#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:32:16 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179115 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/77/4307747.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_4307747
loop_
_publ_author_name
'Mohamed Osman Awaleh'
'Antonella Badia'
'François Brisse'
_publ_contact_author_address
;
      Université de Montréal
      Département de Chimie
      C.P. 6128, Succ. Centre-ville
      Montréal, Québec
      Canada, H3C 3J7
;
_publ_contact_author_email       francois.brisse@umontreal.ca
_publ_contact_author_fax         '+1 514 343 7586'
_publ_contact_author_name        'Dr François Brisse'
_publ_contact_author_phone       '+1 514 343 2088'
_publ_section_title
;
One-Dimensional Coordination Polymers Incorporating Silver(I)
Perfluorocarboxylate Cuboctahedral Clusters and the Bis(methylthio)methane
Ligand
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3185
_journal_page_last               3191
_journal_paper_doi               10.1021/ic062232q
_journal_volume                  46
_journal_year                    2007
_chemical_compound_source        'Synthesized by the authors. See text'
_chemical_formula_moiety         'C18 H33 Ag6 F9 O6 S9'
_chemical_formula_sum            'C18 H33 Ag6 F9 O6 S9'
_chemical_formula_weight         1452.20
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_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                 109.47
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.2763(2)
_cell_length_b                   20.7631(4)
_cell_length_c                   15.7275(3)
_cell_measurement_reflns_used    35230
_cell_measurement_temperature    200(2)
_cell_measurement_theta_max      68.89
_cell_measurement_theta_min      3.53
_cell_volume                     4087.48(13)
_computing_cell_refinement       'SMART (Bruker, 2003)'
_computing_data_collection       'SMART (Bruker, 2003)'
_computing_data_reduction        'SAINT (Bruker, 2004)'
_computing_molecular_graphics    'SHELXTL (Bruker, 1997)'
_computing_publication_material  'UdMX (local program)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      200(2)
_diffrn_detector_area_resol_mean 5.5
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.990
_diffrn_measurement_device_type  'Bruker Smart 6000'
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  'Montel 200 optics'
_diffrn_radiation_source         'Rotating Anode'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.057
_diffrn_reflns_av_sigmaI/netI    0.0229
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            57314
_diffrn_reflns_theta_full        68.96
_diffrn_reflns_theta_max         68.96
_diffrn_reflns_theta_min         3.53
_diffrn_standards_decay_%        -0.40
_diffrn_standards_number         388
_exptl_absorpt_coefficient_mu    27.585
_exptl_absorpt_correction_T_max  0.5040
_exptl_absorpt_correction_T_min  0.3030
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Sadabs (Sheldrick,1996)'
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    2.360
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2784
_exptl_crystal_size_max          0.16
_exptl_crystal_size_mid          0.04
_exptl_crystal_size_min          0.04
_refine_diff_density_max         2.520
_refine_diff_density_min         -1.187
_refine_diff_density_rms         0.146
_refine_ls_extinction_coef       0.000046(8)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.046
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     434
_refine_ls_number_reflns         7523
_refine_ls_number_restraints     53
_refine_ls_restrained_S_all      1.049
_refine_ls_R_factor_all          0.0398
_refine_ls_R_factor_gt           0.0374
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0567P)²+14.9094P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0980
_refine_ls_wR_factor_ref         0.0998
_reflns_number_gt                6948
_reflns_number_total             7523
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            ic062232qsi20061123_031502.cif
_cod_data_source_block           ande37
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_geom_angle_publ_flag' value 'Y' changed to 'y' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (245
times).

'_geom_bond_publ_flag' value 'Y' changed to 'y' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (81 time).

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_cell_volume        4087.41(13)
_cod_database_code               4307747
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, 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 0.80308(3) 0.080245(19) 0.02244(2) 0.03289(11) Uani 1 1 d . . .
Ag2 Ag 0.85659(3) 0.08668(2) -0.15524(3) 0.03468(11) Uani 1 1 d . . .
Ag3 Ag 0.99646(3) 0.16026(2) 0.01195(2) 0.03303(11) Uani 1 1 d . . .
Ag4 Ag 1.01484(3) 0.01352(2) -0.20940(3) 0.04090(12) Uani 1 1 d . . .
Ag5 Ag 0.76296(3) -0.05844(2) 0.04249(3) 0.03990(12) Uani 1 1 d . . .
Ag6 Ag 1.17239(3) 0.10406(2) 0.15882(3) 0.04069(12) Uani 1 1 d . . .
S1 S 0.77997(11) 0.11542(7) -0.32658(9) 0.0387(3) Uani 1 1 d . . .
S2 S 0.89145(13) 0.00511(7) -0.37834(10) 0.0428(3) Uani 1 1 d . . .
S3 S 1.06037(11) 0.27680(7) 0.07746(9) 0.0366(3) Uani 1 1 d . . .
S4 S 1.26220(10) 0.20426(7) 0.11444(9) 0.0353(3) Uani 1 1 d . . .
S5 S 0.76236(8) -0.00056(5) -0.10270(7) 0.0225(2) Uani 1 1 d . . .
S6 S 0.59565(9) -0.13357(7) 0.00339(9) 0.0337(3) Uani 1 1 d . . .
S7 S 0.97405(9) 0.09785(6) 0.14501(7) 0.0260(2) Uani 1 1 d . . .
S8 S 0.63091(10) 0.14329(7) -0.00134(10) 0.0389(3) Uani 1 1 d . . .
S9 S 1.05620(9) 0.11376(6) -0.10971(7) 0.0256(2) Uani 1 1 d . . .
O3 O 0.7834(5) 0.2004(3) -0.1619(3) 0.0715(11) Uani 1 1 d . . .
O4 O 0.8299(5) 0.2224(3) -0.0181(3) 0.0715(11) Uani 1 1 d . . .
O5 O 0.6956(4) -0.0057(2) 0.1512(3) 0.0559(12) Uani 1 1 d . . .
O7 O 1.2822(3) 0.0902(2) 0.3092(3) 0.0436(10) Uani 1 1 d . . .
O10 O 1.2281(3) 0.1870(2) 0.3393(3) 0.0449(10) Uani 1 1 d . . .
O11 O 0.8409(4) -0.0240(4) 0.2706(4) 0.090(2) Uani 1 1 d . . .
C1 C 1.2817(4) 0.1379(3) 0.3564(3) 0.0349(12) Uani 1 1 d . A .
C3 C 0.7458(5) -0.0121(3) 0.2319(4) 0.0443(14) Uani 1 1 d . . .
C5 C 0.7831(5) 0.2320(3) -0.0983(4) 0.0402(13) Uani 1 1 d . B .
C11 C 0.7647(5) 0.0425(3) -0.3931(4) 0.0439(14) Uani 1 1 d . . .
H11A H 0.7183 0.0119 -0.3751 0.053 Uiso 1 1 calc R . .
H11B H 0.7294 0.0530 -0.4577 0.053 Uiso 1 1 calc R . .
C12 C 0.6410(5) 0.1370(4) -0.3526(5) 0.062(2) Uani 1 1 d . . .
H12A H 0.6109 0.1494 -0.4162 0.094 Uiso 1 1 calc R . .
H12B H 0.6353 0.1733 -0.3146 0.094 Uiso 1 1 calc R . .
H12C H 0.6014 0.1001 -0.3410 0.094 Uiso 1 1 calc R . .
C22 C 0.9486(6) 0.0612(4) -0.4377(4) 0.0565(18) Uani 1 1 d . . .
H22A H 0.9097 0.0584 -0.5026 0.085 Uiso 1 1 calc R . .
H22B H 1.0239 0.0505 -0.4259 0.085 Uiso 1 1 calc R . .
H22C H 0.9431 0.1051 -0.4166 0.085 Uiso 1 1 calc R . .
C31 C 1.0769(6) 0.3179(4) -0.0188(4) 0.0559(17) Uani 1 1 d . . .
H31A H 1.1073 0.3608 -0.0005 0.084 Uiso 1 1 calc R . .
H31B H 1.0073 0.3222 -0.0664 0.084 Uiso 1 1 calc R . .
H31C H 1.1251 0.2930 -0.0417 0.084 Uiso 1 1 calc R . .
C32 C 1.1968(5) 0.2696(3) 0.1503(4) 0.0390(12) Uani 1 1 d . . .
H32A H 1.2352 0.3103 0.1493 0.047 Uiso 1 1 calc R . .
H32B H 1.1988 0.2619 0.2129 0.047 Uiso 1 1 calc R . .
C41 C 1.3938(5) 0.2125(4) 0.1981(4) 0.0544(17) Uani 1 1 d . . .
H41A H 1.4280 0.2515 0.1859 0.082 Uiso 1 1 calc R . .
H41B H 1.4373 0.1749 0.1955 0.082 Uiso 1 1 calc R . .
H41C H 1.3873 0.2154 0.2583 0.082 Uiso 1 1 calc R . .
C51 C 0.6231(4) 0.0071(3) -0.1754(4) 0.0362(13) Uani 1 1 d . . .
