#------------------------------------------------------------------------------
#$Date: 2017-06-03 05:19:29 +0300 (Sat, 03 Jun 2017) $
#$Revision: 197192 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/04/32/7043210.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_7043210
loop_
_publ_author_name
'Mehring, Michael'
'Preda, Ana Maria'
'Schneider, Wolfgang B.'
'Rainer, Martin'
'Rueffer, Tobias'
'Schaarschmidt, Dieter'
'Lang, Heinrich'
_publ_section_title
;
 Heteroaryl Bismuthines: A Novel Synthetic Concept and
 Metal···π Heteroarene Interaction
;
_journal_name_full               'Dalton Trans.'
_journal_paper_doi               10.1039/C7DT01437F
_journal_year                    2017
_chemical_formula_moiety         'C56 H72 Bi4 O10 S8'
_chemical_formula_sum            'C56 H72 Bi4 O10 S8'
_chemical_formula_weight         1997.53
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/6
_audit_update_record
;
2017-03-31 deposited with the CCDC.
2017-06-02 downloaded from the CCDC.
;
_cell_angle_alpha                114.879(6)
_cell_angle_beta                 101.803(5)
_cell_angle_gamma                99.558(5)
_cell_formula_units_Z            1
_cell_length_a                   10.3241(5)
_cell_length_b                   12.9973(8)
_cell_length_c                   14.0496(8)
_cell_measurement_reflns_used    8092
_cell_measurement_temperature    100
_cell_measurement_theta_max      28.5194
_cell_measurement_theta_min      2.9608
_cell_volume                     1605.3(2)
_computing_cell_refinement
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.37 (release 24-10-2008 CrysAlis171 .NET)
(compiled Oct 24 2008,09:44:38)
;
_computing_data_collection
;
CrysAlis CCD, Oxford Diffraction Ltd.,
Version 1.171.32.37 (release 24-10-2008 CrysAlis171 .NET)
(compiled Oct 24 2008,09:44:38)
;
_computing_data_reduction
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.37 (release 24-10-2008 CrysAlis171 .NET)
(compiled Oct 24 2008,09:44:38)
;
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      100
_diffrn_measured_fraction_theta_full 0.989
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  'Oxford Gemini S'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0327
_diffrn_reflns_av_unetI/netI     0.0463
_diffrn_reflns_Laue_measured_fraction_full 0.989
_diffrn_reflns_Laue_measured_fraction_max 0.983
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            12911
_diffrn_reflns_point_group_measured_fraction_full 0.989
_diffrn_reflns_point_group_measured_fraction_max 0.983
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.997
_diffrn_reflns_theta_min         2.971
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 50
_diffrn_standards_interval_time  10
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    11.242
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.28394
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.37 (release 24-10-2008 CrysAlis171 .NET)
(compiled Oct 24 2008,09:44:38)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    2.066
_exptl_crystal_description       needle
_exptl_crystal_F_000             948
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.06
_refine_diff_density_max         2.278
_refine_diff_density_min         -1.531
_refine_diff_density_rms         0.207
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.982
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     352
_refine_ls_number_reflns         6199
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.982
_refine_ls_R_factor_all          0.0427
_refine_ls_R_factor_gt           0.0313
_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)+(0.0486P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0763
_refine_ls_wR_factor_ref         0.0779
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4863
_reflns_number_total             6199
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c7dt01437f2.cif
_cod_data_source_block           2
_cod_original_cell_volume        1605.25(17)
_cod_database_code               7043210
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelxl_version_number           2014/6
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
C1 C 0.2711(6) 0.1163(6) 0.4095(6) 0.0215(15) Uani 1 1 d . .
C2 C 0.2952(7) 0.0831(7) 0.2996(6) 0.0312(18) Uani 1 1 d . .
H2A H 0.3914 0.1138 0.3107 0.047 Uiso 1 1 calc R U
H2B H 0.2681 -0.0015 0.2566 0.047 Uiso 1 1 calc R U
H2C H 0.2416 0.1156 0.2613 0.047 Uiso 1 1 calc R U
C3 C 0.3517(7) 0.0612(7) 0.4694(7) 0.0352(19) Uani 1 1 d . .
