#------------------------------------------------------------------------------
#$Date: 2019-11-24 06:13:25 +0200 (Sun, 24 Nov 2019) $
#$Revision: 236917 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/08/76/4087681.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_4087681
loop_
_publ_author_name
'Ibad, Muhammad Farooq'
'Schulz, Axel'
'Villinger, Alexander'
_publ_section_title
;
 Pentafluorophenyl Silver: Structure and Bonding of Arene Solvates
;
_journal_issue                   15
_journal_name_full               Organometallics
_journal_page_first              3893
_journal_paper_doi               10.1021/acs.organomet.5b00492
_journal_volume                  34
_journal_year                    2015
_chemical_formula_moiety         'C24 Ag4 F20, 4(C9 H12) '
_chemical_formula_sum            'C60 H48 Ag4 F20'
_chemical_formula_weight         1580.46
_space_group_IT_number           86
_space_group_name_Hall           '-P 4bc'
_space_group_name_H-M_alt        'P 42/n :2'
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      86
_symmetry_space_group_name_Hall  '-P 4bc'
_symmetry_space_group_name_H-M   'P 42/n :2'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   15.4856(4)
_cell_length_b                   15.4856(4)
_cell_length_c                   11.8338(4)
_cell_measurement_reflns_used    5869
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      50.274
_cell_measurement_theta_min      5.261
_cell_volume                     2837.79(14)
_computing_cell_refinement       'Bruker Apex V7.51A'
_computing_data_collection       'Bruker Apex V7.51A'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'ORTEP-3v2.01 (Farrugia, 1997)'
_computing_publication_material  SHELXL-97
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker Apex Kappa II-CCD-diffractometer'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0738
_diffrn_reflns_av_sigmaI/netI    0.0378
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            44049
_diffrn_reflns_theta_full        31.00
_diffrn_reflns_theta_max         31.00
_diffrn_reflns_theta_min         1.86
_exptl_absorpt_coefficient_mu    1.465
_exptl_absorpt_correction_T_max  0.8794
_exptl_absorpt_correction_T_min  0.6132
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 2004)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.850
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             1552
_exptl_crystal_size_max          0.37
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.09
_refine_diff_density_max         0.537
_refine_diff_density_min         -0.434
_refine_diff_density_rms         0.073
_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     239
_refine_ls_number_reflns         4526
_refine_ls_number_restraints     27
_refine_ls_restrained_S_all      1.032
_refine_ls_R_factor_all          0.0773
_refine_ls_R_factor_gt           0.0316
_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)+(0.0208P)²+1.5820P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0575
_refine_ls_wR_factor_ref         0.0736
_reflns_number_gt                2722
_reflns_number_total             4526
_reflns_threshold_expression     >2σ(I)
_cod_data_source_file            om5b00492_si_002.cif
_cod_data_source_block           is_fi127b_AgC6F5_124MeC6H3_b
_cod_original_sg_symbol_H-M      'P 42/n'
_cod_database_code               4087681
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y+1/2, z'
'-y, x+1/2, z+1/2'
'y+1/2, -x, z+1/2'
'-x, -y, -z'
'x-1/2, y-1/2, -z'
'y, -x-1/2, -z-1/2'
'-y-1/2, x, -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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.647717(13) 0.685688(12) 0.214610(19) 0.04030(7) Uani 1 1 d . . .