H51A H 0.5987 0.0513 -0.1724 0.054 Uiso 1 1 calc R . .
H51B H 0.5787 -0.0228 -0.1552 0.054 Uiso 1 1 calc R . .
H51C H 0.6173 -0.0030 -0.2378 0.054 Uiso 1 1 calc R . .
C61 C 0.4767(4) -0.0904(3) 0.0009(4) 0.0318(11) Uani 1 1 d . . .
H61A H 0.4940 -0.0615 0.0540 0.038 Uiso 1 1 calc R . .
H61B H 0.4528 -0.0631 -0.0539 0.038 Uiso 1 1 calc R . .
C62 C 0.6258(5) -0.1757(3) 0.1085(5) 0.0555(18) Uani 1 1 d . . .
H62A H 0.6414 -0.1446 0.1580 0.083 Uiso 1 1 calc R . .
H62B H 0.6881 -0.2035 0.1171 0.083 Uiso 1 1 calc R . .
H62C H 0.5644 -0.2021 0.1077 0.083 Uiso 1 1 calc R . .
C71 C 0.9548(5) 0.1568(3) 0.2238(4) 0.0424(14) Uani 1 1 d . . .
H71A H 0.9194 0.1950 0.1905 0.064 Uiso 1 1 calc R . .
H71B H 1.0243 0.1691 0.2670 0.064 Uiso 1 1 calc R . .
H71C H 0.9104 0.1381 0.2562 0.064 Uiso 1 1 calc R . .
C81 C 0.6549(6) 0.1852(4) 0.1030(6) 0.072(2) Uani 1 1 d . . .
H81A H 0.5948 0.2140 0.0981 0.108 Uiso 1 1 calc R . .
H81B H 0.7207 0.2106 0.1165 0.108 Uiso 1 1 calc R . .
H81C H 0.6625 0.1540 0.1515 0.108 Uiso 1 1 calc R . .
C91 C 1.0600(5) 0.1775(3) -0.1892(4) 0.0411(13) Uani 1 1 d . . .
H91A H 0.9887 0.1963 -0.2155 0.062 Uiso 1 1 calc R . .
H91B H 1.0828 0.1592 -0.2373 0.062 Uiso 1 1 calc R . .
H91C H 1.1106 0.2109 -0.1574 0.062 Uiso 1 1 calc R . .
C4 C 0.6818(5) -0.0054(4) 0.2953(5) 0.061(2) Uani 1 1 d D . .
F13 F 0.7384(4) 0.0013(3) 0.3804(4) 0.0944(11) Uani 1 1 d D . .
F14 F 0.6147(4) 0.0459(3) 0.2738(3) 0.0944(11) Uani 1 1 d D . .
F15 F 0.6159(4) -0.0559(3) 0.2881(3) 0.0944(11) Uani 1 1 d D . .
C2 C 1.3674(5) 0.1354(3) 0.4508(4) 0.0471(15) Uani 1 1 d D . .
F1 F 1.3865(11) 0.0793(6) 0.4896(8) 0.0656(18) Uani 0.412(9) 1 d PD A 1
F2 F 1.3573(11) 0.1786(6) 0.5085(7) 0.0656(18) Uani 0.412(9) 1 d PD A 1
F3 F 1.4622(8) 0.1529(6) 0.4389(7) 0.0656(18) Uani 0.412(9) 1 d PD A 1
F4 F 1.4175(13) 0.0781(7) 0.4739(9) 0.0656(18) Uani 0.364(8) 1 d PD A 2
F5 F 1.4435(10) 0.1809(7) 0.4607(9) 0.0656(18) Uani 0.364(8) 1 d PD A 2
F6 F 1.3238(10) 0.1472(8) 0.5178(7) 0.0656(18) Uani 0.364(8) 1 d PD A 2
F7 F 1.4050(17) 0.1895(8) 0.4932(13) 0.0656(18) Uani 0.232(7) 1 d PD A 3
F8 F 1.3243(15) 0.1040(10) 0.5053(10) 0.0656(18) Uani 0.232(7) 1 d PD A 3
F9 F 1.4531(14) 0.1010(9) 0.4526(12) 0.0656(18) Uani 0.232(7) 1 d PD A 3
C6 C 0.7169(4) 0.2937(3) -0.1203(4) 0.0467(15) Uani 1 1 d D . .
F20 F 0.7826(16) 0.3459(9) -0.095(2) 0.0686(16) Uani 0.186(11) 1 d PD B 4
F21 F 0.6422(18) 0.2946(13) -0.0786(18) 0.0686(16) Uani 0.186(11) 1 d PD B 4
F22 F 0.6505(19) 0.3012(16) -0.2046(11) 0.0686(16) Uani 0.186(11) 1 d PD B 4
F23 F 0.6858(10) 0.3159(6) -0.0547(6) 0.0686(16) Uani 0.593(14) 1 d PD B 5
F24 F 0.6294(8) 0.2876(6) -0.1927(7) 0.0686(16) Uani 0.593(14) 1 d PD B 5
F27 F 0.7751(8) 0.3410(4) -0.1423(10) 0.0686(16) Uani 0.593(14) 1 d PD B 5
F25 F 0.724(2) 0.3287(12) -0.0454(13) 0.0686(16) Uani 0.218(14) 1 d PD B 6
F26 F 0.742(2) 0.3333(10) -0.1784(17) 0.0686(16) Uani 0.218(14) 1 d PD B 6
F28 F 0.6123(14) 0.2771(12) -0.1598(18) 0.0686(16) Uani 0.218(14) 1 d PD B 6
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag 0.1306 4.2820 '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_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
S7 AG1 S5 . . . 127.94(4) y
S7 AG1 S8 . . . 125.77(5) y
S5 AG1 S8 . . . 106.28(4) y
S7 AG1 AG5 . . . 102.24(3) y
S5 AG1 AG5 . . . 55.49(3) y
S8 AG1 AG5 . . . 109.27(3) y
S7 AG1 AG2 . . . 105.65(3) y
S5 AG1 AG2 . . . 51.41(3) y
S8 AG1 AG2 . . . 107.96(4) y
AG5 AG1 AG2 . . . 103.918(16) y
S7 AG1 AG3 . . . 53.21(3) y
S5 AG1 AG3 . . . 106.39(3) y
S8 AG1 AG3 . . . 115.69(3) y
AG5 AG1 AG3 . . . 134.893(17) y
AG2 AG1 AG3 . . . 59.252(12) y
S5 AG2 O3 . . . 117.46(15) y
S5 AG2 S9 . . . 130.70(4) y
O3 AG2 S9 . . . 98.81(15) y
S5 AG2 S1 . . . 116.22(4) y
O3 AG2 S1 . . . 74.53(12) y
S9 AG2 S1 . . . 104.39(4) y
S5 AG2 AG4 . . . 101.92(3) y
O3 AG2 AG4 . . . 140.21(14) y
S9 AG2 AG4 . . . 54.74(3) y
S1 AG2 AG4 . . . 83.64(4) y
S5 AG2 AG3 . . . 107.73(3) y
O3 AG2 AG3 . . . 71.77(12) y
S9 AG2 AG3 . . . 51.62(3) y
S1 AG2 AG3 . . . 133.28(4) y
AG4 AG2 AG3 . . . 102.622(16) y
S5 AG2 AG1 . . . 51.71(3) y
O3 AG2 AG1 . . . 83.00(13) y
S9 AG2 AG1 . . . 106.43(3) y
S1 AG2 AG1 . . . 144.13(4) y
AG4 AG2 AG1 . . . 129.655(18) y
AG3 AG2 AG1 . . . 60.390(12) y
O4 AG3 S9 . . . 123.30(12) y
O4 AG3 S7 . . . 94.60(14) y
S9 AG3 S7 . . . 125.70(4) y
O4 AG3 S3 . . . 75.40(15) y
S9 AG3 S3 . . . 120.51(4) y
S7 AG3 S3 . . . 104.65(4) y
O4 AG3 AG6 . . . 142.10(12) y
S9 AG3 AG6 . . . 94.41(3) y
S7 AG3 AG6 . . . 55.44(3) y
S3 AG3 AG6 . . . 89.39(3) y
O4 AG3 AG2 . . . 81.29(13) y
S9 AG3 AG2 . . . 53.68(3) y
S7 AG3 AG2 . . . 104.24(3) y
S3 AG3 AG2 . . . 143.98(3) y
AG6 AG3 AG2 . . . 124.972(18) y
O4 AG3 AG1 . . . 65.54(15) y
S9 AG3 AG1 . . . 108.24(3) y
S7 AG3 AG1 . . . 50.45(3) y
S3 AG3 AG1 . . . 128.98(3) y
AG6 AG3 AG1 . . . 101.601(17) y
