19 -46.6(4) . . . . ?
C24 Fe2 C23 C19 -123.51(17) . . . . ?
C25 Fe2 C23 C19 -81.32(19) . . . . ?
C22 Fe2 C24 C28 -75.9(2) . . . . ?
C21 Fe2 C24 C28 -40.3(4) . . . . ?
C23 Fe2 C24 C28 -118.83(19) . . . . ?
C27 Fe2 C24 C28 37.90(19) . . . . ?
C20 Fe2 C24 C28 164.9(3) . . . . ?
C26 Fe2 C24 C28 81.8(2) . . . . ?
C25 Fe2 C24 C28 119.4(3) . . . . ?
C19 Fe2 C24 C28 -160.77(18) . . . . ?
C22 Fe2 C24 C25 164.76(17) . . . . ?
C21 Fe2 C24 C25 -159.7(3) . . . . ?
C28 Fe2 C24 C25 -119.4(3) . . . . ?
C23 Fe2 C24 C25 121.78(18) . . . . ?
C27 Fe2 C24 C25 -81.49(19) . . . . ?
C20 Fe2 C24 C25 45.5(4) . . . . ?
C26 Fe2 C24 C25 -37.57(18) . . . . ?
C19 Fe2 C24 C25 79.8(2) . . . . ?
C28 C24 C25 C26 0.1(3) . . . . ?
Fe2 C24 C25 C26 59.12(19) . . . . ?
C28 C24 C25 Fe2 -59.1(2) . . . . ?
C22 Fe2 C25 C26 -157.2(3) . . . . ?
C21 Fe2 C25 C26 36.2(4) . . . . ?
C28 Fe2 C25 C26 -81.6(2) . . . . ?
C23 Fe2 C25 C26 162.84(18) . . . . ?
C27 Fe2 C25 C26 -37.58(18) . . . . ?
C20 Fe2 C25 C26 76.4(2) . . . . ?
C24 Fe2 C25 C26 -119.1(3) . . . . ?
C19 Fe2 C25 C26 119.45(19) . . . . ?
C22 Fe2 C25 C24 -38.1(4) . . . . ?
C21 Fe2 C25 C24 155.3(3) . . . . ?
C28 Fe2 C25 C24 37.55(18) . . . . ?
C23 Fe2 C25 C24 -78.0(2) . . . . ?
C27 Fe2 C25 C24 81.54(19) . . . . ?
C20 Fe2 C25 C24 -164.48(17) . . . . ?
C26 Fe2 C25 C24 119.1(3) . . . . ?
C19 Fe2 C25 C24 -121.43(18) . . . . ?
C24 C25 C26 C27 0.1(3) . . . . ?
Fe2 C25 C26 C27 59.3(2) . . . . ?
C24 C25 C26 Fe2 -59.15(19) . . . . ?
C22 Fe2 C26 C25 157.9(3) . . . . ?
C21 Fe2 C26 C25 -166.32(18) . . . . ?
C28 Fe2 C26 C25 81.6(2) . . . . ?
C23 Fe2 C26 C25 -46.3(4) . . . . ?
C27 Fe2 C26 C25 119.5(3) . . . . ?
C20 Fe2 C26 C25 -123.61(19) . . . . ?
C24 Fe2 C26 C25 37.78(18) . . . . ?
C19 Fe2 C26 C25 -81.3(2) . . . . ?
C22 Fe2 C26 C27 38.4(4) . . . . ?
C21 Fe2 C26 C27 74.1(2) . . . . ?
C28 Fe2 C26 C27 -37.94(17) . . . . ?
C23 Fe2 C26 C27 -165.9(3) . . . . ?
C20 Fe2 C26 C27 116.84(18) . . . . ?
C24 Fe2 C26 C27 -81.76(19) . . . . ?
C25 Fe2 C26 C27 -119.5(3) . . . . ?
C19 Fe2 C26 C27 159.12(16) . . . . ?
C25 C26 C27 C28 -0.3(3) . . . . ?
Fe2 C26 C27 C28 59.4(2) . . . . ?
C25 C26 C27 Fe2 -59.7(2) . . . . ?
C22 Fe2 C27 C26 -164.29(17) . . . . ?
C21 Fe2 C27 C26 -123.12(18) . . . . ?
C28 Fe2 C27 C26 118.9(3) . . . . ?
C23 Fe2 C27 C26 167.4(3) . . . . ?
C20 Fe2 C27 C26 -82.3(2) . . . . ?
C24 Fe2 C27 C26 81.16(19) . . . . ?