H3A H 0.4488 0.0938 0.4855 0.053 Uiso 1 1 calc R U
H3B H 0.3305 0.0780 0.5369 0.053 Uiso 1 1 calc R U
H3C H 0.3264 -0.0229 0.4235 0.053 Uiso 1 1 calc R U
C4 C 0.3093(7) 0.2482(6) 0.4824(6) 0.0249(16) Uani 1 1 d . .
C5 C 0.3290(7) 0.3092(7) 0.5941(6) 0.0337(19) Uani 1 1 d . .
H5 H 0.3268 0.2746 0.6400 0.040 Uiso 1 1 calc R U
C6 C 0.3537(9) 0.4349(7) 0.6299(8) 0.047(3) Uani 1 1 d . .
H6 H 0.3674 0.4899 0.7025 0.057 Uiso 1 1 calc R U
C7 C 0.3552(10) 0.4650(7) 0.5515(9) 0.056(3) Uani 1 1 d . .
H7 H 0.3713 0.5422 0.5623 0.068 Uiso 1 1 calc R U
C8 C -0.1690(7) 0.2115(6) 0.3218(5) 0.0216(15) Uani 1 1 d . .
C9 C -0.0700(7) 0.3318(6) 0.4124(6) 0.0312(18) Uani 1 1 d . .
H9A H -0.0924 0.3937 0.3981 0.047 Uiso 1 1 calc R U
H9B H -0.0792 0.3442 0.4828 0.047 Uiso 1 1 calc R U
H9C H 0.0232 0.3324 0.4129 0.047 Uiso 1 1 calc R U
C10 C -0.3176(7) 0.2125(6) 0.3220(6) 0.0247(16) Uani 1 1 d . .
H10A H -0.3383 0.2758 0.3093 0.037 Uiso 1 1 calc R U
H10B H -0.3805 0.1385 0.2648 0.037 Uiso 1 1 calc R U
H10C H -0.3268 0.2238 0.3921 0.037 Uiso 1 1 calc R U
C11 C -0.1547(6) 0.1929(6) 0.2103(5) 0.0207(15) Uani 1 1 d . .
C12 C -0.2246(7) 0.2226(6) 0.1369(6) 0.0291(17) Uani 1 1 d . .
H12 H -0.2966 0.2566 0.1463 0.035 Uiso 1 1 calc R U
C13 C -0.1760(8) 0.1964(7) 0.0451(7) 0.040(2) Uani 1 1 d . .
H13 H -0.2131 0.2102 -0.0131 0.048 Uiso 1 1 calc R U
C14 C -0.0689(9) 0.1487(7) 0.0507(6) 0.038(2) Uani 1 1 d . .
H14 H -0.0236 0.1270 -0.0024 0.045 Uiso 1 1 calc R U
C15 C -0.4469(6) -0.2222(6) 0.1463(6) 0.0224(16) Uani 1 1 d . .
C16 C -0.5535(7) -0.3405(6) 0.1073(6) 0.036(2) Uani 1 1 d . .
H16A H -0.6398 -0.3430 0.0635 0.054 Uiso 1 1 calc R U
H16B H -0.5212 -0.4044 0.0638 0.054 Uiso 1 1 calc R U
H16C H -0.5662 -0.3480 0.1701 0.054 Uiso 1 1 calc R U
C17 C -0.4957(8) -0.1209(7) 0.2202(6) 0.0346(19) Uani 1 1 d . .
H17A H -0.5789 -0.1177 0.1774 0.052 Uiso 1 1 calc R U
H17B H -0.5133 -0.1341 0.2792 0.052 Uiso 1 1 calc R U
H17C H -0.4255 -0.0474 0.2501 0.052 Uiso 1 1 calc R U
C18 C -0.4213(6) -0.2060(6) 0.0512(5) 0.0230(16) Uani 1 1 d . .
C19 C -0.4012(7) -0.1068(7) 0.0383(6) 0.0285(17) Uani 1 1 d . .
H19 H -0.4100 -0.0354 0.0879 0.034 Uiso 1 1 calc R U
C20 C -0.3657(8) -0.1235(8) -0.0580(7) 0.042(2) Uani 1 1 d . .