AG2 AG3 AG1 . . . 60.359(12) y
O11 AG4 S7 3_755 . 3_755 107.17(19) y
O11 AG4 S9 3_755 . . 97.7(2) y
S7 AG4 S9 3_755 . . 122.13(4) y
O11 AG4 S2 3_755 . . 85.00(14) y
S7 AG4 S2 3_755 . . 106.29(4) y
S9 AG4 S2 . . . 127.64(4) y
O11 AG4 AG2 3_755 . . 143.6(2) y
S7 AG4 AG2 3_755 . . 108.12(3) y
S9 AG4 AG2 . . . 55.17(3) y
S2 AG4 AG2 . . . 93.59(4) y
O11 AG4 AG5 3_755 . 3_755 71.42(15) y
S7 AG4 AG5 3_755 . 3_755 91.28(3) y
S9 AG4 AG5 . . 3_755 48.79(3) y
S2 AG4 AG5 . . 3_755 154.05(4) y
AG2 AG4 AG5 . . 3_755 98.992(16) y
O5 AG5 S9 . . 3_755 115.21(11) y
O5 AG5 S5 . . . 121.24(12) y
S9 AG5 S5 3_755 . . 107.55(4) y
O5 AG5 S6 . . . 87.21(13) y
S9 AG5 S6 3_755 . . 115.92(4) y
S5 AG5 S6 . . . 108.56(4) y
O5 AG5 AG1 . . . 76.09(13) y
S9 AG5 AG1 3_755 . . 107.69(3) y
S5 AG5 AG1 . . . 53.17(3) y
S6 AG5 AG1 . . . 136.33(3) y
O5 AG5 AG4 . . 3_755 76.07(11) y
S9 AG5 AG4 3_755 . 3_755 48.83(3) y
S5 AG5 AG4 . . 3_755 107.77(3) y
S6 AG5 AG4 . . 3_755 143.59(3) y
AG1 AG5 AG4 . . 3_755 70.825(14) y
O7 AG6 S7 . . . 110.69(12) y
O7 AG6 S5 . . 3_755 94.37(10) y
S7 AG6 S5 . . 3_755 112.36(4) y
O7 AG6 S4 . . . 100.49(11) y
S7 AG6 S4 . . . 124.35(4) y
S5 AG6 S4 3_755 . . 109.73(4) y
O7 AG6 AG3 . . . 155.41(11) y
S7 AG6 AG3 . . . 55.10(3) y
S5 AG6 AG3 3_755 . . 109.44(3) y
S4 AG6 AG3 . . . 77.66(3) y
C12 S1 C11 . . . 99.6(3) y
C12 S1 AG2 . . . 107.9(3) y
C11 S1 AG2 . . . 109.6(2) y
C11 S2 C22 . . . 101.0(3) y
C11 S2 AG4 . . . 110.1(2) y
C22 S2 AG4 . . . 104.6(2) y
C32 S3 C31 . . . 101.2(3) y
C32 S3 AG3 . . . 107.16(19) y
C31 S3 AG3 . . . 102.5(3) y
C32 S4 C41 . . . 98.7(3) y
C32 S4 AG6 . . . 101.9(2) y
C41 S4 AG6 . . . 107.3(3) y
C51 S5 AG2 . . . 104.1(2) y
C51 S5 AG1 . . . 109.98(19) y
AG2 S5 AG1 . . . 76.88(3) y
C51 S5 AG5 . . . 107.40(19) y
AG2 S5 AG5 . . . 141.11(5) y
AG1 S5 AG5 . . . 71.34(3) y
C51 S5 AG6 . . 3_755 104.09(19) y
AG2 S5 AG6 . . 3_755 103.24(4) y
AG1 S5 AG6 . . 3_755 144.85(5) y
AG5 S5 AG6 . . 3_755 90.72(4) y
C62 S6 C61 . . . 100.8(3) y
C62 S6 AG5 . . . 99.4(2) y
C61 S6 AG5 . . . 112.14(18) y
C71 S7 AG1 . . . 109.29(19) y
C71 S7 AG4 . . 3_755 110.4(2) y
AG1 S7 AG4 . . 3_755 95.38(4) y
C71 S7 AG3 . . . 107.3(2) y
AG1 S7 AG3 . . . 76.33(3) y
AG4 S7 AG3 3_755 . . 142.06(5) y
C71 S7 AG6 . . . 106.32(19) y
AG1 S7 AG6 . . . 136.29(5) y
AG4 S7 AG6 3_755 . . 95.24(4) y
AG3 S7 AG6 . . . 69.46(3) y
C81 S8 C61 . . 3_655 101.1(3) y
C81 S8 AG1 . . . 103.8(3) y
C61 S8 AG1 3_655 . . 111.03(18) y
C91 S9 AG3 . . . 109.4(2) y
C91 S9 AG5 . . 3_755 111.8(2) y
AG3 S9 AG5 . . 3_755 110.61(4) y
C91 S9 AG4 . . . 102.6(2) y
AG3 S9 AG4 . . . 136.69(5) y
AG5 S9 AG4 3_755 . . 82.39(4) y
C91 S9 AG2 . . . 103.21(19) y
AG3 S9 AG2 . . . 74.71(3) y
AG5 S9 AG2 3_755 . . 139.34(5) y
AG4 S9 AG2 . . . 70.08(3) y
C5 O3 AG2 . . . 125.6(4) y
C5 O4 AG3 . . . 113.5(4) y
C3 O5 AG5 . . . 118.5(4) y
C1 O7 AG6 . . . 112.4(3) y
C3 O11 AG4 . . 3_755 127.0(5) y
O10 C1 O7 . . . 130.9(5) y
O10 C1 C2 . . . 115.4(5) y
O7 C1 C2 . . . 113.6(5) y
O11 C3 O5 . . . 130.3(6) y
O11 C3 C4 . . . 113.6(6) y
O5 C3 C4 . . . 116.0(5) y
O3 C5 O4 . . . 129.0(6) y
O3 C5 C6 . . . 115.7(5) y
O4 C5 C6 . . . 115.3(5) y
S2 C11 S1 . . . 111.5(3) y
S2 C11 H11A . . . 109.3 ?
S1 C11 H11A . . . 109.3 ?
S2 C11 H11B . . . 109.3 ?
S1 C11 H11B . . . 109.3 ?
H11A C11 H11B . . . 108 ?
S1 C12 H12A . . . 109.5 ?
S1 C12 H12B . . . 109.5 ?
H12A C12 H12B . . . 109.5 ?
S1 C12 H12C . . . 109.5 ?
H12A C12 H12C . . . 109.5 ?
H12B C12 H12C . . . 109.5 ?
S2 C22 H22A . . . 109.5 ?
S2 C22 H22B . . . 109.5 ?
H22A C22 H22B . . . 109.5 ?
S2 C22 H22C . . . 109.5 ?
H22A C22 H22C . . . 109.5 ?
H22B C22 H22C . . . 109.5 ?
S3 C31 H31A . . . 109.5 ?
S3 C31 H31B . . . 109.5 ?
H31A C31 H31B . . . 109.5 ?
S3 C31 H31C . . . 109.5 ?
H31A C31 H31C . . . 109.5 ?
H31B C31 H31C . . . 109.5 ?
S4 C32 S3 . . . 110.6(3) y
S4 C32 H32A . . . 109.5 ?
S3 C32 H32A . . . 109.5 ?
S4 C32 H32B . . . 109.5 ?
S3 C32 H32B . . . 109.5 ?
H32A C32 H32B . . . 108.1 ?
S4 C41 H41A . . . 109.5 ?
S4 C41 H41B . . . 109.5 ?
H41A C41 H41B . . . 109.5 ?
S4 C41 H41C . . . 109.5 ?
H41A C41 H41C . . . 109.5 ?
H41B C41 H41C . . . 109.5 ?
S5 C51 H51A . . . 109.5 ?
S5 C51 H51B . . . 109.5 ?
H51A C51 H51B . . . 109.5 ?
S5 C51 H51C . . . 109.5 ?
H51A C51 H51C . . . 109.5 ?
H51B C51 H51C . . . 109.5 ?
S8 C61 S6 3_655 . . 112.7(3) y
S8 C61 H61A 3_655 . . 109.1 ?
S6 C61 H61A . . . 109.1 ?
S8 C61 H61B 3_655 . . 109.1 ?
S6 C61 H61B . . . 109.1 ?
H61A C61 H61B . . . 107.8 ?
S6 C62 H62A . . . 109.5 ?
S6 C62 H62B . . . 109.5 ?
H62A C62 H62B . . . 109.5 ?
S6 C62 H62C . . . 109.5 ?
H62A C62 H62C . . . 109.5 ?
H62B C62 H62C . . . 109.5 ?
S7 C71 H71A . . . 109.5 ?
S7 C71 H71B . . . 109.5 ?
H71A C71 H71B . . . 109.5 ?
S7 C71 H71C . . . 109.5 ?
H71A C71 H71C . . . 109.5 ?
H71B C71 H71C . . . 109.5 ?
S8 C81 H81A . . . 109.5 ?
S8 C81 H81B . . . 109.5 ?
H81A C81 H81B . . . 109.5 ?
