#------------------------------------------------------------------------------
#$Date: 2025-08-20 21:19:29 +0200 (Wed 20 de Aug de 2025) $
#$Revision: 301836 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/29/4302955.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_4302955
loop_
_publ_author_name
'Nail M. Shavaleev'
'Rosario Scopelliti'
'Frédéric Gumy'
'Jean-Claude G. Bünzli'
_publ_contact_author_address
;Ecole polytechnique fédérale de Lausanne
Institut des sciences et ingénierie chimiques
EPFL SB ISIC LCSL
BCH 1402 (Bât. BCH)
CH-1015 Lausanne
Switzerland
;
_publ_contact_author_email       jean-claude.bunzli@epfl.ch
_publ_contact_author_fax         '+41 21 693 98 25'
_publ_contact_author_name        'Jean-Claude Bünzli'
_publ_contact_author_phone       '+41 21 693 98 21'
_publ_section_title
;
Surprisingly Bright Near-Infrared Luminescence and Short Radiative
Lifetimes of Ytterbium in Hetero-Binuclear Yb-Na Chelates
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              7937
_journal_page_last               7946
_journal_paper_doi               10.1021/ic900888m
_journal_volume                  48
_journal_year                    2009
_chemical_formula_moiety         'C64 H32 Cl4 N8 Na O8 Yb'
_chemical_formula_sum            'C64 H32 Cl4 N8 Na O8 Yb'
_chemical_formula_weight         1378.81
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_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                 100.95(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   22.139(9)
_cell_length_b                   19.226(6)
_cell_length_c                   13.166(3)
_cell_measurement_reflns_used    84
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      12.697
_cell_measurement_theta_min      3.244
_cell_volume                     5502(3)
_computing_cell_refinement       'Dirax/lsq (Duisenberg & Schreurs, 1989-2000)'
_computing_data_collection       'Collect (Bruker AXS BV, 1997-2004)'
_computing_data_reduction        'EvalCCD (Duisenberg & Schreurs, 1990-2000)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Bruker APEX II CCD'
_diffrn_measurement_method       'phi and omega 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  0.1709
_diffrn_reflns_av_sigmaI/netI    0.0941
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            45131
_diffrn_reflns_theta_full        21.10
_diffrn_reflns_theta_max         21.10
_diffrn_reflns_theta_min         3.31
_exptl_absorpt_coefficient_mu    1.970
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.5816
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS V2.10, G.M. Sheldrick, 2003'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.664
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             2740
_exptl_crystal_size_max          0.10
_exptl_crystal_size_mid          0.09
_exptl_crystal_size_min          0.06
_refine_diff_density_max         4.829
_refine_diff_density_min         -1.497
_refine_diff_density_rms         0.189
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.059
_refine_ls_hydrogen_treatment    riding
_refine_ls_matrix_type           full
_refine_ls_number_parameters     713
_refine_ls_number_reflns         5939
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.060
_refine_ls_R_factor_all          0.1248
_refine_ls_R_factor_gt           0.0789
_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)+(0.1091P)²+0.3525P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1804
_refine_ls_wR_factor_ref         0.2107
_reflns_number_gt                4008
_reflns_number_total             5939
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic900888m_si_002_3.cif
_cod_data_source_block           Na[Yb(LCl)4]
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
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_database_code               4302955
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
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.24475(3) 0.09157(3) 0.14842(5) 0.0268(3) Uani 1 1 d . . .
Na1 Na 0.2437(3) -0.0895(3) 0.1367(4) 0.0391(16) Uani 1 1 d . . .
Cl1 Cl -0.0049(2) -0.1276(3) 0.0432(4) 0.0602(14) Uani 1 1 d . . .
Cl2 Cl 0.5094(2) -0.1076(2) 0.2889(3) 0.0446(12) Uani 1 1 d . . .
Cl3A Cl -0.0008(3) -0.3439(4) 0.0801(6) 0.079(3) Uani 0.763(12) 1 d PD A 1
Cl3B Cl -0.0111(7) -0.4049(8) -0.0907(14) 0.043(7) Uani 0.237(12) 1 d PD A 2
Cl4 Cl 0.5272(2) -0.3690(2) 0.2334(3) 0.0491(12) Uani 1 1 d . . .
O1 O 0.3167(4) 0.1740(5) 0.1654(7) 0.028(3) Uani 1 1 d . . .
O2 O 0.1492(6) 0.0298(7) -0.1879(8) 0.055(4) Uani 1 1 d . . .
O3 O 0.1656(5) 0.1681(5) 0.1253(7) 0.031(3) Uani 1 1 d . . .
O4 O 0.3366(5) 0.0424(5) 0.4912(7) 0.034(3) Uani 1 1 d . . .
O5 O 0.3029(5) 0.0064(5) 0.1001(7) 0.031(3) Uani 1 1 d . . .
O6 O 0.1699(6) -0.2336(6) -0.1595(10) 0.061(4) Uani 1 1 d . . .
O7 O 0.1913(5) 0.0038(5) 0.2025(8) 0.035(3) Uani 1 1 d . . .
O8 O 0.3293(5) -0.1741(6) 0.2436(8) 0.043(3) Uani 1 1 d . . .
N1 N 0.2604(5) 0.1344(6) -0.0213(9) 0.027(3) Uani 1 1 d . . .
N2 N 0.1701(6) 0.0425(7) -0.0128(9) 0.030(3) Uani 1 1 d . . .
N4 N 0.3218(6) 0.0521(7) 0.3163(9) 0.028(3) Uani 1 1 d . . .
N5 N 0.2681(7) -0.0980(7) -0.0363(10) 0.038(4) Uani 1 1 d . . .
N6 N 0.1810(7) -0.1922(7) 0.0068(11) 0.045(4) Uani 1 1 d . . .
N7 N 0.2488(6) -0.0987(6) 0.3255(9) 0.031(3) Uani 1 1 d . . .
N8 N 0.3692(7) -0.2242(8) 0.3963(10) 0.043(4) Uani 1 1 d . . .
C1 C 0.3363(7) 0.2038(8) 0.0855(11) 0.026(4) Uani 1 1 d . . .
C2 C 0.3826(7) 0.2525(8) 0.0909(12) 0.032(4) Uani 1 1 d . . .
H2 H 0.4044 0.2667 0.1569 0.038 Uiso 1 1 calc R . .
C3 C 0.3984(7) 0.2814(9) 0.0024(11) 0.034(4) Uani 1 1 d . . .
H3 H 0.4303 0.3151 0.0101 0.040 Uiso 1 1 calc R . .
C4 C 0.3690(8) 0.2628(8) -0.0973(13) 0.038(5) Uani 1 1 d . . .
H4 H 0.3804 0.2842 -0.1559 0.046 Uiso 1 1 calc R . .
C5 C 0.3212(8) 0.2109(8) -0.1109(12) 0.033(4) Uani 1 1 d . . .
C6 C 0.3055(6) 0.1827(7) -0.0192(11) 0.021(4) Uani 1 1 d . . .
C7 C 0.2321(8) 0.1116(8) -0.1132(12) 0.034(4) Uani 1 1 d . . .
C8 C 0.2433(8) 0.1398(9) -0.2053(13) 0.044(5) Uani 1 1 d . . .
H8 H 0.2189 0.1254 -0.2692 0.052 Uiso 1 1 calc R . .
C9 C 0.2884(7) 0.1877(8) -0.2052(11) 0.032(4) Uani 1 1 d . . .
H9 H 0.2972 0.2050 -0.2684 0.039 Uiso 1 1 calc R . .
C10 C 0.1850(8) 0.0625(9) -0.1008(13) 0.040(5) Uani 1 1 d . . .
C11 C 0.1114(8) -0.0141(9) -0.1445(13) 0.042(5) Uani 1 1 d . . .
C12 C 0.0655(10) -0.0579(10) -0.1982(15) 0.061(6) Uani 1 1 d . . .
H12 H 0.0581 -0.0630 -0.2713 0.073 Uiso 1 1 calc R . .
C13 C 0.0315(9) -0.0935(10) -0.1348(17) 0.064(6) Uani 1 1 d . . .
H13 H 0.0007 -0.1257 -0.1651 0.077 Uiso 1 1 calc R . .
C14 C 0.0423(8) -0.0821(9) -0.0254(15) 0.046(5) Uani 1 1 d . . .
C15 C 0.0865(7) -0.0399(8) 0.0221(13) 0.034(4) Uani 1 1 d . . .
H15 H 0.0935 -0.0335 0.0950 0.041 Uiso 1 1 calc R . .
C16 C 0.1220(8) -0.0052(9) -0.0391(13) 0.037(4) Uani 1 1 d . . .
C17 C 0.1485(7) 0.2021(9) 0.2040(12) 0.032(4) Uani 1 1 d . . .
C18 C 0.1026(7) 0.2498(8) 0.1921(12) 0.031(4) Uani 1 1 d . . .
H18 H 0.0799 0.2600 0.1250 0.038 Uiso 1 1 calc R . .
C19 C 0.0883(8) 0.2847(10) 0.2796(14) 0.051(5) Uani 1 1 d . . .
H19 H 0.0573 0.3196 0.2690 0.061 Uiso 1 1 calc R . .
C20 C 0.1172(8) 0.2702(10) 0.3780(13) 0.045(5) Uani 1 1 d . . .
H20 H 0.1056 0.2940 0.4346 0.053 Uiso 1 1 calc R . .
