#------------------------------------------------------------------------------
#$Date: 2016-02-20 22:30:07 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176789 $
#$URL: svn://www.crystallography.net/cod/cif/2/22/45/2224561.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# 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_2224561
loop_
_publ_author_name
'Wei, Lian-Qiang'
'Zeng, Ming-Hua'
'Ng, Seik Weng'
_publ_section_title
μ-Adipato-κ²O¹:O⁴-bis{[2,6-bis(1H-benzimidazol-2-yl-κN³)pyridine-κN](nitrato-κO)lead(II)}
_journal_coeditor_code           BT5131
_journal_issue                   1
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m56
_journal_paper_doi               10.1107/S1600536809052647
_journal_volume                  66
_journal_year                    2010
_chemical_formula_iupac          '[Pb2 (C6 H8 O4) (N O3)2 (C19 H13 N5)2]'
_chemical_formula_moiety         'C44 H34 N12 O10 Pb2'
_chemical_formula_sum            'C44 H34 N12 O10 Pb2'
_chemical_formula_weight         1305.21
_chemical_name_systematic
;μ-Adipato-κ²O¹:O⁴-bis{[2,6-bis(1H-benzimidazol-2-
yl-κN³)pyridine-κN](nitrato-κO)lead(II)}
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                106.6960(10)
_cell_angle_beta                 95.3430(10)
_cell_angle_gamma                99.1170(10)
_cell_formula_units_Z            1
_cell_length_a                   9.3470(7)
_cell_length_b                   10.6433(8)
_cell_length_c                   11.3776(8)
_cell_measurement_reflns_used    3150
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      24.8
_cell_measurement_theta_min      2.2
_cell_volume                     1058.90(14)
_computing_cell_refinement       'SAINT (Bruker, 2004)'
_computing_data_collection       'APEX2 (Bruker, 2004)'
_computing_data_reduction        'SAINT (Bruker, 2004)'
_computing_molecular_graphics    'X-SEED (Barbour, 2001)'
_computing_publication_material  'publCIF (Westrip, 2009)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.976
_diffrn_measured_fraction_theta_max 0.976
_diffrn_measurement_device_type  'Bruker APEXII diffractometer'
_diffrn_measurement_method       'φ and ω scans'
_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  0.0362
_diffrn_reflns_av_sigmaI/netI    0.0694
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            8299
_diffrn_reflns_theta_full        27.09
_diffrn_reflns_theta_max         27.09
_diffrn_reflns_theta_min         1.89
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    8.017
_exptl_absorpt_correction_T_max  0.5664
_exptl_absorpt_correction_T_min  0.2297
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 1996)'
_exptl_crystal_colour            Brown
_exptl_crystal_density_diffrn    2.047
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             626
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.08
_refine_diff_density_max         1.933
_refine_diff_density_min         -1.173
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.017
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     307
_refine_ls_number_reflns         4561
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.017
_refine_ls_R_factor_all          0.0623
_refine_ls_R_factor_gt           0.0410
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0524P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0895
_refine_ls_wR_factor_ref         0.0986
_reflns_number_gt                3586
_reflns_number_total             4561
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            bt5131.cif
_cod_data_source_block           I
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-scan' changed
to 'multi-scan' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-scan'
changed to 'multi-scan' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        1058.90(10)
_cod_database_code               2224561
_cod_database_fobs_code          2224561
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pb Pb1 1.07669(3) 0.71714(3) 0.65491(3) 0.02682(11) Uani d . 1 . .
O O1 0.8637(6) 0.6980(5) 0.5092(5) 0.0341(13) Uani d . 1 . .
O O2 0.8304(6) 0.4985(5) 0.5330(5) 0.0381(13) Uani d . 1 . .
O O3 1.2560(7) 0.8902(7) 0.8623(6) 0.0579(18) Uani d . 1 . .
O O4 1.3952(11) 0.7543(10) 0.8022(10) 0.126(5) Uani d . 1 . .
O O5 1.4055(12) 0.8554(14) 0.9916(9) 0.141(5) Uani d . 1 . .