S8 C81 H81C . . . 109.5 ?
H81A C81 H81C . . . 109.5 ?
H81B C81 H81C . . . 109.5 ?
S9 C91 H91A . . . 109.5 ?
S9 C91 H91B . . . 109.5 ?
H91A C91 H91B . . . 109.5 ?
S9 C91 H91C . . . 109.5 ?
H91A C91 H91C . . . 109.5 ?
H91B C91 H91C . . . 109.5 ?
F13 C4 F15 . . . 107.8(6) y
F13 C4 F14 . . . 106.1(6) y
F15 C4 F14 . . . 103.6(5) y
F13 C4 C3 . . . 115.2(5) y
F15 C4 C3 . . . 111.3(6) y
F14 C4 C3 . . . 112.0(6) y
F1 C2 F2 . . . 109.6(7) y
F1 C2 F7 . . . 123.0(1) y
F1 C2 F9 . . . 58.7(1) y
F2 C2 F9 . . . 129.2(1) y
F7 C2 F9 . . . 105.6(1) y
F2 C2 F4 . . . 124.6(9) y
F7 C2 F4 . . . 123.00(11) y
F1 C2 F5 . . . 123.3(9) y
F2 C2 F5 . . . 71.8(8) y
F9 C2 F5 . . . 76.8(1) y
F4 C2 F5 . . . 107.6(8) y
F1 C2 F8 . . . 47.5(9) y
F2 C2 F8 . . . 74.2(9) y
F7 C2 F8 . . . 105.1(1) y
F9 C2 F8 . . . 105.5(1) y
F4 C2 F8 . . . 71.2(1) y
F5 C2 F8 . . . 136.3(9) y
F1 C2 F3 . . . 104.8(7) y
F2 C2 F3 . . . 102.8(7) y
F7 C2 F3 . . . 68.6(1) y
F9 C2 F3 . . . 48.4(9) y
F4 C2 F3 . . . 83.1(8) y
F8 C2 F3 . . . 144.3(1) y
F1 C2 F6 . . . 82.2(8) y
F7 C2 F6 . . . 69.4(1) y
F9 C2 F6 . . . 130.4(1) y
F4 C2 F6 . . . 104.1(8) y
F5 C2 F6 . . . 105.9(7) y
F3 C2 F6 . . . 133.5(7) y
F1 C2 C1 . . . 116.7(7) y
F2 C2 C1 . . . 115.5(6) y
F7 C2 C1 . . . 119.5(9) y
F9 C2 C1 . . . 112.9(9) y
F4 C2 C1 . . . 115.3(7) y
F5 C2 C1 . . . 111.8(6) y
F8 C2 C1 . . . 107.2(8) y
F3 C2 C1 . . . 105.9(6) y
F6 C2 C1 . . . 111.5(6) y
F23 C6 F24 . . . 106.9(7) y
F23 C6 F22 . . . 117.50(13) y
F23 C6 F26 . . . 122.10(12) y
F24 C6 F26 . . . 79.9(1) y
F22 C6 F26 . . . 59.30(15) y
F24 C6 F21 . . . 81.10(12) y
F22 C6 F21 . . . 97.50(15) y
F26 C6 F21 . . . 134.80(15) y
F23 C6 F28 . . . 84.7(1) y
F22 C6 F28 . . . 48.80(15) y
F26 C6 F28 . . . 107.0(1) y
F21 C6 F28 . . . 55.00(15) y
F24 C6 F25 . . . 125.10(11) y
F22 C6 F25 . . . 128.80(19) y
F26 C6 F25 . . . 107.50(11) y
F21 C6 F25 . . . 54.70(15) y
F28 C6 F25 . . . 106.9(1) y
F23 C6 F27 . . . 107.4(7) y
F24 C6 F27 . . . 104.9(6) y
F22 C6 F27 . . . 84.60(12) y
F21 C6 F27 . . . 132.70(13) y
F28 C6 F27 . . . 130.10(11) y
F25 C6 F27 . . . 87.40(11) y
F23 C6 F20 . . . 80.40(12) y
F24 C6 F20 . . . 127.70(12) y
F22 C6 F20 . . . 109.90(13) y
F26 C6 F20 . . . 55.40(15) y
F21 C6 F20 . . . 110.40(13) y
F28 C6 F20 . . . 142.00(15) y
F25 C6 F20 . . . 58.40(15) y
F23 C6 C5 . . . 115.1(6) y
F24 C6 C5 . . . 112.7(7) y
F22 C6 C5 . . . 117.60(15) y
F26 C6 C5 . . . 114.0(1) y
F21 C6 C5 . . . 111.10(11) y
F28 C6 C5 . . . 108.30(11) y
F25 C6 C5 . . . 112.70(11) y
F27 C6 C5 . . . 109.2(6) y
F20 C6 C5 . . . 109.60(11) y
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Ag1 S7 . . 2.4666(11) y
Ag1 S5 . . 2.5043(11) y
Ag1 S8 . . 2.5511(13) y
Ag1 Ag5 . . 2.9642(6) y
Ag1 Ag2 . . 3.1073(5) y
Ag1 Ag3 . . 3.1082(5) y
Ag2 S5 . . 2.4937(12) y
Ag2 O3 . . 2.542(5) y
Ag2 S9 . . 2.5664(11) y
Ag2 S1 . . 2.6124(13) y
Ag2 Ag4 . . 2.9394(6) y
Ag2 Ag3 . . 3.0725(5) y
Ag3 O4 . . 2.465(5) y
Ag3 S9 . . 2.4969(12) y
Ag3 S7 . . 2.5617(12) y
Ag3 S3 . . 2.6559(15) y
Ag3 Ag6 . . 2.9250(5) y
Ag4 O11 . 3_755 2.423(5) y
Ag4 S7 . 3_755 2.5091(13) y
Ag4 S9 . . 2.5528(13) y
Ag4 S2 . . 2.6215(15) y
Ag4 Ag5 . 3_755 3.3616(6) y
Ag5 O5 . . 2.438(4) y
Ag5 S9 . 3_755 2.5513(12) y
Ag5 S5 . . 2.5781(12) y
Ag5 S6 . . 2.6145(13) y
Ag5 Ag4 . 3_755 3.3616(6) y
Ag6 O7 . . 2.346(4) y
Ag6 S7 . . 2.5723(12) y
Ag6 S5 . 3_755 2.5802(11) y
Ag6 S4 . . 2.6062(15) y
S1 C12 . . 1.809(7) y
S1 C11 . . 1.814(6) y
S2 C11 . . 1.797(7) y
S2 C22 . . 1.810(7) y
S3 C32 . . 1.798(6) y
S3 C31 . . 1.814(7) y
S4 C32 . . 1.799(6) y
S4 C41 . . 1.811(6) y
S5 C51 . . 1.828(5) y
S5 Ag6 . 3_755 2.5802(11) y
S6 C62 . . 1.793(7) y
S6 C61 . . 1.805(5) y
S7 C71 . . 1.819(5) y
S7 Ag4 . 3_755 2.5091(13) y
S8 C81 . . 1.790(7) y
S8 C61 . 3_655 1.805(5) y
S9 C91 . . 1.833(5) y
S9 Ag5 . 3_755 2.5513(12) y
O3 C5 . . 1.197(8) y
O4 C5 . . 1.223(7) y
O5 C3 . . 1.228(8) y
O7 C1 . . 1.238(7) y
O10 C1 . . 1.221(7) y
O11 C3 . . 1.230(8) y
O11 Ag4 . 3_755 2.423(5) y
C1 C2 . . 1.541(7) y
C3 C4 . . 1.517(9) y
C5 C6 . . 1.526(8) y
C11 H11a . . 0.99 ?
C11 H11b . . 0.99 ?
C12 H12a . . 0.98 ?
C12 H12b . . 0.98 ?
C12 H12c . . 0.98 ?
C22 H22a . . 0.98 ?
C22 H22b . . 0.98 ?
C22 H22c . . 0.98 ?
C31 H31a . . 0.98 ?
C31 H31b . . 0.98 ?
C31 H31c . . 0.98 ?
C32 H32a . . 0.99 ?
C32 H32b . . 0.99 ?
C41 H41a . . 0.98 ?
C41 H41b . . 0.98 ?
C41 H41c . . 0.98 ?
C51 H51a . . 0.98 ?
C51 H51b . . 0.98 ?
C51 H51c . . 0.98 ?
C61 S8 . 3_655 1.805(5) y
C61 H61a . . 0.99 ?
C61 H61b . . 0.99 ?
C62 H62a . . 0.98 ?
C62 H62b . . 0.98 ?
C62 H62c . . 0.98 ?
C71 H71a . . 0.98 ?
C71 H71b . . 0.98 ?
C71 H71c . . 0.98 ?
C81 H81a . . 0.98 ?
C81 H81b . . 0.98 ?
C81 H81c . . 0.98 ?
C91 H91a . . 0.98 ?
C91 H91b . . 0.98 ?
C91 H91c . . 0.98 ?