C25 Fe2 C27 C26 37.33(17) . . . . ?
C19 Fe2 C27 C26 -53.6(4) . . . . ?
C22 Fe2 C27 C28 76.8(2) . . . . ?
C21 Fe2 C27 C28 117.99(19) . . . . ?
C23 Fe2 C27 C28 48.5(4) . . . . ?
C20 Fe2 C27 C28 158.83(18) . . . . ?
C26 Fe2 C27 C28 -118.9(3) . . . . ?
C24 Fe2 C27 C28 -37.74(19) . . . . ?
C25 Fe2 C27 C28 -81.6(2) . . . . ?
C19 Fe2 C27 C28 -172.4(3) . . . . ?
C25 C24 C28 C27 -0.2(3) . . . . ?
Fe2 C24 C28 C27 -59.7(2) . . . . ?
C25 C24 C28 Fe2 59.45(19) . . . . ?
C26 C27 C28 C24 0.3(3) . . . . ?
Fe2 C27 C28 C24 59.9(2) . . . . ?
C26 C27 C28 Fe2 -59.6(2) . . . . ?
C22 Fe2 C28 C24 121.01(19) . . . . ?
C21 Fe2 C28 C24 162.44(18) . . . . ?
C23 Fe2 C28 C24 80.5(2) . . . . ?
C27 Fe2 C28 C24 -119.0(3) . . . . ?
C20 Fe2 C28 C24 -168.7(3) . . . . ?
C26 Fe2 C28 C24 -81.1(2) . . . . ?
C25 Fe2 C28 C24 -37.58(18) . . . . ?
C19 Fe2 C28 C24 52.8(4) . . . . ?
C22 Fe2 C28 C27 -119.99(19) . . . . ?
C21 Fe2 C28 C27 -78.6(2) . . . . ?
C23 Fe2 C28 C27 -160.50(17) . . . . ?
C20 Fe2 C28 C27 -49.7(4) . . . . ?
C26 Fe2 C28 C27 37.85(18) . . . . ?
C24 Fe2 C28 C27 119.0(3) . . . . ?
C25 Fe2 C28 C27 81.42(19) . . . . ?
C19 Fe2 C28 C27 171.8(3) . . . . ?
C16 C7 B2 C1 148.2(2) . . . . ?
B8 C7 B2 C1 3.2(3) . . . . ?
B11 C7 B2 C1 -100.5(2) . . . . ?
B12 C7 B2 C1 -63.9(2) . . . . ?
B3 C7 B2 C1 39.33(18) . . . . ?
C16 C7 B2 B6 -149.5(2) . . . . ?
B8 C7 B2 B6 65.5(3) . . . . ?
B11 C7 B2 B6 -38.22(19) . . . . ?
B12 C7 B2 B6 -1.5(3) . . . . ?
B3 C7 B2 B6 101.6(2) . . . . ?
C16 C7 B2 B11 -111.2(2) . . . . ?
B8 C7 B2 B11 103.7(2) . . . . ?
B12 C7 B2 B11 36.7(2) . . . . ?
B3 C7 B2 B11 139.9(2) . . . . ?
C16 C7 B2 B3 108.9(2) . . . . ?
B8 C7 B2 B3 -36.1(2) . . . . ?
B11 C7 B2 B3 -139.9(2) . . . . ?
B12 C7 B2 B3 -103.2(2) . . . . ?
C2 C1 B2 C7 -149.2(2) . . . . ?
B3 C1 B2 C7 -40.20(19) . . . . ?
B5 C1 B2 C7 63.9(3) . . . . ?
B6 C1 B2 C7 101.5(2) . . . . ?
B4 C1 B2 C7 -2.9(3) . . . . ?
C2 C1 B2 B6 109.3(3) . . . . ?
B3 C1 B2 B6 -141.7(2) . . . . ?
B5 C1 B2 B6 -37.5(2) . . . . ?
B4 C1 B2 B6 -104.3(2) . . . . ?
C2 C1 B2 B11 148.4(2) . . . . ?
B3 C1 B2 B11 -102.5(2) . . . . ?
B5 C1 B2 B11 1.6(3) . . . . ?
B6 C1 B2 B11 39.1(2) . . . . ?
B4 C1 B2 B11 -65.2(3) . . . . ?
C2 C1 B2 B3 -109.0(2) . . . . ?
B5 C1 B2 B3 104.1(2) . . . . ?
B6 C1 B2 B3 141.7(2) . . . . ?
B4 C1 B2 B3 37.3(2) . . . . ?
