#------------------------------------------------------------------------------
#$Date: 2016-03-23 20:55:54 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179431 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/28/4332818.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the Crystal Eye server at
# http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
# Peter Murray-Rust laboratory.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_4332818
loop_
_publ_author_name
'Fan, Sai-Rong'
'Zhu, Long-Guan'
_publ_section_title
;
 Influence of the Reaction Conditions on the Self-assembly of Lead(II)
 5-Sulfosalicylate Coordination Polymers with Chelating Amine Ligands
;
_journal_issue                   19
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              7935
_journal_page_last               7942
_journal_paper_doi               10.1021/ic060871v
_journal_volume                  45
_journal_year                    2006
_chemical_formula_sum            'C50 H30 N6 O12 Pb3 S2'
_chemical_formula_weight         1592.49
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           14
_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                 106.2470(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.7889(7)
_cell_length_b                   21.5596(12)
_cell_length_c                   18.6853(10)
_cell_measurement_temperature    295(2)
_cell_volume                     4559.5(4)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      295(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0311
_diffrn_reflns_av_sigmaI/netI    0.0404
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            24584
_diffrn_reflns_theta_full        25.50
_diffrn_reflns_theta_max         25.50
_diffrn_reflns_theta_min         1.48
_exptl_absorpt_coefficient_mu    11.218
_exptl_absorpt_correction_T_max  0.1823
_exptl_absorpt_correction_T_min  0.0970
_exptl_crystal_density_diffrn    2.320
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2984
_exptl_crystal_size_max          0.39
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.23
_refine_diff_density_max         0.794
_refine_diff_density_min         -1.288
_refine_diff_density_rms         0.219
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     658
_refine_ls_number_reflns         8455
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.063
_refine_ls_R_factor_all          0.0398
_refine_ls_R_factor_gt           0.0307
_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)+(0.0336P)²+3.2353P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0732
_refine_ls_wR_factor_ref         0.0767
_reflns_number_gt                7085
_reflns_number_total             8455
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic060871vsup1.cif
_cod_data_source_block           comp-4
_cod_database_code               4332818
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
Pb1 Pb 1.148656(18) 0.344107(10) 0.214855(11) 0.02456(7) Uani 1 1 d .
Pb2 Pb 0.851898(18) 0.354710(10) 0.284989(11) 0.02394(7) Uani 1 1 d .
Pb3 Pb 0.492244(16) 0.266063(10) 0.244855(10) 0.02310(7) Uani 1 1 d .
S1 S 1.30760(15) 0.14493(7) 0.57568(8) 0.0337(4) Uani 1 1 d .
S2 S 0.70637(14) 0.14735(7) -0.07343(8) 0.0319(4) Uani 1 1 d .
O1 O 1.0764(3) 0.33382(18) 0.3192(2) 0.0288(9) Uani 1 1 d .
O2 O 0.9864(3) 0.2564(2) 0.3592(2) 0.0455(11) Uani 1 1 d .
O3 O 1.2999(3) 0.28934(18) 0.3072(2) 0.0296(9) Uani 1 1 d .
O4 O 1.1940(5) 0.1161(3) 0.5614(2) 0.0687(17) Uani 1 1 d .
O5 O 1.3257(5) 0.1841(2) 0.6413(2) 0.0578(15) Uani 1 1 d .
O6 O 1.4024(6) 0.1028(3) 0.5810(4) 0.105(3) Uani 1 1 d .
O7 O 0.6749(4) 0.3099(3) 0.1996(3) 0.0666(17) Uani 1 1 d .
O8 O 0.5833(4) 0.2263(2) 0.1547(2) 0.0516(13) Uani 1 1 d .
O9 O 0.9045(3) 0.3216(2) 0.1742(2) 0.0357(10) Uani 1 1 d .
O10 O 0.6696(4) 0.1852(2) -0.1403(2) 0.0514(13) Uani 1 1 d .
O11 O 0.8024(4) 0.1073(2) -0.0778(2) 0.0468(12) Uani 1 1 d .
O12 O 0.6115(5) 0.1155(3) -0.0560(3) 0.0718(17) Uani 1 1 d .
N1 N 1.2446(4) 0.4353(2) 0.2927(3) 0.0320(12) Uani 1 1 d .
N2 N 1.0630(4) 0.4522(2) 0.1658(3) 0.0354(12) Uani 1 1 d .
N3 N 0.9509(5) 0.4646(2) 0.3281(3) 0.0389(13) Uani 1 1 d .
N4 N 0.7788(5) 0.4490(2) 0.1966(3) 0.0378(13) Uani 1 1 d .
N5 N 0.3929(4) 0.1659(2) 0.1819(3) 0.0323(12) Uani 1 1 d .
N6 N 0.5660(4) 0.1639(2) 0.3140(2) 0.0299(11) Uani 1 1 d .
C1 C 1.0776(5) 0.2814(3) 0.3549(3) 0.0255(12) Uani 1 1 d .
C2 C 1.1943(5) 0.2546(2) 0.3945(3) 0.0242(12) Uani 1 1 d .
C3 C 1.2993(5) 0.2650(2) 0.3722(3) 0.0240(12) Uani 1 1 d .
C4 C 1.4057(5) 0.2440(3) 0.4215(3) 0.0289(13) Uani 1 1 d .
H4 H 1.4765 0.2542 0.4116 0.035 Uiso 1 1 calc R
C5 C 1.4095(5) 0.2092(3) 0.4829(3) 0.0293(13) Uani 1 1 d .
H5 H 1.4816 0.1954 0.5134 0.035 Uiso 1 1 calc R
C6 C 1.3055(5) 0.1943(2) 0.5002(3) 0.0241(12) Uani 1 1 d .
C7 C 1.1999(5) 0.2185(2) 0.4561(3) 0.0277(12) Uani 1 1 d .
H7 H 1.1305 0.2100 0.4686 0.033 Uiso 1 1 calc R
C8 C 1.3300(6) 0.4276(3) 0.3565(4) 0.0455(17) Uani 1 1 d .
H8 H 1.3565 0.3876 0.3708 0.055 Uiso 1 1 calc R
C9 C 1.3803(7) 0.4765(4) 0.4020(4) 0.055(2) Uani 1 1 d .
H9 H 1.4351 0.4691 0.4477 0.066 Uiso 1 1 calc R
C10 C 1.3494(7) 0.5355(4) 0.3796(5) 0.061(2) Uani 1 1 d .
