#------------------------------------------------------------------------------
#$Date: 2019-11-23 15:57:10 +0200 (Sat, 23 Nov 2019) $
#$Revision: 233911 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/34/93/4349384.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_4349384
loop_
_publ_author_name
'Weßing, Jana'
'Göbel, Christoph'
'Weber, Birgit'
'Gemel, Christian'
'Fischer, Roland A.'
_publ_section_title
;
 Diverse Reactivity of ECp* (E = Al, Ga) toward Low-Coordinate Transition
 Metal Amides [TM(N(SiMe₃)₂)₂] (TM = Fe,
 Co, Zn): Insertion, Cp* Transfer, and Orthometalation.
;
_journal_issue                   6
_journal_name_full               'Inorganic chemistry'
_journal_page_first              3517
_journal_page_last               3525
_journal_paper_doi               10.1021/acs.inorgchem.6b03127
_journal_volume                  56
_journal_year                    2017
_chemical_compound_source        'see text'
_chemical_formula_moiety         'C32 H70 Al2 Co N2 Si4'
_chemical_formula_sum            'C32 H70 Al2 Co N2 Si4'
_chemical_formula_weight         708.15
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                94.067(2)
_cell_angle_beta                 106.104(1)
_cell_angle_gamma                113.135(1)
_cell_formula_units_Z            1
_cell_length_a                   8.6323(3)
_cell_length_b                   9.6301(3)
_cell_length_c                   13.9237(5)
_cell_measurement_reflns_used    9979
_cell_measurement_temperature    100
_cell_measurement_theta_max      35.8755
_cell_measurement_theta_min      2.3491
_cell_volume                     1001.20(6)
_computing_cell_refinement       'SAINT (Bruker, 2014)'
_computing_data_collection       'APEX III Control Software (Bruker, 2015)'
_computing_data_reduction        'SAINT (Bruker, 2014)'
_computing_publication_material  'PLATON (Spek, 2011), enCIFer (Allen, 2014)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXT (Sheldrick, 2015)'
_diffrn_ambient_temperature      100
_diffrn_detector                 ' CMOS plate '
_diffrn_detector_area_resol_mean 16
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  ' Bruker Photon CMOS '
_diffrn_measurement_method       ' phi- and omega-rotation '
_diffrn_radiation_monochromator  'Helios optic'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_source         'TXS rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0473
_diffrn_reflns_av_unetI/netI     0.0350
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            64049
_diffrn_reflns_reduction_process
;
;
_diffrn_reflns_theta_full        25.24
_diffrn_reflns_theta_max         35.63
_diffrn_reflns_theta_min         2.35
_exptl_absorpt_coefficient_mu    0.615
_exptl_absorpt_correction_T_max  0.7471
_exptl_absorpt_correction_T_min  0.7109
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS 2016/2, Bruker, 2016'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.174
_exptl_crystal_density_method    'Not Measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             385
_exptl_crystal_size_max          0.173
_exptl_crystal_size_mid          0.101
_exptl_crystal_size_min          0.043
_refine_diff_density_max         0.613
_refine_diff_density_min         -0.421
_refine_diff_density_rms         0.068
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.035
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     206
_refine_ls_number_reflns         9232
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.035
_refine_ls_R_factor_all          0.0517
_refine_ls_R_factor_gt           0.0344
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'W=1/[Σ²(FO²)+(0.0307P)²+0.3859P] WHERE P=(FO²+2FC²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0722
_refine_ls_wR_factor_ref         0.0776
_reflns_number_gt                7434
_reflns_number_total             9232
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            ic6b03127_si_001.cif
_cod_data_source_block           wesja6_0m_a
_cod_database_code               4349384
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x,-y,-z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_thermal_displace_type
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
_atom_site_calc_flag
_atom_site_refinement_flags
Co01 Co Uani 0.50000 0.50000 0.50000 1.000 0.0085(1) d SP
Si1 Si Uani 0.61990(4) 0.66089(3) 0.84406(2) 1.000 0.0114(1) d .
Si2 Si Uani 0.97325(4) 0.73212(3) 0.81110(2) 1.000 0.0117(1) d .
Al1 Al Uani 0.63186(4) 0.46233(3) 0.66497(2) 1.000 0.0102(1) d .
N1 N Uani 0.74430(11) 0.62261(9) 0.77587(6) 1.000 0.0101(2) d .
C1 C Uani 0.37993(14) 0.51804(13) 0.78919(8) 1.000 0.0170(3) d .