H20 H -0.3505 -0.0644 -0.0787 0.051 Uiso 1 1 calc R U
C21 C -0.3560(9) -0.2313(8) -0.1163(7) 0.048(2) Uani 1 1 d . .
H21 H -0.3325 -0.2561 -0.1813 0.058 Uiso 1 1 calc R U
C22 C -0.0292(7) -0.3429(6) 0.1945(6) 0.0256(16) Uani 1 1 d . .
C23 C -0.1633(9) -0.4345(7) 0.1457(9) 0.072(4) Uani 1 1 d . .
H23A H -0.1554 -0.5069 0.0913 0.108 Uiso 1 1 calc R U
H23B H -0.1894 -0.4474 0.2025 0.108 Uiso 1 1 calc R U
H23C H -0.2322 -0.4088 0.1116 0.108 Uiso 1 1 calc R U
C24 C 0.0133(12) -0.3222(10) 0.1044(8) 0.071(4) Uani 1 1 d . .
H24A H 0.0183 -0.3952 0.0488 0.106 Uiso 1 1 calc R U
H24B H -0.0536 -0.2937 0.0719 0.106 Uiso 1 1 calc R U
H24C H 0.1021 -0.2647 0.1361 0.106 Uiso 1 1 calc R U
C25 C 0.0826(7) -0.3803(6) 0.2485(5) 0.0216(15) Uani 1 1 d . .
C26 C 0.0938(10) -0.4894(7) 0.2266(8) 0.058(3) Uani 1 1 d . .
H26 H 0.0257 -0.5585 0.1743 0.069 Uiso 1 1 calc R U
C27 C 0.2176(13) -0.4883(9) 0.2902(9) 0.083(4) Uani 1 1 d . .
H27 H 0.2396 -0.5569 0.2841 0.099 Uiso 1 1 calc R U
C28 C 0.3021(10) -0.3796(9) 0.3607(8) 0.057(3) Uani 1 1 d . .
H28 H 0.3881 -0.3633 0.4091 0.069 Uiso 1 1 calc R U
O1 O 0.1259(4) 0.0672(4) 0.3856(3) 0.0224(11) Uani 1 1 d . .
O2 O -0.1384(4) 0.1174(4) 0.3407(4) 0.0177(10) Uani 1 1 d . .
O3 O -0.1076(4) -0.0417(4) 0.4091(3) 0.0151(9) Uani 1 1 d . .
O4 O -0.3222(4) -0.2267(4) 0.2106(4) 0.0228(11) Uani 1 1 d . .
O5 O -0.0358(5) -0.2333(4) 0.2761(4) 0.0227(11) Uani 1 1 d . .
S1 S 0.3241(2) 0.34404(17) 0.42803(19) 0.0419(5) Uani 1 1 d . .
S2 S -0.0281(2) 0.13374(19) 0.16626(16) 0.0353(5) Uani 1 1 d . .
S3 S -0.3922(3) -0.3193(2) -0.05656(18) 0.0524(6) Uani 1 1 d . .
S4 S 0.2290(2) -0.27569(18) 0.34894(18) 0.0386(5) Uani 1 1 d . .
Bi1 Bi 0.00697(2) 0.13663(2) 0.49042(2) 0.01570(8) Uani 1 1 d . .
Bi2 Bi -0.13005(2) -0.11409(2) 0.24169(2) 0.01688(8) Uani 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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Bi Bi -4.1077 10.2566 '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
O1 C1 C2 105.9(5) . .
O1 C1 C4 108.9(5) . .
C2 C1 C4 113.2(6) . .
O1 C1 C3 109.2(6) . .
C2 C1 C3 110.0(6) . .
C4 C1 C3 109.5(6) . .
C1 C2 H2A 109.5 . .
C1 C2 H2B 109.5 . .
H2A C2 H2B 109.5 . .
C1 C2 H2C 109.5 . .
H2A C2 H2C 109.5 . .
H2B C2 H2C 109.5 . .
C1 C3 H3A 109.5 . .