C2 C1 B3 C7 148.0(2) . . . . ?
B2 C1 B3 C7 38.72(18) . . . . ?
B5 C1 B3 C7 -65.2(2) . . . . ?
B6 C1 B3 C7 2.5(3) . . . . ?
B4 C1 B3 C7 -101.0(2) . . . . ?
C2 C1 B3 B4 -110.9(2) . . . . ?
B2 C1 B3 B4 139.7(2) . . . . ?
B5 C1 B3 B4 35.8(2) . . . . ?
B6 C1 B3 B4 103.6(2) . . . . ?
C2 C1 B3 B8 -150.9(2) . . . . ?
B2 C1 B3 B8 99.8(2) . . . . ?
B5 C1 B3 B8 -4.2(3) . . . . ?
B6 C1 B3 B8 63.6(3) . . . . ?
B4 C1 B3 B8 -40.0(2) . . . . ?
C2 C1 B3 B2 109.3(2) . . . . ?
B5 C1 B3 B2 -104.0(2) . . . . ?
B6 C1 B3 B2 -36.2(2) . . . . ?
B4 C1 B3 B2 -139.7(2) . . . . ?
C16 C7 B3 C1 -147.8(2) . . . . ?
B2 C7 B3 C1 -39.42(18) . . . . ?
B8 C7 B3 C1 102.1(2) . . . . ?
B11 C7 B3 C1 -1.6(3) . . . . ?
B12 C7 B3 C1 64.8(3) . . . . ?
C16 C7 B3 B4 149.4(2) . . . . ?
B2 C7 B3 B4 -102.2(2) . . . . ?
B8 C7 B3 B4 39.3(2) . . . . ?
B11 C7 B3 B4 -64.4(3) . . . . ?
B12 C7 B3 B4 2.0(3) . . . . ?
C16 C7 B3 B8 110.1(3) . . . . ?
B2 C7 B3 B8 -141.5(2) . . . . ?
B11 C7 B3 B8 -103.7(2) . . . . ?
B12 C7 B3 B8 -37.3(2) . . . . ?
C16 C7 B3 B2 -108.4(2) . . . . ?
B8 C7 B3 B2 141.5(2) . . . . ?
B11 C7 B3 B2 37.8(2) . . . . ?
B12 C7 B3 B2 104.2(2) . . . . ?
C7 B2 B3 C1 134.0(2) . . . . ?
B6 B2 B3 C1 34.3(2) . . . . ?
B11 B2 B3 C1 98.0(2) . . . . ?
C1 B2 B3 C7 -134.0(2) . . . . ?
B6 B2 B3 C7 -99.7(2) . . . . ?
B11 B2 B3 C7 -36.09(19) . . . . ?
C7 B2 B3 B4 97.6(2) . . . . ?
C1 B2 B3 B4 -36.4(2) . . . . ?
B6 B2 B3 B4 -2.1(3) . . . . ?
B11 B2 B3 B4 61.5(3) . . . . ?
C7 B2 B3 B8 33.82(19) . . . . ?
C1 B2 B3 B8 -100.2(2) . . . . ?
B6 B2 B3 B8 -65.9(3) . . . . ?
B11 B2 B3 B8 -2.3(3) . . . . ?
C2 C1 B4 B3 107.8(3) . . . . ?
B2 C1 B4 B3 -37.9(2) . . . . ?
B5 C1 B4 B3 -141.9(2) . . . . ?
B6 C1 B4 B3 -104.6(2) . . . . ?
C2 C1 B4 B9 -149.6(2) . . . . ?
B3 C1 B4 B9 102.6(2) . . . . ?
B2 C1 B4 B9 64.7(3) . . . . ?
B5 C1 B4 B9 -39.4(2) . . . . ?
B6 C1 B4 B9 -2.0(3) . . . . ?
C2 C1 B4 B8 147.2(2) . . . . ?
B3 C1 B4 B8 39.4(2) . . . . ?
B2 C1 B4 B8 1.5(3) . . . . ?
B5 C1 B4 B8 -102.5(2) . . . . ?
B6 C1 B4 B8 -65.1(3) . . . . ?
C2 C1 B4 B5 -110.3(3) . . . . ?
B3 C1 B4 B5 141.9(2) . . . . ?
B2 C1 B4 B5 104.0(2) . . . . ?
B6 C1 B4 B5 37.3(2) . . . . ?
C7 B3 B4 C1 96.6(2) . . . . ?
B8 B3 B4 C1 135.1(2) . . . . ?
B2 B3 B4 C1 35.86(19) . . . . ?