C2 C Uani 0.61503(17) 0.85376(13) 0.84136(10) 1.000 0.0226(3) d .
C3 C Uani 0.70533(15) 0.65321(13) 0.98184(8) 1.000 0.0184(3) d .
C4 C Uani 1.05426(14) 0.70181(14) 0.70329(8) 1.000 0.0182(3) d .
C5 C Uani 1.10305(15) 0.68783(14) 0.92735(9) 1.000 0.0206(3) d .
C6 C Uani 1.04150(16) 0.94442(13) 0.84386(10) 1.000 0.0230(3) d .
C7 C Uani 0.55082(13) 0.23783(11) 0.70901(7) 1.000 0.0119(2) d .
C8 C Uani 0.70483(13) 0.27324(11) 0.67534(8) 1.000 0.0140(2) d .
C9 C Uani 0.63810(14) 0.23215(12) 0.56633(8) 1.000 0.0154(3) d .
C10 C Uani 0.45162(14) 0.17843(11) 0.53348(8) 1.000 0.0143(2) d .
C11 C Uani 0.39727(13) 0.18016(11) 0.62047(7) 1.000 0.0122(2) d .
C12 C Uani 0.55747(16) 0.23113(12) 0.81764(8) 1.000 0.0182(3) d .
C13 C Uani 0.88464(15) 0.29349(13) 0.74355(10) 1.000 0.0233(3) d .
C14 C Uani 0.74808(18) 0.24928(14) 0.49771(10) 1.000 0.0248(3) d .
C15 C Uani 0.32918(18) 0.12582(14) 0.42427(8) 1.000 0.0230(3) d .
C16 C Uani 0.20817(14) 0.13325(13) 0.61721(9) 1.000 0.0188(3) d .
H1 H Uiso 0.6875(19) 0.5288(17) 0.5592(11) 1.000 0.018(4) d .
H1A H Uiso 0.32860 0.53070 0.72010 1.000 0.0250 c RU
H1B H Uiso 0.31400 0.53530 0.83220 1.000 0.0250 c RU
H1C H Uiso 0.37150 0.41330 0.78650 1.000 0.0250 c RU
H2 H Uiso 0.434(2) 0.4665(17) 0.5900(12) 1.000 0.022(4) d .
H2A H Uiso 0.57200 0.86340 0.77040 1.000 0.0340 c RU
H2B H Uiso 0.73570 0.93570 0.87560 1.000 0.0340 c RU
H2C H Uiso 0.53480 0.86280 0.87680 1.000 0.0340 c RU
H3A H Uiso 0.70950 0.55370 0.98700 1.000 0.0280 c RU
H3B H Uiso 0.62550 0.66520 1.01660 1.000 0.0280 c RU
H3C H Uiso 0.82560 0.73670 1.01400 1.000 0.0280 c RU
H4A H Uiso 1.01790 0.59140 0.68150 1.000 0.0270 c RU
H4B H Uiso 1.18480 0.75690 0.72610 1.000 0.0270 c RU
H4C H Uiso 1.00250 0.74130 0.64590 1.000 0.0270 c RU
H5A H Uiso 1.07040 0.57690 0.91670 1.000 0.0310 c RU
H5B H Uiso 1.07530 0.71870 0.98670 1.000 0.0310 c RU
H5C H Uiso 1.23120 0.74480 0.93930 1.000 0.0310 c RU
H6A H Uiso 1.16990 1.00060 0.85630 1.000 0.0340 c RU
H6B H Uiso 1.01510 0.96820 0.90540 1.000 0.0340 c RU
H6C H Uiso 0.97520 0.97550 0.78700 1.000 0.0340 c RU
H12A H Uiso 0.44280 0.21890 0.82410 1.000 0.0270 c RU
H12B H Uiso 0.65310 0.32680 0.86300 1.000 0.0270 c RU
H12C H Uiso 0.58080 0.14330 0.83650 1.000 0.0270 c RU
H13A H Uiso 0.87850 0.19300 0.75630 1.000 0.0350 c RU
H13B H Uiso 0.91860 0.36250 0.80850 1.000 0.0350 c RU
H13C H Uiso 0.97390 0.33820 0.71020 1.000 0.0350 c RU
H14A H Uiso 0.70270 0.15080 0.45060 1.000 0.0370 c RU
H14B H Uiso 0.87280 0.27980 0.53900 1.000 0.0370 c RU