C1 C3 H3B 109.5 . .
H3A C3 H3B 109.5 . .
C1 C3 H3C 109.5 . .
H3A C3 H3C 109.5 . .
H3B C3 H3C 109.5 . .
C5 C4 C1 128.4(7) . .
C5 C4 S1 110.5(5) . .
C1 C4 S1 121.0(6) . .
C4 C5 C6 110.4(8) . .
C4 C5 H5 124.8 . .
C6 C5 H5 124.8 . .
C7 C6 C5 114.7(8) . .
C7 C6 H6 122.6 . .
C5 C6 H6 122.6 . .
C6 C7 S1 111.1(7) . .
C6 C7 H7 124.4 . .
S1 C7 H7 124.4 . .
O2 C8 C11 109.3(5) . .
O2 C8 C10 109.4(6) . .
C11 C8 C10 109.4(5) . .
O2 C8 C9 110.9(6) . .
C11 C8 C9 109.2(6) . .
C10 C8 C9 108.6(5) . .
C8 C9 H9A 109.5 . .
C8 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
C8 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
C8 C10 H10A 109.5 . .
C8 C10 H10B 109.5 . .
H10A C10 H10B 109.5 . .
C8 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
C12 C11 C8 129.7(6) . .
C12 C11 S2 110.7(6) . .
C8 C11 S2 119.5(5) . .
C11 C12 C13 112.7(7) . .
C11 C12 H12 123.6 . .
C13 C12 H12 123.6 . .
C14 C13 C12 112.6(8) . .
C14 C13 H13 123.7 . .
C12 C13 H13 123.7 . .
C13 C14 S2 111.7(6) . .
C13 C14 H14 124.1 . .
S2 C14 H14 124.1 . .
O4 C15 C18 109.8(5) . .
O4 C15 C17 109.3(5) . .
C18 C15 C17 111.0(6) . .
O4 C15 C16 105.4(6) . .
C18 C15 C16 111.9(6) . .
C17 C15 C16 109.2(6) . .
C15 C16 H16A 109.5 . .
C15 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
C15 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
C15 C17 H17A 109.5 . .
C15 C17 H17B 109.5 . .
H17A C17 H17B 109.5 . .
C15 C17 H17C 109.5 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
C19 C18 C15 129.8(6) . .
C19 C18 S3 109.5(6) . .
C15 C18 S3 120.3(5) . .
C18 C19 C20 113.2(7) . .
C18 C19 H19 123.4 . .
C20 C19 H19 123.4 . .
C21 C20 C19 113.8(9) . .
C21 C20 H20 123.1 . .
C19 C20 H20 123.1 . .
C20 C21 S3 111.4(7) . .
C20 C21 H21 124.3 . .
S3 C21 H21 124.3 . .
O5 C22 C23 111.6(6) . .
O5 C22 C25 107.8(5) . .
C23 C22 C25 111.2(7) . .
O5 C22 C24 108.4(6) . .
C23 C22 C24 109.8(8) . .
C25 C22 C24 108.0(6) . .
C22 C23 H23A 109.5 . .
C22 C23 H23B 109.5 . .
H23A C23 H23B 109.5 . .
C22 C23 H23C 109.5 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
C22 C24 H24A 109.5 . .
C22 C24 H24B 109.5 . .
H24A C24 H24B 109.5 . .
C22 C24 H24C 109.5 . .
H24A C24 H24C 109.5 . .
H24B C24 H24C 109.5 . .
C26 C25 C22 130.2(7) . .
C26 C25 S4 109.6(6) . .
C22 C25 S4 120.1(5) . .
C25 C26 C27 113.4(8) . .
C25 C26 H26 123.3 . .
C27 C26 H26 123.3 . .
C28 C27 C26 114.0(8) . .
C28 C27 H27 123.0 . .
C26 C27 H27 123.0 . .
C27 C28 S4 110.1(7) . .
C27 C28 H28 124.9 . .
S4 C28 H28 124.9 . .
C1 O1 Bi1 125.2(3) . .
C8 O2 Bi1 126.1(4) . .
C8 O2 Bi2 144.9(4) . .
Bi1 O2 Bi2 86.27(13) . .