N N1 1.1854(7) 0.8782(6) 0.5449(5) 0.0286(14) Uani d . 1 . .
N N2 1.2263(6) 1.0797(6) 0.5237(5) 0.0274(14) Uani d . 1 . .
H H2 1.2215 1.1621 0.5343 0.033 Uiso calc R 1 . .
N N3 1.0091(7) 0.9473(6) 0.7236(5) 0.0251(13) Uani d . 1 . .
N N4 0.8962(7) 0.7470(6) 0.8149(6) 0.0329(15) Uani d . 1 . .
N N5 0.7760(7) 0.8747(6) 0.9451(6) 0.0352(16) Uani d . 1 . .
H H5 0.7435 0.9440 0.9839 0.042 Uiso calc R 1 . .
N N6 1.3504(9) 0.8307(8) 0.8859(7) 0.052(2) Uani d . 1 . .
C C1 1.2754(8) 0.8763(7) 0.4564(7) 0.0262(16) Uani d . 1 . .
C C2 1.3328(9) 0.7741(8) 0.3826(7) 0.0324(18) Uani d . 1 . .
H H2A 1.3132 0.6882 0.3893 0.039 Uiso calc R 1 . .
C C3 1.4197(9) 0.8036(8) 0.2989(7) 0.0349(19) Uani d . 1 . .
H H3 1.4600 0.7366 0.2490 0.042 Uiso calc R 1 . .
C C4 1.4490(9) 0.9331(9) 0.2873(7) 0.0369(19) Uani d . 1 . .
H H4 1.5085 0.9499 0.2303 0.044 Uiso calc R 1 . .
C C5 1.3918(8) 1.0343(8) 0.3581(7) 0.0350(19) Uani d . 1 . .
H H5A 1.4106 1.1200 0.3508 0.042 Uiso calc R 1 . .
C C6 1.3046(8) 1.0032(7) 0.4412(7) 0.0278(16) Uani d . 1 . .
C C7 1.1608(8) 1.0009(7) 0.5828(6) 0.0258(16) Uani d . 1 . .
C C8 1.0701(7) 1.0443(7) 0.6764(6) 0.0208(14) Uani d . 1 . .
C C9 1.0481(8) 1.1737(7) 0.7213(8) 0.0344(18) Uani d . 1 . .
H H9 1.0887 1.2392 0.6882 0.041 Uiso calc R 1 . .
C C10 0.9640(9) 1.2052(8) 0.8172(7) 0.038(2) Uani d . 1 . .
H H10 0.9509 1.2926 0.8495 0.045 Uiso calc R 1 . .
C C11 0.9004(9) 1.1077(8) 0.8642(7) 0.0340(18) Uani d . 1 . .
H H11 0.8428 1.1276 0.9269 0.041 Uiso calc R 1 . .
C C12 0.9248(8) 0.9783(7) 0.8148(7) 0.0263(16) Uani d . 1 . .
C C13 0.8642(8) 0.8677(8) 0.8563(7) 0.0299(17) Uani d . 1 . .
C C14 0.7477(9) 0.7502(8) 0.9616(8) 0.0345(18) Uani d . 1 . .
C C15 0.6696(9) 0.7026(9) 1.0431(8) 0.041(2) Uani d . 1 . .
H H15 0.6169 0.7550 1.0960 0.049 Uiso calc R 1 . .
C C16 0.6744(9) 0.5751(10) 1.0410(8) 0.046(2) Uani d . 1 . .
H H16 0.6258 0.5401 1.0958 0.056 Uiso calc R 1 . .
C C17 0.7503(11) 0.4942(10) 0.9588(9) 0.056(3) Uani d . 1 . .
H H17 0.7483 0.4066 0.9590 0.067 Uiso calc R 1 . .
C C18 0.8266(11) 0.5409(9) 0.8793(9) 0.050(2) Uani d . 1 . .
H H18 0.8782 0.4876 0.8261 0.060 Uiso calc R 1 . .
C C19 0.8245(9) 0.6720(8) 0.8805(7) 0.0333(18) Uani d . 1 . .