C21 C 0.1652(4) 0.2189(5) 0.3961(7) 0.034(4) Uani 1 1 d G . .
C22 C 0.1797(4) 0.1900(5) 0.3070(5) 0.032(4) Uani 1 1 d G . .
N3 N 0.2260(4) 0.1404(5) 0.3145(5) 0.028(3) Uani 1 1 d G . .
C23 C 0.2578(4) 0.1196(5) 0.4112(6) 0.032(2) Uani 1 1 d G . .
C24 C 0.2432(4) 0.1485(5) 0.5003(5) 0.032(2) Uani 1 1 d G . .
H24 H 0.2649 0.1343 0.5663 0.038 Uiso 1 1 calc R . .
C25 C 0.1969(4) 0.1981(5) 0.4928(6) 0.032(2) Uani 1 1 d G . .
H25 H 0.1870 0.2178 0.5537 0.038 Uiso 1 1 calc R . .
C26 C 0.3042(7) 0.0716(8) 0.4018(13) 0.034(4) Uani 1 1 d . . .
C27 C 0.3796(8) 0.0006(9) 0.4569(13) 0.038(5) Uani 1 1 d . . .
C28 C 0.4242(8) -0.0394(9) 0.5142(13) 0.042(5) Uani 1 1 d . . .
H28 H 0.4294 -0.0423 0.5873 0.051 Uiso 1 1 calc R . .
C29 C 0.4618(8) -0.0758(9) 0.4595(12) 0.040(5) Uani 1 1 d . . .
H29 H 0.4924 -0.1063 0.4952 0.048 Uiso 1 1 calc R . .
C30 C 0.4551(7) -0.0681(8) 0.3527(13) 0.035(4) Uani 1 1 d . . .
C31 C 0.4085(7) -0.0286(8) 0.2944(12) 0.033(4) Uani 1 1 d . . .
H31 H 0.4026 -0.0259 0.2211 0.040 Uiso 1 1 calc R . .
C32 C 0.3711(7) 0.0066(8) 0.3502(12) 0.027(4) Uani 1 1 d . . .
C33 C 0.3339(8) -0.0014(9) 0.0231(12) 0.038(5) Uani 1 1 d . . .
C34 C 0.3845(8) 0.0393(9) 0.0093(14) 0.042(5) Uani 1 1 d . . .
H34 H 0.3999 0.0740 0.0587 0.051 Uiso 1 1 calc R . .
C35 C 0.4119(8) 0.0293(9) -0.0748(14) 0.047(5) Uani 1 1 d . . .
H35 H 0.4466 0.0570 -0.0809 0.056 Uiso 1 1 calc R . .
C36 C 0.3914(10) -0.0187(9) -0.1505(14) 0.052(6) Uani 1 1 d . . .
H36 H 0.4106 -0.0223 -0.2090 0.063 Uiso 1 1 calc R . .
C37 C 0.3425(9) -0.0621(9) -0.1416(13) 0.043(5) Uani 1 1 d . . .
C38 C 0.3144(8) -0.0557(9) -0.0545(12) 0.038(4) Uani 1 1 d . . .
C39 C 0.2477(8) -0.1454(9) -0.1096(14) 0.043(5) Uani 1 1 d . . .
C40 C 0.2712(10) -0.1526(10) -0.1986(13) 0.055(6) Uani 1 1 d . . .
H40 H 0.2536 -0.1859 -0.2490 0.066 Uiso 1 1 calc R . .
C41 C 0.3205(11) -0.1118(11) -0.2160(14) 0.065(6) Uani 1 1 d . . .
H41 H 0.3381 -0.1178 -0.2759 0.078 Uiso 1 1 calc R . .
C42 C 0.2009(9) -0.1893(10) -0.0854(14) 0.051(5) Uani 1 1 d . . .
C43 C 0.1277(5) -0.2669(7) -0.1141(8) 0.054(5) Uiso 1 1 d G . .
C44 C 0.0828(6) -0.3162(7) -0.1508(8) 0.073(6) Uiso 1 1 d G A .
H44 H 0.0786 -0.3332 -0.2195 0.088 Uiso 1 1 calc R . .
C45 C 0.0442(6) -0.3405(7) -0.0868(11) 0.077(7) Uiso 1 1 d GD . .
H45 H 0.0136 -0.3742 -0.1119 0.093 Uiso 0.763(12) 1 calc PR A 1
C46 C 0.0504(6) -0.3156(7) 0.0137(10) 0.082(7) Uiso 1 1 d GD A .
H46 H 0.0240 -0.3323 0.0574 0.098 Uiso 0.237(12) 1 calc PR A 2
C47 C 0.0952(6) -0.2664(7) 0.0504(7) 0.052(5) Uiso 1 1 d G . .
H47 H 0.0995 -0.2494 0.1191 0.062 Uiso 1 1 calc R A .
C48 C 0.1339(5) -0.2420(6) -0.0135(9) 0.053(5) Uiso 1 1 d G A .
C49 C 0.1735(8) -0.0088(8) 0.2877(14) 0.042(3) Uani 1 1 d . . .
C50 C 0.1252(8) 0.0269(8) 0.3251(14) 0.042(3) Uani 1 1 d . . .
H50 H 0.1013 0.0604 0.2818 0.051 Uiso 1 1 calc R . .
C51 C 0.1118(10) 0.0140(11) 0.4244(15) 0.065(6) Uani 1 1 d . . .
H51 H 0.0769 0.0359 0.4426 0.078 Uiso 1 1 calc R . .
C52 C 0.1475(8) -0.0294(9) 0.4964(15) 0.050(5) Uani 1 1 d . . .
H52 H 0.1409 -0.0321 0.5656 0.059 Uiso 1 1 calc R . .
C53 C 0.1929(8) -0.0686(8) 0.4641(14) 0.044(5) Uani 1 1 d . . .
C54 C 0.2058(8) -0.0596(9) 0.3593(12) 0.038(5) Uani 1 1 d . . .
C55 C 0.2832(9) -0.1424(9) 0.3905(12) 0.040(5) Uani 1 1 d . . .
C56 C 0.2747(8) -0.1540(9) 0.4925(13) 0.044(5) Uani 1 1 d . . .
H56 H 0.2997 -0.1866 0.5358 0.053 Uiso 1 1 calc R . .
C57 C 0.2305(9) -0.1182(10) 0.5275(14) 0.051(5) Uani 1 1 d . . .
H57 H 0.2242 -0.1262 0.5959 0.062 Uiso 1 1 calc R . .
C58 C 0.3269(8) -0.1828(8) 0.3465(13) 0.036(4) Uani 1 1 d . . .
C59 C 0.3781(8) -0.2156(9) 0.2269(14) 0.045(5) Uani 1 1 d . . .
C60 C 0.3986(8) -0.2279(9) 0.1367(13) 0.045(5) Uani 1 1 d . . .
H60 H 0.3817 -0.2044 0.0743 0.054 Uiso 1 1 calc R . .
C61 C 0.4449(8) -0.2763(9) 0.1413(14) 0.044(5) Uani 1 1 d . . .
H61 H 0.4608 -0.2868 0.0809 0.053 Uiso 1 1 calc R . .
C62 C 0.4687(8) -0.3103(9) 0.2352(14) 0.045(5) Uani 1 1 d . . .
C63 C 0.4492(8) -0.2964(9) 0.3258(12) 0.041(5) Uani 1 1 d . . .
H63 H 0.4672 -0.3186 0.3887 0.049 Uiso 1 1 calc R . .
C64 C 0.4015(9) -0.2482(8) 0.3216(13) 0.041(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'
Na Na 0.0362 0.0249 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Yb Yb -0.3850 5.5486 '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
O1 Yb1 O5 96.3(4) . . ?
O1 Yb1 O7 155.4(4) . . ?
O5 Yb1 O7 84.7(4) . . ?
O1 Yb1 O3 94.1(4) . . ?
O5 Yb1 O3 154.9(4) . . ?
O7 Yb1 O3 95.2(4) . . ?
O1 Yb1 N1 68.5(4) . . ?
O5 Yb1 N1 78.5(4) . . ?
O7 Yb1 N1 135.1(4) . . ?
O3 Yb1 N1 84.2(4) . . ?
O1 Yb1 N3 83.0(3) . . ?
O5 Yb1 N3 136.4(3) . . ?
O7 Yb1 N3 79.6(3) . . ?
O3 Yb1 N3 67.6(3) . . ?
N1 Yb1 N3 138.3(3) . . ?
O1 Yb1 N2 132.0(4) . . ?
O5 Yb1 N2 79.3(4) . . ?
O7 Yb1 N2 72.3(4) . . ?
O3 Yb1 N2 76.8(4) . . ?
N1 Yb1 N2 63.9(4) . . ?
N3 Yb1 N2 131.9(4) . . ?
O1 Yb1 N4 77.5(4) . . ?
O5 Yb1 N4 73.4(4) . . ?
O7 Yb1 N4 79.3(4) . . ?
O3 Yb1 N4 131.4(4) . . ?
N1 Yb1 N4 132.6(4) . . ?
N3 Yb1 N4 63.9(3) . . ?
N2 Yb1 N4 142.0(4) . . ?
O1 Yb1 C1 20.5(3) . . ?
O5 Yb1 C1 89.6(4) . . ?
O7 Yb1 C1 172.3(4) . . ?