C4 F13 . . 1.306(8) y
C4 F15 . . 1.346(8) y
C4 F14 . . 1.357(8) y
C2 F1 . . 1.300(12) y
C2 F2 . . 1.314(10) y
C2 F7 . . 1.317(16) y
C2 F9 . . 1.336(16) y
C2 F4 . . 1.353(13) y
C2 F5 . . 1.353(12) y
C2 F8 . . 1.348(16) y
C2 F3 . . 1.381(11) y
C2 F6 . . 1.383(12) y
C6 F23 . . 1.317(9) y
C6 F24 . . 1.334(9) y
C6 F22 . . 1.334(14) y
C6 F26 . . 1.354(17) y
C6 F21 . . 1.359(14) y
C6 F28 . . 1.363(17) y
C6 F25 . . 1.363(18) y
C6 F27 . . 1.365(9) y
C6 F20 . . 1.364(14) y
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_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
S7 AG1 AG2 S5 . . . . 126.40(5) ?
S8 AG1 AG2 S5 . . . . -96.80(5) ?
AG5 AG1 AG2 S5 . . . . 19.16(3) ?
AG3 AG1 AG2 S5 . . . . 153.48(3) ?
S7 AG1 AG2 O3 . . . . -100.07(14) ?
S5 AG1 AG2 O3 . . . . 133.54(14) ?
S8 AG1 AG2 O3 . . . . 36.74(14) ?
AG5 AG1 AG2 O3 . . . . 152.70(14) ?
AG3 AG1 AG2 O3 . . . . -72.98(14) ?
S7 AG1 AG2 S9 . . . . -2.90(5) ?
S5 AG1 AG2 S9 . . . . -129.30(4) ?
S8 AG1 AG2 S9 . . . . 133.90(5) ?
AG5 AG1 AG2 S9 . . . . -110.14(3) ?
AG3 AG1 AG2 S9 . . . . 24.18(3) ?
S7 AG1 AG2 S1 . . . . -151.13(7) ?
S5 AG1 AG2 S1 . . . . 82.47(7) ?
S8 AG1 AG2 S1 . . . . -14.33(7) ?
AG5 AG1 AG2 S1 . . . . 101.63(6) ?
AG3 AG1 AG2 S1 . . . . -124.05(6) ?
S7 AG1 AG2 AG4 . . . . 54.60(4) ?
S5 AG1 AG2 AG4 . . . . -71.80(4) ?
S8 AG1 AG2 AG4 . . . . -168.60(4) ?
AG5 AG1 AG2 AG4 . . . . -52.63(2) ?
AG3 AG1 AG2 AG4 . . . . 81.68(2) ?
S7 AG1 AG2 AG3 . . . . -27.08(3) ?
S5 AG1 AG2 AG3 . . . . -153.48(3) ?
S8 AG1 AG2 AG3 . . . . 109.72(4) ?
AG5 AG1 AG2 AG3 . . . . -134.319(17) ?
S5 AG2 AG3 O4 . . . . -88.34(15) ?
O3 AG2 AG3 O4 . . . . 25.5(2) ?
S9 AG2 AG3 O4 . . . . 143.33(15) ?
S1 AG2 AG3 O4 . . . . 71.42(16) ?
AG4 AG2 AG3 O4 . . . . 164.57(15) ?
AG1 AG2 AG3 O4 . . . . -66.75(15) ?
S5 AG2 AG3 S9 . . . . 128.33(5) ?
O3 AG2 AG3 S9 . . . . -117.81(15) ?
S1 AG2 AG3 S9 . . . . -71.91(6) ?
AG4 AG2 AG3 S9 . . . . 21.24(3) ?
AG1 AG2 AG3 S9 . . . . 149.92(4) ?
S5 AG2 AG3 S7 . . . . 4.23(4) ?
O3 AG2 AG3 S7 . . . . 118.09(15) ?
S9 AG2 AG3 S7 . . . . -124.10(5) ?
S1 AG2 AG3 S7 . . . . 163.99(6) ?
AG4 AG2 AG3 S7 . . . . -102.86(3) ?
AG1 AG2 AG3 S7 . . . . 25.82(3) ?
S5 AG2 AG3 S3 . . . . -138.21(6) ?
O3 AG2 AG3 S3 . . . . -24.35(16) ?
S9 AG2 AG3 S3 . . . . 93.46(7) ?
S1 AG2 AG3 S3 . . . . 21.55(8) ?
AG4 AG2 AG3 S3 . . . . 114.70(6) ?
AG1 AG2 AG3 S3 . . . . -116.62(6) ?
S5 AG2 AG3 AG6 . . . . 61.77(4) ?
O3 AG2 AG3 AG6 . . . . 175.63(15) ?
S9 AG2 AG3 AG6 . . . . -66.56(4) ?
S1 AG2 AG3 AG6 . . . . -138.47(5) ?
AG4 AG2 AG3 AG6 . . . . -45.32(2) ?
AG1 AG2 AG3 AG6 . . . . 83.36(2) ?
S5 AG2 AG3 AG1 . . . . -21.59(3) ?
O3 AG2 AG3 AG1 . . . . 92.27(15) ?
S9 AG2 AG3 AG1 . . . . -149.92(4) ?
S1 AG2 AG3 AG1 . . . . 138.17(5) ?
AG4 AG2 AG3 AG1 . . . . -128.678(18) ?
S7 AG1 AG3 O4 . . . . -119.33(14) ?
S5 AG1 AG3 O4 . . . . 115.19(14) ?
S8 AG1 AG3 O4 . . . . -2.57(14) ?
AG5 AG1 AG3 O4 . . . . 172.46(13) ?
AG2 AG1 AG3 O4 . . . . 93.86(13) ?
S7 AG1 AG3 S9 . . . . 121.65(5) ?
S5 AG1 AG3 S9 . . . . -3.83(4) ?
S8 AG1 AG3 S9 . . . . -121.59(5) ?
AG5 AG1 AG3 S9 . . . . 53.44(4) ?
AG2 AG1 AG3 S9 . . . . -25.16(3) ?
S5 AG1 AG3 S7 . . . . -125.48(5) ?
S8 AG1 AG3 S7 . . . . 116.76(5) ?
AG5 AG1 AG3 S7 . . . . -68.21(4) ?
AG2 AG1 AG3 S7 . . . . -146.81(4) ?
S7 AG1 AG3 S3 . . . . -75.75(5) ?
S5 AG1 AG3 S3 . . . . 158.77(5) ?
S8 AG1 AG3 S3 . . . . 41.01(6) ?
AG5 AG1 AG3 S3 . . . . -143.96(4) ?
AG2 AG1 AG3 S3 . . . . 137.44(4) ?
S7 AG1 AG3 AG6 . . . . 23.00(4) ?
S5 AG1 AG3 AG6 . . . . -102.48(3) ?
S8 AG1 AG3 AG6 . . . . 139.76(4) ?
AG5 AG1 AG3 AG6 . . . . -45.21(3) ?
AG2 AG1 AG3 AG6 . . . . -123.808(18) ?
S7 AG1 AG3 AG2 . . . . 146.81(4) ?
S5 AG1 AG3 AG2 . . . . 21.33(3) ?
S8 AG1 AG3 AG2 . . . . -96.43(4) ?
AG5 AG1 AG3 AG2 . . . . 78.60(2) ?
S5 AG2 AG4 O11 . . . 3_755 -180.0(2) ?
O3 AG2 AG4 O11 . . . 3_755 8.1(3) ?
S9 AG2 AG4 O11 . . . 3_755 -48.1(2) ?
S1 AG2 AG4 O11 . . . 3_755 64.5(2) ?
AG3 AG2 AG4 O11 . . . 3_755 -68.5(2) ?
AG1 AG2 AG4 O11 . . . 3_755 -130.3(2) ?
S5 AG2 AG4 S7 . . . 3_755 -14.83(4) ?
O3 AG2 AG4 S7 . . . 3_755 173.24(19) ?
S9 AG2 AG4 S7 . . . 3_755 117.01(4) ?
S1 AG2 AG4 S7 . . . 3_755 -130.35(4) ?
AG3 AG2 AG4 S7 . . . 3_755 96.65(3) ?
AG1 AG2 AG4 S7 . . . 3_755 34.82(4) ?
S5 AG2 AG4 S9 . . . . -131.83(4) ?
O3 AG2 AG4 S9 . . . . 56.23(19) ?
S1 AG2 AG4 S9 . . . . 112.65(5) ?
AG3 AG2 AG4 S9 . . . . -20.35(3) ?
AG1 AG2 AG4 S9 . . . . -82.19(4) ?
S5 AG2 AG4 S2 . . . . 93.61(4) ?
O3 AG2 AG4 S2 . . . . -78.33(19) ?
S9 AG2 AG4 S2 . . . . -134.56(5) ?
S1 AG2 AG4 S2 . . . . -21.91(5) ?
AG3 AG2 AG4 S2 . . . . -154.91(3) ?