C C20 0.7885(8) 0.5807(7) 0.4878(7) 0.0264(16) Uani d . 1 . .
C C21 0.6450(8) 0.5467(8) 0.4015(8) 0.039(2) Uani d . 1 . .
H H21A 0.6606 0.4989 0.3187 0.047 Uiso calc R 1 . .
H H21B 0.6159 0.6292 0.3982 0.047 Uiso calc R 1 . .
C C22 0.5208(9) 0.4628(8) 0.4384(7) 0.038(2) Uani d . 1 . .
H H22A 0.5500 0.3811 0.4443 0.045 Uiso calc R 1 . .
H H22B 0.4361 0.4383 0.3746 0.045 Uiso calc R 1 . .
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'
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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
O1 Pb1 N1 . . 81.15(19) ?
O1 Pb1 N3 . . 76.12(18) ?
N1 Pb1 N3 . . 65.32(19) ?
O1 Pb1 N4 . . 83.9(2) ?
N1 Pb1 N4 . . 129.70(19) ?
N3 Pb1 N4 . . 64.51(19) ?
O1 Pb1 O3 . . 142.75(18) ?
N1 Pb1 O3 . . 84.8(2) ?
N3 Pb1 O3 . . 66.66(19) ?
N4 Pb1 O3 . . 78.9(2) ?
O1 Pb1 O2 . . 47.51(16) ?
N1 Pb1 O2 . . 121.65(18) ?
N3 Pb1 O2 . . 114.54(17) ?
N4 Pb1 O2 . . 77.49(18) ?
O3 Pb1 O2 . . 152.3(2) ?
O1 Pb1 O2 . 2_766 89.14(17) ?
N1 Pb1 O2 . 2_766 87.79(17) ?
N3 Pb1 O2 . 2_766 150.76(17) ?
N4 Pb1 O2 . 2_766 139.77(18) ?
O3 Pb1 O2 . 2_766 124.72(17) ?
O2 Pb1 O2 . 2_766 68.94(18) ?
O1 Pb1 O4 . . 167.8(3) ?
N1 Pb1 O4 . . 88.3(3) ?
N3 Pb1 O4 . . 105.0(2) ?
N4 Pb1 O4 . . 107.6(2) ?
O3 Pb1 O4 . . 40.80(19) ?
O2 Pb1 O4 . . 137.4(2) ?
O2 Pb1 O4 2_766 . 84.36(19) ?
C20 O1 Pb1 . . 106.6(5) ?
C20 O2 Pb1 . . 83.5(4) ?
N6 O3 Pb1 . . 105.7(5) ?
N6 O4 Pb1 . . 84.3(6) ?
C7 N1 C1 . . 106.2(6) ?
C7 N1 Pb1 . . 116.8(4) ?
C1 N1 Pb1 . . 136.9(5) ?
C7 N2 C6 . . 107.1(6) ?
C7 N2 H2 . . 126.5 ?
C6 N2 H2 . . 126.5 ?
C12 N3 C8 . . 119.6(6) ?
C12 N3 Pb1 . . 120.8(5) ?
C8 N3 Pb1 . . 119.3(4) ?
C13 N4 C19 . . 105.6(6) ?
C13 N4 Pb1 . . 116.7(5) ?
C19 N4 Pb1 . . 137.6(5) ?
C13 N5 C14 . . 107.4(6) ?
C13 N5 H5 . . 126.3 ?
C14 N5 H5 . . 126.3 ?
O5 N6 O4 . . 120.5(10) ?
O5 N6 O3 . . 119.2(9) ?
O4 N6 O3 . . 120.1(9) ?
N1 C1 C2 . . 131.7(7) ?
N1 C1 C6 . . 109.1(6) ?
C2 C1 C6 . . 119.2(7) ?
C3 C2 C1 . . 118.0(8) ?
C3 C2 H2A . . 121.0 ?
C1 C2 H2A . . 121.0 ?
C2 C3 C4 . . 121.4(7) ?
C2 C3 H3 . . 119.3 ?
C4 C3 H3 . . 119.3 ?
C5 C4 C3 . . 121.3(7) ?
