#------------------------------------------------------------------------------
#$Date: 2020-10-06 13:13:42 +0300 (Tue, 06 Oct 2020) $
#$Revision: 257772 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/05/95/7059580.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_7059580
loop_
_publ_author_name
'Nisa, Zaib ul'
'Tashi, Lobzang'
'Sen, Charanjeet'
'Ashashi, Nargis Akhter'
'Sahoo, Subash Chandra'
'Sheikh, Haq Nawaz'
_publ_section_title
;
 Synthesis of eight isostructural 2D lanthanide coordination polymers
 assembled by rigid furan-2,5-dicarboxylic acid and flexible adipic acid
 as linkers and exploration of luminescent Eu/Tb polymers as efficient and
 sensitive sensors for nitroaromatic compounds
;
_journal_issue                   19
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              8125
_journal_page_last               8137
_journal_paper_doi               10.1039/D0NJ01018A
_journal_volume                  44
_journal_year                    2020
_chemical_formula_moiety         'C30 H20 N3 O9 Pb2'
_chemical_formula_sum            'C30 H20 N3 O9 Pb2'
_chemical_formula_weight         980.87
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_block_doi                 10.5517/ccdc.csd.cc236zz9
_audit_creation_date             2019-08-14
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2019-09-17 deposited with the CCDC.	2020-04-24 downloaded from the CCDC.
;
_cell_angle_alpha                93.919(2)
_cell_angle_beta                 94.862(2)
_cell_angle_gamma                98.199(2)
_cell_formula_units_Z            2
_cell_length_a                   10.3203(2)
_cell_length_b                   13.2585(3)
_cell_length_c                   13.5030(3)
_cell_measurement_reflns_used    9477
_cell_measurement_temperature    100.01(10)
_cell_measurement_theta_max      30.4230
_cell_measurement_theta_min      2.0520
_cell_volume                     1816.10(7)
_computing_cell_refinement       'CrysAlisPro 1.171.39.34b (Rigaku OD, 2017)'
_computing_data_collection       'CrysAlisPro 1.171.39.34b (Rigaku OD, 2017)'
_computing_data_reduction        'CrysAlisPro 1.171.39.34b (Rigaku OD, 2017)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      100.01(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_type            HyPix
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.828
_diffrn_measurement_details
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -54.00 -26.00   0.50   25.00    --   10.30 -65.00 -97.00   56
  2  ω     -8.00  31.00   0.50   25.00    --   10.30 -65.00 -97.00   78
  3  ω    -18.00  23.00   0.50   25.00    --   -9.20 -99.00-120.00   82
  4  ω    -20.00  18.00   0.50   25.00    --   -9.20 -99.00-180.00   76
  5  ω    -65.00  33.00   0.50   25.00    --   10.30 -37.00-180.00  196
  6  ω    -32.00  59.00   0.50   25.00    --   -9.20  57.00 -60.00  182
  7  ω    -14.00  85.00   0.50   25.00    --   10.30  65.00  37.00  198
  8  ω    -22.00  18.00   0.50   25.00    --   -9.20 -99.00  90.00   80
  9  ω     22.00  49.00   0.50   25.00    --   10.30 -99.00  90.00   54
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Synergy, Dualflex, HyPix'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0352911000
_diffrn_orient_matrix_UB_12      0.0251099000
_diffrn_orient_matrix_UB_13      0.0345356000
_diffrn_orient_matrix_UB_21      0.0199162000
_diffrn_orient_matrix_UB_22      0.0472193000
_diffrn_orient_matrix_UB_23      -0.0200180000
_diffrn_orient_matrix_UB_31      -0.0567812000
_diffrn_orient_matrix_UB_32      -0.0089907000
_diffrn_orient_matrix_UB_33      -0.0347053000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0334
_diffrn_reflns_av_unetI/netI     0.0417
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.828
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            25486
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.828
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         30.356
_diffrn_reflns_theta_min         2.003
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'PhotonJet (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    9.307
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.55039
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.39.34b (Rigaku Oxford Diffraction, 2017)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            'clear light colourless'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.794
_exptl_crystal_description       block
_exptl_crystal_F_000             914
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.15
_refine_diff_density_max         2.465
_refine_diff_density_min         -1.335
_refine_diff_density_rms         0.171
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.059
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     399
_refine_ls_number_reflns         9057
_refine_ls_number_restraints     36
_refine_ls_restrained_S_all      1.061
_refine_ls_R_factor_all          0.0416
_refine_ls_R_factor_gt           0.0300
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0353P)²+2.8508P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0711
_refine_ls_wR_factor_ref         0.0742
_reflns_Friedel_coverage         0.000
_reflns_number_gt                7350
_reflns_number_total             9057
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d0nj01018a2.cif
_cod_data_source_block           1
_cod_depositor_comments
;Adding full bibliography for 7059575--7059582.cif.

