#------------------------------------------------------------------------------
#$Date: 2016-03-26 16:24:46 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180337 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/06/7200651.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_7200651
loop_
_publ_author_name
'Deng, Hai-Ying'
'He, Jian-Rong'
'Pan, Mei'
'Li, Lei'
'Su, Cheng-Yong'
_publ_section_title
;
 Synergistic metal and anion effects on the formation of coordination
 assemblies from a N,N′-bis(3-pyridylmethyl)naphthalene diimide
 ligand
;
_journal_issue                   5
_journal_name_full               CrystEngComm
_journal_page_first              909
_journal_paper_doi               10.1039/b819608g
_journal_volume                  11
_journal_year                    2009
_chemical_formula_sum            'C52 H32 Cd N10 O14'
_chemical_formula_weight         1133.28
_chemical_name_systematic
;
?
;
_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                84.447(2)
_cell_angle_beta                 83.507(2)
_cell_angle_gamma                86.195(2)
_cell_formula_units_Z            1
_cell_length_a                   9.1325(12)
_cell_length_b                   9.1810(12)
_cell_length_c                   13.3784(17)
_cell_measurement_reflns_used    4889
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      54.114
_cell_measurement_theta_min      4.496
_cell_volume                     1107.5(2)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.972
_diffrn_measured_fraction_theta_max 0.972
_diffrn_measurement_device_type  Bruker
_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  0.0232
_diffrn_reflns_av_sigmaI/netI    0.0380
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            9411
_diffrn_reflns_theta_full        27.19
_diffrn_reflns_theta_max         27.19
_diffrn_reflns_theta_min         2.23
_exptl_absorpt_coefficient_mu    0.582
_exptl_absorpt_correction_T_max  0.9126
_exptl_absorpt_correction_T_min  0.8222
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            Red
_exptl_crystal_density_diffrn    1.699
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             574
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.16
_refine_diff_density_max         0.792
_refine_diff_density_min         -0.427
_refine_diff_density_rms         0.079
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.087
_refine_ls_hydrogen_treatment    geom
_refine_ls_matrix_type           full
_refine_ls_number_parameters     365
_refine_ls_number_reflns         4785
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.087
_refine_ls_R_factor_all          0.0457
_refine_ls_R_factor_gt           0.0378
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0658P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0999
_refine_ls_wR_factor_ref         0.1056
_reflns_number_gt                4210
_reflns_number_total             4785
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b819608g.txt
_cod_data_source_block           4
_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.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7200651
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Cd1 Cd -1.0000 1.0000 0.0000 0.03293(11) Uani 1 2 d S . .
C14 C -1.1640(3) 0.7212(3) 0.0967(2) 0.0320(5) Uani 1 1 d . . .
H14A H -1.1661 0.7788 0.1522 0.038 Uiso 1 1 calc R . .
C23 C -1.1384(3) 0.3992(3) 0.3168(2) 0.0387(6) Uani 1 1 d . . .
C1 C -0.6961(3) 0.9269(3) -0.1590(2) 0.0339(6) Uani 1 1 d . . .
H1A H -0.7573 0.9601 -0.2104 0.041 Uiso 1 1 calc R . .
C15 C -1.2324(3) 0.5895(3) 0.1125(2) 0.0357(6) Uani 1 1 d . . .
C26 C -1.0415(3) 0.5073(3) 0.45873(19) 0.0347(6) Uani 1 1 d . . .
C4 C -0.5233(4) 0.8253(4) -0.0122(3) 0.0544(9) Uani 1 1 d . . .
H4A H -0.4655 0.7874 0.0402 0.065 Uiso 1 1 calc R . .
C24 C -1.0472(3) 0.3858(3) 0.4013(2) 0.0362(6) Uani 1 1 d . . .
C18 C -1.0938(3) 0.6912(3) -0.0701(2) 0.0393(6) Uani 1 1 d . . .
H18A H -1.0466 0.7263 -0.1340 0.047 Uiso 1 1 calc R . .
C5 C -0.6713(3) 0.8575(3) 0.0081(2) 0.0421(7) Uani 1 1 d . . .
H5A H -0.7146 0.8422 0.0760 0.051 Uiso 1 1 calc R . .