C5 C4 H4 . . 119.3 ?
C3 C4 H4 . . 119.3 ?
C4 C5 C6 . . 116.6(7) ?
C4 C5 H5A . . 121.7 ?
C6 C5 H5A . . 121.7 ?
C5 C6 C1 . . 123.5(7) ?
C5 C6 N2 . . 131.7(7) ?
C1 C6 N2 . . 104.8(6) ?
N1 C7 N2 . . 112.8(6) ?
N1 C7 C8 . . 123.6(7) ?
N2 C7 C8 . . 123.6(7) ?
N3 C8 C9 . . 120.6(6) ?
N3 C8 C7 . . 114.8(6) ?
C9 C8 C7 . . 124.5(7) ?
C8 C9 C10 . . 119.2(7) ?
C8 C9 H9 . . 120.4 ?
C10 C9 H9 . . 120.4 ?
C11 C10 C9 . . 120.6(7) ?
C11 C10 H10 . . 119.7 ?
C9 C10 H10 . . 119.7 ?
C10 C11 C12 . . 118.0(7) ?
C10 C11 H11 . . 121.0 ?
C12 C11 H11 . . 121.0 ?
N3 C12 C11 . . 121.9(7) ?
N3 C12 C13 . . 114.9(6) ?
C11 C12 C13 . . 123.2(7) ?
N4 C13 N5 . . 111.9(7) ?
N4 C13 C12 . . 122.8(7) ?
N5 C13 C12 . . 125.2(7) ?
N5 C14 C15 . . 131.9(8) ?
N5 C14 C19 . . 105.6(7) ?
C15 C14 C19 . . 122.4(8) ?
C16 C15 C14 . . 116.2(8) ?
C16 C15 H15 . . 121.9 ?
C14 C15 H15 . . 121.9 ?
C15 C16 C17 . . 122.1(8) ?
C15 C16 H16 . . 118.9 ?
C17 C16 H16 . . 118.9 ?
C18 C17 C16 . . 121.6(9) ?
C18 C17 H17 . . 119.2 ?
C16 C17 H17 . . 119.2 ?
C17 C18 C19 . . 117.3(9) ?
C17 C18 H18 . . 121.3 ?
C19 C18 H18 . . 121.3 ?
N4 C19 C14 . . 109.5(7) ?
N4 C19 C18 . . 130.0(7) ?
C14 C19 C18 . . 120.4(8) ?
O2 C20 O1 . . 122.3(7) ?
O2 C20 C21 . . 121.4(7) ?
O1 C20 C21 . . 116.4(7) ?
C20 C21 C22 . . 114.5(7) ?
C20 C21 H21A . . 108.6 ?
C22 C21 H21A . . 108.6 ?
C20 C21 H21B . . 108.6 ?
C22 C21 H21B . . 108.6 ?
H21A C21 H21B . . 107.6 ?
C21 C22 C22 . 2_666 111.7(8) ?
C21 C22 H22A . . 109.3 ?
C22 C22 H22A 2_666 . 109.3 ?
C21 C22 H22B . . 109.3 ?
C22 C22 H22B 2_666 . 109.3 ?
H22A C22 H22B . . 107.9 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Pb1 O1 . 2.411(5) ?
Pb1 N1 . 2.541(6) ?
Pb1 N3 . 2.548(6) ?
Pb1 N4 . 2.583(6) ?
Pb1 O3 . 2.749(6) ?
Pb1 O2 . 2.914(6) ?
Pb1 O2 2_766 2.958(5) ?
Pb1 O4 . 3.185(10) ?
O1 C20 . 1.275(9) ?
O2 C20 . 1.231(9) ?
O3 N6 . 1.217(9) ?
O4 N6 . 1.216(11) ?
O5 N6 . 1.200(11) ?
N1 C7 . 1.317(9) ?
N1 C1 . 1.369(9) ?
N2 C7 . 1.330(9) ?
N2 C6 . 1.399(9) ?
N2 H2 . 0.8600 ?
N3 C12 . 1.358(9) ?
N3 C8 . 1.367(9) ?