H10 H 1.3852 0.5688 0.4090 0.073 Uiso 1 1 calc R
C11 C 1.2626(6) 0.5460(3) 0.3114(4) 0.0441(17) Uani 1 1 d .
C12 C 1.2272(8) 0.6075(3) 0.2833(6) 0.064(3) Uani 1 1 d .
H12 H 1.2631 0.6421 0.3100 0.077 Uiso 1 1 calc R
C13 C 1.1424(8) 0.6150(4) 0.2185(6) 0.069(3) Uani 1 1 d .
H13 H 1.1206 0.6549 0.2013 0.083 Uiso 1 1 calc R
C14 C 1.0856(6) 0.5636(3) 0.1758(4) 0.0469(18) Uani 1 1 d .
C15 C 0.9946(7) 0.5685(5) 0.1067(5) 0.067(3) Uani 1 1 d .
H15 H 0.9711 0.6075 0.0864 0.081 Uiso 1 1 calc R
C16 C 0.9429(7) 0.5173(4) 0.0707(4) 0.059(2) Uani 1 1 d .
H16 H 0.8843 0.5204 0.0257 0.070 Uiso 1 1 calc R
C17 C 0.9787(6) 0.4599(4) 0.1022(3) 0.0481(18) Uani 1 1 d .
H17 H 0.9417 0.4247 0.0775 0.058 Uiso 1 1 calc R
C18 C 1.1178(6) 0.5035(3) 0.2021(4) 0.0367(15) Uani 1 1 d .
C19 C 1.2109(5) 0.4942(3) 0.2701(3) 0.0321(14) Uani 1 1 d .
C20 C 0.6639(5) 0.2641(3) 0.1574(3) 0.0258(12) Uani 1 1 d .
C21 C 0.7432(4) 0.2545(2) 0.1089(3) 0.0224(12) Uani 1 1 d .
C22 C 0.8542(5) 0.2849(3) 0.1187(3) 0.0249(12) Uani 1 1 d .
C23 C 0.9123(5) 0.2725(3) 0.0630(3) 0.0330(14) Uani 1 1 d .
H23 H 0.9826 0.2932 0.0656 0.040 Uiso 1 1 calc R
C24 C 0.8701(5) 0.2318(3) 0.0060(3) 0.0306(13) Uani 1 1 d .
H24 H 0.9118 0.2250 -0.0288 0.037 Uiso 1 1 calc R
C25 C 0.7638(5) 0.2002(3) -0.0002(3) 0.0258(12) Uani 1 1 d .
C26 C 0.7022(5) 0.2128(3) 0.0508(3) 0.0263(12) Uani 1 1 d .
H26 H 0.6306 0.1928 0.0461 0.032 Uiso 1 1 calc R
C27 C 1.0298(7) 0.4724(4) 0.3926(4) 0.057(2) Uani 1 1 d .
H27 H 1.0630 0.4372 0.4191 0.068 Uiso 1 1 calc R
C28 C 1.0668(8) 0.5299(5) 0.4240(5) 0.074(3) Uani 1 1 d .
H28 H 1.1223 0.5328 0.4704 0.089 Uiso 1 1 calc R
C29 C 1.0209(9) 0.5813(5) 0.3861(6) 0.086(3) Uani 1 1 d .
H29 H 1.0467 0.6201 0.4058 0.103 Uiso 1 1 calc R
C30 C 0.9332(8) 0.5771(4) 0.3159(5) 0.061(2) Uani 1 1 d .
C31 C 0.8789(10) 0.6272(4) 0.2737(8) 0.096(4) Uani 1 1 d .
H31 H 0.9011 0.6670 0.2912 0.115 Uiso 1 1 calc R
C32 C 0.7955(10) 0.6205(4) 0.2085(7) 0.092(4) Uani 1 1 d .
H32 H 0.7613 0.6555 0.1819 0.110 Uiso 1 1 calc R
C33 C 0.7587(7) 0.5600(4) 0.1795(5) 0.064(2) Uani 1 1 d .
C34 C 0.6722(8) 0.5480(5) 0.1097(5) 0.077(3) Uani 1 1 d .
H34 H 0.6348 0.5809 0.0802 0.093 Uiso 1 1 calc R
C35 C 0.6455(8) 0.4903(5) 0.0872(5) 0.076(3) Uani 1 1 d .
H35 H 0.5913 0.4827 0.0413 0.091 Uiso 1 1 calc R
C36 C 0.6973(6) 0.4420(4) 0.1312(4) 0.057(2) Uani 1 1 d .
H36 H 0.6746 0.4019 0.1148 0.068 Uiso 1 1 calc R
C37 C 0.8097(6) 0.5079(3) 0.2202(4) 0.0401(16) Uani 1 1 d .
C38 C 0.8998(6) 0.5159(3) 0.2904(4) 0.0400(16) Uani 1 1 d .
C39 C 0.3132(6) 0.1665(3) 0.1158(4) 0.0471(18) Uani 1 1 d .
H39 H 0.2823 0.2045 0.0958 0.056 Uiso 1 1 calc R
C40 C 0.2737(8) 0.1125(4) 0.0747(4) 0.070(3) Uani 1 1 d .
H40 H 0.2227 0.1151 0.0268 0.084 Uiso 1 1 calc R
C41 C 0.3107(7) 0.0566(4) 0.1056(4) 0.060(2) Uani 1 1 d .
H41 H 0.2817 0.0202 0.0804 0.072 Uiso 1 1 calc R
C42 C 0.3928(6) 0.0544(3) 0.1757(4) 0.0431(17) Uani 1 1 d .
C43 C 0.4352(7) -0.0038(3) 0.2117(4) 0.0480(19) Uani 1 1 d .
H43 H 0.4055 -0.0409 0.1887 0.058 Uiso 1 1 calc R
C44 C 0.5177(7) -0.0046(3) 0.2783(4) 0.0508(19) Uani 1 1 d .
H44 H 0.5453 -0.0424 0.3003 0.061 Uiso 1 1 calc R
C45 C 0.5635(6) 0.0520(3) 0.3158(4) 0.0380(16) Uani 1 1 d .
C46 C 0.6486(6) 0.0526(3) 0.3847(4) 0.0473(18) Uani 1 1 d .
H46 H 0.6765 0.0155 0.4085 0.057 Uiso 1 1 calc R
C47 C 0.6907(7) 0.1071(3) 0.4170(4) 0.051(2) Uani 1 1 d .