O3 Yb1 C1 92.2(4) . . ?
N1 Yb1 C1 48.0(4) . . ?
N3 Yb1 C1 101.2(3) . . ?
N2 Yb1 C1 111.7(4) . . ?
N4 Yb1 C1 94.1(4) . . ?
O1 Yb1 C17 90.0(4) . . ?
O5 Yb1 C17 173.2(4) . . ?
O7 Yb1 C17 90.7(4) . . ?
O3 Yb1 C17 20.7(4) . . ?
N1 Yb1 C17 101.6(4) . . ?
N3 Yb1 C17 46.9(3) . . ?
N2 Yb1 C17 94.6(4) . . ?
N4 Yb1 C17 110.7(4) . . ?
C1 Yb1 C17 95.4(4) . . ?
O1 Yb1 Na1 135.5(3) . . ?
O5 Yb1 Na1 42.2(3) . . ?
O7 Yb1 Na1 42.8(3) . . ?
O3 Yb1 Na1 130.2(3) . . ?
N1 Yb1 Na1 107.1(3) . . ?
N3 Yb1 Na1 114.5(2) . . ?
N2 Yb1 Na1 66.7(3) . . ?
N4 Yb1 Na1 75.4(3) . . ?
C1 Yb1 Na1 131.8(3) . . ?
C17 Yb1 Na1 132.5(3) . . ?
O5 Na1 O7 79.3(4) . . ?
O5 Na1 N5 68.4(4) . . ?
O7 Na1 N5 126.7(5) . . ?
O5 Na1 N7 109.8(4) . . ?
O7 Na1 N7 67.8(4) . . ?
N5 Na1 N7 162.9(5) . . ?
O5 Na1 O8 102.4(4) . . ?
O7 Na1 O8 127.5(4) . . ?
N5 Na1 O8 100.9(4) . . ?
N7 Na1 O8 62.4(4) . . ?
O5 Na1 N6 130.9(4) . . ?
O7 Na1 N6 122.2(5) . . ?
N5 Na1 N6 63.6(5) . . ?
N7 Na1 N6 119.1(5) . . ?
O8 Na1 N6 96.4(4) . . ?
O5 Na1 Yb1 39.7(3) . . ?
O7 Na1 Yb1 39.9(3) . . ?
N5 Na1 Yb1 96.1(4) . . ?
N7 Na1 Yb1 91.6(3) . . ?
O8 Na1 Yb1 125.7(3) . . ?
N6 Na1 Yb1 136.8(3) . . ?
C1 O1 Yb1 123.8(9) . . ?
C11 O2 C10 103.1(12) . . ?
C17 O3 Yb1 122.6(9) . . ?
C26 O4 C27 103.7(12) . . ?
C33 O5 Yb1 134.5(9) . . ?
C33 O5 Na1 116.9(10) . . ?
Yb1 O5 Na1 98.1(4) . . ?
C43 O6 C42 105.7(14) . . ?
C49 O7 Yb1 133.3(10) . . ?
C49 O7 Na1 115.3(10) . . ?
Yb1 O7 Na1 97.3(4) . . ?
C58 O8 C59 105.1(12) . . ?
C58 O8 Na1 115.8(9) . . ?
C59 O8 Na1 139.1(10) . . ?
C7 N1 C6 117.5(13) . . ?
C7 N1 Yb1 126.4(10) . . ?
C6 N1 Yb1 116.0(9) . . ?
C10 N2 C16 106.2(13) . . ?
C10 N2 Yb1 112.6(10) . . ?
C16 N2 Yb1 140.7(10) . . ?
C26 N4 C32 104.2(12) . . ?
C26 N4 Yb1 112.7(10) . . ?
C32 N4 Yb1 141.9(10) . . ?
C39 N5 C38 116.0(14) . . ?
C39 N5 Na1 127.7(12) . . ?
C38 N5 Na1 115.5(11) . . ?
C42 N6 C48 102.2(14) . . ?
C42 N6 Na1 107.9(11) . . ?
C48 N6 Na1 149.4(10) . . ?
C55 N7 C54 119.5(14) . . ?
C55 N7 Na1 127.1(11) . . ?
C54 N7 Na1 112.9(11) . . ?
C58 N8 C64 105.1(14) . . ?
O1 C1 C2 126.6(14) . . ?
O1 C1 C6 117.1(13) . . ?
C2 C1 C6 116.3(13) . . ?
C2 C1 Yb1 162.1(11) . . ?
C6 C1 Yb1 81.5(8) . . ?
C1 C2 C3 121.9(14) . . ?
C1 C2 H2 119.1 . . ?
C3 C2 H2 119.1 . . ?
C2 C3 C4 122.5(15) . . ?
C2 C3 H3 118.7 . . ?
C4 C3 H3 118.7 . . ?
C3 C4 C5 119.6(14) . . ?
C3 C4 H4 120.2 . . ?
C5 C4 H4 120.2 . . ?
C9 C5 C6 117.7(14) . . ?
C9 C5 C4 125.5(14) . . ?
C6 C5 C4 116.7(14) . . ?
N1 C6 C5 122.6(13) . . ?
N1 C6 C1 114.5(13) . . ?
C5 C6 C1 122.9(13) . . ?
N1 C7 C8 122.3(15) . . ?
N1 C7 C10 109.9(14) . . ?
C8 C7 C10 127.3(16) . . ?
C9 C8 C7 121.0(16) . . ?
C9 C8 H8 119.5 . . ?
C7 C8 H8 119.5 . . ?
C8 C9 C5 118.6(14) . . ?
C8 C9 H9 120.7 . . ?
C5 C9 H9 120.7 . . ?
N2 C10 O2 112.9(15) . . ?
N2 C10 C7 126.7(15) . . ?
O2 C10 C7 120.5(15) . . ?
C16 C11 O2 109.8(15) . . ?
C16 C11 C12 123.6(18) . . ?
O2 C11 C12 126.5(16) . . ?
C11 C12 C13 114.3(18) . . ?
C11 C12 H12 122.8 . . ?
C13 C12 H12 122.8 . . ?
C12 C13 C14 121.1(17) . . ?
C12 C13 H13 119.4 . . ?
C14 C13 H13 119.4 . . ?
C15 C14 C13 122.3(16) . . ?
C15 C14 Cl1 121.4(15) . . ?
C13 C14 Cl1 116.3(14) . . ?
C14 C15 C16 117.6(16) . . ?
C14 C15 H15 121.2 . . ?
C16 C15 H15 121.2 . . ?
C11 C16 N2 108.0(15) . . ?
C11 C16 C15 121.0(16) . . ?
N2 C16 C15 131.0(15) . . ?
O3 C17 C18 123.8(14) . . ?
O3 C17 C22 120.1(13) . . ?
C18 C17 C22 116.1(13) . . ?
C18 C17 Yb1 160.5(11) . . ?
C22 C17 Yb1 83.4(8) . . ?
C17 C18 C19 120.2(15) . . ?
C17 C18 H18 119.9 . . ?
C19 C18 H18 119.9 . . ?
C20 C19 C18 122.6(16) . . ?
C20 C19 H19 118.7 . . ?
C18 C19 H19 118.7 . . ?
C19 C20 C21 119.9(15) . . ?
C19 C20 H20 120.1 . . ?
C21 C20 H20 120.1 . . ?
C22 C21 C25 120.0 . . ?
C22 C21 C20 114.6(9) . . ?
C25 C21 C20 125.4(9) . . ?
C21 C22 N3 120.0 . . ?
C21 C22 C17 126.3(9) . . ?
N3 C22 C17 113.5(9) . . ?
C23 N3 C22 120.0 . . ?
C23 N3 Yb1 123.8(4) . . ?
C22 N3 Yb1 116.1(4) . . ?
C24 C23 N3 120.0 . . ?
C24 C23 C26 128.9(9) . . ?
N3 C23 C26 111.1(9) . . ?
C23 C24 C25 120.0 . . ?
C23 C24 H24 120.0 . . ?
C25 C24 H24 120.0 . . ?
C24 C25 C21 120.0 . . ?
C24 C25 H25 120.0 . . ?
C21 C25 H25 120.0 . . ?
N4 C26 O4 115.1(14) . . ?
N4 C26 C23 127.2(14) . . ?
O4 C26 C23 117.7(13) . . ?
C28 C27 O4 128.2(15) . . ?
C28 C27 C32 123.6(16) . . ?
O4 C27 C32 108.2(15) . . ?
C27 C28 C29 116.1(16) . . ?
C27 C28 H28 121.9 . . ?
C29 C28 H28 121.9 . . ?
C28 C29 C30 120.7(15) . . ?
C28 C29 H29 119.7 . . ?
C30 C29 H29 119.7 . . ?
C31 C30 C29 122.7(15) . . ?
C31 C30 Cl2 118.3(13) . . ?
C29 C30 Cl2 118.9(12) . . ?
C32 C31 C30 115.5(14) . . ?
C32 C31 H31 122.3 . . ?
C30 C31 H31 122.3 . . ?
C31 C32 C27 121.2(15) . . ?
C31 C32 N4 130.0(14) . . ?
C27 C32 N4 108.8(13) . . ?
O5 C33 C34 124.9(15) . . ?
O5 C33 C38 118.9(16) . . ?
C34 C33 C38 116.2(15) . . ?
C35 C34 C33 120.7(17) . . ?
C35 C34 H34 119.6 . . ?