C1 B3 B4 B9 -97.6(2) . . . . ?
C7 B3 B4 B9 -1.0(3) . . . . ?
B8 B3 B4 B9 37.6(2) . . . . ?
B2 B3 B4 B9 -61.7(3) . . . . ?
C1 B3 B4 B8 -135.1(2) . . . . ?
C7 B3 B4 B8 -38.5(2) . . . . ?
B2 B3 B4 B8 -99.3(2) . . . . ?
C1 B3 B4 B5 -33.6(2) . . . . ?
C7 B3 B4 B5 63.1(3) . . . . ?
B8 B3 B4 B5 101.6(2) . . . . ?
B2 B3 B4 B5 2.3(3) . . . . ?
C2 C1 B5 B4 110.5(3) . . . . ?
B3 C1 B5 B4 -35.5(2) . . . . ?
B2 C1 B5 B4 -103.3(2) . . . . ?
B6 C1 B5 B4 -140.5(2) . . . . ?
C2 C1 B5 B9 149.2(2) . . . . ?
B3 C1 B5 B9 3.1(3) . . . . ?
B2 C1 B5 B9 -64.6(3) . . . . ?
B6 C1 B5 B9 -101.9(2) . . . . ?
B4 C1 B5 B9 38.7(2) . . . . ?
C2 C1 B5 B10 -147.8(2) . . . . ?
B3 C1 B5 B10 66.1(3) . . . . ?
B2 C1 B5 B10 -1.6(3) . . . . ?
B6 C1 B5 B10 -38.9(2) . . . . ?
B4 C1 B5 B10 101.7(2) . . . . ?
C2 C1 B5 B6 -109.0(3) . . . . ?
B3 C1 B5 B6 105.0(2) . . . . ?
B2 C1 B5 B6 37.2(2) . . . . ?
B4 C1 B5 B6 140.5(2) . . . . ?
B3 B4 B5 C1 33.5(2) . . . . ?
B9 B4 B5 C1 135.5(2) . . . . ?
B8 B4 B5 C1 97.2(2) . . . . ?
C1 B4 B5 B9 -135.5(2) . . . . ?
B3 B4 B5 B9 -102.0(2) . . . . ?
B8 B4 B5 B9 -38.3(2) . . . . ?
C1 B4 B5 B10 -98.5(2) . . . . ?
B3 B4 B5 B10 -65.0(3) . . . . ?
B9 B4 B5 B10 37.0(2) . . . . ?
B8 B4 B5 B10 -1.3(3) . . . . ?
C1 B4 B5 B6 -35.2(2) . . . . ?
B3 B4 B5 B6 -1.7(3) . . . . ?
B9 B4 B5 B6 100.4(2) . . . . ?
B8 B4 B5 B6 62.0(3) . . . . ?
C2 C1 B6 B11 -147.8(2) . . . . ?
B3 C1 B6 B11 -2.5(3) . . . . ?
B2 C1 B6 B11 -39.1(2) . . . . ?
B5 C1 B6 B11 101.2(2) . . . . ?
B4 C1 B6 B11 64.0(3) . . . . ?
C2 C1 B6 B2 -108.8(2) . . . . ?
B3 C1 B6 B2 36.6(2) . . . . ?
B5 C1 B6 B2 140.2(2) . . . . ?
B4 C1 B6 B2 103.1(2) . . . . ?
C2 C1 B6 B10 149.8(2) . . . . ?
B3 C1 B6 B10 -64.9(3) . . . . ?
B2 C1 B6 B10 -101.4(2) . . . . ?
B5 C1 B6 B10 38.8(2) . . . . ?
B4 C1 B6 B10 1.7(3) . . . . ?
C2 C1 B6 B5 111.0(3) . . . . ?
B3 C1 B6 B5 -103.7(2) . . . . ?
B2 C1 B6 B5 -140.2(2) . . . . ?
B4 C1 B6 B5 -37.1(2) . . . . ?
C7 B2 B6 C1 -97.4(2) . . . . ?
B11 B2 B6 C1 -135.6(2) . . . . ?
B3 B2 B6 C1 -33.84(19) . . . . ?
C7 B2 B6 B11 38.16(19) . . . . ?
C1 B2 B6 B11 135.6(2) . . . . ?
B3 B2 B6 B11 101.7(2) . . . . ?
C7 B2 B6 B10 0.6(3) . . . . ?
C1 B2 B6 B10 98.0(2) . . . . ?
B11 B2 B6 B10 -37.6(2) . . . . ?