H47 H 0.7460 0.1081 0.4636 0.061 Uiso 1 1 calc R
C48 C 0.6489(6) 0.1626(3) 0.3785(3) 0.0428(17) Uani 1 1 d .
H48 H 0.6812 0.2000 0.3995 0.051 Uiso 1 1 calc R
C49 C 0.5230(5) 0.1096(3) 0.2825(3) 0.0264(13) Uani 1 1 d .
C50 C 0.4334(5) 0.1106(3) 0.2116(3) 0.0286(13) 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'
N N 0.0061 0.0033 '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'
Pb Pb -3.3944 10.1111 '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 Pb1 O3 74.18(12) . .
O1 Pb1 N1 78.64(15) . .
O3 Pb1 N1 81.18(14) . .
O1 Pb1 N2 100.49(14) . .
O3 Pb1 N2 145.68(15) . .
N1 Pb1 N2 64.63(16) . .
O1 Pb1 O9 68.00(12) . .
O3 Pb1 O9 127.27(13) . .
N1 Pb1 O9 123.55(14) . .
N2 Pb1 O9 77.99(15) . .
O1 Pb1 O5 149.37(12) . 4_565
O3 Pb1 O5 75.37(12) . 4_565
N1 Pb1 O5 99.92(16) . 4_565
N2 Pb1 O5 106.48(15) . 4_565
O9 Pb1 O5 131.51(13) . 4_565
O9 Pb2 O7 72.69(13) . .
O9 Pb2 O1 70.83(13) . .
O7 Pb2 O1 136.21(14) . .
O9 Pb2 N4 78.88(15) . .
O7 Pb2 N4 79.86(19) . .
O1 Pb2 N4 115.27(14) . .
O9 Pb2 N3 108.92(15) . .
O7 Pb2 N3 140.43(18) . .
O1 Pb2 N3 75.41(15) . .
N4 Pb2 N3 62.47(16) . .
O9 Pb2 O2 87.43(14) . .
O7 Pb2 O2 106.79(17) . .
O1 Pb2 O2 48.71(12) . .
N4 Pb2 O2 162.35(14) . .
N3 Pb2 O2 112.78(14) . .
O9 Pb2 O11 176.81(13) . 4_566
O7 Pb2 O11 110.00(13) . 4_566
O1 Pb2 O11 106.01(13) . 4_566
N4 Pb2 O11 103.13(14) . 4_566
N3 Pb2 O11 70.22(14) . 4_566
O2 Pb2 O11 90.10(13) . 4_566
O9 Pb2 O10 134.40(12) . 4_566
O7 Pb2 O10 66.28(13) . 4_566
O1 Pb2 O10 130.76(12) . 4_566
N4 Pb2 O10 111.46(15) . 4_566
N3 Pb2 O10 115.18(15) . 4_566
O2 Pb2 O10 86.08(13) . 4_566
O11 Pb2 O10 47.32(12) 4_566 4_566
O8 Pb3 O5 91.06(16) . 4_465
O8 Pb3 N6 83.82(16) . .
O5 Pb3 N6 144.36(17) 4_465 .
O8 Pb3 N5 67.37(15) . .
O5 Pb3 N5 81.59(17) 4_465 .
N6 Pb3 N5 63.86(16) . .
O8 Pb3 O7 49.48(13) . .
O5 Pb3 O7 97.25(17) 4_465 .
N6 Pb3 O7 105.66(17) . .
N5 Pb3 O7 116.84(14) . .
O8 Pb3 O10 107.02(15) . 4_566
O5 Pb3 O10 132.85(19) 4_465 4_566
N6 Pb3 O10 81.89(14) . 4_566
N5 Pb3 O10 145.54(15) . 4_566
O7 Pb3 O10 67.10(13) . 4_566
O8 Pb3 O3 155.36(13) . 1_455
O5 Pb3 O3 73.06(13) 4_465 1_455
N6 Pb3 O3 98.05(13) . 1_455
N5 Pb3 O3 91.27(14) . 1_455
O7 Pb3 O3 149.05(14) . 1_455
O10 Pb3 O3 97.55(13) 4_566 1_455
O8 Pb3 O5 153.00(12) . 4_466
O5 Pb3 O5 115.39(11) 4_465 4_466
N6 Pb3 O5 71.58(10) . 4_466
N5 Pb3 O5 109.34(11) . 4_466
O7 Pb3 O5 126.46(9) . 4_466
O10 Pb3 O5 59.50(10) 4_566 4_466
O3 Pb3 O5 44.34(7) 1_455 4_466
O6 S1 O4 114.3(4) . .
O6 S1 O5 112.6(4) . .
O4 S1 O5 108.5(3) . .
O6 S1 C6 106.0(3) . .
O4 S1 C6 108.1(3) . .
O5 S1 C6 106.9(3) . .
O12 S2 O11 113.7(3) . .
O12 S2 O10 113.8(3) . .
O11 S2 O10 109.7(3) . .
O12 S2 C25 106.8(3) . .
O11 S2 C25 107.1(3) . .
O10 S2 C25 105.1(3) . .
C1 O1 Pb1 123.3(3) . .
C1 O1 Pb2 98.1(3) . .
Pb1 O1 Pb2 111.27(14) . .
C1 O2 Pb2 91.2(3) . .
C3 O3 Pb1 131.0(3) . .
S1 O5 Pb3 141.0(3) . 4_666
C20 O7 Pb2 130.1(4) . .
C20 O7 Pb3 88.3(4) . .
Pb2 O7 Pb3 123.06(18) . .
C20 O8 Pb3 103.0(3) . .
C22 O9 Pb2 133.4(3) . .
C22 O9 Pb1 121.5(3) . .
Pb2 O9 Pb1 101.85(12) . .
S2 O10 Pb3 149.7(3) . 4_565
C8 N1 C19 118.3(5) . .
C8 N1 Pb1 121.4(4) . .
C19 N1 Pb1 120.3(4) . .
C17 N2 C18 118.5(6) . .
C17 N2 Pb1 123.1(5) . .
C18 N2 Pb1 117.9(4) . .
C27 N3 C38 118.0(6) . .
C27 N3 Pb2 122.0(5) . .
C38 N3 Pb2 118.3(4) . .
C36 N4 C37 117.5(6) . .
C36 N4 Pb2 121.2(5) . .
C37 N4 Pb2 120.7(4) . .
C39 N5 C50 118.1(6) . .