C33 C34 H34 119.6 . . ?
C36 C35 C34 123.0(17) . . ?
C36 C35 H35 118.5 . . ?
C34 C35 H35 118.5 . . ?
C35 C36 C37 119.9(16) . . ?
C35 C36 H36 120.0 . . ?
C37 C36 H36 120.0 . . ?
C41 C37 C36 121.9(17) . . ?
C41 C37 C38 119.0(19) . . ?
C36 C37 C38 119.1(16) . . ?
N5 C38 C37 123.5(16) . . ?
N5 C38 C33 115.6(15) . . ?
C37 C38 C33 120.9(17) . . ?
N5 C39 C40 123.5(18) . . ?
N5 C39 C42 113.7(16) . . ?
C40 C39 C42 122.7(18) . . ?
C39 C40 C41 121.0(18) . . ?
C39 C40 H40 119.5 . . ?
C41 C40 H40 119.5 . . ?
C37 C41 C40 116.8(18) . . ?
C37 C41 H41 121.6 . . ?
C40 C41 H41 121.6 . . ?
N6 C42 O6 113.7(18) . . ?
N6 C42 C39 126.6(17) . . ?
O6 C42 C39 119.7(17) . . ?
O6 C43 C44 132.2(10) . . ?
O6 C43 C48 107.8(10) . . ?
C44 C43 C48 120.0 . . ?
C43 C44 C45 120.0 . . ?
C43 C44 H44 120.0 . . ?
C45 C44 H44 120.0 . . ?
C46 C45 C44 120.0 . . ?
C46 C45 Cl3B 102.4(10) . . ?
C44 C45 Cl3B 137.2(10) . . ?
C46 C45 H45 120.0 . . ?
C44 C45 H45 120.0 . . ?
C45 C46 C47 120.0 . . ?
C45 C46 Cl3A 116.0(9) . . ?
C47 C46 Cl3A 123.9(9) . . ?
C45 C46 H46 120.0 . . ?
C47 C46 H46 120.0 . . ?
C46 C47 C48 120.0 . . ?
C46 C47 H47 120.0 . . ?
C48 C47 H47 120.0 . . ?
C47 C48 C43 120.0 . . ?
C47 C48 N6 129.4(10) . . ?
C43 C48 N6 110.6(10) . . ?
O7 C49 C50 125.7(15) . . ?
O7 C49 C54 120.1(15) . . ?
C50 C49 C54 114.1(16) . . ?
C51 C50 C49 122.2(16) . . ?
C51 C50 H50 118.9 . . ?
C49 C50 H50 118.9 . . ?
C52 C51 C50 123.0(17) . . ?
C52 C51 H51 118.5 . . ?
C50 C51 H51 118.5 . . ?
C53 C52 C51 117.9(18) . . ?
C53 C52 H52 121.1 . . ?
C51 C52 H52 121.1 . . ?
C52 C53 C57 124.0(17) . . ?
C52 C53 C54 120.4(17) . . ?
C57 C53 C54 115.6(15) . . ?
N7 C54 C49 116.9(15) . . ?
N7 C54 C53 121.1(16) . . ?
C49 C54 C53 121.9(16) . . ?
N7 C55 C56 123.3(17) . . ?
N7 C55 C58 115.3(14) . . ?
C56 C55 C58 121.2(17) . . ?
C57 C56 C55 118.8(17) . . ?
C57 C56 H56 120.6 . . ?
C55 C56 H56 120.6 . . ?
C56 C57 C53 121.5(17) . . ?
C56 C57 H57 119.3 . . ?
C53 C57 H57 119.3 . . ?
N8 C58 O8 114.3(15) . . ?
N8 C58 C55 126.6(16) . . ?
O8 C58 C55 118.9(14) . . ?
C60 C59 O8 129.0(17) . . ?
C60 C59 C64 124.5(18) . . ?
O8 C59 C64 106.4(14) . . ?
C59 C60 C61 116.4(17) . . ?
C59 C60 H60 121.8 . . ?
C61 C60 H60 121.8 . . ?
C60 C61 C62 120.2(16) . . ?
C60 C61 H61 119.9 . . ?
C62 C61 H61 119.9 . . ?
C63 C62 C61 123.1(17) . . ?
C63 C62 Cl4 120.1(13) . . ?
C61 C62 Cl4 116.7(14) . . ?
C62 C63 C64 117.1(15) . . ?
C62 C63 H63 121.5 . . ?
C64 C63 H63 121.5 . . ?
C63 C64 N8 132.3(16) . . ?
C63 C64 C59 118.7(16) . . ?
N8 C64 C59 109.0(16) . . ?
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
Yb1 O1 2.229(10) . ?
Yb1 O5 2.248(10) . ?
Yb1 O7 2.254(10) . ?
Yb1 O3 2.264(10) . ?
Yb1 N1 2.466(12) . ?
Yb1 N3 2.486(6) . ?
Yb1 N2 2.607(12) . ?
Yb1 N4 2.634(12) . ?
Yb1 C1 3.176(15) . ?
Yb1 C17 3.192(16) . ?
Yb1 Na1 3.485(6) . ?
Na1 O5 2.364(12) . ?
Na1 O7 2.387(12) . ?
Na1 N5 2.444(13) . ?
Na1 N7 2.473(14) . ?
Na1 O8 2.684(13) . ?
Na1 N6 2.801(15) . ?
Cl1 C14 1.741(17) . ?
Cl2 C30 1.763(16) . ?
Cl3A C46 1.650(11) . ?
Cl3B C45 1.735(16) . ?
Cl4 C62 1.720(19) . ?
O1 C1 1.340(16) . ?
O2 C11 1.39(2) . ?
O2 C10 1.411(19) . ?
O3 C17 1.339(17) . ?
O4 C26 1.377(18) . ?
O4 C27 1.385(18) . ?
O5 C33 1.336(18) . ?
O6 C43 1.363(15) . ?
O6 C42 1.38(2) . ?
O7 C49 1.280(19) . ?
O8 C58 1.376(19) . ?
O8 C59 1.394(19) . ?
N1 C7 1.327(19) . ?
N1 C6 1.360(17) . ?
N2 C10 1.320(19) . ?
N2 C16 1.40(2) . ?
N4 C26 1.313(19) . ?
N4 C32 1.404(19) . ?
N5 C39 1.34(2) . ?
N5 C38 1.37(2) . ?
N6 C42 1.37(2) . ?
N6 C48 1.405(16) . ?
N7 C55 1.33(2) . ?
N7 C54 1.35(2) . ?
N8 C58 1.31(2) . ?
N8 C64 1.40(2) . ?
C1 C2 1.38(2) . ?
C1 C6 1.47(2) . ?
C2 C3 1.39(2) . ?
C2 H2 0.9500 . ?
C3 C4 1.40(2) . ?
C3 H3 0.9500 . ?
C4 C5 1.44(2) . ?
C4 H4 0.9500 . ?
C5 C9 1.39(2) . ?
C5 C6 1.43(2) . ?
C7 C8 1.39(2) . ?
C7 C10 1.44(2) . ?
C8 C9 1.36(2) . ?
C8 H8 0.9500 . ?
C9 H9 0.9500 . ?
C11 C16 1.37(2) . ?
C11 C12 1.40(2) . ?
C12 C13 1.40(3) . ?
C12 H12 0.9500 . ?
C13 C14 1.43(3) . ?
C13 H13 0.9500 . ?
C14 C15 1.33(2) . ?
C15 C16 1.40(2) . ?
C15 H15 0.9500 . ?
C17 C18 1.36(2) . ?
C17 C22 1.420(17) . ?
C18 C19 1.42(2) . ?
C18 H18 0.9500 . ?
C19 C20 1.36(2) . ?
C19 H19 0.9500 . ?
C20 C21 1.436(19) . ?
C20 H20 0.9500 . ?
C21 C22 1.3900 . ?
C21 C25 1.3900 . ?
C22 N3 1.3900 . ?
N3 C23 1.3900 . ?
C23 C24 1.3900 . ?
C23 C26 1.404(18) . ?
C24 C25 1.3900 . ?
C24 H24 0.9500 . ?
C25 H25 0.9500 . ?
C27 C28 1.36(2) . ?
C27 C32 1.39(2) . ?
C28 C29 1.39(2) . ?
C28 H28 0.9500 . ?
C29 C30 1.39(2) . ?
C29 H29 0.9500 . ?
C30 C31 1.39(2) . ?
C31 C32 1.38(2) . ?
C31 H31 0.9500 . ?
C33 C34 1.41(2) . ?
C33 C38 1.47(2) . ?
C34 C35 1.37(2) . ?
C34 H34 0.9500 . ?
C35 C36 1.37(2) . ?
C35 H35 0.9500 . ?
C36 C37 1.39(2) . ?
C36 H36 0.9500 . ?
C37 C41 1.39(3) . ?
C37 C38 1.41(2) . ?
C39 C40 1.38(2) . ?
C39 C42 1.42(3) . ?
C40 C41 1.40(3) . ?
C40 H40 0.9500 . ?
C41 H41 0.9500 . ?
C43 C44 1.3900 . ?
C43 C48 1.3900 . ?
C44 C45 1.3900 . ?
C44 H44 0.9500 . ?
C45 C46 1.3900 . ?
C45 H45 0.9500 . ?
C46 C47 1.3900 . ?
C46 H46 0.9500 . ?
C47 C48 1.3900 . ?