Bi2 O3 Bi1 110.2(2) . .
Bi2 O3 Bi1 118.22(17) . 2_556
Bi1 O3 Bi1 107.68(16) . 2_556
C15 O4 Bi2 120.7(4) . .
C22 O5 Bi2 124.8(4) . .
C7 S1 C4 93.3(5) . .
C14 S2 C11 92.2(4) . .
C21 S3 C18 92.1(4) . .
C28 S4 C25 92.8(4) . .
O3 Bi1 O1 81.19(16) . .
O3 Bi1 O2 76.25(16) . .
O1 Bi1 O2 84.75(17) . .
O3 Bi1 O3 72.32(16) . 2_556
O1 Bi1 O3 85.00(17) . 2_556
O2 Bi1 O3 148.06(14) . 2_556
O3 Bi1 Bi2 34.75(12) . .
O1 Bi1 Bi2 57.32(11) . .
O2 Bi1 Bi2 53.60(10) . .
O3 Bi1 Bi2 95.80(9) 2_556 .
O3 Bi1 Bi1 39.22(12) . 2_556
O1 Bi1 Bi1 81.63(14) . 2_556
O2 Bi1 Bi1 115.28(11) . 2_556
O3 Bi1 Bi1 33.09(9) 2_556 2_556
Bi2 Bi1 Bi1 66.188(9) . 2_556
O3 Bi2 O4 88.69(17) . .
O3 Bi2 O5 81.34(16) . .
O4 Bi2 O5 88.10(18) . .
O3 Bi2 O2 64.93(15) . .
O4 Bi2 O2 109.16(15) . .
O5 Bi2 O2 140.95(14) . .
O3 Bi2 Bi1 35.09(12) . .
O4 Bi2 Bi1 118.15(12) . .
O5 Bi2 Bi1 100.82(11) . .
O2 Bi2 Bi1 40.13(9) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.437(7) .
C1 C2 1.505(10) .
C1 C4 1.509(9) .
C1 C3 1.527(10) .
C2 H2A 0.9600 .
C2 H2B 0.9600 .
C2 H2C 0.9600 .
C3 H3A 0.9600 .
C3 H3B 0.9600 .
C3 H3C 0.9600 .
C4 C5 1.379(10) .
C4 S1 1.715(8) .
C5 C6 1.452(12) .
C5 H5 0.9300 .
C6 C7 1.316(15) .
C6 H6 0.9300 .
C7 S1 1.701(9) .
C7 H7 0.9300 .
C8 O2 1.426(8) .
C8 C11 1.524(10) .
C8 C10 1.537(9) .
C8 C9 1.540(9) .
C9 H9A 0.9600 .
C9 H9B 0.9600 .
C9 H9C 0.9600 .
C10 H10A 0.9600 .
C10 H10B 0.9600 .
C10 H10C 0.9600 .
C11 C12 1.363(10) .
C11 S2 1.716(6) .
C12 C13 1.408(11) .
C12 H12 0.9300 .
C13 C14 1.358(11) .
C13 H13 0.9300 .
C14 S2 1.692(9) .
C14 H14 0.9300 .
C15 O4 1.439(8) .
C15 C18 1.504(10) .
C15 C17 1.533(9) .
C15 C16 1.535(10) .
C16 H16A 0.9600 .
C16 H16B 0.9600 .
C16 H16C 0.9600 .
C17 H17A 0.9600 .
C17 H17B 0.9600 .
C17 H17C 0.9600 .
C18 C19 1.364(11) .
C18 S3 1.735(7) .
C19 C20 1.412(11) .
C19 H19 0.9300 .
C20 C21 1.326(11) .
C20 H20 0.9300 .
C21 S3 1.716(10) .
C21 H21 0.9300 .
C22 O5 1.428(7) .
C22 C23 1.477(11) .
C22 C25 1.511(9) .
C22 C24 1.531(12) .
C23 H23A 0.9600 .
C23 H23B 0.9600 .
C23 H23C 0.9600 .
C24 H24A 0.9600 .
C24 H24B 0.9600 .
C24 H24C 0.9600 .