H14C H Uiso 0.74070 0.32850 0.45860 1.000 0.0370 c RU
H15A H Uiso 0.36700 0.20850 0.38690 1.000 0.0340 c RU
H15B H Uiso 0.20650 0.10050 0.42220 1.000 0.0340 c RU
H15C H Uiso 0.33430 0.03420 0.39260 1.000 0.0340 c RU
H16A H Uiso 0.16060 0.19880 0.58060 1.000 0.0280 c RU
H16B H Uiso 0.20490 0.14500 0.68700 1.000 0.0280 c RU
H16C H Uiso 0.13540 0.02530 0.58190 1.000 0.0280 c RU
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'
Al Al 0.0645 0.0514 ' International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Co Co 0.3494 0.9721 ' International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 ' International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 ' 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
Al1 Co01 Al1 180.00 . 2_666 yes
H1 Co01 H2 93.8(9) . . no
Al1 Co01 H1 132.7(6) 2_666 . no
H1 Co01 H1 180.00 . 2_666 no
H1 Co01 H2 86.2(9) . 2_666 no
Al1 Co01 H2 132.8(7) 2_666 . no
H1 Co01 H2 86.2(9) 2_666 . no
H2 Co01 H2 180.00 . 2_666 no
Al1 Co01 H1 47.3(6) 2_666 2_666 no
Al1 Co01 H2 47.2(7) 2_666 2_666 no
H1 Co01 H2 93.8(9) 2_666 2_666 no
Al1 Co01 H1 132.7(6) . 2_666 no
Al1 Co01 H1 47.3(6) . . no
Al1 Co01 H2 47.2(7) . . no
Al1 Co01 H2 132.8(7) . 2_666 no
N1 Si1 C3 111.57(5) . . yes
N1 Si1 C1 110.57(5) . . yes
N1 Si1 C2 114.65(5) . . yes
C2 Si1 C3 106.57(6) . . yes
C1 Si1 C2 104.58(6) . . yes
C1 Si1 C3 108.49(5) . . yes
C4 Si2 C6 106.22(6) . . yes
N1 Si2 C4 110.26(5) . . yes
N1 Si2 C5 113.13(5) . . yes
N1 Si2 C6 113.15(6) . . yes
C4 Si2 C5 108.84(6) . . yes
C5 Si2 C6 104.87(6) . . yes
N1 Al1 C8 116.99(4) . . yes
C7 Al1 C8 39.20(4) . . yes
Co01 Al1 N1 120.52(3) . . yes
Co01 Al1 C7 123.56(3) . . yes
Co01 Al1 C8 118.74(3) . . yes
N1 Al1 C7 112.23(4) . . yes
Co01 Al1 H1 38.9(6) . . no
Co01 Al1 H2 39.5(6) . . no
H1 Al1 H2 77.7(8) . . no
N1 Al1 H1 109.4(5) . . no
N1 Al1 H2 109.3(5) . . no
C7 Al1 H1 133.8(5) . . no
C7 Al1 H2 105.8(5) . . no
C8 Al1 H1 103.0(5) . . no
C8 Al1 H2 129.8(5) . . no
Si1 N1 Si2 121.34(5) . . yes
Si1 N1 Al1 119.40(6) . . yes
Si2 N1 Al1 119.26(6) . . yes
Al1 C7 C8 69.07(6) . . yes
Al1 C7 C11 88.42(6) . . yes
Al1 C7 C12 118.64(7) . . yes
C8 C7 C11 107.30(9) . . no
C8 C7 C12 123.81(10) . . no
C11 C7 C12 127.50(11) . . no
C9 C8 C13 126.31(11) . . no
Al1 C8 C7 71.73(6) . . yes
Al1 C8 C9 88.52(7) . . yes
Al1 C8 C13 121.98(7) . . yes
C7 C8 C9 106.86(10) . . no
C7 C8 C13 123.54(10) . . no
C8 C9 C14 126.08(11) . . no
C10 C9 C14 125.29(10) . . no
C8 C9 C10 108.58(10) . . no
C9 C10 C15 125.88(11) . . no
C11 C10 C15 125.52(12) . . no