C47 H47 0.9500 . ?
C49 C50 1.43(2) . ?
C49 C54 1.45(2) . ?
C50 C51 1.42(2) . ?
C50 H50 0.9500 . ?
C51 C52 1.39(3) . ?
C51 H51 0.9500 . ?
C52 C53 1.39(2) . ?
C52 H52 0.9500 . ?
C53 C57 1.43(2) . ?
C53 C54 1.47(2) . ?
C55 C56 1.41(2) . ?
C55 C58 1.45(2) . ?
C56 C57 1.35(2) . ?
C56 H56 0.9500 . ?
C57 H57 0.9500 . ?
C59 C60 1.37(2) . ?
C59 C64 1.40(2) . ?
C60 C61 1.38(2) . ?
C60 H60 0.9500 . ?
C61 C62 1.41(2) . ?
C61 H61 0.9500 . ?
C62 C63 1.37(2) . ?
C63 C64 1.40(2) . ?
C63 H63 0.9500 . ?
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
O1 Yb1 Na1 O5 -27.0(5) . . . . ?
O7 Yb1 Na1 O5 -171.2(6) . . . . ?
O3 Yb1 Na1 O5 146.4(5) . . . . ?
N1 Yb1 Na1 O5 49.4(5) . . . . ?
N3 Yb1 Na1 O5 -133.0(4) . . . . ?
N2 Yb1 Na1 O5 100.0(5) . . . . ?
N4 Yb1 Na1 O5 -81.2(5) . . . . ?
C1 Yb1 Na1 O5 1.0(6) . . . . ?
C17 Yb1 Na1 O5 173.9(5) . . . . ?
O1 Yb1 Na1 O7 144.2(5) . . . . ?
O5 Yb1 Na1 O7 171.2(6) . . . . ?
O3 Yb1 Na1 O7 -42.4(5) . . . . ?
N1 Yb1 Na1 O7 -139.4(5) . . . . ?
N3 Yb1 Na1 O7 38.2(5) . . . . ?
N2 Yb1 Na1 O7 -88.8(5) . . . . ?
N4 Yb1 Na1 O7 90.0(5) . . . . ?
C1 Yb1 Na1 O7 172.2(5) . . . . ?
C17 Yb1 Na1 O7 -14.9(6) . . . . ?
O1 Yb1 Na1 N5 -71.9(5) . . . . ?
O5 Yb1 Na1 N5 -44.9(5) . . . . ?
O7 Yb1 Na1 N5 143.9(6) . . . . ?
O3 Yb1 Na1 N5 101.5(5) . . . . ?
N1 Yb1 Na1 N5 4.5(5) . . . . ?
N3 Yb1 Na1 N5 -177.9(4) . . . . ?
N2 Yb1 Na1 N5 55.1(5) . . . . ?
N4 Yb1 Na1 N5 -126.1(5) . . . . ?
C1 Yb1 Na1 N5 -43.9(5) . . . . ?
C17 Yb1 Na1 N5 129.0(5) . . . . ?
O1 Yb1 Na1 N7 92.8(5) . . . . ?
O5 Yb1 Na1 N7 119.8(5) . . . . ?
O7 Yb1 Na1 N7 -51.4(5) . . . . ?
O3 Yb1 Na1 N7 -93.8(5) . . . . ?
N1 Yb1 Na1 N7 169.2(4) . . . . ?
N3 Yb1 Na1 N7 -13.2(4) . . . . ?
N2 Yb1 Na1 N7 -140.2(5) . . . . ?
N4 Yb1 Na1 N7 38.6(4) . . . . ?
C1 Yb1 Na1 N7 120.8(5) . . . . ?
C17 Yb1 Na1 N7 -66.3(5) . . . . ?
O1 Yb1 Na1 O8 36.2(5) . . . . ?
O5 Yb1 Na1 O8 63.2(5) . . . . ?
O7 Yb1 Na1 O8 -108.0(5) . . . . ?
O3 Yb1 Na1 O8 -150.4(5) . . . . ?
N1 Yb1 Na1 O8 112.6(5) . . . . ?
N3 Yb1 Na1 O8 -69.8(4) . . . . ?
N2 Yb1 Na1 O8 163.2(5) . . . . ?
N4 Yb1 Na1 O8 -18.0(4) . . . . ?
C1 Yb1 Na1 O8 64.2(5) . . . . ?
C17 Yb1 Na1 O8 -122.8(5) . . . . ?
O1 Yb1 Na1 N6 -129.3(6) . . . . ?
O5 Yb1 Na1 N6 -102.3(7) . . . . ?
O7 Yb1 Na1 N6 86.5(7) . . . . ?
O3 Yb1 Na1 N6 44.1(6) . . . . ?
N1 Yb1 Na1 N6 -52.9(6) . . . . ?
N3 Yb1 Na1 N6 124.7(6) . . . . ?
N2 Yb1 Na1 N6 -2.3(6) . . . . ?
N4 Yb1 Na1 N6 176.5(6) . . . . ?
C1 Yb1 Na1 N6 -101.3(6) . . . . ?
C17 Yb1 Na1 N6 71.6(7) . . . . ?
O5 Yb1 O1 C1 71.7(10) . . . . ?
O7 Yb1 O1 C1 162.6(10) . . . . ?
O3 Yb1 O1 C1 -85.4(10) . . . . ?
N1 Yb1 O1 C1 -3.3(10) . . . . ?
N3 Yb1 O1 C1 -152.2(10) . . . . ?
N2 Yb1 O1 C1 -9.6(12) . . . . ?
N4 Yb1 O1 C1 143.0(11) . . . . ?
C17 Yb1 O1 C1 -105.7(10) . . . . ?
Na1 Yb1 O1 C1 89.5(10) . . . . ?
O1 Yb1 O3 C17 -79.0(11) . . . . ?
O5 Yb1 O3 C17 166.6(10) . . . . ?
O7 Yb1 O3 C17 78.2(11) . . . . ?
N1 Yb1 O3 C17 -146.9(11) . . . . ?
N3 Yb1 O3 C17 1.7(10) . . . . ?
N2 Yb1 O3 C17 148.7(11) . . . . ?
N4 Yb1 O3 C17 -2.1(12) . . . . ?
C1 Yb1 O3 C17 -99.5(11) . . . . ?
Na1 Yb1 O3 C17 105.6(10) . . . . ?
O1 Yb1 O5 C33 -57.5(14) . . . . ?
O7 Yb1 O5 C33 147.2(14) . . . . ?
O3 Yb1 O5 C33 56.4(17) . . . . ?
N1 Yb1 O5 C33 9.0(13) . . . . ?
N3 Yb1 O5 C33 -144.0(13) . . . . ?
N2 Yb1 O5 C33 74.2(14) . . . . ?
N4 Yb1 O5 C33 -132.4(14) . . . . ?
C1 Yb1 O5 C33 -38.0(14) . . . . ?
Na1 Yb1 O5 C33 141.2(15) . . . . ?
O1 Yb1 O5 Na1 161.3(4) . . . . ?
O7 Yb1 O5 Na1 6.0(4) . . . . ?
O3 Yb1 O5 Na1 -84.8(9) . . . . ?
N1 Yb1 O5 Na1 -132.2(5) . . . . ?
N3 Yb1 O5 Na1 74.8(6) . . . . ?
N2 Yb1 O5 Na1 -67.0(4) . . . . ?
N4 Yb1 O5 Na1 86.4(4) . . . . ?
C1 Yb1 O5 Na1 -179.2(4) . . . . ?
O7 Na1 O5 C33 -155.7(10) . . . . ?
N5 Na1 O5 C33 -18.9(10) . . . . ?
N7 Na1 O5 C33 142.9(10) . . . . ?
O8 Na1 O5 C33 78.0(10) . . . . ?
N6 Na1 O5 C33 -32.0(12) . . . . ?
Yb1 Na1 O5 C33 -149.9(11) . . . . ?
O7 Na1 O5 Yb1 -5.7(4) . . . . ?
N5 Na1 O5 Yb1 131.0(5) . . . . ?
N7 Na1 O5 Yb1 -67.2(5) . . . . ?
O8 Na1 O5 Yb1 -132.1(4) . . . . ?
N6 Na1 O5 Yb1 117.9(5) . . . . ?
O1 Yb1 O7 C49 36.1(19) . . . . ?
O5 Yb1 O7 C49 129.6(14) . . . . ?
O3 Yb1 O7 C49 -75.6(14) . . . . ?
N1 Yb1 O7 C49 -162.6(13) . . . . ?
N3 Yb1 O7 C49 -9.6(14) . . . . ?
N2 Yb1 O7 C49 -150.0(15) . . . . ?
N4 Yb1 O7 C49 55.6(14) . . . . ?
C17 Yb1 O7 C49 -55.4(14) . . . . ?
Na1 Yb1 O7 C49 135.5(16) . . . . ?
O1 Yb1 O7 Na1 -99.4(8) . . . . ?
O5 Yb1 O7 Na1 -5.9(4) . . . . ?
O3 Yb1 O7 Na1 148.9(4) . . . . ?
N1 Yb1 O7 Na1 61.9(6) . . . . ?
N3 Yb1 O7 Na1 -145.1(4) . . . . ?
N2 Yb1 O7 Na1 74.5(4) . . . . ?
N4 Yb1 O7 Na1 -79.9(4) . . . . ?
C17 Yb1 O7 Na1 169.1(4) . . . . ?