 Adding full bibliography for 7059575--7059582.cif.
;
_cod_database_code               7059580
_shelx_shelxl_version_number     2014/7
_chemical_oxdiff_formula         'C H O N Pb'
_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.
;
_shelx_estimated_absorpt_t_max   0.336
_shelx_estimated_absorpt_t_min   0.204
_reflns_odcompleteness_completeness 99.97
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Uiso/Uaniso restraints and constraints
Uanis(O9) \\sim Ueq, Uanis(C27) \\sim Ueq, Uanis(C28) \\sim Ueq, Uanis(N3)
\\sim Ueq, Uanis(C29) \\sim Ueq, Uanis(C30) \\sim Ueq: with sigma of 0.002 and
sigma for terminal atoms of 0.005
3.a Aromatic/amide H refined with riding coordinates:
 C7(H7), C5(H5), C3(H3), C13(H13), C12(H12), C11(H11), C10(H10), C20(H20),
 C18(H18), C16(H16), C26(H26), C25(H25), C24(H24), C23(H23)
3.b Idealised Me refined as rotating group:
 C29(H29A,H29B,H29C), C30(H30A,H30B,H30C)
;
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 2.134
_oxdiff_exptl_absorpt_empirical_full_min 0.543
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
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pb1 Pb 0.48547(2) 0.93679(2) 0.16384(2) 0.01690(3) Uani 1 1 d . . . . .
Pb2 Pb -0.14720(2) 0.09199(2) 0.04884(2) 0.01317(3) Uani 1 1 d . . . . .
O1 O 0.6452(2) 0.9019(2) 0.29608(17) 0.0242(6) Uani 1 1 d . . . . .
O2 O 0.7392(2) 0.92993(19) 0.15635(16) 0.0215(6) Uani 1 1 d . . . . .
O3 O 1.2106(2) 0.88757(19) 0.14112(16) 0.0223(6) Uani 1 1 d . . . . .
O4 O 1.3305(2) 0.8832(2) 0.28458(18) 0.0314(7) Uani 1 1 d . . . . .
O5 O 0.0274(2) 0.23926(19) 0.03520(19) 0.0246(6) Uani 1 1 d . . . . .
O6 O 0.1060(2) 0.09286(18) 0.04712(17) 0.0188(5) Uani 1 1 d . . . . .
O8 O 0.7243(2) 0.23871(18) 0.09515(17) 0.0211(6) Uani 1 1 d . . . . .
O7 O 0.5852(2) 0.09846(18) 0.04351(17) 0.0209(6) Uani 1 1 d . . . . .
O9 O 0.5001(4) 1.0972(3) 0.2946(3) 0.0632(9) Uani 1 1 d . U . . .
N1 N 1.0637(3) 0.8563(2) 0.7646(2) 0.0257(8) Uani 1 1 d . . . . .
N2 N 0.4633(3) 0.7380(2) 0.1454(2) 0.0196(7) Uani 1 1 d . . . . .
N3 N 0.4765(12) 1.2152(10) 0.4298(10) 0.2300(14) Uani 1 1 d . U . . .