C25 C26 1.349(11) .
C25 S4 1.719(7) .
C26 C27 1.396(13) .
C26 H26 0.9300 .
C27 C28 1.341(14) .
C27 H27 0.9300 .
C28 S4 1.701(10) .
C28 H28 0.9300 .
O1 Bi1 2.117(4) .
O2 Bi1 2.209(4) .
O2 Bi2 2.759(4) .
O3 Bi2 2.077(4) .
O3 Bi1 2.095(4) .
O3 Bi1 2.426(4) 2_556
O4 Bi2 2.101(4) .
O5 Bi2 2.126(5) .
Bi1 O3 2.426(4) 2_556
Bi1 Bi2 3.4201(5) .
Bi1 Bi1 3.6548(5) 2_556
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
O1 C1 C4 C5 77.8(9)
C2 C1 C4 C5 -164.7(7)
C3 C1 C4 C5 -41.5(9)
O1 C1 C4 S1 -98.1(6)
C2 C1 C4 S1 19.4(8)
C3 C1 C4 S1 142.5(6)
C1 C4 C5 C6 -175.4(7)
S1 C4 C5 C6 0.9(8)
C4 C5 C6 C7 -1.3(11)
C5 C6 C7 S1 1.1(11)
O2 C8 C11 C12 148.2(7)
C10 C8 C11 C12 28.4(10)
C9 C8 C11 C12 -90.4(8)
O2 C8 C11 S2 -35.9(7)
C10 C8 C11 S2 -155.7(5)
C9 C8 C11 S2 85.5(6)
C8 C11 C12 C13 176.7(7)
S2 C11 C12 C13 0.5(8)
C11 C12 C13 C14 -0.8(10)
C12 C13 C14 S2 0.8(9)
O4 C15 C18 C19 -102.4(8)
C17 C15 C18 C19 18.5(9)
C16 C15 C18 C19 140.9(7)
O4 C15 C18 S3 69.4(6)
C17 C15 C18 S3 -169.6(5)
C16 C15 C18 S3 -47.3(7)
C15 C18 C19 C20 173.7(7)
S3 C18 C19 C20 1.1(8)
C18 C19 C20 C21 -1.3(10)
C19 C20 C21 S3 0.7(10)
O5 C22 C25 C26 149.5(9)
C23 C22 C25 C26 26.9(13)
C24 C22 C25 C26 -93.6(11)
O5 C22 C25 S4 -35.3(8)
C23 C22 C25 S4 -157.9(6)
C24 C22 C25 S4 81.7(7)
C22 C25 C26 C27 176.1(10)
S4 C25 C26 C27 0.4(13)
C25 C26 C27 C28 -0.1(17)
C26 C27 C28 S4 -0.2(15)
C2 C1 O1 Bi1 -151.6(5)
C4 C1 O1 Bi1 -29.5(8)
C3 C1 O1 Bi1 90.0(6)
C11 C8 O2 Bi1 129.3(4)
C10 C8 O2 Bi1 -110.9(5)
C9 C8 O2 Bi1 9.0(8)
C11 C8 O2 Bi2 -24.4(9)
C10 C8 O2 Bi2 95.4(7)
C9 C8 O2 Bi2 -144.8(5)
C18 C15 O4 Bi2 39.8(6)
C17 C15 O4 Bi2 -82.2(6)
C16 C15 O4 Bi2 160.5(4)
C23 C22 O5 Bi2 -75.8(8)
C25 C22 O5 Bi2 161.8(4)
C24 C22 O5 Bi2 45.1(8)
C6 C7 S1 C4 -0.4(8)
C5 C4 S1 C7 -0.3(6)
C1 C4 S1 C7 176.3(6)
C13 C14 S2 C11 -0.4(6)
C12 C11 S2 C14 0.0(6)
C8 C11 S2 C14 -176.7(6)
C20 C21 S3 C18 -0.1(7)
C19 C18 S3 C21 -0.6(6)
C15 C18 S3 C21 -174.0(6)
C27 C28 S4 C25 0.4(10)
C26 C25 S4 C28 -0.5(8)
C22 C25 S4 C28 -176.6(6)