C2 C -0.5456(3) 0.8985(3) -0.1868(2) 0.0367(6) Uani 1 1 d . . .
C6 C -0.4797(3) 0.9269(3) -0.2960(2) 0.0445(7) Uani 1 1 d . . .
H6A H -0.5322 1.0140 -0.3278 0.053 Uiso 1 1 calc R . .
H6B H -0.3748 0.9491 -0.2973 0.053 Uiso 1 1 calc R . .
C22 C -1.1119(3) 0.7596(3) 0.4906(2) 0.0408(7) Uani 1 1 d . . .
H22A H -1.169(3) 0.860(4) 0.477(2) 0.049(9) Uiso 1 1 d . . .
C16 C -1.2287(4) 0.5070(3) 0.0314(2) 0.0468(7) Uani 1 1 d . . .
H16A H -1.2740 0.4158 0.0391 0.056 Uiso 1 1 calc R . .
C21 C -1.1195(3) 0.6425(3) 0.4342(2) 0.0376(6) Uani 1 1 d . . .
C25 C -0.9718(3) 0.2548(3) 0.4273(2) 0.0416(7) Uani 1 1 d . . .
H25A H -0.980(3) 0.172(4) 0.394(2) 0.045(8) Uiso 1 1 d . . .
C19 C -1.3119(3) 0.5429(3) 0.2146(2) 0.0451(7) Uani 1 1 d . . .
H19A H -1.3958 0.6141 0.2297 0.054 Uiso 1 1 calc R . .
H19B H -1.3526 0.4461 0.2121 0.054 Uiso 1 1 calc R . .
C20 C -1.2120(3) 0.6570(3) 0.3496(2) 0.0398(6) Uani 1 1 d . . .
C3 C -0.4591(3) 0.8494(4) -0.1117(3) 0.0517(8) Uani 1 1 d . . .
H3A H -0.3558 0.8319 -0.1274 0.062 Uiso 1 1 calc R . .
C17 C -1.1590(4) 0.5579(3) -0.0609(2) 0.0479(7) Uani 1 1 d . . .
H17A H -1.1557 0.5022 -0.1174 0.057 Uiso 1 1 calc R . .
C7 C -0.3969(3) 0.6763(3) -0.3338(2) 0.0371(6) Uani 1 1 d . . .
C11 C -0.5809(3) 0.8178(3) -0.4343(2) 0.0383(6) Uani 1 1 d . . .
C10 C -0.3314(3) 0.2997(3) -0.4263(2) 0.0378(6) Uani 1 1 d . . .
H10A H -0.276(4) 0.210(4) -0.410(2) 0.048(9) Uiso 1 1 d . . .
C13 C -0.4972(3) 0.5602(3) -0.47161(19) 0.0324(6) Uani 1 1 d . . .
C9 C -0.3253(3) 0.4197(3) -0.3706(2) 0.0366(6) Uani 1 1 d . . .
H9A H -0.271(3) 0.413(3) -0.308(2) 0.038(8) Uiso 1 1 d . . .
C8 C -0.4058(3) 0.5484(3) -0.39210(19) 0.0338(6) Uani 1 1 d . . .
C12 C -0.5827(3) 0.6912(3) -0.4951(2) 0.0346(6) Uani 1 1 d . . .
N10 N -0.9145(2) 0.8970(3) 0.23382(17) 0.0378(5) Uani 1 1 d . . .
N1 N -0.7584(2) 0.9095(2) -0.06273(17) 0.0327(5) Uani 1 1 d . . .
N4 N -1.2154(3) 0.5330(3) 0.29660(17) 0.0393(5) Uani 1 1 d . . .
N3 N -1.0953(2) 0.7720(2) 0.00776(16) 0.0316(5) Uani 1 1 d . . .
N2 N -0.4891(3) 0.8004(2) -0.35591(17) 0.0372(5) Uani 1 1 d . . .
O4 O -1.1502(3) 0.2990(2) 0.26554(17) 0.0515(5) Uani 1 1 d . . .
O3 O -1.2830(3) 0.7684(2) 0.32620(16) 0.0506(5) Uani 1 1 d . . .
O7 O -0.9017(3) 0.7656(3) 0.21758(18) 0.0583(6) Uani 1 1 d . . .