C2 C 0.8737(3) 0.8903(3) 0.2954(2) 0.0175(8) Uani 1 1 d . . . . .
C7 C 0.8853(3) 0.8782(3) 0.3981(2) 0.0192(8) Uani 1 1 d . . . . .
H7 H 0.8122 0.8783 0.4338 0.023 Uiso 1 1 calc R . . . .
C6 C 1.0067(3) 0.8658(3) 0.4472(2) 0.0179(8) Uani 1 1 d . . . . .
C5 C 1.1132(3) 0.8667(3) 0.3911(2) 0.0196(8) Uani 1 1 d . . . . .
H5 H 1.1948 0.8597 0.4226 0.024 Uiso 1 1 calc R . . . .
C4 C 1.1022(3) 0.8776(3) 0.2894(2) 0.0176(7) Uani 1 1 d . . . . .
C3 C 0.9802(3) 0.8891(3) 0.2418(2) 0.0171(7) Uani 1 1 d . . . . .
H3 H 0.9714 0.8961 0.1736 0.021 Uiso 1 1 calc R . . . .
C9 C 1.0228(3) 0.8575(3) 0.5566(2) 0.0181(8) Uani 1 1 d . . . . .
C13 C 0.9227(3) 0.8676(3) 0.6172(2) 0.0233(8) Uani 1 1 d . . . . .
H13 H 0.8394 0.8745 0.5888 0.028 Uiso 1 1 calc R . . . .
C12 C 0.9463(3) 0.8675(3) 0.7198(3) 0.0280(9) Uani 1 1 d . . . . .
H12 H 0.8781 0.8755 0.7591 0.034 Uiso 1 1 calc R . . . .
C11 C 1.1581(4) 0.8419(4) 0.7061(3) 0.0370(10) Uani 1 1 d . . . . .
H11 H 1.2391 0.8309 0.7356 0.044 Uiso 1 1 calc R . . . .
C10 C 1.1412(4) 0.8426(4) 0.6047(3) 0.0358(11) Uani 1 1 d . . . . .
H10 H 1.2107 0.8328 0.5674 0.043 Uiso 1 1 calc R . . . .
C1 C 0.7436(3) 0.9095(3) 0.2468(2) 0.0175(8) Uani 1 1 d . . . . .
C8 C 1.2222(3) 0.8824(3) 0.2342(2) 0.0201(8) Uani 1 1 d . . . . .
C15 C 0.2599(3) 0.2469(3) 0.0660(2) 0.0174(7) Uani 1 1 d . . . . .
C20 C 0.2790(3) 0.3534(3) 0.0842(2) 0.0200(8) Uani 1 1 d . . . . .
H20 H 0.2068 0.3882 0.0828 0.024 Uiso 1 1 calc R . . . .
C19 C 0.4060(3) 0.4080(3) 0.1045(2) 0.0190(8) Uani 1 1 d . . . . .
C18 C 0.5128(3) 0.3540(3) 0.1039(2) 0.0194(8) Uani 1 1 d . . . . .
H18 H 0.5978 0.3892 0.1174 0.023 Uiso 1 1 calc R . . . .
C17 C 0.4935(3) 0.2485(3) 0.0832(2) 0.0171(7) Uani 1 1 d . . . . .
C16 C 0.3661(3) 0.1941(3) 0.0650(2) 0.0165(7) Uani 1 1 d . . . . .
H16 H 0.3532 0.1233 0.0525 0.020 Uiso 1 1 calc R . . . .
C22 C 0.4256(3) 0.5216(3) 0.1212(2) 0.0207(8) Uani 1 1 d . . . . .
C26 C 0.3221(3) 0.5774(3) 0.1105(3) 0.0266(9) Uani 1 1 d . . . . .
H26 H 0.2368 0.5433 0.0951 0.032 Uiso 1 1 calc R . . . .
C25 C 0.3438(3) 0.6822(3) 0.1223(3) 0.0263(9) Uani 1 1 d . . . . .