O5 Na1 O7 C49 -140.0(11) . . . . ?
N5 Na1 O7 C49 167.4(11) . . . . ?
N7 Na1 O7 C49 -23.2(11) . . . . ?
O8 Na1 O7 C49 -42.4(13) . . . . ?
N6 Na1 O7 C49 88.1(12) . . . . ?
Yb1 Na1 O7 C49 -145.7(13) . . . . ?
O5 Na1 O7 Yb1 5.7(4) . . . . ?
N5 Na1 O7 Yb1 -46.9(7) . . . . ?
N7 Na1 O7 Yb1 122.4(5) . . . . ?
O8 Na1 O7 Yb1 103.2(5) . . . . ?
N6 Na1 O7 Yb1 -126.2(5) . . . . ?
O5 Na1 O8 C58 112.0(10) . . . . ?
O7 Na1 O8 C58 26.0(12) . . . . ?
N5 Na1 O8 C58 -178.0(10) . . . . ?
N7 Na1 O8 C58 5.9(10) . . . . ?
N6 Na1 O8 C58 -113.6(10) . . . . ?
Yb1 Na1 O8 C58 76.3(10) . . . . ?
O5 Na1 O8 C59 -69.5(15) . . . . ?
O7 Na1 O8 C59 -155.5(14) . . . . ?
N5 Na1 O8 C59 0.5(16) . . . . ?
N7 Na1 O8 C59 -175.6(16) . . . . ?
N6 Na1 O8 C59 64.9(15) . . . . ?
Yb1 Na1 O8 C59 -105.2(15) . . . . ?
O1 Yb1 N1 C7 178.0(13) . . . . ?
O5 Yb1 N1 C7 76.4(12) . . . . ?
O7 Yb1 N1 C7 6.3(15) . . . . ?
O3 Yb1 N1 C7 -85.2(12) . . . . ?
N3 Yb1 N1 C7 -131.7(12) . . . . ?
N2 Yb1 N1 C7 -7.2(12) . . . . ?
N4 Yb1 N1 C7 130.7(12) . . . . ?
C1 Yb1 N1 C7 176.5(14) . . . . ?
C17 Yb1 N1 C7 -96.6(12) . . . . ?
Na1 Yb1 N1 C7 45.1(13) . . . . ?
O1 Yb1 N1 C6 2.9(9) . . . . ?
O5 Yb1 N1 C6 -98.7(10) . . . . ?
O7 Yb1 N1 C6 -168.9(9) . . . . ?
O3 Yb1 N1 C6 99.6(10) . . . . ?
N3 Yb1 N1 C6 53.2(12) . . . . ?
N2 Yb1 N1 C6 177.7(11) . . . . ?
N4 Yb1 N1 C6 -44.4(12) . . . . ?
C1 Yb1 N1 C6 1.4(9) . . . . ?
C17 Yb1 N1 C6 88.3(10) . . . . ?
Na1 Yb1 N1 C6 -130.0(9) . . . . ?
O1 Yb1 N2 C10 12.6(13) . . . . ?
O5 Yb1 N2 C10 -76.2(11) . . . . ?
O7 Yb1 N2 C10 -164.0(11) . . . . ?
O3 Yb1 N2 C10 96.1(11) . . . . ?
N1 Yb1 N2 C10 6.1(10) . . . . ?
N3 Yb1 N2 C10 138.7(10) . . . . ?
N4 Yb1 N2 C10 -120.5(11) . . . . ?
C1 Yb1 N2 C10 9.0(12) . . . . ?
C17 Yb1 N2 C10 106.7(11) . . . . ?
Na1 Yb1 N2 C10 -118.5(11) . . . . ?
O1 Yb1 N2 C16 -176.9(15) . . . . ?
O5 Yb1 N2 C16 94.2(16) . . . . ?
O7 Yb1 N2 C16 6.4(16) . . . . ?
O3 Yb1 N2 C16 -93.5(16) . . . . ?
N1 Yb1 N2 C16 176.5(17) . . . . ?
N3 Yb1 N2 C16 -50.9(18) . . . . ?
N4 Yb1 N2 C16 50.0(18) . . . . ?
C1 Yb1 N2 C16 179.4(15) . . . . ?
C17 Yb1 N2 C16 -82.8(16) . . . . ?
Na1 Yb1 N2 C16 51.9(16) . . . . ?
O1 Yb1 N4 C26 97.4(10) . . . . ?
O5 Yb1 N4 C26 -162.0(11) . . . . ?
O7 Yb1 N4 C26 -74.4(10) . . . . ?
O3 Yb1 N4 C26 13.0(12) . . . . ?
N1 Yb1 N4 C26 141.9(10) . . . . ?
N3 Yb1 N4 C26 9.2(10) . . . . ?
N2 Yb1 N4 C26 -116.3(11) . . . . ?
C1 Yb1 N4 C26 109.6(10) . . . . ?
C17 Yb1 N4 C26 12.2(11) . . . . ?
Na1 Yb1 N4 C26 -118.1(10) . . . . ?
O1 Yb1 N4 C32 -98.0(15) . . . . ?
O5 Yb1 N4 C32 2.6(15) . . . . ?
O7 Yb1 N4 C32 90.2(15) . . . . ?
O3 Yb1 N4 C32 177.6(14) . . . . ?
N1 Yb1 N4 C32 -53.5(17) . . . . ?
N3 Yb1 N4 C32 173.8(16) . . . . ?
N2 Yb1 N4 C32 48.3(17) . . . . ?
C1 Yb1 N4 C32 -85.8(15) . . . . ?
C17 Yb1 N4 C32 176.9(14) . . . . ?
Na1 Yb1 N4 C32 46.5(15) . . . . ?
O5 Na1 N5 C39 -173.9(15) . . . . ?
O7 Na1 N5 C39 -116.8(14) . . . . ?
N7 Na1 N5 C39 99(2) . . . . ?
O8 Na1 N5 C39 86.9(14) . . . . ?
N6 Na1 N5 C39 -5.0(13) . . . . ?
Yb1 Na1 N5 C39 -144.9(13) . . . . ?
O5 Na1 N5 C38 16.2(10) . . . . ?
O7 Na1 N5 C38 73.3(12) . . . . ?
N7 Na1 N5 C38 -71(2) . . . . ?
O8 Na1 N5 C38 -83.0(11) . . . . ?
N6 Na1 N5 C38 -174.8(12) . . . . ?
Yb1 Na1 N5 C38 45.2(11) . . . . ?
O5 Na1 N6 C42 14.0(13) . . . . ?
O7 Na1 N6 C42 118.8(11) . . . . ?
N5 Na1 N6 C42 0.4(10) . . . . ?
N7 Na1 N6 C42 -160.5(10) . . . . ?
O8 Na1 N6 C42 -98.6(11) . . . . ?
Yb1 Na1 N6 C42 69.7(12) . . . . ?
O5 Na1 N6 C48 -155.6(17) . . . . ?
O7 Na1 N6 C48 -51(2) . . . . ?
N5 Na1 N6 C48 -169(2) . . . . ?
N7 Na1 N6 C48 30(2) . . . . ?
O8 Na1 N6 C48 91.8(19) . . . . ?
Yb1 Na1 N6 C48 -100.0(19) . . . . ?
O5 Na1 N7 C55 -101.4(13) . . . . ?
O7 Na1 N7 C55 -170.2(14) . . . . ?
N5 Na1 N7 C55 -20(2) . . . . ?
O8 Na1 N7 C55 -7.3(12) . . . . ?
N6 Na1 N7 C55 74.2(14) . . . . ?
Yb1 Na1 N7 C55 -137.4(13) . . . . ?
O5 Na1 N7 C54 86.9(10) . . . . ?
O7 Na1 N7 C54 18.1(9) . . . . ?
N5 Na1 N7 C54 167.9(17) . . . . ?
O8 Na1 N7 C54 -179.0(11) . . . . ?
N6 Na1 N7 C54 -97.5(10) . . . . ?
Yb1 Na1 N7 C54 50.9(10) . . . . ?
Yb1 O1 C1 C2 -176.6(12) . . . . ?
Yb1 O1 C1 C6 3.3(17) . . . . ?
O5 Yb1 C1 O1 -109.4(10) . . . . ?
O3 Yb1 C1 O1 95.7(10) . . . . ?
N1 Yb1 C1 O1 175.9(12) . . . . ?
N3 Yb1 C1 O1 28.1(10) . . . . ?
N2 Yb1 C1 O1 172.3(10) . . . . ?
N4 Yb1 C1 O1 -36.1(10) . . . . ?
C17 Yb1 C1 O1 75.2(10) . . . . ?
Na1 Yb1 C1 O1 -110.0(10) . . . . ?
O1 Yb1 C1 C2 9(3) . . . . ?
O5 Yb1 C1 C2 -101(4) . . . . ?
O3 Yb1 C1 C2 105(4) . . . . ?
N1 Yb1 C1 C2 -175(4) . . . . ?
N3 Yb1 C1 C2 37(4) . . . . ?
N2 Yb1 C1 C2 -179(3) . . . . ?
N4 Yb1 C1 C2 -27(4) . . . . ?
C17 Yb1 C1 C2 84(4) . . . . ?
Na1 Yb1 C1 C2 -101(3) . . . . ?
O1 Yb1 C1 C6 -177.0(15) . . . . ?