C9 C10 C11 108.59(9) . . no
C7 C11 C16 126.53(10) . . no
C10 C11 C16 124.81(10) . . no
C7 C11 C10 108.63(10) . . no
Si1 C1 H1A 109.00 . . no
Si1 C1 H1B 109.00 . . no
Si1 C1 H1C 109.00 . . no
H1A C1 H1B 109.00 . . no
H1A C1 H1C 109.00 . . no
H1B C1 H1C 109.00 . . no
Si1 C2 H2A 109.00 . . no
Si1 C2 H2B 109.00 . . no
Si1 C2 H2C 109.00 . . no
H2A C2 H2B 110.00 . . no
H2A C2 H2C 109.00 . . no
H2B C2 H2C 109.00 . . no
Si1 C3 H3A 109.00 . . no
Si1 C3 H3B 109.00 . . no
Si1 C3 H3C 109.00 . . no
H3A C3 H3B 109.00 . . no
H3A C3 H3C 109.00 . . no
H3B C3 H3C 109.00 . . no
Si2 C4 H4A 109.00 . . no
Si2 C4 H4B 109.00 . . no
Si2 C4 H4C 110.00 . . no
H4A C4 H4B 109.00 . . no
H4A C4 H4C 109.00 . . no
H4B C4 H4C 109.00 . . no
Si2 C5 H5A 109.00 . . no
Si2 C5 H5B 109.00 . . no
Si2 C5 H5C 109.00 . . no
H5A C5 H5B 109.00 . . no
H5A C5 H5C 109.00 . . no
H5B C5 H5C 109.00 . . no
Si2 C6 H6A 109.00 . . no
Si2 C6 H6B 109.00 . . no
Si2 C6 H6C 109.00 . . no
H6A C6 H6B 109.00 . . no
H6A C6 H6C 110.00 . . no
H6B C6 H6C 109.00 . . no
C7 C12 H12A 109.00 . . no
C7 C12 H12B 109.00 . . no
C7 C12 H12C 109.00 . . no
H12A C12 H12B 109.00 . . no
H12A C12 H12C 110.00 . . no
H12B C12 H12C 109.00 . . no
C8 C13 H13A 109.00 . . no
C8 C13 H13B 109.00 . . no
C8 C13 H13C 109.00 . . no
H13A C13 H13B 109.00 . . no
H13A C13 H13C 109.00 . . no
H13B C13 H13C 109.00 . . no
C9 C14 H14A 109.00 . . no
C9 C14 H14B 109.00 . . no
C9 C14 H14C 109.00 . . no
H14A C14 H14B 109.00 . . no
H14A C14 H14C 109.00 . . no
H14B C14 H14C 109.00 . . no
C10 C15 H15A 109.00 . . no
C10 C15 H15B 109.00 . . no
C10 C15 H15C 109.00 . . no
H15A C15 H15B 109.00 . . no
H15A C15 H15C 109.00 . . no
H15B C15 H15C 109.00 . . no
C11 C16 H16A 109.00 . . no
C11 C16 H16B 109.00 . . no
C11 C16 H16C 109.00 . . no
H16A C16 H16B 109.00 . . no
H16A C16 H16C 109.00 . . no
H16B C16 H16C 109.00 . . no
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
Co01 Al1 2.3866(3) . yes
Co01 Al1 2.3866(3) 2_666 yes
Co01 H2 1.519(17) . no
Co01 H1 1.500(17) 2_666 no
Co01 H2 1.519(17) 2_666 no
Co01 H1 1.500(17) . no
Si1 N1 1.7371(10) . yes
Si1 C1 1.8711(13) . yes
Si1 C3 1.8729(11) . yes
Si1 C2 1.8771(13) . yes
Si2 N1 1.7349(10) . yes
Si2 C4 1.8730(12) . yes
Si2 C5 1.8774(13) . yes
Si2 C6 1.8727(12) . yes
Al1 C8 2.1498(11) . yes
Al1 N1 1.8336(8) . yes
Al1 C7 2.1856(10) . yes
Al1 H1 1.759(15) . no
Al1 H2 1.755(18) . no
C7 C12 1.5046(14) . no
C7 C11 1.4153(14) . no
C7 C8 1.4546(17) . no
C8 C9 1.4293(15) . no
C8 C13 1.5058(18) . no
C9 C10 1.4042(18) . no
C9 C14 1.498(2) . no