H25 H 0.2717 0.7167 0.1138 0.032 Uiso 1 1 calc R . . . .
C24 C 0.5641(4) 0.6840(3) 0.1568(3) 0.0298(10) Uani 1 1 d . . . . .
H24 H 0.6483 0.7198 0.1729 0.036 Uiso 1 1 calc R . . . .
C23 C 0.5491(4) 0.5793(3) 0.1459(3) 0.0292(9) Uani 1 1 d . . . . .
H23 H 0.6225 0.5464 0.1551 0.035 Uiso 1 1 calc R . . . .
C14 C 0.1226(3) 0.1894(3) 0.0470(2) 0.0184(8) Uani 1 1 d . . . . .
C21 C 0.6095(3) 0.1912(3) 0.0744(2) 0.0156(7) Uani 1 1 d . . . . .
C27 C 0.4933(14) 1.1144(11) 0.3760(10) 0.1965(14) Uani 1 1 d . U . . .
C28 C 0.4956(11) 1.0304(8) 0.4599(7) 0.1352(14) Uani 1 1 d . U . . .
C29 C 0.4585(14) 1.2953(11) 0.3581(10) 0.226(3) Uani 1 1 d . U . . .
H29A H 0.5425 1.3231 0.3381 0.340 Uiso 1 1 calc GR . . . .
H29B H 0.4195 1.3489 0.3899 0.340 Uiso 1 1 calc GR . . . .
H29C H 0.4021 1.2648 0.3004 0.340 Uiso 1 1 calc GR . . . .
C30 C 0.5091(12) 1.2588(10) 0.5483(9) 0.195(3) Uani 1 1 d . U . . .
H30A H 0.4409 1.2286 0.5860 0.293 Uiso 1 1 calc GR . . . .
H30B H 0.5132 1.3318 0.5539 0.293 Uiso 1 1 calc GR . . . .
H30C H 0.5919 1.2412 0.5737 0.293 Uiso 1 1 calc GR . . . .
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_
_citation_id
_citation_doi
_citation_year
1 10.1021/acs.inorgchem.9b02697 2019
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
_geom_angle_publ_flag
O1 Pb1 O2 51.68(7) . . ?
O1 Pb1 O4 82.14(8) . 1_455 ?
O1 Pb1 O9 77.00(10) . . ?
O1 Pb1 N2 77.40(8) . . ?
O2 Pb1 O9 99.33(10) . . ?
O4 Pb1 O2 132.99(7) 1_455 . ?
O4 Pb1 O9 74.87(11) 1_455 . ?
O4 Pb1 N2 76.51(9) 1_455 . ?
N2 Pb1 O2 84.32(8) . . ?
N2 Pb1 O9 143.71(10) . . ?
O5 Pb2 O3 84.21(8) . 2_665 ?
O5 Pb2 O6 51.47(8) . . ?
O5 Pb2 O8 81.14(8) . 1_455 ?
O5 Pb2 N1 78.31(9) . 2_666 ?
O6 Pb2 O3 99.85(7) . 2_665 ?
O8 Pb2 O3 89.16(8) 1_455 2_665 ?
O8 Pb2 O6 129.87(7) 1_455 . ?
O8 Pb2 N1 76.82(9) 1_455 2_666 ?
N1 Pb2 O3 159.01(9) 2_666 2_665 ?
N1 Pb2 O6 78.25(8) 2_666 . ?
C1 O1 Pb1 97.29(19) . . ?
C1 O2 Pb1 87.57(18) . . ?
C8 O3 Pb2 170.2(2) . 2_665 ?
C8 O4 Pb1 101.2(2) . 1_655 ?
C14 O5 Pb2 95.6(2) . . ?
C14 O6 Pb2 89.82(18) . . ?
C21 O8 Pb2 98.4(2) . 1_655 ?
C27 O9 Pb1 139.2(8) . . ?
C12 N1 Pb2 126.2(2) . 2_666 ?
C11 N1 Pb2 114.4(2) . 2_666 ?