O6 O -0.9543(3) 0.9903(2) 0.16878(16) 0.0574(6) Uani 1 1 d . . .
O5 O -0.8920(3) 0.9360(3) 0.31668(18) 0.0653(7) Uani 1 1 d . . .
O2 O -0.3152(2) 0.6738(2) -0.26842(16) 0.0472(5) Uani 1 1 d . . .
O1 O -0.6535(2) 0.9304(2) -0.45070(17) 0.0515(5) 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'
Cd Cd -0.8075 1.2024 '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
_geom_angle_publ_flag
N3 Cd1 N3 180.0 . 2_375 ?
N3 Cd1 O6 97.15(8) . . ?
N3 Cd1 O6 82.85(8) 2_375 . ?
N3 Cd1 O6 82.85(8) . 2_375 ?
N3 Cd1 O6 97.15(8) 2_375 2_375 ?
O6 Cd1 O6 180.000(1) . 2_375 ?
N3 Cd1 N1 87.34(7) . 2_375 ?
N3 Cd1 N1 92.66(7) 2_375 2_375 ?
O6 Cd1 N1 83.97(8) . 2_375 ?
O6 Cd1 N1 96.03(8) 2_375 2_375 ?
N3 Cd1 N1 92.66(7) . . ?
N3 Cd1 N1 87.34(7) 2_375 . ?
O6 Cd1 N1 96.03(8) . . ?
O6 Cd1 N1 83.97(8) 2_375 . ?
N1 Cd1 N1 180.0 2_375 . ?
N3 C14 C15 123.7(2) . . ?
N3 C14 H14A 118.1 . . ?
C15 C14 H14A 118.1 . . ?
O4 C23 N4 119.5(3) . . ?
O4 C23 C24 123.0(3) . . ?
N4 C23 C24 117.5(2) . . ?
N1 C1 C2 123.1(2) . . ?
N1 C1 H1A 118.5 . . ?
C2 C1 H1A 118.5 . . ?
C16 C15 C14 117.6(3) . . ?
C16 C15 C19 122.2(3) . . ?
C14 C15 C19 120.2(3) . . ?
C26 C26 C21 119.6(3) 2_366 . ?
C26 C26 C24 119.4(3) 2_366 . ?
C21 C26 C24 121.0(3) . . ?
C5 C4 C3 118.4(3) . . ?
C5 C4 H4A 120.8 . . ?
C3 C4 H4A 120.8 . . ?
C25 C24 C26 120.0(3) . . ?
C25 C24 C23 120.5(3) . . ?
C26 C24 C23 119.5(3) . . ?
N3 C18 C17 122.2(3) . . ?
N3 C18 H18A 118.9 . . ?
C17 C18 H18A 118.9 . . ?
N1 C5 C4 123.4(3) . . ?
N1 C5 H5A 118.3 . . ?
C4 C5 H5A 118.3 . . ?
C3 C2 C1 117.7(3) . . ?
C3 C2 C6 121.4(3) . . ?
C1 C2 C6 120.9(3) . . ?
N2 C6 C2 112.7(2) . . ?
N2 C6 H6A 109.1 . . ?
C2 C6 H6A 109.1 . . ?
N2 C6 H6B 109.1 . . ?
C2 C6 H6B 109.1 . . ?
H6A C6 H6B 107.8 . . ?
C21 C22 C25 120.2(3) . 2_366 ?
C21 C22 H22A 123.5(17) . . ?
C25 C22 H22A 116.2(17) 2_366 . ?
C17 C16 C15 119.5(3) . . ?
C17 C16 H16A 120.3 . . ?
C15 C16 H16A 120.3 . . ?
C22 C21 C26 120.2(3) . . ?
C22 C21 C20 119.9(3) . . ?
C26 C21 C20 119.9(3) . . ?
C24 C25 C22 120.6(3) . 2_366 ?
C24 C25 H25A 121(2) . . ?
C22 C25 H25A 118.1(19) 2_366 . ?
N4 C19 C15 112.8(2) . . ?
N4 C19 H19A 109.0 . . ?
C15 C19 H19A 109.0 . . ?
N4 C19 H19B 109.0 . . ?
C15 C19 H19B 109.0 . . ?
H19A C19 H19B 107.8 . . ?