C39 N5 Pb3 121.9(4) . .
C50 N5 Pb3 119.4(4) . .
C48 N6 C49 118.1(5) . .
C48 N6 Pb3 122.3(4) . .
C49 N6 Pb3 119.5(4) . .
O2 C1 O1 121.8(5) . .
O2 C1 C2 120.3(5) . .
O1 C1 C2 117.8(5) . .
C7 C2 C3 119.4(5) . .
C7 C2 C1 117.2(5) . .
C3 C2 C1 123.4(5) . .
O3 C3 C4 119.6(5) . .
O3 C3 C2 123.8(5) . .
C4 C3 C2 116.4(5) . .
C5 C4 C3 122.8(5) . .
C5 C4 H4 118.6 . .
C3 C4 H4 118.6 . .
C4 C5 C6 120.0(5) . .
C4 C5 H5 120.0 . .
C6 C5 H5 120.0 . .
C7 C6 C5 118.7(5) . .
C7 C6 S1 120.7(4) . .
C5 C6 S1 120.6(4) . .
C2 C7 C6 122.2(5) . .
C2 C7 H7 118.9 . .
C6 C7 H7 118.9 . .
N1 C8 C9 122.6(7) . .
N1 C8 H8 118.7 . .
C9 C8 H8 118.7 . .
C10 C9 C8 119.7(7) . .
C10 C9 H9 120.2 . .
C8 C9 H9 120.2 . .
C9 C10 C11 119.6(7) . .
C9 C10 H10 120.2 . .
C11 C10 H10 120.2 . .
C19 C11 C10 117.6(6) . .
C19 C11 C12 119.8(7) . .
C10 C11 C12 122.6(7) . .
C13 C12 C11 120.2(7) . .
C13 C12 H12 119.9 . .
C11 C12 H12 119.9 . .
C12 C13 C14 121.8(7) . .
C12 C13 H13 119.1 . .
C14 C13 H13 119.1 . .
C18 C14 C13 119.1(7) . .
C18 C14 C15 116.5(7) . .
C13 C14 C15 124.4(7) . .
C16 C15 C14 120.6(7) . .
C16 C15 H15 119.7 . .
C14 C15 H15 119.7 . .
C15 C16 C17 118.7(8) . .
C15 C16 H16 120.7 . .
C17 C16 H16 120.7 . .
N2 C17 C16 123.6(8) . .
N2 C17 H17 118.2 . .
C16 C17 H17 118.2 . .
N2 C18 C14 122.1(6) . .
N2 C18 C19 117.6(5) . .
C14 C18 C19 120.2(6) . .
N1 C19 C11 122.0(6) . .
N1 C19 C18 119.2(5) . .
C11 C19 C18 118.8(6) . .
O8 C20 O7 119.2(5) . .
O8 C20 C21 119.2(5) . .
O7 C20 C21 121.6(5) . .
C26 C21 C22 120.2(5) . .
C26 C21 C20 115.2(5) . .
C22 C21 C20 124.6(5) . .
O9 C22 C23 119.3(5) . .
O9 C22 C21 125.1(5) . .
C23 C22 C21 115.6(5) . .
C24 C23 C22 123.2(5) . .
C24 C23 H23 118.4 . .
C22 C23 H23 118.4 . .
C23 C24 C25 120.1(5) . .
C23 C24 H24 120.0 . .
C25 C24 H24 120.0 . .
C26 C25 C24 118.6(5) . .
C26 C25 S2 120.1(4) . .
C24 C25 S2 121.2(4) . .
C25 C26 C21 122.2(5) . .
C25 C26 H26 118.9 . .
C21 C26 H26 118.9 . .
N3 C27 C28 124.1(9) . .
N3 C27 H27 117.9 . .
C28 C27 H27 117.9 . .
C29 C28 C27 118.7(9) . .
C29 C28 H28 120.6 . .
C27 C28 H28 120.6 . .
C28 C29 C30 120.9(8) . .
C28 C29 H29 119.6 . .
C30 C29 H29 119.6 . .
C31 C30 C38 119.5(9) . .
C31 C30 C29 125.1(9) . .
C38 C30 C29 115.4(8) . .
C32 C31 C30 122.6(10) . .
C32 C31 H31 118.7 . .
C30 C31 H31 118.7 . .
C31 C32 C33 120.5(9) . .
C31 C32 H32 119.8 . .
C33 C32 H32 119.8 . .
C37 C33 C32 119.3(9) . .
C37 C33 C34 115.9(8) . .
C32 C33 C34 124.8(8) . .
C35 C34 C33 120.2(8) . .
C35 C34 H34 119.9 . .
C33 C34 H34 119.9 . .
C34 C35 C36 120.1(9) . .
C34 C35 H35 120.0 . .
C36 C35 H35 120.0 . .
N4 C36 C35 123.6(9) . .
N4 C36 H36 118.2 . .
C35 C36 H36 118.2 . .
N4 C37 C33 122.6(7) . .
N4 C37 C38 117.9(6) . .
C33 C37 C38 119.5(7) . .
N3 C38 C30 122.8(7) . .
N3 C38 C37 118.5(6) . .
C30 C38 C37 118.6(7) . .
N5 C39 C40 122.8(7) . .
N5 C39 H39 118.6 . .
C40 C39 H39 118.6 . .
C41 C40 C39 119.2(7) . .
C41 C40 H40 120.4 . .
C39 C40 H40 120.4 . .
C40 C41 C42 119.0(7) . .
C40 C41 H41 120.5 . .
C42 C41 H41 120.5 . .
C41 C42 C50 118.3(6) . .
C41 C42 C43 121.6(6) . .
C50 C42 C43 120.0(6) . .
C44 C43 C42 120.4(6) . .
C44 C43 H43 119.8 . .
C42 C43 H43 119.8 . .
C43 C44 C45 121.1(6) . .
C43 C44 H44 119.5 . .
C45 C44 H44 119.5 . .
C46 C45 C49 117.7(6) . .
C46 C45 C44 122.4(6) . .
C49 C45 C44 119.9(6) . .
C47 C46 C45 120.1(6) . .
C47 C46 H46 120.0 . .
C45 C46 H46 120.0 . .
C46 C47 C48 118.6(6) . .
C46 C47 H47 120.7 . .
C48 C47 H47 120.7 . .
N6 C48 C47 123.1(6) . .
N6 C48 H48 118.5 . .
C47 C48 H48 118.5 . .