N4 C13 . 1.327(9) ?
N4 C19 . 1.382(10) ?
N5 C13 . 1.356(9) ?
N5 C14 . 1.379(10) ?
N5 H5 . 0.8600 ?
C1 C2 . 1.386(10) ?
C1 C6 . 1.399(10) ?
C2 C3 . 1.378(11) ?
C2 H2A . 0.9300 ?
C3 C4 . 1.408(11) ?
C3 H3 . 0.9300 ?
C4 C5 . 1.364(11) ?
C4 H4 . 0.9300 ?
C5 C6 . 1.380(11) ?
C5 H5A . 0.9300 ?
C7 C8 . 1.441(10) ?
C8 C9 . 1.381(10) ?
C9 C10 . 1.397(11) ?
C9 H9 . 0.9300 ?
C10 C11 . 1.378(11) ?
C10 H10 . 0.9300 ?
C11 C12 . 1.393(10) ?
C11 H11 . 0.9300 ?
C12 C13 . 1.445(11) ?
C14 C15 . 1.389(11) ?
C14 C19 . 1.389(11) ?
C15 C16 . 1.359(12) ?
C15 H15 . 0.9300 ?
C16 C17 . 1.405(13) ?
C16 H16 . 0.9300 ?
C17 C18 . 1.356(13) ?
C17 H17 . 0.9300 ?
C18 C19 . 1.394(12) ?
C18 H18 . 0.9300 ?
C20 C21 . 1.513(11) ?
C21 C22 . 1.516(11) ?
C21 H21A . 0.9700 ?
C21 H21B . 0.9700 ?
C22 C22 2_666 1.519(14) ?
C22 H22A . 0.9700 ?
C22 H22B . 0.9700 ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_publ_flag
N2 H2 O1 2_776 0.86 1.95 2.744(8) 152 y
N5 H5 O3 2_777 0.86 2.10 2.891(9) 153 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
N1 Pb1 O1 C20 . . . . 151.2(5) ?
N3 Pb1 O1 C20 . . . . -142.2(5) ?
N4 Pb1 O1 C20 . . . . -77.0(5) ?
O3 Pb1 O1 C20 . . . . -139.6(5) ?
O2 Pb1 O1 C20 . . . . 1.6(4) ?
O2 Pb1 O1 C20 2_766 . . . 63.3(5) ?
O4 Pb1 O1 C20 . . . . 120.9(10) ?
O1 Pb1 O2 C20 . . . . -1.6(4) ?
N1 Pb1 O2 C20 . . . . -37.5(5) ?
N3 Pb1 O2 C20 . . . . 37.6(5) ?
N4 Pb1 O2 C20 . . . . 91.7(4) ?
O3 Pb1 O2 C20 . . . . 123.7(5) ?
O2 Pb1 O2 C20 2_766 . . . -110.9(5) ?
O4 Pb1 O2 C20 . . . . -165.8(4) ?
O1 Pb1 O3 N6 . . . . -178.2(5) ?
N1 Pb1 O3 N6 . . . . -110.1(6) ?
N3 Pb1 O3 N6 . . . . -175.4(7) ?
N4 Pb1 O3 N6 . . . . 117.7(6) ?
O2 Pb1 O3 N6 . . . . 85.9(7) ?
O2 Pb1 O3 N6 2_766 . . . -26.4(7) ?
O4 Pb1 O3 N6 . . . . -16.7(6) ?
O1 Pb1 O4 N6 . . . . 130.1(9) ?
N1 Pb1 O4 N6 . . . . 100.2(8) ?
N3 Pb1 O4 N6 . . . . 36.4(8) ?
N4 Pb1 O4 N6 . . . . -31.1(8) ?
O3 Pb1 O4 N6 . . . . 16.2(6) ?
O2 Pb1 O4 N6 . . . . -121.7(7) ?
O2 Pb1 O4 N6 2_766 . . . -171.8(8) ?
O1 Pb1 N1 C7 . . . . 82.8(5) ?
N3 Pb1 N1 C7 . . . . 4.0(5) ?