C1A C 0.5801(2) 0.8052(6) 0.1649(4) 0.0348(11) Uani 0.869(10) 1 d PD A 1
C2A C 0.4958(2) 0.8107(4) 0.2003(4) 0.0399(8) Uani 0.869(10) 1 d PD A 1
C3A C 0.4313(2) 0.8524(3) 0.1405(5) 0.0488(11) Uani 0.869(10) 1 d PD A 1
C4A C 0.4504(3) 0.8890(3) 0.0394(5) 0.0512(11) Uani 0.869(10) 1 d PD A 1
C5A C 0.5327(3) 0.8845(3) -0.0017(4) 0.0484(10) Uani 0.869(10) 1 d PD A 1
C6A C 0.5953(3) 0.8430(3) 0.0614(3) 0.0382(8) Uani 0.869(10) 1 d PD A 1
F1A F 0.4727(2) 0.7744(3) 0.3005(3) 0.0544(7) Uani 0.869(10) 1 d PD A 1
F2A F 0.34960(16) 0.8549(3) 0.1802(4) 0.0748(11) Uani 0.869(10) 1 d PD A 1
F3A F 0.3881(3) 0.9269(2) -0.0215(4) 0.0789(13) Uani 0.869(10) 1 d PD A 1
F4A F 0.5517(3) 0.9200(2) -0.1025(3) 0.0710(10) Uani 0.869(10) 1 d PD A 1
F5A F 0.6760(2) 0.8421(3) 0.0170(3) 0.0555(6) Uani 0.869(10) 1 d PD A 1
C1B C 0.5767(13) 0.808(4) 0.186(3) 0.0348(11) Uani 0.131(10) 1 d PD A 2
C2B C 0.4947(11) 0.802(3) 0.229(3) 0.0399(8) Uani 0.131(10) 1 d PD A 2
C3B C 0.4216(10) 0.833(3) 0.177(2) 0.0488(11) Uani 0.131(10) 1 d PD A 2
C4B C 0.4293(12) 0.874(3) 0.076(3) 0.0512(11) Uani 0.131(10) 1 d PD A 2
C5B C 0.5090(13) 0.887(2) 0.031(2) 0.0484(10) Uani 0.131(10) 1 d PD A 2
C6B C 0.5802(13) 0.852(2) 0.085(2) 0.0382(8) Uani 0.131(10) 1 d PD A 2
F1B F 0.4838(15) 0.7518(19) 0.323(2) 0.0544(7) Uani 0.131(10) 1 d PD A 2
F2B F 0.3429(10) 0.8237(19) 0.224(2) 0.0748(11) Uani 0.131(10) 1 d PD A 2
F3B F 0.3592(14) 0.9104(15) 0.030(2) 0.0789(13) Uani 0.131(10) 1 d PD A 2
F4B F 0.5174(18) 0.9215(16) -0.0728(18) 0.0710(10) Uani 0.131(10) 1 d PD A 2
F5B F 0.6525(16) 0.847(3) 0.022(3) 0.0555(6) Uani 0.131(10) 1 d PD A 2
C7 C 0.5946(2) 0.5855(2) 0.0329(3) 0.0547(8) Uani 1 1 d . . .
C8 C 0.5845(2) 0.6348(2) -0.0625(3) 0.0527(8) Uani 1 1 d . B .
C9 C 0.5036(2) 0.67134(18) -0.0807(3) 0.0512(8) Uani 1 1 d . . .
H9 H 0.4949 0.7058 -0.1461 0.061 Uiso 0.831(5) 1 calc PR B 1
C10 C 0.4351(2) 0.65930(18) -0.0069(3) 0.0493(7) Uani 1 1 d . B .
H10 H 0.3805 0.6846 -0.0226 0.059 Uiso 0.169(5) 1 calc PR B 2
C11 C 0.4466(2) 0.61012(19) 0.0901(3) 0.0516(8) Uani 1 1 d . . .
C12 C 0.5268(2) 0.5727(2) 0.1079(3) 0.0561(9) Uani 1 1 d . B .
C13 C 0.6568(2) 0.6493(3) -0.1446(3) 0.0732(11) Uani 1 1 d . . .
H13A H 0.6756 0.7096 -0.1406 0.110 Uiso 1 1 calc R B .
H13B H 0.6367 0.6364 -0.2213 0.110 Uiso 1 1 calc R . .
H13C H 0.7052 0.6112 -0.1256 0.110 Uiso 1 1 calc R . .
C14A C 0.3468(2) 0.6982(3) -0.0354(4) 0.0646(12) Uani 0.831(5) 1 d P B 1
H14A H 0.3068 0.6520 -0.0567 0.097 Uiso 0.831(5) 1 calc PR B 1
H14B H 0.3529 0.7388 -0.0984 0.097 Uiso 0.831(5) 1 calc PR B 1
H14C H 0.3242 0.7288 0.0308 0.097 Uiso 0.831(5) 1 calc PR B 1
C14B C 0.4977(12) 0.7168(11) -0.1767(15) 0.0512(8) Uani 0.169(5) 1 d P B 2
H14D H 0.5536 0.7166 -0.2153 0.077 Uiso 0.169(5) 1 calc PR B 2
H14E H 0.4811 0.7764 -0.1591 0.077 Uiso 0.169(5) 1 calc PR B 2
H14F H 0.4539 0.6907 -0.2258 0.077 Uiso 0.169(5) 1 calc PR B 2
C15 C 0.3735(2) 0.5960(3) 0.1720(3) 0.0731(10) Uani 1 1 d . B .
H15A H 0.3922 0.5565 0.2319 0.110 Uiso 1 1 calc R . .