O3 C20 N4 120.5(3) . . ?
O3 C20 C21 123.0(3) . . ?
N4 C20 C21 116.6(2) . . ?
C2 C3 C4 119.8(3) . . ?
C2 C3 H3A 120.1 . . ?
C4 C3 H3A 120.1 . . ?
C16 C17 C18 119.2(3) . . ?
C16 C17 H17A 120.4 . . ?
C18 C17 H17A 120.4 . . ?
O2 C7 N2 120.8(3) . . ?
O2 C7 C8 121.8(3) . . ?
N2 C7 C8 117.4(3) . . ?
O1 C11 N2 121.2(3) . . ?
O1 C11 C12 122.3(3) . . ?
N2 C11 C12 116.4(2) . . ?
C12 C10 C9 120.4(3) 2_464 . ?
C12 C10 H10A 119.3(19) 2_464 . ?
C9 C10 H10A 120.3(19) . . ?
C13 C13 C8 119.3(3) 2_464 . ?
C13 C13 C12 119.5(3) 2_464 . ?
C8 C13 C12 121.2(3) . . ?
C8 C9 C10 121.0(3) . . ?
C8 C9 H9A 116.6(17) . . ?
C10 C9 H9A 122.1(17) . . ?
C9 C8 C13 119.8(3) . . ?
C9 C8 C7 120.7(3) . . ?
C13 C8 C7 119.4(2) . . ?
C10 C12 C13 120.0(3) 2_464 . ?
C10 C12 C11 119.9(2) 2_464 . ?
C13 C12 C11 120.1(2) . . ?
O6 N10 O5 118.8(3) . . ?
O6 N10 O7 120.3(2) . . ?
O5 N10 O7 120.9(2) . . ?
C5 N1 C1 117.6(2) . . ?
C5 N1 Cd1 115.23(18) . . ?
C1 N1 Cd1 126.33(17) . . ?
C23 N4 C20 125.4(3) . . ?
C23 N4 C19 117.0(2) . . ?
C20 N4 C19 117.5(2) . . ?
C18 N3 C14 117.9(2) . . ?
C18 N3 Cd1 125.30(18) . . ?
C14 N3 Cd1 116.74(17) . . ?
C7 N2 C11 125.2(2) . . ?
C7 N2 C6 116.6(2) . . ?
C11 N2 C6 118.0(2) . . ?
N10 O6 Cd1 137.24(19) . . ?
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
Cd1 N3 2.308(2) . ?
Cd1 N3 2.308(2) 2_375 ?
Cd1 O6 2.334(2) . ?
Cd1 O6 2.334(2) 2_375 ?
Cd1 N1 2.395(2) 2_375 ?
Cd1 N1 2.395(2) . ?
C14 N3 1.338(3) . ?
C14 C15 1.385(4) . ?
C14 H14A 0.9500 . ?
C23 O4 1.216(3) . ?
C23 N4 1.393(4) . ?
C23 C24 1.470(4) . ?
C1 N1 1.347(3) . ?
C1 C2 1.396(4) . ?
C1 H1A 0.9500 . ?
C15 C16 1.378(4) . ?
C15 C19 1.510(4) . ?
C26 C26 1.399(6) 2_366 ?
C26 C21 1.419(4) . ?
C26 C24 1.421(4) . ?
C4 C5 1.366(4) . ?
C4 C3 1.396(5) . ?
C4 H4A 0.9500 . ?
C24 C25 1.380(4) . ?
C18 N3 1.335(3) . ?
C18 C17 1.385(4) . ?
C18 H18A 0.9500 . ?
C5 N1 1.339(3) . ?
C5 H5A 0.9500 . ?
C2 C3 1.371(4) . ?
C2 C6 1.521(4) . ?
C6 N2 1.486(4) . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C22 C21 1.381(4) . ?
C22 C25 1.399(4) 2_366 ?
C22 H22A 1.04(3) . ?
C16 C17 1.377(5) . ?
C16 H16A 0.9500 . ?
C21 C20 1.478(4) . ?
C25 C22 1.399(4) 2_366 ?
C25 H25A 0.93(3) . ?
C19 N4 1.476(4) . ?
C19 H19A 0.9900 . ?
C19 H19B 0.9900 . ?