B3 B2 B6 B10 64.1(3) . . . . ?
C7 B2 B6 B5 -62.6(3) . . . . ?
C1 B2 B6 B5 34.8(2) . . . . ?
B11 B2 B6 B5 -100.7(2) . . . . ?
B3 B2 B6 B5 1.0(3) . . . . ?
B4 B5 B6 C1 35.4(2) . . . . ?
B9 B5 B6 C1 98.0(2) . . . . ?
B10 B5 B6 C1 135.8(2) . . . . ?
C1 B5 B6 B11 -98.2(2) . . . . ?
B4 B5 B6 B11 -62.8(3) . . . . ?
B9 B5 B6 B11 -0.2(3) . . . . ?
B10 B5 B6 B11 37.6(2) . . . . ?
C1 B5 B6 B2 -35.0(2) . . . . ?
B4 B5 B6 B2 0.4(3) . . . . ?
B9 B5 B6 B2 63.0(3) . . . . ?
B10 B5 B6 B2 100.8(2) . . . . ?
C1 B5 B6 B10 -135.8(2) . . . . ?
B4 B5 B6 B10 -100.4(3) . . . . ?
B9 B5 B6 B10 -37.8(2) . . . . ?
C16 C7 B8 B3 -108.0(3) . . . . ?
B2 C7 B8 B3 36.4(2) . . . . ?
B11 C7 B8 B3 103.9(2) . . . . ?
B12 C7 B8 B3 140.0(2) . . . . ?
C16 C7 B8 B12 112.0(3) . . . . ?
B2 C7 B8 B12 -103.6(2) . . . . ?
B11 C7 B8 B12 -36.2(2) . . . . ?
B3 C7 B8 B12 -140.0(2) . . . . ?
C16 C7 B8 B4 -146.7(2) . . . . ?
B2 C7 B8 B4 -2.3(3) . . . . ?
B11 C7 B8 B4 65.1(3) . . . . ?
B12 C7 B8 B4 101.3(2) . . . . ?
B3 C7 B8 B4 -38.7(2) . . . . ?
C16 C7 B8 B9 151.4(2) . . . . ?
B2 C7 B8 B9 -64.2(3) . . . . ?
B11 C7 B8 B9 3.2(3) . . . . ?
B12 C7 B8 B9 39.4(2) . . . . ?
B3 C7 B8 B9 -100.6(2) . . . . ?
C1 B3 B8 C7 -95.6(2) . . . . ?
B4 B3 B8 C7 -135.6(2) . . . . ?
B2 B3 B8 C7 -33.41(19) . . . . ?
C1 B3 B8 B12 -60.0(3) . . . . ?
C7 B3 B8 B12 35.7(2) . . . . ?
B4 B3 B8 B12 -99.9(2) . . . . ?
B2 B3 B8 B12 2.3(3) . . . . ?
C1 B3 B8 B4 40.0(2) . . . . ?
C7 B3 B8 B4 135.6(2) . . . . ?
B2 B3 B8 B4 102.2(2) . . . . ?
C1 B3 B8 B9 3.4(3) . . . . ?
C7 B3 B8 B9 99.1(2) . . . . ?
B4 B3 B8 B9 -36.6(2) . . . . ?
B2 B3 B8 B9 65.7(3) . . . . ?
C1 B4 B8 C7 0.4(3) . . . . ?
B3 B4 B8 C7 39.0(2) . . . . ?
B9 B4 B8 C7 -99.4(2) . . . . ?
B5 B4 B8 C7 -61.1(3) . . . . ?
C1 B4 B8 B3 -38.61(19) . . . . ?
B9 B4 B8 B3 -138.5(2) . . . . ?
B5 B4 B8 B3 -100.1(2) . . . . ?
C1 B4 B8 B12 62.8(3) . . . . ?
B3 B4 B8 B12 101.4(2) . . . . ?
B9 B4 B8 B12 -37.1(2) . . . . ?
B5 B4 B8 B12 1.3(3) . . . . ?
C1 B4 B8 B9 99.9(2) . . . . ?
B3 B4 B8 B9 138.5(2) . . . . ?
B5 B4 B8 B9 38.3(2) . . . . ?
C1 B4 B9 B12 -61.9(3) . . . . ?
B3 B4 B9 B12 -0.4(3) . . . . ?
B8 B4 B9 B12 37.1(2) . . . . ?
B5 B4 B9 B12 -100.4(2) . . . . ?
C1 B4 B9 B8 -99.0(2) . . . . ?
B3 B4 B9 B8 -37.4(2) . . . . ?