C11 N1 C12 117.2(3) . . ?
C25 N2 Pb1 119.4(2) . . ?
C25 N2 C24 115.5(3) . . ?
C24 N2 Pb1 125.1(2) . . ?
C27 N3 C30 131.3(12) . . ?
C29 N3 C27 111.6(12) . . ?
C29 N3 C30 115.2(11) . . ?
C7 C2 C1 118.7(3) . . ?
C3 C2 C7 120.4(3) . . ?
C3 C2 C1 120.8(3) . . ?
C2 C7 H7 119.8 . . ?
C6 C7 C2 120.4(3) . . ?
C6 C7 H7 119.8 . . ?
C7 C6 C9 121.4(3) . . ?
C5 C6 C7 117.7(3) . . ?
C5 C6 C9 120.8(3) . . ?
C6 C5 H5 118.9 . . ?
C6 C5 C4 122.2(3) . . ?
C4 C5 H5 118.9 . . ?
C5 C4 C3 119.1(3) . . ?
C5 C4 C8 119.4(3) . . ?
C3 C4 C8 121.4(3) . . ?
C2 C3 C4 120.1(3) . . ?
C2 C3 H3 120.0 . . ?
C4 C3 H3 120.0 . . ?
C13 C9 C6 122.7(3) . . ?
C10 C9 C6 121.5(3) . . ?
C10 C9 C13 115.8(3) . . ?
C9 C13 H13 119.9 . . ?
C9 C13 C12 120.2(3) . . ?
C12 C13 H13 119.9 . . ?
N1 C12 C13 122.5(3) . . ?
N1 C12 H12 118.7 . . ?
C13 C12 H12 118.7 . . ?
N1 C11 H11 118.6 . . ?
N1 C11 C10 122.9(3) . . ?
C10 C11 H11 118.6 . . ?
C9 C10 H10 119.4 . . ?
C11 C10 C9 121.3(3) . . ?
C11 C10 H10 119.4 . . ?
O1 C1 O2 123.5(3) . . ?
O1 C1 C2 119.1(3) . . ?
O2 C1 C2 117.4(3) . . ?
O3 C8 C4 119.1(3) . . ?
O4 C8 O3 123.6(3) . . ?
O4 C8 C4 117.3(3) . . ?
C20 C15 C14 119.7(3) . . ?
C16 C15 C20 120.6(3) . . ?
C16 C15 C14 119.7(3) . . ?
C15 C20 H20 119.8 . . ?
C19 C20 C15 120.5(3) . . ?
C19 C20 H20 119.8 . . ?
C20 C19 C22 120.1(3) . . ?
C18 C19 C20 118.5(3) . . ?
C18 C19 C22 121.3(3) . . ?
C19 C18 H18 119.6 . . ?
C17 C18 C19 120.8(3) . . ?
C17 C18 H18 119.6 . . ?
C18 C17 C16 120.4(3) . . ?
C18 C17 C21 120.7(3) . . ?
C16 C17 C21 118.8(3) . . ?
C15 C16 C17 119.1(3) . . ?
C15 C16 H16 120.4 . . ?
C17 C16 H16 120.4 . . ?
C26 C22 C19 122.2(3) . . ?
C26 C22 C23 115.3(3) . . ?
C23 C22 C19 122.4(3) . . ?
C22 C26 H26 119.6 . . ?
C25 C26 C22 120.9(3) . . ?
C25 C26 H26 119.6 . . ?
N2 C25 C26 123.8(3) . . ?
N2 C25 H25 118.1 . . ?
C26 C25 H25 118.1 . . ?
N2 C24 H24 118.2 . . ?
N2 C24 C23 123.6(3) . . ?
C23 C24 H24 118.2 . . ?
C22 C23 H23 119.6 . . ?
C24 C23 C22 120.9(3) . . ?
C24 C23 H23 119.6 . . ?
O5 C14 O6 122.3(3) . . ?
O5 C14 C15 118.9(3) . . ?
O6 C14 C15 118.8(3) . . ?