N6 C49 C45 122.3(5) . .
N6 C49 C50 118.4(5) . .
C45 C49 C50 119.2(5) . .
N5 C50 C42 122.3(5) . .
N5 C50 C49 118.5(5) . .
C42 C50 C49 119.2(5) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pb1 O1 2.347(4) .
Pb1 O3 2.414(4) .
Pb1 N1 2.519(5) .
Pb1 N2 2.603(5) .
Pb1 O9 2.806(4) .
Pb1 O5 2.866(5) 4_565
Pb2 O9 2.429(4) .
Pb2 O7 2.443(4) .
Pb2 O1 2.582(4) .
Pb2 N4 2.609(5) .
Pb2 N3 2.664(5) .
Pb2 O2 2.775(4) .
Pb2 O11 2.903(4) 4_566
Pb2 O10 2.997(5) 4_566
Pb3 O8 2.395(4) .
Pb3 O5 2.574(4) 4_465
Pb3 N6 2.578(5) .
Pb3 N5 2.579(5) .
Pb3 O7 2.695(4) .
Pb3 O10 2.751(4) 4_566
Pb3 O3 2.868(4) 1_455
Pb3 O5 17.436(4) 4_466
S1 O6 1.422(6) .
S1 O4 1.432(5) .
S1 O5 1.455(5) .
S1 C6 1.762(5) .
S2 O12 1.426(5) .
S2 O11 1.444(4) .
S2 O10 1.454(4) .
S2 C25 1.764(5) .
O1 C1 1.311(6) .
O2 C1 1.225(6) .
O3 C3 1.326(6) .
O5 Pb3 2.574(4) 4_666
O7 C20 1.249(7) .
O8 C20 1.242(6) .
O9 C22 1.307(6) .
O10 Pb3 2.751(4) 4_565
N1 C8 1.339(7) .
N1 C19 1.361(7) .
N2 C17 1.328(8) .
N2 C18 1.363(8) .
N3 C27 1.312(8) .
N3 C38 1.358(8) .
N4 C36 1.335(8) .
N4 C37 1.360(8) .
N5 C39 1.327(7) .
N5 C50 1.344(7) .
N6 C48 1.323(7) .
N6 C49 1.345(7) .
C1 C2 1.485(7) .
C2 C7 1.376(7) .
C2 C3 1.429(7) .
C3 C4 1.408(7) .
C4 C5 1.362(7) .
C4 H4 0.9300 .
C5 C6 1.389(8) .
C5 H5 0.9300 .
C6 C7 1.388(7) .
C7 H7 0.9300 .
C8 C9 1.380(9) .
C8 H8 0.9300 .
C9 C10 1.356(11) .
C9 H9 0.9300 .
C10 C11 1.411(11) .
C10 H10 0.9300 .
C11 C19 1.398(9) .
C11 C12 1.444(10) .
C12 C13 1.347(12) .
C12 H12 0.9300 .
C13 C14 1.419(12) .
C13 H13 0.9300 .
C14 C18 1.400(9) .
C14 C15 1.434(11) .
C15 C16 1.347(12) .
C15 H15 0.9300 .
C16 C17 1.386(10) .
C16 H16 0.9300 .
C17 H17 0.9300 .
C18 C19 1.442(9) .
C20 C21 1.487(7) .
C21 C26 1.388(7) .
C21 C22 1.428(7) .
C22 C23 1.422(7) .
C23 C24 1.361(7) .
C23 H23 0.9300 .
C24 C25 1.402(7) .
C24 H24 0.9300 .
C25 C26 1.378(7) .
C26 H26 0.9300 .
C27 C28 1.388(11) .
C27 H27 0.9300 .
C28 C29 1.345(13) .
C28 H28 0.9300 .
C29 C30 1.427(13) .
C29 H29 0.9300 .
C30 C31 1.384(14) .
C30 C38 1.419(9) .
C31 C32 1.342(14) .
C31 H31 0.9300 .
C32 C33 1.432(14) .
C32 H32 0.9300 .
C33 C37 1.396(9) .
C33 C34 1.438(13) .
C34 C35 1.323(13) .
C34 H34 0.9300 .
C35 C36 1.360(11) .
C35 H35 0.9300 .
C36 H36 0.9300 .
C37 C38 1.449(9) .
C39 C40 1.400(10) .
C39 H39 0.9300 .
C40 C41 1.356(11) .
C40 H40 0.9300 .
C41 C42 1.395(9) .
C41 H41 0.9300 .
C42 C50 1.403(8) .
C42 C43 1.445(9) .
C43 C44 1.348(11) .
C43 H43 0.9300 .
C44 C45 1.434(9) .
C44 H44 0.9300 .
C45 C46 1.394(9) .
C45 C49 1.411(8) .
C46 C47 1.350(10) .
C46 H46 0.9300 .
C47 C48 1.412(9) .
C47 H47 0.9300 .
C48 H48 0.9300 .
C49 C50 1.445(8) .
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
O3 Pb1 O1 C1 -48.1(4) . .
N1 Pb1 O1 C1 -132.1(4) . .
N2 Pb1 O1 C1 166.7(4) . .
O9 Pb1 O1 C1 94.4(4) . .
O5 Pb1 O1 C1 -41.7(5) 4_565 .
O3 Pb1 O1 Pb2 -164.07(18) . .
N1 Pb1 O1 Pb2 111.99(18) . .
N2 Pb1 O1 Pb2 50.79(18) . .
O9 Pb1 O1 Pb2 -21.58(15) . .
O5 Pb1 O1 Pb2 -157.7(2) 4_565 .
O9 Pb2 O1 C1 -106.0(3) . .
O7 Pb2 O1 C1 -70.8(4) . .
N4 Pb2 O1 C1 -173.0(3) . .
N3 Pb2 O1 C1 137.6(3) . .
O2 Pb2 O1 C1 -1.9(3) . .
O11 Pb2 O1 C1 73.6(3) 4_566 .
O10 Pb2 O1 C1 26.8(4) 4_566 .
O9 Pb2 O1 Pb1 24.64(17) . .
O7 Pb2 O1 Pb1 59.8(3) . .
N4 Pb2 O1 Pb1 -42.4(2) . .
N3 Pb2 O1 Pb1 -91.79(18) . .
O2 Pb2 O1 Pb1 128.7(2) . .
O11 Pb2 O1 Pb1 -155.79(14) 4_566 .
O10 Pb2 O1 Pb1 157.36(14) 4_566 .