B5 B4 B9 B8 -137.5(2) . . . . ?
C1 B4 B9 B5 38.5(2) . . . . ?
B3 B4 B9 B5 100.0(2) . . . . ?
B8 B4 B9 B5 137.5(2) . . . . ?
C1 B4 B9 B10 1.5(3) . . . . ?
B3 B4 B9 B10 63.1(3) . . . . ?
B8 B4 B9 B10 100.5(2) . . . . ?
B5 B4 B9 B10 -37.0(2) . . . . ?
C7 B8 B9 B4 99.4(2) . . . . ?
B3 B8 B9 B4 36.6(2) . . . . ?
B12 B8 B9 B4 138.5(2) . . . . ?
C7 B8 B9 B12 -39.1(2) . . . . ?
B3 B8 B9 B12 -101.9(2) . . . . ?
B4 B8 B9 B12 -138.5(2) . . . . ?
C7 B8 B9 B5 61.2(3) . . . . ?
B3 B8 B9 B5 -1.6(3) . . . . ?
B12 B8 B9 B5 100.3(2) . . . . ?
B4 B8 B9 B5 -38.2(2) . . . . ?
C7 B8 B9 B10 -2.1(3) . . . . ?
B3 B8 B9 B10 -64.9(3) . . . . ?
B12 B8 B9 B10 36.9(2) . . . . ?
B4 B8 B9 B10 -101.5(3) . . . . ?
C1 B5 B9 B4 -39.0(2) . . . . ?
B10 B5 B9 B4 -138.8(2) . . . . ?
B6 B5 B9 B4 -101.1(2) . . . . ?
C1 B5 B9 B12 62.3(3) . . . . ?
B4 B5 B9 B12 101.2(2) . . . . ?
B10 B5 B9 B12 -37.5(2) . . . . ?
B6 B5 B9 B12 0.1(3) . . . . ?
C1 B5 B9 B8 -0.8(3) . . . . ?
B4 B5 B9 B8 38.1(2) . . . . ?
B10 B5 B9 B8 -100.6(2) . . . . ?
B6 B5 B9 B8 -63.0(3) . . . . ?
C1 B5 B9 B10 99.8(2) . . . . ?
B4 B5 B9 B10 138.8(2) . . . . ?
B6 B5 B9 B10 37.6(2) . . . . ?
C1 B6 B10 B11 99.4(2) . . . . ?
B2 B6 B10 B11 37.7(2) . . . . ?
B5 B6 B10 B11 137.6(2) . . . . ?
C1 B6 B10 B12 62.3(3) . . . . ?
B11 B6 B10 B12 -37.2(2) . . . . ?
B2 B6 B10 B12 0.5(3) . . . . ?
B5 B6 B10 B12 100.5(2) . . . . ?
C1 B6 B10 B5 -38.2(2) . . . . ?
B11 B6 B10 B5 -137.6(2) . . . . ?
B2 B6 B10 B5 -99.9(2) . . . . ?
C1 B6 B10 B9 -0.7(3) . . . . ?
B11 B6 B10 B9 -100.1(2) . . . . ?
B2 B6 B10 B9 -62.4(3) . . . . ?
B5 B6 B10 B9 37.5(2) . . . . ?
C1 B5 B10 B11 1.0(3) . . . . ?
B4 B5 B10 B11 63.8(3) . . . . ?
B9 B5 B10 B11 100.2(2) . . . . ?
B6 B5 B10 B11 -37.6(2) . . . . ?
C1 B5 B10 B12 -61.9(3) . . . . ?
B4 B5 B10 B12 0.9(3) . . . . ?
B9 B5 B10 B12 37.4(2) . . . . ?
B6 B5 B10 B12 -100.4(2) . . . . ?
C1 B5 B10 B6 38.6(2) . . . . ?
B4 B5 B10 B6 101.3(2) . . . . ?
B9 B5 B10 B6 137.8(2) . . . . ?
C1 B5 B10 B9 -99.2(2) . . . . ?
B4 B5 B10 B9 -36.5(2) . . . . ?
B6 B5 B10 B9 -137.8(2) . . . . ?
B4 B9 B10 B11 -63.4(3) . . . . ?
B12 B9 B10 B11 37.3(2) . . . . ?
B8 B9 B10 B11 0.4(3) . . . . ?
B5 B9 B10 B11 -100.6(2) . . . . ?
B4 B9 B10 B12 -100.7(2) . . . . ?
B8 B9 B10 B12 -36.9(2) . . . . ?
B5 B9 B10 B12 -137.8(2) . . . . ?