O5 Yb1 C1 C6 73.6(8) . . . . ?
O3 Yb1 C1 C6 -81.3(8) . . . . ?
N1 Yb1 C1 C6 -1.1(7) . . . . ?
N3 Yb1 C1 C6 -148.9(8) . . . . ?
N2 Yb1 C1 C6 -4.7(9) . . . . ?
N4 Yb1 C1 C6 146.9(8) . . . . ?
C17 Yb1 C1 C6 -101.8(8) . . . . ?
Na1 Yb1 C1 C6 73.0(9) . . . . ?
O1 C1 C2 C3 -178.4(14) . . . . ?
C6 C1 C2 C3 2(2) . . . . ?
Yb1 C1 C2 C3 175(3) . . . . ?
C1 C2 C3 C4 -1(3) . . . . ?
C2 C3 C4 C5 -1(2) . . . . ?
C3 C4 C5 C9 179.9(16) . . . . ?
C3 C4 C5 C6 2(2) . . . . ?
C7 N1 C6 C5 3(2) . . . . ?
Yb1 N1 C6 C5 178.2(11) . . . . ?
C7 N1 C6 C1 -178.0(13) . . . . ?
Yb1 N1 C6 C1 -2.4(15) . . . . ?
C9 C5 C6 N1 0(2) . . . . ?
C4 C5 C6 N1 178.6(13) . . . . ?
C9 C5 C6 C1 -179.1(14) . . . . ?
C4 C5 C6 C1 -1(2) . . . . ?
O1 C1 C6 N1 -0.3(19) . . . . ?
C2 C1 C6 N1 179.7(13) . . . . ?
Yb1 C1 C6 N1 1.7(11) . . . . ?
O1 C1 C6 C5 179.2(13) . . . . ?
C2 C1 C6 C5 -1(2) . . . . ?
Yb1 C1 C6 C5 -178.9(13) . . . . ?
C6 N1 C7 C8 -6(2) . . . . ?
Yb1 N1 C7 C8 178.9(12) . . . . ?
C6 N1 C7 C10 -178.4(13) . . . . ?
Yb1 N1 C7 C10 6.5(18) . . . . ?
N1 C7 C8 C9 7(3) . . . . ?
C10 C7 C8 C9 177.7(17) . . . . ?
C7 C8 C9 C5 -3(3) . . . . ?
C6 C5 C9 C8 0(2) . . . . ?
C4 C5 C9 C8 -178.1(16) . . . . ?
C16 N2 C10 O2 -0.6(18) . . . . ?
Yb1 N2 C10 O2 173.1(10) . . . . ?
C16 N2 C10 C7 179.9(16) . . . . ?
Yb1 N2 C10 C7 -6(2) . . . . ?
C11 O2 C10 N2 -1.5(18) . . . . ?
C11 O2 C10 C7 178.1(15) . . . . ?
N1 C7 C10 N2 1(2) . . . . ?
C8 C7 C10 N2 -171.2(16) . . . . ?
N1 C7 C10 O2 -178.8(14) . . . . ?
C8 C7 C10 O2 9(3) . . . . ?
C10 O2 C11 C16 3.0(18) . . . . ?
C10 O2 C11 C12 178.4(18) . . . . ?
C16 C11 C12 C13 -1(3) . . . . ?
O2 C11 C12 C13 -176.0(17) . . . . ?
C11 C12 C13 C14 3(3) . . . . ?
C12 C13 C14 C15 -3(3) . . . . ?
C12 C13 C14 Cl1 178.0(16) . . . . ?
C13 C14 C15 C16 1(3) . . . . ?
Cl1 C14 C15 C16 -179.8(12) . . . . ?
O2 C11 C16 N2 -3.5(19) . . . . ?
C12 C11 C16 N2 -179.1(17) . . . . ?
O2 C11 C16 C15 175.2(15) . . . . ?
C12 C11 C16 C15 0(3) . . . . ?
C10 N2 C16 C11 2.4(18) . . . . ?
Yb1 N2 C16 C11 -168.4(12) . . . . ?
C10 N2 C16 C15 -176.0(17) . . . . ?
Yb1 N2 C16 C15 13(3) . . . . ?
C14 C15 C16 C11 1(2) . . . . ?
C14 C15 C16 N2 178.8(16) . . . . ?
Yb1 O3 C17 C18 177.8(12) . . . . ?
Yb1 O3 C17 C22 -0.8(18) . . . . ?
O1 Yb1 C17 O3 101.7(11) . . . . ?
O7 Yb1 C17 O3 -102.9(11) . . . . ?
N1 Yb1 C17 O3 33.7(11) . . . . ?
N3 Yb1 C17 O3 -177.9(13) . . . . ?
N2 Yb1 C17 O3 -30.5(11) . . . . ?
N4 Yb1 C17 O3 178.3(10) . . . . ?
C1 Yb1 C17 O3 81.9(11) . . . . ?
Na1 Yb1 C17 O3 -92.8(11) . . . . ?
O1 Yb1 C17 C18 96(3) . . . . ?
O7 Yb1 C17 C18 -108(3) . . . . ?
O3 Yb1 C17 C18 -6(3) . . . . ?
N1 Yb1 C17 C18 28(3) . . . . ?
N3 Yb1 C17 C18 177(4) . . . . ?
N2 Yb1 C17 C18 -36(3) . . . . ?
N4 Yb1 C17 C18 173(3) . . . . ?
C1 Yb1 C17 C18 76(3) . . . . ?
Na1 Yb1 C17 C18 -98(3) . . . . ?
O1 Yb1 C17 C22 -79.0(8) . . . . ?
O7 Yb1 C17 C22 76.5(8) . . . . ?
O3 Yb1 C17 C22 179.3(16) . . . . ?
N1 Yb1 C17 C22 -147.0(8) . . . . ?
N3 Yb1 C17 C22 1.5(5) . . . . ?
N2 Yb1 C17 C22 148.8(8) . . . . ?
N4 Yb1 C17 C22 -2.3(9) . . . . ?
C1 Yb1 C17 C22 -98.8(8) . . . . ?
Na1 Yb1 C17 C22 86.5(8) . . . . ?
O3 C17 C18 C19 -178.4(15) . . . . ?
C22 C17 C18 C19 0(2) . . . . ?
Yb1 C17 C18 C19 -174(3) . . . . ?
C17 C18 C19 C20 -3(3) . . . . ?
C18 C19 C20 C21 1(3) . . . . ?
C19 C20 C21 C22 3(2) . . . . ?
C19 C20 C21 C25 -178.1(13) . . . . ?
C25 C21 C22 N3 0.0 . . . . ?
C20 C21 C22 N3 179.2(12) . . . . ?
C25 C21 C22 C17 174.9(12) . . . . ?
C20 C21 C22 C17 -6.0(14) . . . . ?
O3 C17 C22 C21 -176.8(9) . . . . ?
C18 C17 C22 C21 4.6(18) . . . . ?
Yb1 C17 C22 C21 -177.3(7) . . . . ?
O3 C17 C22 N3 -1.6(17) . . . . ?
C18 C17 C22 N3 179.7(11) . . . . ?
Yb1 C17 C22 N3 -2.1(7) . . . . ?
C21 C22 N3 C23 0.0 . . . . ?
C17 C22 N3 C23 -175.5(11) . . . . ?
C21 C22 N3 Yb1 178.5(6) . . . . ?
C17 C22 N3 Yb1 3.0(10) . . . . ?
O1 Yb1 N3 C23 -86.7(6) . . . . ?
O5 Yb1 N3 C23 5.1(8) . . . . ?
O7 Yb1 N3 C23 75.9(6) . . . . ?
O3 Yb1 N3 C23 175.9(6) . . . . ?
N1 Yb1 N3 C23 -132.8(6) . . . . ?
N2 Yb1 N3 C23 130.5(6) . . . . ?
N4 Yb1 N3 C23 -7.2(5) . . . . ?
C1 Yb1 N3 C23 -96.3(6) . . . . ?
C17 Yb1 N3 C23 176.7(8) . . . . ?
Na1 Yb1 N3 C23 50.6(6) . . . . ?
O1 Yb1 N3 C22 94.9(5) . . . . ?
O5 Yb1 N3 C22 -173.3(5) . . . . ?
O7 Yb1 N3 C22 -102.5(5) . . . . ?
O3 Yb1 N3 C22 -2.5(5) . . . . ?
N1 Yb1 N3 C22 48.7(7) . . . . ?
N2 Yb1 N3 C22 -47.9(7) . . . . ?
N4 Yb1 N3 C22 174.4(6) . . . . ?
C1 Yb1 N3 C22 85.3(5) . . . . ?
C17 Yb1 N3 C22 -1.7(5) . . . . ?
Na1 Yb1 N3 C22 -127.8(4) . . . . ?
C22 N3 C23 C24 0.0 . . . . ?
Yb1 N3 C23 C24 -178.3(6) . . . . ?
C22 N3 C23 C26 -177.4(10) . . . . ?
Yb1 N3 C23 C26 4.2(10) . . . . ?
N3 C23 C24 C25 0.0 . . . . ?
C26 C23 C24 C25 176.9(12) . . . . ?
C23 C24 C25 C21 0.0 . . . . ?
C22 C21 C25 C24 0.0 . . . . ?
C20 C21 C25 C24 -179.1(13) . . . . ?
C32 N4 C26 O4 -1.1(17) . . . . ?