C20 O3 1.208(3) . ?
C20 N4 1.402(4) . ?
C3 H3A 0.9500 . ?
C17 H17A 0.9500 . ?
C7 O2 1.210(3) . ?
C7 N2 1.399(3) . ?
C7 C8 1.483(4) . ?
C11 O1 1.206(3) . ?
C11 N2 1.406(4) . ?
C11 C12 1.485(4) . ?
C10 C12 1.373(4) 2_464 ?
C10 C9 1.396(4) . ?
C10 H10A 0.96(3) . ?
C13 C13 1.407(5) 2_464 ?
C13 C8 1.416(4) . ?
C13 C12 1.419(4) . ?
C9 C8 1.373(4) . ?
C9 H9A 1.01(3) . ?
C12 C10 1.373(4) 2_464 ?
N10 O6 1.229(3) . ?
N10 O5 1.240(3) . ?
N10 O7 1.242(3) . ?
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N3 C14 C15 C16 0.0(4) . . . . ?
N3 C14 C15 C19 -177.9(2) . . . . ?
C26 C26 C24 C25 0.2(5) 2_366 . . . ?
C21 C26 C24 C25 -179.2(2) . . . . ?
C26 C26 C24 C23 177.9(3) 2_366 . . . ?
C21 C26 C24 C23 -1.5(4) . . . . ?
O4 C23 C24 C25 -1.1(4) . . . . ?
N4 C23 C24 C25 177.9(2) . . . . ?
O4 C23 C24 C26 -178.8(3) . . . . ?
N4 C23 C24 C26 0.2(4) . . . . ?
C3 C4 C5 N1 0.8(5) . . . . ?
N1 C1 C2 C3 0.6(4) . . . . ?
N1 C1 C2 C6 -177.1(2) . . . . ?
C3 C2 C6 N2 95.6(3) . . . . ?
C1 C2 C6 N2 -86.8(3) . . . . ?
C14 C15 C16 C17 -0.2(4) . . . . ?
C19 C15 C16 C17 177.6(3) . . . . ?
C25 C22 C21 C26 -0.5(4) 2_366 . . . ?
C25 C22 C21 C20 178.0(2) 2_366 . . . ?
C26 C26 C21 C22 0.9(5) 2_366 . . . ?
C24 C26 C21 C22 -179.7(2) . . . . ?
C26 C26 C21 C20 -177.6(3) 2_366 . . . ?
C24 C26 C21 C20 1.8(4) . . . . ?
C26 C24 C25 C22 -0.6(4) . . . 2_366 ?
C23 C24 C25 C22 -178.3(2) . . . 2_366 ?
C16 C15 C19 N4 124.2(3) . . . . ?
C14 C15 C19 N4 -58.0(4) . . . . ?
C22 C21 C20 O3 0.1(4) . . . . ?
C26 C21 C20 O3 178.7(3) . . . . ?
C22 C21 C20 N4 -179.3(2) . . . . ?
C26 C21 C20 N4 -0.8(4) . . . . ?
C1 C2 C3 C4 2.0(4) . . . . ?
C6 C2 C3 C4 179.7(3) . . . . ?
C5 C4 C3 C2 -2.7(5) . . . . ?
C15 C16 C17 C18 0.0(5) . . . . ?
N3 C18 C17 C16 0.5(5) . . . . ?
C12 C10 C9 C8 0.8(4) 2_464 . . . ?
C10 C9 C8 C13 0.2(4) . . . . ?
C10 C9 C8 C7 -178.9(2) . . . . ?
C13 C13 C8 C9 -0.7(4) 2_464 . . . ?
C12 C13 C8 C9 179.5(2) . . . . ?
C13 C13 C8 C7 178.5(3) 2_464 . . . ?
C12 C13 C8 C7 -1.4(4) . . . . ?
O2 C7 C8 C9 2.7(4) . . . . ?
N2 C7 C8 C9 -176.1(2) . . . . ?
O2 C7 C8 C13 -176.5(2) . . . . ?
N2 C7 C8 C13 4.7(4) . . . . ?
C13 C13 C12 C10 -0.9(5) 2_464 . . 2_464 ?
C8 C13 C12 C10 179.0(2) . . . 2_464 ?