O9 Pb2 O2 C1 68.6(3) . .
O7 Pb2 O2 C1 139.7(3) . .
O1 Pb2 O2 C1 2.1(3) . .
N4 Pb2 O2 C1 29.7(7) . .
N3 Pb2 O2 C1 -40.8(4) . .
O11 Pb2 O2 C1 -109.4(3) 4_566 .
O10 Pb2 O2 C1 -156.6(3) 4_566 .
O1 Pb1 O3 C3 9.2(4) . .
N1 Pb1 O3 C3 89.8(4) . .
N2 Pb1 O3 C3 94.6(5) . .
O9 Pb1 O3 C3 -36.0(5) . .
O5 Pb1 O3 C3 -167.5(5) 4_565 .
O6 S1 O5 Pb3 29.9(6) . 4_666
O4 S1 O5 Pb3 157.4(4) . 4_666
C6 S1 O5 Pb3 -86.2(5) . 4_666
O9 Pb2 O7 C20 38.2(5) . .
O1 Pb2 O7 C20 3.5(7) . .
N4 Pb2 O7 C20 119.6(6) . .
N3 Pb2 O7 C20 137.2(5) . .
O2 Pb2 O7 C20 -43.6(6) . .
O11 Pb2 O7 C20 -140.0(5) 4_566 .
O10 Pb2 O7 C20 -121.4(6) 4_566 .
O9 Pb2 O7 Pb3 158.3(3) . .
O1 Pb2 O7 Pb3 123.6(2) . .
N4 Pb2 O7 Pb3 -120.3(3) . .
N3 Pb2 O7 Pb3 -102.8(3) . .
O2 Pb2 O7 Pb3 76.5(3) . .
O11 Pb2 O7 Pb3 -19.9(3) 4_566 .
O10 Pb2 O7 Pb3 -1.3(2) 4_566 .
O8 Pb3 O7 C20 -1.2(3) . .
O5 Pb3 O7 C20 -86.4(4) 4_465 .
N6 Pb3 O7 C20 66.1(4) . .
N5 Pb3 O7 C20 -2.1(4) . .
O10 Pb3 O7 C20 140.0(4) 4_566 .
O3 Pb3 O7 C20 -155.3(3) 1_455 .
O5 Pb3 O7 C20 144.5(3) 4_466 .
O8 Pb3 O7 Pb2 -139.7(4) . .
O5 Pb3 O7 Pb2 135.1(3) 4_465 .
N6 Pb3 O7 Pb2 -72.4(3) . .
N5 Pb3 O7 Pb2 -140.7(2) . .
O10 Pb3 O7 Pb2 1.5(2) 4_566 .
O3 Pb3 O7 Pb2 66.2(4) 1_455 .
O5 Pb3 O7 Pb2 6.0(3) 4_466 .
O5 Pb3 O8 C20 99.9(4) 4_465 .
N6 Pb3 O8 C20 -115.5(4) . .
N5 Pb3 O8 C20 -179.7(4) . .
O7 Pb3 O8 C20 1.2(3) . .
O10 Pb3 O8 C20 -36.0(4) 4_566 .
O3 Pb3 O8 C20 148.6(3) 1_455 .
O5 Pb3 O8 C20 -91.3(4) 4_466 .
O7 Pb2 O9 C22 -15.7(5) . .
O1 Pb2 O9 C22 139.6(5) . .
N4 Pb2 O9 C22 -98.5(5) . .
N3 Pb2 O9 C22 -154.0(5) . .
O2 Pb2 O9 C22 92.7(5) . .
O11 Pb2 O9 C22 132(2) 4_566 .
O10 Pb2 O9 C22 10.8(6) 4_566 .
O7 Pb2 O9 Pb1 -174.7(2) . .
O1 Pb2 O9 Pb1 -19.40(13) . .
N4 Pb2 O9 Pb1 102.53(17) . .
N3 Pb2 O9 Pb1 46.95(19) . .
O2 Pb2 O9 Pb1 -66.27(14) . .
O11 Pb2 O9 Pb1 -27(2) 4_566 .
O10 Pb2 O9 Pb1 -148.23(14) 4_566 .
O1 Pb1 O9 C22 -140.4(4) . .
O3 Pb1 O9 C22 -93.0(4) . .
N1 Pb1 O9 C22 161.2(4) . .
N2 Pb1 O9 C22 113.0(4) . .
O5 Pb1 O9 C22 11.5(5) 4_565 .
O1 Pb1 O9 Pb2 21.85(15) . .
O3 Pb1 O9 Pb2 69.25(19) . .
N1 Pb1 O9 Pb2 -36.6(2) . .
N2 Pb1 O9 Pb2 -84.81(17) . .
O5 Pb1 O9 Pb2 173.71(14) 4_565 .
O12 S2 O10 Pb3 5.3(6) . 4_565
O11 S2 O10 Pb3 134.0(5) . 4_565
C25 S2 O10 Pb3 -111.2(5) . 4_565
O1 Pb1 N1 C8 69.6(5) . .
O3 Pb1 N1 C8 -6.0(5) . .
N2 Pb1 N1 C8 177.1(5) . .
O9 Pb1 N1 C8 123.3(5) . .
O5 Pb1 N1 C8 -79.3(5) 4_565 .
O1 Pb1 N1 C19 -110.9(4) . .
O3 Pb1 N1 C19 173.6(4) . .
N2 Pb1 N1 C19 -3.4(4) . .
O9 Pb1 N1 C19 -57.2(5) . .
O5 Pb1 N1 C19 100.3(4) 4_565 .
O1 Pb1 N2 C17 -111.4(5) . .
O3 Pb1 N2 C17 171.3(4) . .
N1 Pb1 N2 C17 176.6(5) . .
O9 Pb1 N2 C17 -46.8(5) . .
O5 Pb1 N2 C17 83.3(5) 4_565 .
O1 Pb1 N2 C18 77.3(4) . .
O3 Pb1 N2 C18 0.1(6) . .
N1 Pb1 N2 C18 5.4(4) . .
O9 Pb1 N2 C18 141.9(4) . .
O5 Pb1 N2 C18 -88.0(4) 4_565 .
O9 Pb2 N3 C27 -117.1(5) . .
O7 Pb2 N3 C27 157.4(5) . .
O1 Pb2 N3 C27 -53.7(5) . .
N4 Pb2 N3 C27 177.0(6) . .