Yb1 N4 C26 O4 169.1(10) . . . . ?
C32 N4 C26 C23 177.2(14) . . . . ?
Yb1 N4 C26 C23 -12.5(19) . . . . ?
C27 O4 C26 N4 0.8(17) . . . . ?
C27 O4 C26 C23 -177.7(13) . . . . ?
C24 C23 C26 N4 -170.6(11) . . . . ?
N3 C23 C26 N4 6.5(18) . . . . ?
C24 C23 C26 O4 7.6(18) . . . . ?
N3 C23 C26 O4 -175.2(10) . . . . ?
C26 O4 C27 C28 178.8(17) . . . . ?
C26 O4 C27 C32 -0.1(16) . . . . ?
O4 C27 C28 C29 -179.4(16) . . . . ?
C32 C27 C28 C29 -1(3) . . . . ?
C27 C28 C29 C30 3(3) . . . . ?
C28 C29 C30 C31 -5(3) . . . . ?
C28 C29 C30 Cl2 172.9(13) . . . . ?
C29 C30 C31 C32 4(2) . . . . ?
Cl2 C30 C31 C32 -173.9(11) . . . . ?
C30 C31 C32 C27 -1(2) . . . . ?
C30 C31 C32 N4 177.7(15) . . . . ?
C28 C27 C32 C31 0(3) . . . . ?
O4 C27 C32 C31 178.8(14) . . . . ?
C28 C27 C32 N4 -179.5(16) . . . . ?
O4 C27 C32 N4 -0.5(17) . . . . ?
C26 N4 C32 C31 -178.3(16) . . . . ?
Yb1 N4 C32 C31 16(3) . . . . ?
C26 N4 C32 C27 1.0(16) . . . . ?
Yb1 N4 C32 C27 -164.4(12) . . . . ?
Yb1 O5 C33 C34 64(2) . . . . ?
Na1 O5 C33 C34 -160.0(13) . . . . ?
Yb1 O5 C33 C38 -115.5(15) . . . . ?
Na1 O5 C33 C38 20.5(17) . . . . ?
O5 C33 C34 C35 -177.2(15) . . . . ?
C38 C33 C34 C35 2(2) . . . . ?
C33 C34 C35 C36 1(3) . . . . ?
C34 C35 C36 C37 -3(3) . . . . ?
C35 C36 C37 C41 -179.6(18) . . . . ?
C35 C36 C37 C38 0(3) . . . . ?
C39 N5 C38 C37 -3(2) . . . . ?
Na1 N5 C38 C37 167.9(12) . . . . ?
C39 N5 C38 C33 176.6(14) . . . . ?
Na1 N5 C38 C33 -12.4(18) . . . . ?
C41 C37 C38 N5 3(3) . . . . ?
C36 C37 C38 N5 -176.8(16) . . . . ?
C41 C37 C38 C33 -176.6(17) . . . . ?
C36 C37 C38 C33 4(2) . . . . ?
O5 C33 C38 N5 -5(2) . . . . ?
C34 C33 C38 N5 175.5(14) . . . . ?
O5 C33 C38 C37 174.8(14) . . . . ?
C34 C33 C38 C37 -5(2) . . . . ?
C38 N5 C39 C40 0(2) . . . . ?
Na1 N5 C39 C40 -169.6(13) . . . . ?
C38 N5 C39 C42 178.2(15) . . . . ?
Na1 N5 C39 C42 8(2) . . . . ?
N5 C39 C40 C41 3(3) . . . . ?
C42 C39 C40 C41 -175.1(18) . . . . ?
C36 C37 C41 C40 179.8(18) . . . . ?
C38 C37 C41 C40 0(3) . . . . ?
C39 C40 C41 C37 -3(3) . . . . ?
C48 N6 C42 O6 -0.4(18) . . . . ?
Na1 N6 C42 O6 -175.1(11) . . . . ?
C48 N6 C42 C39 178.3(17) . . . . ?
Na1 N6 C42 C39 4(2) . . . . ?
C43 O6 C42 N6 0.2(19) . . . . ?
C43 O6 C42 C39 -178.6(15) . . . . ?
N5 C39 C42 N6 -8(3) . . . . ?
C40 C39 C42 N6 170.3(17) . . . . ?
N5 C39 C42 O6 171.0(15) . . . . ?
C40 C39 C42 O6 -11(3) . . . . ?
C42 O6 C43 C44 178.6(12) . . . . ?
C42 O6 C43 C48 0.0(14) . . . . ?
O6 C43 C44 C45 -178.4(15) . . . . ?
C48 C43 C44 C45 0.0 . . . . ?
C43 C44 C45 C46 0.0 . . . . ?
C43 C44 C45 Cl3B -172.1(16) . . . . ?
C44 C45 C46 C47 0.0 . . . . ?
Cl3B C45 C46 C47 174.5(11) . . . . ?
C44 C45 C46 Cl3A 175.9(11) . . . . ?
Cl3B C45 C46 Cl3A -9.5(10) . . . . ?
C45 C46 C47 C48 0.0 . . . . ?
Cl3A C46 C47 C48 -175.6(12) . . . . ?
C46 C47 C48 C43 0.0 . . . . ?
C46 C47 C48 N6 178.9(14) . . . . ?
O6 C43 C48 C47 178.8(12) . . . . ?
C44 C43 C48 C47 0.0 . . . . ?
O6 C43 C48 N6 -0.3(12) . . . . ?
C44 C43 C48 N6 -179.1(12) . . . . ?
C42 N6 C48 C47 -178.5(11) . . . . ?
Na1 N6 C48 C47 -9(3) . . . . ?
C42 N6 C48 C43 0.4(14) . . . . ?
Na1 N6 C48 C43 170.4(15) . . . . ?
Yb1 O7 C49 C50 72(2) . . . . ?
Na1 O7 C49 C50 -157.9(14) . . . . ?
Yb1 O7 C49 C54 -103.1(17) . . . . ?
Na1 O7 C49 C54 26.7(19) . . . . ?
O7 C49 C50 C51 -174.4(18) . . . . ?
C54 C49 C50 C51 1(3) . . . . ?
C49 C50 C51 C52 6(3) . . . . ?
C50 C51 C52 C53 -9(3) . . . . ?
C51 C52 C53 C57 -176.1(19) . . . . ?
C51 C52 C53 C54 5(3) . . . . ?
C55 N7 C54 C49 174.9(15) . . . . ?
Na1 N7 C54 C49 -12.7(17) . . . . ?
C55 N7 C54 C53 -5(2) . . . . ?
Na1 N7 C54 C53 167.4(12) . . . . ?
O7 C49 C54 N7 -9(2) . . . . ?
C50 C49 C54 N7 175.2(14) . . . . ?
O7 C49 C54 C53 171.0(15) . . . . ?
C50 C49 C54 C53 -5(2) . . . . ?
C52 C53 C54 N7 -178.2(15) . . . . ?
C57 C53 C54 N7 3(2) . . . . ?
C52 C53 C54 C49 2(3) . . . . ?
C57 C53 C54 C49 -177.1(16) . . . . ?
C54 N7 C55 C56 4(2) . . . . ?
Na1 N7 C55 C56 -166.8(12) . . . . ?
C54 N7 C55 C58 178.8(14) . . . . ?
Na1 N7 C55 C58 8(2) . . . . ?
N7 C55 C56 C57 -2(3) . . . . ?
C58 C55 C56 C57 -175.6(17) . . . . ?
C55 C56 C57 C53 -1(3) . . . . ?
C52 C53 C57 C56 -178.9(18) . . . . ?
C54 C53 C57 C56 0(3) . . . . ?
C64 N8 C58 O8 -2.7(19) . . . . ?
C64 N8 C58 C55 -177.0(16) . . . . ?
C59 O8 C58 N8 1.0(18) . . . . ?
Na1 O8 C58 N8 -180.0(11) . . . . ?
C59 O8 C58 C55 175.8(15) . . . . ?
Na1 O8 C58 C55 -5.2(18) . . . . ?
N7 C55 C58 N8 173.4(16) . . . . ?
C56 C55 C58 N8 -12(3) . . . . ?
N7 C55 C58 O8 -1(2) . . . . ?
C56 C55 C58 O8 173.8(15) . . . . ?
C58 O8 C59 C60 177.1(18) . . . . ?
Na1 O8 C59 C60 -2(3) . . . . ?
C58 O8 C59 C64 1.1(17) . . . . ?
Na1 O8 C59 C64 -177.5(11) . . . . ?
O8 C59 C60 C61 -174.7(17) . . . . ?
C64 C59 C60 C61 1(3) . . . . ?
C59 C60 C61 C62 0(3) . . . . ?
C60 C61 C62 C63 -2(3) . . . . ?
C60 C61 C62 Cl4 -179.2(13) . . . . ?
C61 C62 C63 C64 3(3) . . . . ?
Cl4 C62 C63 C64 -180.0(13) . . . . ?
C62 C63 C64 N8 177.0(17) . . . . ?
C62 C63 C64 C59 -2(3) . . . . ?
C58 N8 C64 C63 -175.8(19) . . . . ?
C58 N8 C64 C59 3.2(19) . . . . ?
C60 C59 C64 C63 0(3) . . . . ?
O8 C59 C64 C63 176.5(15) . . . . ?
C60 C59 C64 N8 -178.9(16) . . . . ?
O8 C59 C64 N8 -2.7(19) . . . . ?
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 139126969