AG1 AG2 AG4 S2 . . . . 143.26(4) ?
S5 AG2 AG4 AG5 . . . 3_755 -109.15(3) ?
O3 AG2 AG4 AG5 . . . 3_755 78.91(19) ?
S9 AG2 AG4 AG5 . . . 3_755 22.68(3) ?
S1 AG2 AG4 AG5 . . . 3_755 135.32(3) ?
AG3 AG2 AG4 AG5 . . . 3_755 2.325(18) ?
AG1 AG2 AG4 AG5 . . . 3_755 -59.51(2) ?
S7 AG1 AG5 O5 . . . . 83.54(11) ?
S5 AG1 AG5 O5 . . . . -148.55(11) ?
S8 AG1 AG5 O5 . . . . -51.66(12) ?
AG2 AG1 AG5 O5 . . . . -166.69(11) ?
AG3 AG1 AG5 O5 . . . . 133.09(11) ?
S7 AG1 AG5 S9 . . . 3_755 -28.89(4) ?
S5 AG1 AG5 S9 . . . 3_755 99.01(4) ?
S8 AG1 AG5 S9 . . . 3_755 -164.09(5) ?
AG2 AG1 AG5 S9 . . . 3_755 80.87(3) ?
AG3 AG1 AG5 S9 . . . 3_755 20.65(4) ?
S7 AG1 AG5 S5 . . . . -127.91(4) ?
S8 AG1 AG5 S5 . . . . 96.90(5) ?
AG2 AG1 AG5 S5 . . . . -18.14(3) ?
AG3 AG1 AG5 S5 . . . . -78.36(4) ?
S7 AG1 AG5 S6 . . . . 154.13(5) ?
S5 AG1 AG5 S6 . . . . -77.96(6) ?
S8 AG1 AG5 S6 . . . . 18.94(6) ?
AG2 AG1 AG5 S6 . . . . -96.10(5) ?
AG3 AG1 AG5 S6 . . . . -156.32(5) ?
S7 AG1 AG5 AG4 . . . 3_755 3.70(3) ?
S5 AG1 AG5 AG4 . . . 3_755 131.61(3) ?
S8 AG1 AG5 AG4 . . . 3_755 -131.49(4) ?
AG2 AG1 AG5 AG4 . . . 3_755 113.470(15) ?
AG3 AG1 AG5 AG4 . . . 3_755 53.25(2) ?
O4 AG3 AG6 O7 . . . . -17.3(4) ?
S9 AG3 AG6 O7 . . . . 168.2(3) ?
S7 AG3 AG6 O7 . . . . -60.7(3) ?
S3 AG3 AG6 O7 . . . . 47.6(3) ?
AG2 AG3 AG6 O7 . . . . -144.0(3) ?
AG1 AG3 AG6 O7 . . . . -82.2(3) ?
O4 AG3 AG6 S7 . . . . 43.4(3) ?
S9 AG3 AG6 S7 . . . . -131.12(4) ?
S3 AG3 AG6 S7 . . . . 108.33(4) ?
AG2 AG3 AG6 S7 . . . . -83.26(4) ?
AG1 AG3 AG6 S7 . . . . -21.46(3) ?
O4 AG3 AG6 S5 . . . 3_755 147.6(3) ?
S9 AG3 AG6 S5 . . . 3_755 -26.90(4) ?
S7 AG3 AG6 S5 . . . 3_755 104.21(4) ?
S3 AG3 AG6 S5 . . . 3_755 -147.45(4) ?
AG2 AG3 AG6 S5 . . . 3_755 20.95(4) ?
AG1 AG3 AG6 S5 . . . 3_755 82.75(3) ?
O4 AG3 AG6 S4 . . . . -105.5(3) ?
S9 AG3 AG6 S4 . . . . 79.91(4) ?
S7 AG3 AG6 S4 . . . . -148.98(4) ?
S3 AG3 AG6 S4 . . . . -40.65(4) ?
AG2 AG3 AG6 S4 . . . . 127.76(3) ?
AG1 AG3 AG6 S4 . . . . -170.44(3) ?
S5 AG2 S1 C12 . . . . 56.8(3) ?
O3 AG2 S1 C12 . . . . -56.6(3) ?
S9 AG2 S1 C12 . . . . -151.9(3) ?
AG4 AG2 S1 C12 . . . . 157.0(3) ?
AG3 AG2 S1 C12 . . . . -101.6(3) ?
AG1 AG2 S1 C12 . . . . -3.3(3) ?
S5 AG2 S1 C11 . . . . -50.7(2) ?
O3 AG2 S1 C11 . . . . -164.1(3) ?
S9 AG2 S1 C11 . . . . 100.6(2) ?
AG4 AG2 S1 C11 . . . . 49.5(2) ?
AG3 AG2 S1 C11 . . . . 150.9(2) ?
AG1 AG2 S1 C11 . . . . -110.9(2) ?
O11 AG4 S2 C11 3_755 . . . -145.4(3) ?
S7 AG4 S2 C11 3_755 . . . 108.1(2) ?
S9 AG4 S2 C11 . . . . -49.5(2) ?
AG2 AG4 S2 C11 . . . . -1.9(2) ?
AG5 AG4 S2 C11 3_755 . . . -121.1(2) ?
O11 AG4 S2 C22 3_755 . . . -37.6(3) ?
S7 AG4 S2 C22 3_755 . . . -144.1(3) ?
S9 AG4 S2 C22 . . . . 58.3(3) ?
AG2 AG4 S2 C22 . . . . 105.9(3) ?
AG5 AG4 S2 C22 3_755 . . . -13.3(3) ?
O4 AG3 S3 C32 . . . . 164.0(3) ?
S9 AG3 S3 C32 . . . . -75.7(2) ?
S7 AG3 S3 C32 . . . . 73.0(2) ?
AG6 AG3 S3 C32 . . . . 19.1(2) ?
AG2 AG3 S3 C32 . . . . -144.6(2) ?
AG1 AG3 S3 C32 . . . . 123.6(2) ?
O4 AG3 S3 C31 . . . . -89.9(3) ?
S9 AG3 S3 C31 . . . . 30.4(3) ?
S7 AG3 S3 C31 . . . . 179.1(3) ?
AG6 AG3 S3 C31 . . . . 125.2(3) ?
AG2 AG3 S3 C31 . . . . -38.6(3) ?
AG1 AG3 S3 C31 . . . . -130.4(2) ?
O7 AG6 S4 C32 . . . . -86.5(2) ?
S7 AG6 S4 C32 . . . . 37.67(19) ?
S5 AG6 S4 C32 3_755 . . . 174.93(19) ?
AG3 AG6 S4 C32 . . . . 68.46(19) ?
O7 AG6 S4 C41 . . . . 16.6(3) ?
S7 AG6 S4 C41 . . . . 140.8(2) ?
S5 AG6 S4 C41 3_755 . . . -81.9(2) ?
AG3 AG6 S4 C41 . . . . 171.6(2) ?
O3 AG2 S5 C51 . . . . 53.5(2) ?
S9 AG2 S5 C51 . . . . -174.09(19) ?
S1 AG2 S5 C51 . . . . -32.0(2) ?
AG4 AG2 S5 C51 . . . . -120.72(19) ?
AG3 AG2 S5 C51 . . . . 131.70(19) ?
AG1 AG2 S5 C51 . . . . 107.65(19) ?
O3 AG2 S5 AG1 . . . . -54.18(14) ?
S9 AG2 S5 AG1 . . . . 78.25(5) ?
S1 AG2 S5 AG1 . . . . -139.64(4) ?
AG4 AG2 S5 AG1 . . . . 131.63(2) ?
AG3 AG2 S5 AG1 . . . . 24.05(3) ?
O3 AG2 S5 AG5 . . . . -89.87(15) ?
S9 AG2 S5 AG5 . . . . 42.56(10) ?
S1 AG2 S5 AG5 . . . . -175.33(7) ?
AG4 AG2 S5 AG5 . . . . 95.94(7) ?
AG3 AG2 S5 AG5 . . . . -11.64(8) ?
AG1 AG2 S5 AG5 . . . . -35.69(6) ?
O3 AG2 S5 AG6 . . . 3_755 161.95(13) ?
S9 AG2 S5 AG6 . . . 3_755 -65.62(6) ?
S1 AG2 S5 AG6 . . . 3_755 76.48(5) ?
AG4 AG2 S5 AG6 . . . 3_755 -12.25(4) ?
AG3 AG2 S5 AG6 . . . 3_755 -119.82(3) ?
AG1 AG2 S5 AG6 . . . 3_755 -143.87(5) ?
S7 AG1 S5 C51 . . . . -179.8(2) ?
S8 AG1 S5 C51 . . . . -0.2(2) ?
AG5 AG1 S5 C51 . . . . 102.3(2) ?
AG2 AG1 S5 C51 . . . . -100.4(2) ?
AG3 AG1 S5 C51 . . . . -124.0(2) ?
S7 AG1 S5 AG2 . . . . -79.37(5) ?