H15B H 0.3241 0.5709 0.1319 0.110 Uiso 1 1 calc R . .
H15C H 0.3566 0.6514 0.2054 0.110 Uiso 1 1 calc R . .
H12 H 0.526(2) 0.540(2) 0.167(3) 0.064(10) Uiso 1 1 d . . .
H7 H 0.646(2) 0.5586(19) 0.045(3) 0.060(10) Uiso 1 1 d . . .
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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 '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
C1B Ag1 C1A 161.3(6) 8_756 .
C1B Ag1 C1B 154.9(10) 8_756 .
C1A Ag1 C1B 6.6(12) . .
C1B Ag1 C1A 5.8(9) 8_756 8_756
C1A Ag1 C1A 156.44(16) . 8_756
C1B Ag1 C1A 149.9(10) . 8_756
C1B Ag1 Ag1 119.4(13) 8_756 7_576
C1A Ag1 Ag1 53.2(2) . 7_576
C1B Ag1 Ag1 50.1(16) . 7_576
C1A Ag1 Ag1 114.11(13) 8_756 7_576
C1B Ag1 Ag1 51.4(15) 8_756 8_756
C1A Ag1 Ag1 134.38(19) . 8_756
C1B Ag1 Ag1 133.6(14) . 8_756
C1A Ag1 Ag1 50.54(19) 8_756 8_756
Ag1 Ag1 Ag1 84.774(5) 7_576 8_756
C2A C1A C6A 114.0(3) . .
C2A C1A Ag1 115.0(4) . .
C6A C1A Ag1 120.8(4) . .
C2A C1A Ag1 118.0(5) . 7_576
C6A C1A Ag1 107.2(4) . 7_576
Ag1 C1A Ag1 76.24(11) . 7_576
F1A C2A C1A 119.3(3) . .
F1A C2A C3A 116.6(3) . .
C1A C2A C3A 124.0(3) . .
F2A C3A C4A 119.9(3) . .
F2A C3A C2A 120.8(4) . .
C4A C3A C2A 119.2(3) . .
F3A C4A C3A 120.1(4) . .
F3A C4A C5A 120.2(4) . .
C3A C4A C5A 119.7(3) . .
F4A C5A C4A 119.9(3) . .
F4A C5A C6A 121.0(4) . .
C4A C5A C6A 119.1(3) . .
F5A C6A C1A 119.9(3) . .
F5A C6A C5A 116.2(3) . .
C1A C6A C5A 123.9(3) . .
C2B C1B C6B 113.4(11) . .
C2B C1B Ag1 122(4) . 7_576
C6B C1B Ag1 106(3) . 7_576
C2B C1B Ag1 110(3) . .
C6B C1B Ag1 123(3) . .
Ag1 C1B Ag1 78.5(5) 7_576 .
F1B C2B C1B 117.4(12) . .
F1B C2B C3B 117.8(12) . .
C1B C2B C3B 124.2(11) . .
F2B C3B C4B 119.6(11) . .
F2B C3B C2B 121.0(12) . .
C4B C3B C2B 119.4(10) . .
F3B C4B C3B 119.1(12) . .
F3B C4B C5B 120.9(12) . .
C3B C4B C5B 119.7(10) . .
F4B C5B C4B 120.4(12) . .
F4B C5B C6B 120.1(12) . .
C4B C5B C6B 118.8(10) . .
F5B C6B C1B 119.0(14) . .
F5B C6B C5B 115.1(13) . .
C1B C6B C5B 124.4(11) . .
C8 C7 C12 121.2(3) . .
C8 C7 H7 119(2) . .
C12 C7 H7 120(2) . .
C7 C8 C9 117.1(3) . .
C7 C8 C13 122.1(3) . .
C9 C8 C13 120.8(3) . .
C14B C9 C10 123.5(9) . .
C14B C9 C8 114.0(9) . .
C10 C9 C8 122.5(3) . .
C14B C9 H9 5.0 . .
C10 C9 H9 118.8 . .
C8 C9 H9 118.8 . .
C9 C10 C11 119.8(3) . .
C9 C10 C14A 119.4(3) . .
C11 C10 C14A 120.8(3) . .
C9 C10 H10 120.1 . .
C11 C10 H10 120.1 . .
C14A C10 H10 1.8 . .
C12 C11 C10 118.0(3) . .
C12 C11 C15 121.0(3) . .
C10 C11 C15 121.0(3) . .
C11 C12 C7 121.4(3) . .
C11 C12 H12 111(2) . .