N4 Pb1 N1 C7 . . . . 8.3(6) ?
O3 Pb1 N1 C7 . . . . -62.6(5) ?
O2 Pb1 N1 C7 . . . . 108.7(5) ?
O2 Pb1 N1 C7 2_766 . . . 172.2(5) ?
O4 Pb1 N1 C7 . . . . -103.4(5) ?
O1 Pb1 N1 C1 . . . . -102.3(7) ?
N3 Pb1 N1 C1 . . . . 179.0(8) ?
N4 Pb1 N1 C1 . . . . -176.8(6) ?
O3 Pb1 N1 C1 . . . . 112.3(7) ?
O2 Pb1 N1 C1 . . . . -76.3(7) ?
O2 Pb1 N1 C1 2_766 . . . -12.8(7) ?
O4 Pb1 N1 C1 . . . . 71.6(7) ?
O1 Pb1 N3 C12 . . . . 95.3(6) ?
N1 Pb1 N3 C12 . . . . -178.2(6) ?
N4 Pb1 N3 C12 . . . . 5.5(5) ?
O3 Pb1 N3 C12 . . . . -83.0(6) ?
O2 Pb1 N3 C12 . . . . 66.7(6) ?
O2 Pb1 N3 C12 2_766 . . . 157.1(5) ?
O4 Pb1 N3 C12 . . . . -97.2(6) ?
O1 Pb1 N3 C8 . . . . -91.0(5) ?
N1 Pb1 N3 C8 . . . . -4.5(5) ?
N4 Pb1 N3 C8 . . . . 179.2(5) ?
O3 Pb1 N3 C8 . . . . 90.7(5) ?
O2 Pb1 N3 C8 . . . . -119.6(5) ?
O2 Pb1 N3 C8 2_766 . . . -29.2(7) ?
O4 Pb1 N3 C8 . . . . 76.5(5) ?
O1 Pb1 N4 C13 . . . . -80.3(6) ?
N1 Pb1 N4 C13 . . . . -7.2(7) ?
N3 Pb1 N4 C13 . . . . -2.9(5) ?
O3 Pb1 N4 C13 . . . . 66.4(6) ?
O2 Pb1 N4 C13 . . . . -128.1(6) ?
O2 Pb1 N4 C13 2_766 . . . -161.8(5) ?
O4 Pb1 N4 C13 . . . . 95.7(6) ?
O1 Pb1 N4 C19 . . . . 104.9(8) ?
N1 Pb1 N4 C19 . . . . 178.1(7) ?
N3 Pb1 N4 C19 . . . . -177.6(9) ?
O3 Pb1 N4 C19 . . . . -108.3(8) ?
O2 Pb1 N4 C19 . . . . 57.2(8) ?
O2 Pb1 N4 C19 2_766 . . . 23.5(9) ?
O4 Pb1 N4 C19 . . . . -79.0(8) ?
Pb1 O4 N6 O5 . . . . 156.9(12) ?
Pb1 O4 N6 O3 . . . . -28.4(10) ?
Pb1 O3 N6 O5 . . . . -150.5(10) ?
Pb1 O3 N6 O4 . . . . 34.7(12) ?
C7 N1 C1 C2 . . . . -177.7(8) ?
Pb1 N1 C1 C2 . . . . 7.0(13) ?
C7 N1 C1 C6 . . . . -0.2(8) ?
Pb1 N1 C1 C6 . . . . -175.5(5) ?
N1 C1 C2 C3 . . . . 178.9(8) ?
C6 C1 C2 C3 . . . . 1.6(11) ?
C1 C2 C3 C4 . . . . -0.5(12) ?
C2 C3 C4 C5 . . . . -0.3(13) ?
C3 C4 C5 C6 . . . . 0.1(12) ?
C4 C5 C6 C1 . . . . 1.0(12) ?
C4 C5 C6 N2 . . . . -177.8(8) ?
N1 C1 C6 C5 . . . . -179.8(7) ?
C2 C1 C6 C5 . . . . -1.9(12) ?
N1 C1 C6 N2 . . . . -0.7(8) ?