C10 C15 1.5048(15) . no
C10 C11 1.4163(15) . no
C11 C16 1.4991(18) . no
C1 H1A 0.9800 . no
C1 H1B 0.9800 . no
C1 H1C 0.9800 . no
C2 H2A 0.9800 . no
C2 H2B 0.9800 . no
C2 H2C 0.9800 . no
C3 H3A 0.9800 . no
C3 H3B 0.9800 . no
C3 H3C 0.9800 . no
C4 H4A 0.9800 . no
C4 H4B 0.9800 . no
C4 H4C 0.9800 . no
C5 H5A 0.9800 . no
C5 H5B 0.9800 . no
C5 H5C 0.9800 . no
C6 H6A 0.9800 . no
C6 H6B 0.9800 . no
C6 H6C 0.9800 . no
C12 H12A 0.9800 . no
C12 H12B 0.9800 . no
C12 H12C 0.9800 . no
C13 H13A 0.9800 . no
C13 H13B 0.9800 . no
C13 H13C 0.9800 . no
C14 H14A 0.9800 . no
C14 H14B 0.9800 . no
C14 H14C 0.9800 . no
C15 H15A 0.9800 . no
C15 H15B 0.9800 . no
C15 H15C 0.9800 . no
C16 H16A 0.9800 . no
C16 H16B 0.9800 . no
C16 H16C 0.9800 . no
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_publ_flag
C1 Si1 N1 Si2 -177.97(5) no
C1 Si1 N1 Al1 1.56(7) no
C2 Si1 N1 Si2 64.13(8) no
C2 Si1 N1 Al1 -116.35(6) no
C3 Si1 N1 Si2 -57.13(7) no
C3 Si1 N1 Al1 122.40(6) no
C4 Si2 N1 Si1 -163.12(6) no
C4 Si2 N1 Al1 17.36(7) no
C5 Si2 N1 Si1 74.75(7) no
C5 Si2 N1 Al1 -104.78(6) no
C6 Si2 N1 Si1 -44.33(7) no
C6 Si2 N1 Al1 136.14(6) no
Co01 Al1 N1 Si1 86.73(5) no
C7 Al1 N1 Si1 -72.38(7) no
C8 Al1 N1 Si1 -115.37(6) no
Co01 Al1 N1 Si2 -93.74(5) no
C7 Al1 N1 Si2 107.16(6) no
C8 Al1 N1 Si2 64.17(6) no
Co01 Al1 C7 C8 95.70(6) no
N1 Al1 C7 C8 -105.94(7) no
Co01 Al1 C7 C11 -13.51(8) no
N1 Al1 C7 C11 144.85(7) no
C8 Al1 C7 C11 -109.22(9) no
Co01 Al1 C7 C12 -146.27(8) no
N1 Al1 C7 C12 12.10(11) no
C8 Al1 C7 C12 118.03(12) no
N1 Al1 C8 C7 92.71(7) no
Co01 Al1 C8 C9 -0.68(8) no
N1 Al1 C8 C9 -158.98(7) no
C7 Al1 C8 C9 108.31(9) no
Co01 Al1 C8 C13 132.35(8) no
N1 Al1 C8 C13 -25.96(11) no
C7 Al1 C8 C13 -118.67(11) no
Co01 Al1 C8 C7 -108.98(5) no
Al1 C7 C11 C10 67.68(8) no
Al1 C7 C11 C16 -110.35(10) no
C8 C7 C11 C10 0.19(11) no
C8 C7 C11 C16 -177.84(10) no
C12 C7 C11 C10 -166.64(10) no
C12 C7 C11 C16 15.33(18) no
C12 C7 C8 C13 5.57(16) no
Al1 C7 C8 C9 -82.62(8) no
Al1 C7 C8 C13 116.77(10) no
C11 C7 C8 Al1 81.37(7) no
C11 C7 C8 C9 -1.25(11) no
C11 C7 C8 C13 -161.86(10) no
C12 C7 C8 Al1 -111.20(10) no
C12 C7 C8 C9 166.19(10) no
Al1 C8 C9 C10 -68.55(8) no
Al1 C8 C9 C14 109.09(11) no
C7 C8 C9 C10 1.85(12) no
C7 C8 C9 C14 179.49(11) no
C13 C8 C9 C10 161.77(10) no
C13 C8 C9 C14 -20.59(18) no
C8 C9 C10 C11 -1.76(12) no
C8 C9 C10 C15 178.94(10) no
C14 C9 C10 C11 -179.42(11) no
C14 C9 C10 C15 1.28(18) no
C9 C10 C11 C7 0.97(12) no
C9 C10 C11 C16 179.04(10) no
C15 C10 C11 C7 -179.73(10) no
C15 C10 C11 C16 -1.66(17) no