S8 AG1 S5 AG2 . . . . 100.25(4) ?
AG5 AG1 S5 AG2 . . . . -157.26(4) ?
AG3 AG1 S5 AG2 . . . . -23.58(3) ?
S7 AG1 S5 AG5 . . . . 77.89(5) ?
S8 AG1 S5 AG5 . . . . -102.50(4) ?
AG2 AG1 S5 AG5 . . . . 157.26(4) ?
AG3 AG1 S5 AG5 . . . . 133.68(2) ?
S7 AG1 S5 AG6 . . . 3_755 15.07(11) ?
S8 AG1 S5 AG6 . . . 3_755 -165.32(8) ?
AG5 AG1 S5 AG6 . . . 3_755 -62.82(8) ?
AG2 AG1 S5 AG6 . . . 3_755 94.44(9) ?
AG3 AG1 S5 AG6 . . . 3_755 70.86(9) ?
O5 AG5 S5 C51 . . . . -69.5(2) ?
S9 AG5 S5 C51 3_755 . . . 154.9(2) ?
S6 AG5 S5 C51 . . . . 28.8(2) ?
AG1 AG5 S5 C51 . . . . -105.8(2) ?
AG4 AG5 S5 C51 3_755 . . . -153.7(2) ?
O5 AG5 S5 AG2 . . . . 73.17(16) ?
S9 AG5 S5 AG2 3_755 . . . -62.43(8) ?
S6 AG5 S5 AG2 . . . . 171.42(7) ?
AG1 AG5 S5 AG2 . . . . 36.85(6) ?
AG4 AG5 S5 AG2 3_755 . . . -11.02(8) ?
O5 AG5 S5 AG1 . . . . 36.32(14) ?
S9 AG5 S5 AG1 3_755 . . . -99.28(4) ?
S6 AG5 S5 AG1 . . . . 134.57(4) ?
AG4 AG5 S5 AG1 3_755 . . . -47.87(3) ?
O5 AG5 S5 AG6 . . . 3_755 -174.49(14) ?
S9 AG5 S5 AG6 3_755 . . 3_755 49.92(4) ?
S6 AG5 S5 AG6 . . . 3_755 -76.23(4) ?
AG1 AG5 S5 AG6 . . . 3_755 149.19(4) ?
AG4 AG5 S5 AG6 3_755 . . 3_755 101.33(3) ?
O5 AG5 S6 C62 . . . . -66.2(3) ?
S9 AG5 S6 C62 3_755 . . . 50.6(3) ?
S5 AG5 S6 C62 . . . . 171.7(3) ?
AG1 AG5 S6 C62 . . . . -132.6(3) ?
AG4 AG5 S6 C62 3_755 . . . -4.4(3) ?
O5 AG5 S6 C61 . . . . 39.6(2) ?
S9 AG5 S6 C61 3_755 . . . 156.42(19) ?
S5 AG5 S6 C61 . . . . -82.5(2) ?
AG1 AG5 S6 C61 . . . . -26.8(2) ?
AG4 AG5 S6 C61 3_755 . . . 101.5(2) ?
S5 AG1 S7 C71 . . . . -174.0(2) ?
S8 AG1 S7 C71 . . . . 6.4(2) ?
AG5 AG1 S7 C71 . . . . -118.5(2) ?
AG2 AG1 S7 C71 . . . . 133.1(2) ?
AG3 AG1 S7 C71 . . . . 103.8(2) ?
S5 AG1 S7 AG4 . . . 3_755 -60.24(6) ?
S8 AG1 S7 AG4 . . . 3_755 120.22(5) ?
AG5 AG1 S7 AG4 . . . 3_755 -4.71(4) ?
AG2 AG1 S7 AG4 . . . 3_755 -113.15(3) ?
AG3 AG1 S7 AG4 . . . 3_755 -142.40(5) ?
S5 AG1 S7 AG3 . . . . 82.16(5) ?
S8 AG1 S7 AG3 . . . . -97.38(5) ?
AG5 AG1 S7 AG3 . . . . 137.69(2) ?
AG2 AG1 S7 AG3 . . . . 29.25(3) ?
S5 AG1 S7 AG6 . . . . 43.13(10) ?
S8 AG1 S7 AG6 . . . . -136.41(7) ?
AG5 AG1 S7 AG6 . . . . 98.66(7) ?
AG2 AG1 S7 AG6 . . . . -9.79(8) ?
AG3 AG1 S7 AG6 . . . . -39.04(6) ?
O4 AG3 S7 C71 . . . . -53.5(2) ?
S9 AG3 S7 C71 . . . . 169.1(2) ?
S3 AG3 S7 C71 . . . . 22.6(2) ?
AG6 AG3 S7 C71 . . . . 101.4(2) ?
AG2 AG3 S7 C71 . . . . -135.7(2) ?
AG1 AG3 S7 C71 . . . . -106.3(2) ?
O4 AG3 S7 AG1 . . . . 52.76(14) ?
S9 AG3 S7 AG1 . . . . -84.64(5) ?
S3 AG3 S7 AG1 . . . . 128.85(4) ?
AG6 AG3 S7 AG1 . . . . -152.30(4) ?
AG2 AG3 S7 AG1 . . . . -29.40(3) ?
O4 AG3 S7 AG4 . . . 3_755 133.85(16) ?
S9 AG3 S7 AG4 . . . 3_755 -3.55(10) ?
S3 AG3 S7 AG4 . . . 3_755 -150.06(8) ?
AG6 AG3 S7 AG4 . . . 3_755 -71.21(7) ?
AG2 AG3 S7 AG4 . . . 3_755 51.69(8) ?
AG1 AG3 S7 AG4 . . . 3_755 81.09(8) ?
O4 AG3 S7 AG6 . . . . -154.93(14) ?
S9 AG3 S7 AG6 . . . . 67.67(5) ?
S3 AG3 S7 AG6 . . . . -78.84(4) ?
AG2 AG3 S7 AG6 . . . . 122.91(2) ?
AG1 AG3 S7 AG6 . . . . 152.30(4) ?
O7 AG6 S7 C71 . . . . 54.4(3) ?
S5 AG6 S7 C71 3_755 . . . 158.5(2) ?
S4 AG6 S7 C71 . . . . -65.2(2) ?
AG3 AG6 S7 C71 . . . . -102.7(2) ?
O7 AG6 S7 AG1 . . . . -162.02(12) ?
S5 AG6 S7 AG1 3_755 . . . -57.93(8) ?
S4 AG6 S7 AG1 . . . . 78.38(8) ?
AG3 AG6 S7 AG1 . . . . 40.81(6) ?
O7 AG6 S7 AG4 . . . 3_755 -58.60(11) ?
S5 AG6 S7 AG4 3_755 . . 3_755 45.49(5) ?
S4 AG6 S7 AG4 . . . 3_755 -178.19(4) ?
AG3 AG6 S7 AG4 . . . 3_755 144.23(5) ?
O7 AG6 S7 AG3 . . . . 157.17(11) ?
S5 AG6 S7 AG3 3_755 . . . -98.74(4) ?
S4 AG6 S7 AG3 . . . . 37.58(5) ?
S7 AG1 S8 C81 . . . . -14.2(3) ?
S5 AG1 S8 C81 . . . . 166.2(3) ?
AG5 AG1 S8 C81 . . . . 107.8(3) ?
AG2 AG1 S8 C81 . . . . -139.8(3) ?
AG3 AG1 S8 C81 . . . . -76.0(3) ?
S7 AG1 S8 C61 . . . 3_655 -122.0(2) ?
S5 AG1 S8 C61 . . . 3_655 58.4(2) ?
AG5 AG1 S8 C61 . . . 3_655 -0.1(2) ?
AG2 AG1 S8 C61 . . . 3_655 112.35(19) ?
AG3 AG1 S8 C61 . . . 3_655 176.22(19) ?
O4 AG3 S9 C91 . . . . 54.0(3) ?
S7 AG3 S9 C91 . . . . -179.8(2) ?
S3 AG3 S9 C91 . . . . -38.1(2) ?
AG6 AG3 S9 C91 . . . . -130.0(2) ?
AG2 AG3 S9 C91 . . . . 98.9(2) ?
AG1 AG3 S9 C91 . . . . 126.2(2) ?
O4 AG3 S9 AG5 . . . 3_755 177.56(19) ?
S7 AG3 S9 AG5 . . . 3_755 -56.27(6) ?
S3 AG3 S9 AG5 . . . 3_755 85.45(6) ?
AG6 AG3 S9 AG5 . . . 3_755 -6.45(4) ?
AG2 AG3 S9 AG5 . . . 3_755 -137.50(6) ?
AG1 AG3 S9 AG5 . . . 3_755 -110.20(4) ?
O4 AG3 S9 AG4 . . . . -81.3(2) ?
S7 AG3 S9 AG4 . . . . 44.84(9) ?
S3 AG3 S9 AG4 . . . . -173.45(6) ?
AG6 AG3 S9 AG4 . . . . 94.65(7) ?