B4 B9 B10 B6 -0.5(3) . . . . ?
B12 B9 B10 B6 100.2(2) . . . . ?
B8 B9 B10 B6 63.2(3) . . . . ?
B5 B9 B10 B6 -37.7(2) . . . . ?
B4 B9 B10 B5 37.2(2) . . . . ?
B12 B9 B10 B5 137.8(2) . . . . ?
B8 B9 B10 B5 100.9(2) . . . . ?
C16 C7 B11 B12 -111.7(3) . . . . ?
B2 C7 B11 B12 140.7(2) . . . . ?
B8 C7 B11 B12 36.3(2) . . . . ?
B3 C7 B11 B12 102.9(2) . . . . ?
C16 C7 B11 B6 145.6(2) . . . . ?
B2 C7 B11 B6 37.99(19) . . . . ?
B8 C7 B11 B6 -66.4(3) . . . . ?
B12 C7 B11 B6 -102.7(2) . . . . ?
B3 C7 B11 B6 0.2(3) . . . . ?
C16 C7 B11 B2 107.6(2) . . . . ?
B8 C7 B11 B2 -104.4(2) . . . . ?
B12 C7 B11 B2 -140.7(2) . . . . ?
B3 C7 B11 B2 -37.8(2) . . . . ?
C16 C7 B11 B10 -151.0(2) . . . . ?
B2 C7 B11 B10 101.4(2) . . . . ?
B8 C7 B11 B10 -3.0(3) . . . . ?
B12 C7 B11 B10 -39.3(2) . . . . ?
B3 C7 B11 B10 63.6(3) . . . . ?
C1 B6 B11 C7 1.3(3) . . . . ?
B2 B6 B11 C7 -37.18(19) . . . . ?
B10 B6 B11 C7 100.5(2) . . . . ?
B5 B6 B11 C7 62.8(3) . . . . ?
C1 B6 B11 B12 -61.3(3) . . . . ?
B2 B6 B11 B12 -99.8(2) . . . . ?
B10 B6 B11 B12 37.9(2) . . . . ?
B5 B6 B11 B12 0.2(3) . . . . ?
C1 B6 B11 B2 38.53(19) . . . . ?
B10 B6 B11 B2 137.7(2) . . . . ?
B5 B6 B11 B2 100.0(2) . . . . ?
C1 B6 B11 B10 -99.2(2) . . . . ?
B2 B6 B11 B10 -137.7(2) . . . . ?
B5 B6 B11 B10 -37.7(2) . . . . ?
C1 B2 B11 C7 97.9(2) . . . . ?
B6 B2 B11 C7 136.9(2) . . . . ?
B3 B2 B11 C7 36.27(19) . . . . ?
C7 B2 B11 B12 -34.9(2) . . . . ?
C1 B2 B11 B12 63.0(3) . . . . ?
B6 B2 B11 B12 102.0(2) . . . . ?
B3 B2 B11 B12 1.4(3) . . . . ?
C7 B2 B11 B6 -136.9(2) . . . . ?
C1 B2 B11 B6 -39.0(2) . . . . ?
B3 B2 B11 B6 -100.6(2) . . . . ?
C7 B2 B11 B10 -98.8(2) . . . . ?
C1 B2 B11 B10 -0.9(3) . . . . ?
B6 B2 B11 B10 38.1(2) . . . . ?
B3 B2 B11 B10 -62.5(3) . . . . ?
B12 B10 B11 C7 38.8(2) . . . . ?
B6 B10 B11 C7 -99.2(2) . . . . ?
B5 B10 B11 C7 -61.4(3) . . . . ?
B9 B10 B11 C7 1.5(3) . . . . ?
B6 B10 B11 B12 -138.1(2) . . . . ?
B5 B10 B11 B12 -100.3(3) . . . . ?
B9 B10 B11 B12 -37.3(2) . . . . ?
B12 B10 B11 B6 138.1(2) . . . . ?
B5 B10 B11 B6 37.8(2) . . . . ?
B9 B10 B11 B6 100.8(2) . . . . ?
B12 B10 B11 B2 100.2(2) . . . . ?
B6 B10 B11 B2 -37.9(2) . . . . ?
B5 B10 B11 B2 0.0(3) . . . . ?
B9 B10 B11 B2 62.9(3) . . . . ?
C16 C7 B12 B11 109.6(3) . . . . ?
B2 C7 B12 B11 -37.0(2) . . . . ?
B8 C7 B12 B11 -141.3(2) . . . . ?