C7 C12 H12 127(2) . .
C8 C13 H13A 109.5 . .
C8 C13 H13B 109.5 . .
H13A C13 H13B 109.5 . .
C8 C13 H13C 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
C10 C14A H14A 109.5 . .
C10 C14A H14B 109.5 . .
C10 C14A H14C 109.5 . .
C9 C14B H14D 109.5 . .
C9 C14B H14E 109.5 . .
H14D C14B H14E 109.5 . .
C9 C14B H14F 109.5 . .
H14D C14B H14F 109.5 . .
H14E C14B H14F 109.5 . .
C11 C15 H15A 109.5 . .
C11 C15 H15B 109.5 . .
H15A C15 H15B 109.5 . .
C11 C15 H15C 109.5 . .
H15A C15 H15C 109.5 . .
H15B C15 H15C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ag1 C1B 2.17(5) 8_756
Ag1 C1A 2.206(6) .
Ag1 C1B 2.21(5) .
Ag1 C1A 2.289(7) 8_756
Ag1 Ag1 2.7754(3) 7_576
Ag1 Ag1 2.7754(3) 8_756
C1A C2A 1.374(4) .
C1A C6A 1.378(4) .
C1A Ag1 2.289(7) 7_576
C2A F1A 1.361(4) .
C2A C3A 1.384(4) .
C3A F2A 1.350(4) .
C3A C4A 1.357(5) .
C4A F3A 1.340(3) .
C4A C5A 1.367(5) .
C5A F4A 1.346(4) .
C5A C6A 1.382(4) .
C6A F5A 1.356(4) .
C1B C2B 1.374(9) .
C1B C6B 1.375(9) .
C1B Ag1 2.17(5) 7_576
C2B F1B 1.357(9) .
C2B C3B 1.381(9) .
C3B F2B 1.349(9) .
C3B C4B 1.353(10) .
C4B F3B 1.339(9) .
C4B C5B 1.361(10) .
C5B F4B 1.342(9) .
C5B C6B 1.386(9) .
C6B F5B 1.349(10) .
C7 C8 1.372(5) .
C7 C12 1.388(5) .
C7 H7 0.91(3) .
C8 C9 1.392(4) .
C8 C13 1.498(5) .
C9 C14B 1.340(17) .
C9 C10 1.386(4) .
C9 H9 0.9500 .
C10 C11 1.389(4) .
C10 C14A 1.532(4) .
C10 H10 0.9500 .
C11 C12 1.387(5) .
C11 C15 1.505(5) .
C12 H12 0.87(3) .
C13 H13A 0.9800 .
C13 H13B 0.9800 .
C13 H13C 0.9800 .
C14A H14A 0.9800 .
C14A H14B 0.9800 .
C14A H14C 0.9800 .
C14B H14D 0.9800 .
C14B H14E 0.9800 .
C14B H14F 0.9800 .
C15 H15A 0.9800 .
C15 H15B 0.9800 .
C15 H15C 0.9800 .
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_4
C1B Ag1 C1A C2A -42(6) 8_756 .
C1B Ag1 C1A C2A -56(12) . .
C1A Ag1 C1A C2A -50.7(6) 8_756 .
Ag1 Ag1 C1A C2A -114.7(5) 7_576 .
Ag1 Ag1 C1A C2A -141.8(4) 8_756 .
C1B Ag1 C1A C6A 175(5) 8_756 .
C1B Ag1 C1A C6A 161(13) . .
C1A Ag1 C1A C6A 166.1(6) 8_756 .
Ag1 Ag1 C1A C6A 102.1(5) 7_576 .
Ag1 Ag1 C1A C6A 75.0(6) 8_756 .
C1B Ag1 C1A Ag1 73(5) 8_756 7_576
C1B Ag1 C1A Ag1 59(13) . 7_576
C1A Ag1 C1A Ag1 64.0(3) 8_756 7_576
Ag1 Ag1 C1A Ag1 -27.07(19) 8_756 7_576
C6A C1A C2A F1A 178.9(6) . .
Ag1 C1A C2A F1A 33.1(9) . .
Ag1 C1A C2A F1A -54.0(9) 7_576 .
C6A C1A C2A C3A -1.8(11) . .
Ag1 C1A C2A C3A -147.5(5) . .
Ag1 C1A C2A C3A 125.4(6) 7_576 .
F1A C2A C3A F2A -1.0(9) . .
C1A C2A C3A F2A 179.6(7) . .
F1A C2A C3A C4A -179.3(5) . .