O8 C21 C17 119.2(3) . . ?
O7 C21 O8 123.4(3) . . ?
O7 C21 C17 117.4(3) . . ?
O9 C27 N3 128.0(13) . . ?
O9 C27 C28 124.8(12) . . ?
N3 C27 C28 107.1(11) . . ?
C28 C28 C27 172.6(13) 2_676 . ?
N3 C29 H29A 109.5 . . ?
N3 C29 H29B 109.5 . . ?
N3 C29 H29C 109.5 . . ?
H29A C29 H29B 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
N3 C30 H30A 109.5 . . ?
N3 C30 H30B 109.5 . . ?
N3 C30 H30C 109.5 . . ?
H30A C30 H30B 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pb1 O1 2.440(2) . ?
Pb1 O2 2.643(2) . ?
Pb1 O4 2.449(2) 1_455 ?
Pb1 O9 2.648(4) . ?
Pb1 N2 2.605(3) . ?
Pb2 O3 2.635(2) 2_665 ?
Pb2 O5 2.489(2) . ?
Pb2 O6 2.613(2) . ?
Pb2 O8 2.578(2) 1_455 ?
Pb2 N1 2.605(3) 2_666 ?
O1 C1 1.256(4) . ?
O2 C1 1.268(4) . ?
O3 Pb2 2.635(2) 2_665 ?
O3 C8 1.260(4) . ?
O4 Pb1 2.449(2) 1_655 ?
O4 C8 1.257(4) . ?
O5 C14 1.266(4) . ?
O6 C14 1.267(4) . ?
O8 Pb2 2.578(2) 1_655 ?
O8 C21 1.259(4) . ?
O7 C21 1.255(4) . ?
O9 C27 1.118(14) . ?
N1 Pb2 2.604(3) 2_666 ?
N1 C12 1.340(5) . ?
N1 C11 1.331(5) . ?
N2 C25 1.345(4) . ?
N2 C24 1.348(5) . ?
N3 C27 1.516(18) . ?
N3 C29 1.506(17) . ?
N3 C30 1.653(16) . ?
C2 C7 1.403(4) . ?
C2 C3 1.369(5) . ?
C2 C1 1.506(4) . ?
C7 H7 0.9300 . ?
C7 C6 1.403(4) . ?
C6 C5 1.386(5) . ?
C6 C9 1.485(4) . ?
C5 H5 0.9300 . ?
C5 C4 1.387(4) . ?
C4 C3 1.398(4) . ?
C4 C8 1.494(5) . ?
C3 H3 0.9300 . ?
C9 C13 1.386(5) . ?
C9 C10 1.380(5) . ?
C13 H13 0.9300 . ?
C13 C12 1.387(5) . ?
C12 H12 0.9300 . ?
C11 H11 0.9300 . ?
C11 C10 1.367(5) . ?
C10 H10 0.9300 . ?
C15 C20 1.400(5) . ?
C15 C16 1.383(5) . ?
C15 C14 1.502(4) . ?
C20 H20 0.9300 . ?
C20 C19 1.400(4) . ?
C19 C18 1.397(5) . ?
C19 C22 1.490(5) . ?
C18 H18 0.9300 . ?
C18 C17 1.390(5) . ?
C17 C16 1.400(4) . ?
C17 C21 1.515(5) . ?
C16 H16 0.9300 . ?
C22 C26 1.386(5) . ?
C22 C23 1.392(5) . ?
C26 H26 0.9300 . ?
C26 C25 1.372(5) . ?
C25 H25 0.9300 . ?
C24 H24 0.9300 . ?
C24 C23 1.371(5) . ?
C23 H23 0.9300 . ?
C27 C28 1.643(16) . ?
C28 C28 1.398(19) 2_676 ?
C29 H29A 0.9600 . ?
C29 H29B 0.9600 . ?
C29 H29C 0.9600 . ?
C30 H30A 0.9600 . ?
C30 H30B 0.9600 . ?
C30 H30C 0.9600 . ?