B3 C7 B12 B11 -104.1(2) . . . . ?
C16 C7 B12 B8 -109.1(3) . . . . ?
B2 C7 B12 B8 104.3(2) . . . . ?
B11 C7 B12 B8 141.3(2) . . . . ?
B3 C7 B12 B8 37.2(2) . . . . ?
C16 C7 B12 B9 -148.4(2) . . . . ?
B2 C7 B12 B9 65.0(3) . . . . ?
B8 C7 B12 B9 -39.4(2) . . . . ?
B11 C7 B12 B9 102.0(2) . . . . ?
B3 C7 B12 B9 -2.2(3) . . . . ?
C16 C7 B12 B10 148.5(2) . . . . ?
B2 C7 B12 B10 1.9(3) . . . . ?
B8 C7 B12 B10 -102.5(2) . . . . ?
B11 C7 B12 B10 38.8(2) . . . . ?
B3 C7 B12 B10 -65.3(3) . . . . ?
B6 B11 B12 C7 97.9(2) . . . . ?
B2 B11 B12 C7 34.4(2) . . . . ?
B10 B11 B12 C7 135.8(2) . . . . ?
C7 B11 B12 B8 -34.3(2) . . . . ?
B6 B11 B12 B8 63.5(3) . . . . ?
B2 B11 B12 B8 0.0(3) . . . . ?
B10 B11 B12 B8 101.5(3) . . . . ?
C7 B11 B12 B9 -98.0(2) . . . . ?
B6 B11 B12 B9 -0.1(3) . . . . ?
B2 B11 B12 B9 -63.6(3) . . . . ?
B10 B11 B12 B9 37.8(2) . . . . ?
C7 B11 B12 B10 -135.8(2) . . . . ?
B6 B11 B12 B10 -37.9(2) . . . . ?
B2 B11 B12 B10 -101.4(2) . . . . ?
B3 B8 B12 C7 -35.9(2) . . . . ?
B4 B8 B12 C7 -98.6(2) . . . . ?
B9 B8 B12 C7 -135.3(2) . . . . ?
C7 B8 B12 B11 34.5(2) . . . . ?
B3 B8 B12 B11 -1.4(3) . . . . ?
B4 B8 B12 B11 -64.1(3) . . . . ?
B9 B8 B12 B11 -100.8(3) . . . . ?
C7 B8 B12 B9 135.3(2) . . . . ?
B3 B8 B12 B9 99.4(2) . . . . ?
B4 B8 B12 B9 36.7(2) . . . . ?
C7 B8 B12 B10 97.9(2) . . . . ?
B3 B8 B12 B10 62.0(3) . . . . ?
B4 B8 B12 B10 -0.7(3) . . . . ?
B9 B8 B12 B10 -37.4(2) . . . . ?
B4 B9 B12 C7 1.5(3) . . . . ?
B8 B9 B12 C7 38.8(2) . . . . ?
B5 B9 B12 C7 -62.2(3) . . . . ?
B10 B9 B12 C7 -99.8(2) . . . . ?
B4 B9 B12 B11 63.8(3) . . . . ?
B8 B9 B12 B11 101.1(2) . . . . ?
B5 B9 B12 B11 0.0(3) . . . . ?
B10 B9 B12 B11 -37.5(2) . . . . ?
B4 B9 B12 B8 -37.3(2) . . . . ?
B5 B9 B12 B8 -101.0(2) . . . . ?
B10 B9 B12 B8 -138.6(2) . . . . ?
B4 B9 B12 B10 101.3(3) . . . . ?
B8 B9 B12 B10 138.6(2) . . . . ?
B5 B9 B12 B10 37.6(2) . . . . ?
B11 B10 B12 C7 -38.6(2) . . . . ?
B6 B10 B12 C7 -1.4(3) . . . . ?
B5 B10 B12 C7 61.9(3) . . . . ?
B9 B10 B12 C7 99.3(2) . . . . ?
B6 B10 B12 B11 37.2(2) . . . . ?
B5 B10 B12 B11 100.5(2) . . . . ?
B9 B10 B12 B11 137.9(2) . . . . ?
B11 B10 B12 B8 -100.7(2) . . . . ?
B6 B10 B12 B8 -63.5(3) . . . . ?
B5 B10 B12 B8 -0.1(3) . . . . ?
B9 B10 B12 B8 37.3(2) . . . . ?
B11 B10 B12 B9 -137.9(2) . . . . ?
B6 B10 B12 B9 -100.8(2) . . . . ?
B5 B10 B12 B9 -37.4(2) . . . . ?