O2 Pb2 N3 C27 -21.8(6) . .
O11 Pb2 N3 C27 59.6(5) 4_566 .
O10 Pb2 N3 C27 74.8(6) 4_566 .
O9 Pb2 N3 C38 78.0(5) . .
O7 Pb2 N3 C38 -7.5(6) . .
O1 Pb2 N3 C38 141.4(5) . .
N4 Pb2 N3 C38 12.1(4) . .
O2 Pb2 N3 C38 173.3(4) . .
O11 Pb2 N3 C38 -105.3(5) 4_566 .
O10 Pb2 N3 C38 -90.1(5) 4_566 .
O9 Pb2 N4 C36 59.7(5) . .
O7 Pb2 N4 C36 -14.5(5) . .
O1 Pb2 N4 C36 122.1(5) . .
N3 Pb2 N4 C36 178.1(5) . .
O2 Pb2 N4 C36 99.5(7) . .
O11 Pb2 N4 C36 -122.8(5) 4_566 .
O10 Pb2 N4 C36 -73.8(5) 4_566 .
O9 Pb2 N4 C37 -129.9(5) . .
O7 Pb2 N4 C37 156.0(5) . .
O1 Pb2 N4 C37 -67.4(5) . .
N3 Pb2 N4 C37 -11.5(4) . .
O2 Pb2 N4 C37 -90.1(6) . .
O11 Pb2 N4 C37 47.6(5) 4_566 .
O10 Pb2 N4 C37 96.6(5) 4_566 .
O8 Pb3 N5 C39 -82.1(5) . .
O5 Pb3 N5 C39 12.6(5) 4_465 .
N6 Pb3 N5 C39 -176.4(6) . .
O7 Pb3 N5 C39 -81.3(5) . .
O10 Pb3 N5 C39 -169.4(4) 4_566 .
O3 Pb3 N5 C39 85.3(5) 1_455 .
O5 Pb3 N5 C39 126.7(5) 4_466 .
O8 Pb3 N5 C50 89.0(4) . .
O5 Pb3 N5 C50 -176.3(4) 4_465 .
N6 Pb3 N5 C50 -5.3(4) . .
O7 Pb3 N5 C50 89.8(4) . .
O10 Pb3 N5 C50 1.7(6) 4_566 .
O3 Pb3 N5 C50 -103.6(4) 1_455 .
O5 Pb3 N5 C50 -62.3(4) 4_466 .
O8 Pb3 N6 C48 113.0(5) . .
O5 Pb3 N6 C48 -163.8(4) 4_465 .
N5 Pb3 N6 C48 -179.2(5) . .
O7 Pb3 N6 C48 68.2(5) . .
O10 Pb3 N6 C48 4.8(5) 4_566 .
O3 Pb3 N6 C48 -91.7(5) 1_455 .
O5 Pb3 N6 C48 -55.7(5) 4_466 .
O8 Pb3 N6 C49 -64.1(4) . .
O5 Pb3 N6 C49 19.1(5) 4_465 .
N5 Pb3 N6 C49 3.7(4) . .
O7 Pb3 N6 C49 -108.9(4) . .
O10 Pb3 N6 C49 -172.3(4) 4_566 .
O3 Pb3 N6 C49 91.2(4) 1_455 .
O5 Pb3 N6 C49 127.2(4) 4_466 .
Pb2 O2 C1 O1 -3.6(5) . .
Pb2 O2 C1 C2 172.5(4) . .
Pb1 O1 C1 O2 -118.3(5) . .
Pb2 O1 C1 O2 3.9(6) . .
Pb1 O1 C1 C2 65.5(5) . .
Pb2 O1 C1 C2 -172.3(4) . .
O2 C1 C2 C7 -24.8(8) . .
O1 C1 C2 C7 151.5(5) . .
O2 C1 C2 C3 155.9(5) . .
O1 C1 C2 C3 -27.8(7) . .
Pb1 O3 C3 C4 -169.8(4) . .
Pb1 O3 C3 C2 14.7(8) . .
C7 C2 C3 O3 167.4(5) . .
C1 C2 C3 O3 -13.2(8) . .
C7 C2 C3 C4 -8.2(7) . .
C1 C2 C3 C4 171.1(5) . .
O3 C3 C4 C5 -168.5(5) . .
C2 C3 C4 C5 7.4(8) . .
C3 C4 C5 C6 -1.5(9) . .
C4 C5 C6 C7 -3.6(8) . .
C4 C5 C6 S1 175.6(4) . .
O6 S1 C6 C7 147.6(5) . .
O4 S1 C6 C7 24.6(5) . .
O5 S1 C6 C7 -92.0(5) . .
O6 S1 C6 C5 -31.6(6) . .
O4 S1 C6 C5 -154.6(5) . .
O5 S1 C6 C5 88.8(5) . .
C3 C2 C7 C6 3.5(8) . .
C1 C2 C7 C6 -175.8(5) . .
C5 C6 C7 C2 2.5(8) . .
S1 C6 C7 C2 -176.7(4) . .
C19 N1 C8 C9 3.5(10) . .
Pb1 N1 C8 C9 -176.9(6) . .
N1 C8 C9 C10 -4.9(12) . .
C8 C9 C10 C11 2.6(12) . .
C9 C10 C11 C19 0.8(11) . .
C9 C10 C11 C12 -178.5(7) . .
C19 C11 C12 C13 1.8(11) . .
C10 C11 C12 C13 -178.9(8) . .
C11 C12 C13 C14 -0.2(12) . .
C12 C13 C14 C18 0.6(11) . .
C12 C13 C14 C15 179.8(8) . .
C18 C14 C15 C16 1.1(11) . .
C13 C14 C15 C16 -178.1(8) . .
C14 C15 C16 C17 0.5(12) . .
C18 N2 C17 C16 -0.2(10) . .
Pb1 N2 C17 C16 -171.5(5) . .
C15 C16 C17 N2 -1.0(11) . .
C17 N2 C18 C14 2.0(9) . .
Pb1 N2 C18 C14 173.7(5) . .
C17 N2 C18 C19 -178.6(6) . .
Pb1 N2 C18 C19 -6.9(7) . .
C13 C14 C18 N2 176.8(6) . .
C15 C14 C18 N2 -2.4(10) . .
C13 C14 C18 C19 -2.5(10) . .
C15 C14 C18 C19 178.2(6) . .
C8 N1 C19 C11 0.0(9) . .
Pb1 N1 C19 C11 -179.5(4) . .