C13 C13 C12 C11 178.5(3) 2_464 . . . ?
C8 C13 C12 C11 -1.7(4) . . . . ?
O1 C11 C12 C10 0.4(4) . . . 2_464 ?
N2 C11 C12 C10 -179.4(2) . . . 2_464 ?
O1 C11 C12 C13 -178.9(3) . . . . ?
N2 C11 C12 C13 1.3(4) . . . . ?
C4 C5 N1 C1 1.7(4) . . . . ?
C4 C5 N1 Cd1 -168.2(3) . . . . ?
C2 C1 N1 C5 -2.4(4) . . . . ?
C2 C1 N1 Cd1 166.27(19) . . . . ?
N3 Cd1 N1 C5 -87.9(2) . . . . ?
N3 Cd1 N1 C5 92.1(2) 2_375 . . . ?
O6 Cd1 N1 C5 9.6(2) . . . . ?
O6 Cd1 N1 C5 -170.4(2) 2_375 . . . ?
N1 Cd1 N1 C5 -180(100) 2_375 . . . ?
N3 Cd1 N1 C1 103.2(2) . . . . ?
N3 Cd1 N1 C1 -76.8(2) 2_375 . . . ?
O6 Cd1 N1 C1 -159.3(2) . . . . ?
O6 Cd1 N1 C1 20.7(2) 2_375 . . . ?
N1 Cd1 N1 C1 11(100) 2_375 . . . ?
O4 C23 N4 C20 179.9(3) . . . . ?
C24 C23 N4 C20 0.8(4) . . . . ?
O4 C23 N4 C19 1.8(4) . . . . ?
C24 C23 N4 C19 -177.2(2) . . . . ?
O3 C20 N4 C23 180.0(3) . . . . ?
C21 C20 N4 C23 -0.6(4) . . . . ?
O3 C20 N4 C19 -2.0(4) . . . . ?
C21 C20 N4 C19 177.5(2) . . . . ?
C15 C19 N4 C23 -88.8(3) . . . . ?
C15 C19 N4 C20 93.0(3) . . . . ?
C17 C18 N3 C14 -0.8(4) . . . . ?
C17 C18 N3 Cd1 -177.1(2) . . . . ?
C15 C14 N3 C18 0.5(4) . . . . ?
C15 C14 N3 Cd1 177.2(2) . . . . ?
N3 Cd1 N3 C18 60(100) 2_375 . . . ?
O6 Cd1 N3 C18 -154.5(2) . . . . ?
O6 Cd1 N3 C18 25.5(2) 2_375 . . . ?
N1 Cd1 N3 C18 122.0(2) 2_375 . . . ?
N1 Cd1 N3 C18 -58.0(2) . . . . ?
N3 Cd1 N3 C14 -116(100) 2_375 . . . ?
O6 Cd1 N3 C14 29.18(19) . . . . ?
O6 Cd1 N3 C14 -150.82(19) 2_375 . . . ?
N1 Cd1 N3 C14 -54.40(18) 2_375 . . . ?
N1 Cd1 N3 C14 125.60(18) . . . . ?
O2 C7 N2 C11 175.8(3) . . . . ?
C8 C7 N2 C11 -5.4(4) . . . . ?
O2 C7 N2 C6 0.6(4) . . . . ?
C8 C7 N2 C6 179.4(2) . . . . ?
O1 C11 N2 C7 -177.4(3) . . . . ?
C12 C11 N2 C7 2.4(4) . . . . ?
O1 C11 N2 C6 -2.2(4) . . . . ?
C12 C11 N2 C6 177.6(2) . . . . ?
C2 C6 N2 C7 -71.0(3) . . . . ?
C2 C6 N2 C11 113.4(3) . . . . ?
O5 N10 O6 Cd1 175.1(2) . . . . ?
O7 N10 O6 Cd1 -7.3(4) . . . . ?
N3 Cd1 O6 N10 35.3(3) . . . . ?
N3 Cd1 O6 N10 -144.7(3) 2_375 . . . ?
O6 Cd1 O6 N10 -89(100) 2_375 . . . ?
N1 Cd1 O6 N10 121.9(3) 2_375 . . . ?
N1 Cd1 O6 N10 -58.1(3) . . . . ?