C2 C1 C6 N2 . . . . 177.2(7) ?
C7 N2 C6 C5 . . . . -179.7(8) ?
C7 N2 C6 C1 . . . . 1.3(8) ?
C1 N1 C7 N2 . . . . 1.1(9) ?
Pb1 N1 C7 N2 . . . . 177.5(5) ?
C1 N1 C7 C8 . . . . 179.9(7) ?
Pb1 N1 C7 C8 . . . . -3.7(9) ?
C6 N2 C7 N1 . . . . -1.6(9) ?
C6 N2 C7 C8 . . . . 179.7(6) ?
C12 N3 C8 C9 . . . . 0.7(10) ?
Pb1 N3 C8 C9 . . . . -173.1(5) ?
C12 N3 C8 C7 . . . . 178.2(6) ?
Pb1 N3 C8 C7 . . . . 4.4(8) ?
N1 C7 C8 N3 . . . . -0.4(10) ?
N2 C7 C8 N3 . . . . 178.2(6) ?
N1 C7 C8 C9 . . . . 177.0(7) ?
N2 C7 C8 C9 . . . . -4.4(11) ?
N3 C8 C9 C10 . . . . 0.8(11) ?
C7 C8 C9 C10 . . . . -176.4(7) ?
C8 C9 C10 C11 . . . . -1.8(12) ?
C9 C10 C11 C12 . . . . 1.2(12) ?
C8 N3 C12 C11 . . . . -1.3(11) ?
Pb1 N3 C12 C11 . . . . 172.4(6) ?
C8 N3 C12 C13 . . . . 179.1(6) ?
Pb1 N3 C12 C13 . . . . -7.3(9) ?
C10 C11 C12 N3 . . . . 0.4(12) ?
C10 C11 C12 C13 . . . . 180.0(8) ?
C19 N4 C13 N5 . . . . 0.0(9) ?
Pb1 N4 C13 N5 . . . . -176.3(5) ?
C19 N4 C13 C12 . . . . 176.8(7) ?
Pb1 N4 C13 C12 . . . . 0.5(10) ?
C14 N5 C13 N4 . . . . -0.6(9) ?
C14 N5 C13 C12 . . . . -177.2(7) ?
N3 C12 C13 N4 . . . . 4.4(11) ?
C11 C12 C13 N4 . . . . -175.2(8) ?
N3 C12 C13 N5 . . . . -179.3(7) ?
C11 C12 C13 N5 . . . . 1.1(12) ?
C13 N5 C14 C15 . . . . 177.1(9) ?
C13 N5 C14 C19 . . . . 0.8(9) ?
N5 C14 C15 C16 . . . . -174.5(9) ?
C19 C14 C15 C16 . . . . 1.2(13) ?
C14 C15 C16 C17 . . . . -1.8(14) ?
C15 C16 C17 C18 . . . . 1.9(16) ?
C16 C17 C18 C19 . . . . -1.2(16) ?
C13 N4 C19 C14 . . . . 0.5(9) ?
Pb1 N4 C19 C14 . . . . 175.6(6) ?
C13 N4 C19 C18 . . . . -176.0(9) ?
Pb1 N4 C19 C18 . . . . -0.9(15) ?
N5 C14 C19 N4 . . . . -0.8(9) ?
C15 C14 C19 N4 . . . . -177.5(8) ?
N5 C14 C19 C18 . . . . 176.1(8) ?
C15 C14 C19 C18 . . . . -0.6(13) ?
C17 C18 C19 N4 . . . . 176.8(9) ?
C17 C18 C19 C14 . . . . 0.6(14) ?
Pb1 O2 C20 O1 . . . . 2.6(7) ?
Pb1 O2 C20 C21 . . . . -178.5(7) ?
Pb1 O1 C20 O2 . . . . -3.2(8) ?
Pb1 O1 C20 C21 . . . . 177.8(5) ?
O2 C20 C21 C22 . . . . 39.6(10) ?
O1 C20 C21 C22 . . . . -141.5(7) ?
C20 C21 C22 C22 . . . 2_666 64.3(12) ?