C8 N1 C19 C18 -179.0(6) . .
Pb1 N1 C19 C18 1.4(7) . .
C10 C11 C19 N1 -2.1(10) . .
C12 C11 C19 N1 177.2(6) . .
C10 C11 C19 C18 177.0(6) . .
C12 C11 C19 C18 -3.7(9) . .
N2 C18 C19 N1 3.9(9) . .
C14 C18 C19 N1 -176.8(6) . .
N2 C18 C19 C11 -175.3(6) . .
C14 C18 C19 C11 4.1(9) . .
Pb3 O8 C20 O7 -2.3(6) . .
Pb3 O8 C20 C21 179.2(4) . .
Pb2 O7 C20 O8 135.5(5) . .
Pb3 O7 C20 O8 2.0(6) . .
Pb2 O7 C20 C21 -46.0(8) . .
Pb3 O7 C20 C21 -179.5(5) . .
O8 C20 C21 C26 15.9(8) . .
O7 C20 C21 C26 -162.6(5) . .
O8 C20 C21 C22 -164.4(5) . .
O7 C20 C21 C22 17.1(9) . .
Pb2 O9 C22 C23 -176.8(4) . .
Pb1 O9 C22 C23 -21.1(7) . .
Pb2 O9 C22 C21 2.3(8) . .
Pb1 O9 C22 C21 158.0(4) . .
C26 C21 C22 O9 -175.2(5) . .
C20 C21 C22 O9 5.2(9) . .
C26 C21 C22 C23 4.0(8) . .
C20 C21 C22 C23 -175.7(5) . .
O9 C22 C23 C24 175.6(5) . .
C21 C22 C23 C24 -3.6(8) . .
C22 C23 C24 C25 0.6(9) . .
C23 C24 C25 C26 2.1(8) . .
C23 C24 C25 S2 179.8(5) . .
O12 S2 C25 C26 -12.7(6) . .
O11 S2 C25 C26 -134.9(5) . .
O10 S2 C25 C26 108.5(5) . .
O12 S2 C25 C24 169.5(5) . .
O11 S2 C25 C24 47.4(5) . .
O10 S2 C25 C24 -69.3(5) . .
C24 C25 C26 C21 -1.6(8) . .
S2 C25 C26 C21 -179.4(4) . .
C22 C21 C26 C25 -1.5(8) . .
C20 C21 C26 C25 178.2(5) . .
C38 N3 C27 C28 -1.9(11) . .
Pb2 N3 C27 C28 -166.9(6) . .
N3 C27 C28 C29 -0.9(13) . .
C27 C28 C29 C30 1.9(14) . .
C28 C29 C30 C31 178.4(9) . .
C28 C29 C30 C38 -0.1(12) . .
C38 C30 C31 C32 -0.5(14) . .
C29 C30 C31 C32 -178.9(9) . .
C30 C31 C32 C33 0.0(16) . .
C31 C32 C33 C37 0.7(13) . .
C31 C32 C33 C34 -178.6(9) . .
C37 C33 C34 C35 -0.3(11) . .
C32 C33 C34 C35 178.9(8) . .
C33 C34 C35 C36 2.0(13) . .
C37 N4 C36 C35 0.9(11) . .
Pb2 N4 C36 C35 171.6(6) . .
C34 C35 C36 N4 -2.4(13) . .
C36 N4 C37 C33 0.9(10) . .
Pb2 N4 C37 C33 -169.9(5) . .
C36 N4 C37 C38 -178.8(6) . .
Pb2 N4 C37 C38 10.4(7) . .
C32 C33 C37 N4 179.6(7) . .
C34 C33 C37 N4 -1.1(10) . .
C32 C33 C37 C38 -0.8(10) . .
C34 C33 C37 C38 178.5(6) . .
C27 N3 C38 C30 3.8(10) . .
Pb2 N3 C38 C30 169.4(5) . .
C27 N3 C38 C37 -178.0(6) . .
Pb2 N3 C38 C37 -12.4(7) . .
C31 C30 C38 N3 178.6(7) . .
C29 C30 C38 N3 -2.9(10) . .
C31 C30 C38 C37 0.4(10) . .
C29 C30 C38 C37 178.9(7) . .
N4 C37 C38 N3 1.6(9) . .
C33 C37 C38 N3 -178.0(6) . .
N4 C37 C38 C30 179.9(6) . .
C33 C37 C38 C30 0.3(9) . .
C50 N5 C39 C40 -2.8(10) . .
Pb3 N5 C39 C40 168.4(6) . .
N5 C39 C40 C41 5.4(13) . .
C39 C40 C41 C42 -3.9(13) . .
C40 C41 C42 C50 0.3(11) . .
C40 C41 C42 C43 179.8(8) . .
C41 C42 C43 C44 177.6(7) . .
C50 C42 C43 C44 -2.9(11) . .
C42 C43 C44 C45 1.3(12) . .
C43 C44 C45 C46 179.9(7) . .
C43 C44 C45 C49 -0.7(10) . .
C49 C45 C46 C47 -0.8(10) . .
C44 C45 C46 C47 178.6(7) . .
C45 C46 C47 C48 -1.7(11) . .
C49 N6 C48 C47 -2.6(10) . .
Pb3 N6 C48 C47 -179.7(5) . .
C46 C47 C48 N6 3.6(11) . .
C48 N6 C49 C45 -0.1(9) . .
Pb3 N6 C49 C45 177.1(4) . .
C48 N6 C49 C50 -179.3(6) . .
Pb3 N6 C49 C50 -2.1(7) . .
C46 C45 C49 N6 1.8(9) . .
C44 C45 C49 N6 -177.6(6) . .
C46 C45 C49 C50 -179.0(6) . .
C44 C45 C49 C50 1.6(9) . .
C39 N5 C50 C42 -1.1(9) . .
Pb3 N5 C50 C42 -172.5(5) . .
C39 N5 C50 C49 178.0(6) . .
Pb3 N5 C50 C49 6.6(7) . .
C41 C42 C50 N5 2.3(10) . .
C43 C42 C50 N5 -177.2(6) . .
C41 C42 C50 C49 -176.7(6) . .
C43 C42 C50 C49 3.8(9) . .
N6 C49 C50 N5 -3.0(8) . .
C45 C49 C50 N5 177.8(5) . .
N6 C49 C50 C42 176.1(5) . .
C45 C49 C50 C42 -3.1(9) . .