C1A C2A C3A C4A 1.3(10) . .
F2A C3A C4A F3A -0.7(8) . .
C2A C3A C4A F3A 177.6(5) . .
F2A C3A C4A C5A -178.4(4) . .
C2A C3A C4A C5A -0.1(8) . .
F3A C4A C5A F4A 1.6(7) . .
C3A C4A C5A F4A 179.3(5) . .
F3A C4A C5A C6A -178.2(4) . .
C3A C4A C5A C6A -0.5(7) . .
C2A C1A C6A F5A 179.8(6) . .
Ag1 C1A C6A F5A -36.6(8) . .
Ag1 C1A C6A F5A 47.3(6) 7_576 .
C2A C1A C6A C5A 1.1(10) . .
Ag1 C1A C6A C5A 144.6(4) . .
Ag1 C1A C6A C5A -131.4(4) 7_576 .
F4A C5A C6A F5A 1.4(6) . .
C4A C5A C6A F5A -178.8(5) . .
F4A C5A C6A C1A -179.8(6) . .
C4A C5A C6A C1A 0.0(8) . .
C1B Ag1 C1B C2B -47(4) 8_756 .
C1A Ag1 C1B C2B 123(16) . .
C1A Ag1 C1B C2B -53(6) 8_756 .
Ag1 Ag1 C1B C2B -121(4) 7_576 .
Ag1 Ag1 C1B C2B -137(3) 8_756 .
C1B Ag1 C1B C6B 176(5) 8_756 .
C1A Ag1 C1B C6B -14(9) . .
C1A Ag1 C1B C6B 169.8(18) 8_756 .
Ag1 Ag1 C1B C6B 102(4) 7_576 .
Ag1 Ag1 C1B C6B 86(5) 8_756 .
C1B Ag1 C1B Ag1 74.0(19) 8_756 7_576
C1A Ag1 C1B Ag1 -116(12) . 7_576
C1A Ag1 C1B Ag1 68(2) 8_756 7_576
Ag1 Ag1 C1B Ag1 -16.1(14) 8_756 7_576
C6B C1B C2B F1B 174(5) . .
Ag1 C1B C2B F1B -57(7) 7_576 .
Ag1 C1B C2B F1B 32(7) . .
C6B C1B C2B C3B 3(9) . .
Ag1 C1B C2B C3B 132(4) 7_576 .
Ag1 C1B C2B C3B -139(5) . .
F1B C2B C3B F2B 8(8) . .
C1B C2B C3B F2B 179(6) . .
F1B C2B C3B C4B -172(5) . .
C1B C2B C3B C4B -1(9) . .
F2B C3B C4B F3B 5(7) . .
C2B C3B C4B F3B -175(4) . .
F2B C3B C4B C5B 177(4) . .
C2B C3B C4B C5B -2(8) . .
F3B C4B C5B F4B -13(6) . .
C3B C4B C5B F4B 175(4) . .
F3B C4B C5B C6B 177(4) . .
C3B C4B C5B C6B 4(7) . .
C2B C1B C6B F5B -166(5) . .
Ag1 C1B C6B F5B 57(5) 7_576 .
Ag1 C1B C6B F5B -30(6) . .
C2B C1B C6B C5B -1(8) . .
Ag1 C1B C6B C5B -138(3) 7_576 .
Ag1 C1B C6B C5B 135(3) . .
F4B C5B C6B F5B -8(5) . .
C4B C5B C6B F5B 163(4) . .
F4B C5B C6B C1B -173(5) . .
C4B C5B C6B C1B -2(7) . .
C12 C7 C8 C9 0.0(4) . .
C12 C7 C8 C13 -179.9(3) . .
C7 C8 C9 C14B -178.4(8) . .
C13 C8 C9 C14B 1.5(9) . .
C7 C8 C9 C10 -0.1(4) . .
C13 C8 C9 C10 179.8(3) . .
C14B C9 C10 C11 179.1(9) . .
C8 C9 C10 C11 0.9(4) . .
C14B C9 C10 C14A 1.0(10) . .
C8 C9 C10 C14A -177.2(3) . .
C9 C10 C11 C12 -1.6(4) . .
C14A C10 C11 C12 176.5(3) . .
C9 C10 C11 C15 179.9(3) . .
C14A C10 C11 C15 -2.0(4) . .
C10 C11 C12 C7 1.6(4) . .
C15 C11 C12 C7 -179.9(3) . .
C8 C7 C12 C11 -0.9(5) . .