AG2 AG3 S9 AG4 . . . . -36.40(5) ?
AG1 AG3 S9 AG4 . . . . -9.10(7) ?
O4 AG3 S9 AG2 . . . . -44.94(19) ?
S7 AG3 S9 AG2 . . . . 81.24(5) ?
S3 AG3 S9 AG2 . . . . -137.05(4) ?
AG6 AG3 S9 AG2 . . . . 131.06(3) ?
AG1 AG3 S9 AG2 . . . . 27.30(3) ?
O11 AG4 S9 C91 3_755 . . . 53.8(2) ?
S7 AG4 S9 C91 3_755 . . . 169.7(2) ?
S2 AG4 S9 C91 . . . . -35.8(2) ?
AG2 AG4 S9 C91 . . . . -99.7(2) ?
AG5 AG4 S9 C91 3_755 . . . 110.7(2) ?
O11 AG4 S9 AG3 3_755 . . . -168.99(15) ?
S7 AG4 S9 AG3 3_755 . . . -53.09(8) ?
S2 AG4 S9 AG3 . . . . 101.40(8) ?
AG2 AG4 S9 AG3 . . . . 37.51(5) ?
AG5 AG4 S9 AG3 3_755 . . . -112.08(8) ?
O11 AG4 S9 AG5 3_755 . . 3_755 -56.91(14) ?
S7 AG4 S9 AG5 3_755 . . 3_755 58.99(5) ?
S2 AG4 S9 AG5 . . . 3_755 -146.52(5) ?
AG2 AG4 S9 AG5 . . . 3_755 149.59(4) ?
O11 AG4 S9 AG2 3_755 . . . 153.51(14) ?
S7 AG4 S9 AG2 3_755 . . . -90.59(4) ?
S2 AG4 S9 AG2 . . . . 63.90(6) ?
AG5 AG4 S9 AG2 3_755 . . . -149.59(4) ?
S5 AG2 S9 C91 . . . . 172.9(2) ?
O3 AG2 S9 C91 . . . . -48.6(3) ?
S1 AG2 S9 C91 . . . . 27.6(2) ?
AG4 AG2 S9 C91 . . . . 98.8(2) ?
AG3 AG2 S9 C91 . . . . -106.8(2) ?
AG1 AG2 S9 C91 . . . . -133.8(2) ?
S5 AG2 S9 AG3 . . . . -80.27(5) ?
O3 AG2 S9 AG3 . . . . 58.23(12) ?
S1 AG2 S9 AG3 . . . . 134.41(4) ?
AG4 AG2 S9 AG3 . . . . -154.34(4) ?
AG1 AG2 S9 AG3 . . . . -27.02(3) ?
S5 AG2 S9 AG5 . . . 3_755 23.72(10) ?
O3 AG2 S9 AG5 . . . 3_755 162.21(14) ?
S1 AG2 S9 AG5 . . . 3_755 -121.61(8) ?
AG4 AG2 S9 AG5 . . . 3_755 -50.36(7) ?
AG3 AG2 S9 AG5 . . . 3_755 103.99(8) ?
AG1 AG2 S9 AG5 . . . 3_755 76.96(8) ?
S5 AG2 S9 AG4 . . . . 74.08(5) ?
O3 AG2 S9 AG4 . . . . -147.43(12) ?
S1 AG2 S9 AG4 . . . . -71.25(4) ?
AG3 AG2 S9 AG4 . . . . 154.34(4) ?
AG1 AG2 S9 AG4 . . . . 127.32(2) ?
S5 AG2 O3 C5 . . . . 66.4(6) ?
S9 AG2 O3 C5 . . . . -79.1(6) ?
S1 AG2 O3 C5 . . . . 178.3(6) ?
AG4 AG2 O3 C5 . . . . -122.5(5) ?
AG3 AG2 O3 C5 . . . . -34.6(6) ?
AG1 AG2 O3 C5 . . . . 26.5(6) ?
S9 AG3 O4 C5 . . . . -4.7(6) ?
S7 AG3 O4 C5 . . . . -143.6(5) ?
S3 AG3 O4 C5 . . . . 112.4(5) ?
AG6 AG3 O4 C5 . . . . -178.2(4) ?
AG2 AG3 O4 C5 . . . . -39.9(5) ?
AG1 AG3 O4 C5 . . . . -101.2(5) ?
S9 AG5 O5 C3 3_755 . . . -5.5(5) ?
S5 AG5 O5 C3 . . . . -138.0(5) ?
S6 AG5 O5 C3 . . . . 111.9(5) ?
AG1 AG5 O5 C3 . . . . -108.8(5) ?
AG4 AG5 O5 C3 3_755 . . . -35.5(5) ?
S7 AG6 O7 C1 . . . . -73.0(4) ?
S5 AG6 O7 C1 3_755 . . . 171.1(4) ?
S4 AG6 O7 C1 . . . . 60.1(4) ?
AG3 AG6 O7 C1 . . . . -23.1(6) ?
AG6 O7 C1 O10 . . . . 7.0(8) ?
AG6 O7 C1 C2 . . . . -169.8(4) ?
AG4 O11 C3 O5 3_755 . . . 17.3(12) ?
AG4 O11 C3 C4 3_755 . . . -163.6(5) ?
AG5 O5 C3 O11 . . . . 25.0(10) ?
AG5 O5 C3 C4 . . . . -154.1(5) ?
AG2 O3 C5 O4 . . . . 12.2(12) ?
AG2 O3 C5 C6 . . . . -169.2(4) ?
AG3 O4 C5 O3 . . . . 27.8(10) ?
AG3 O4 C5 C6 . . . . -150.8(4) ?
C22 S2 C11 S1 . . . . -71.1(4) ?
AG4 S2 C11 S1 . . . . 39.0(4) ?
C12 S1 C11 S2 . . . . -177.3(4) ?
AG2 S1 C11 S2 . . . . -64.3(4) ?
C41 S4 C32 S3 . . . . 178.6(4) ?
AG6 S4 C32 S3 . . . . -71.6(3) ?
C31 S3 C32 S4 . . . . -78.7(4) ?
AG3 S3 C32 S4 . . . . 28.3(4) ?
C62 S6 C61 S8 . . . 3_655 -61.0(4) ?
AG5 S6 C61 S8 . . . 3_655 -165.9(2) ?
O11 C3 C4 F13 . . . . 14.7(10) ?
O5 C3 C4 F13 . . . . -166.2(7) ?
O11 C3 C4 F15 . . . . -108.5(8) ?
O5 C3 C4 F15 . . . . 70.7(8) ?
O11 C3 C4 F14 . . . . 136.0(7) ?
O5 C3 C4 F14 . . . . -44.8(8) ?
O10 C1 C2 F1 . . . . 145.6(9) ?
O7 C1 C2 F1 . . . . -37.0(1) ?
O10 C1 C2 F2 . . . . 14.8(1) ?
O7 C1 C2 F2 . . . . -167.9(9) ?
O10 C1 C2 F7 . . . . -24.20(14) ?
O7 C1 C2 F7 . . . . 153.20(13) ?
O10 C1 C2 F9 . . . . -149.20(11) ?
O7 C1 C2 F9 . . . . 28.20(12) ?
O10 C1 C2 F4 . . . . 172.0(9) ?
O7 C1 C2 F4 . . . . -10.70(11) ?
O10 C1 C2 F5 . . . . -64.8(1) ?
O7 C1 C2 F5 . . . . 112.6(1) ?
O10 C1 C2 F8 . . . . 95.10(11) ?
O7 C1 C2 F8 . . . . -87.60(11) ?
O10 C1 C2 F3 . . . . -98.2(8) ?
O7 C1 C2 F3 . . . . 79.1(8) ?
O10 C1 C2 F6 . . . . 53.6(9) ?
O7 C1 C2 F6 . . . . -129.1(9) ?
O3 C5 C6 F23 . . . . 157.2(9) ?
O4 C5 C6 F23 . . . . -23.90(11) ?
O3 C5 C6 F24 . . . . 34.2(1) ?
O4 C5 C6 F24 . . . . -146.9(9) ?
O3 C5 C6 F22 . . . . 12.00(15) ?
O4 C5 C6 F22 . . . . -169.10(14) ?
O3 C5 C6 F26 . . . . -54.50(15) ?
O4 C5 C6 F26 . . . . 124.30(14) ?
O3 C5 C6 F21 . . . . 123.20(15) ?
O4 C5 C6 F21 . . . . -57.90(16) ?
O3 C5 C6 F28 . . . . 64.50(15) ?
O4 C5 C6 F28 . . . . -116.70(14) ?
O3 C5 C6 F25 . . . . -177.40(13) ?
O4 C5 C6 F25 . . . . 1.40(14) ?
O3 C5 C6 F27 . . . . -82.0(9) ?
O4 C5 C6 F27 . . . . 96.9(9) ?
O3 C5 C6 F20 . . . . -114.40(15) ?
O4 C5 C6 F20 . . . . 64.40(16) ?
