#------------------------------------------------------------------------------
#$Date: 2025-12-09 01:28:38 +0100 (Tue 09 de Dec de 2025) $
#$Revision: 304135 $
#$URL: svn://www.crystallography.net/cod/cif/7/71/99/7719991.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_7719991
loop_
_publ_author_name
'Pan, Fuxing'
'Tang, Yu'
'Deng, Minghao'
'Wang, Xinyue'
_publ_section_title
;
 [Pd2(η4-P7)2]4--: a Pd2 dimer sandwiched by two anionic
 nortricyclane-type polyphosphide
;
_journal_name_full               'Dalton Transactions'
_journal_paper_doi               10.1039/D5DT02437D
_journal_year                    2026
_chemical_formula_moiety         '4(C18 H36 N2 Na O6), P14 Pd2'
_chemical_formula_sum            'C72 H144 N8 Na4 O24 P14 Pd2'
_chemical_formula_weight         2244.28
_chemical_properties_physical
Air-sensitive,Moisture-sensitive,Oxygen-sensitive
_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   mixed
_audit_creation_date             2025-09-28
_audit_creation_method
;
Olex2 1.5
(compiled 2025.07.13 svn.rb7424aed for OlexSys, GUI svn.r7308)
;
_audit_update_record
;
2025-10-04 deposited with the CCDC.	2025-12-02 downloaded from the CCDC.
;
_cell_angle_alpha                105.8900(10)
_cell_angle_beta                 91.8060(10)
_cell_angle_gamma                112.9760(10)
_cell_formula_units_Z            1
_cell_length_a                   13.1373(4)
_cell_length_b                   13.3017(4)
_cell_length_c                   16.1154(5)
_cell_measurement_reflns_used    17521
_cell_measurement_temperature    150.00
_cell_measurement_theta_max      34.893
_cell_measurement_theta_min      2.321
_cell_volume                     2463.02(13)
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_diffrn_ambient_temperature      150.00
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.921
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Eos'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0474
_diffrn_reflns_av_unetI/netI     0.0254
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.921
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            199874
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.921
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         34.893
_diffrn_reflns_theta_min         2.321
_exptl_absorpt_coefficient_mu    0.681
_exptl_absorpt_correction_T_max  0.873
_exptl_absorpt_correction_T_min  0.783
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            'metallic reddish red'
_exptl_crystal_colour_lustre     metallic
_exptl_crystal_colour_modifier   reddish
_exptl_crystal_colour_primary    red
_exptl_crystal_density_diffrn    1.513
_exptl_crystal_description       block
_exptl_crystal_F_000             1170
_exptl_crystal_size_max          0.5
_exptl_crystal_size_mid          0.3
_exptl_crystal_size_min          0.2
_refine_diff_density_max         0.722
_refine_diff_density_min         -0.899
_refine_diff_density_rms         0.094
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.073
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     599
_refine_ls_number_reflns         19812
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.073
_refine_ls_R_factor_all          0.0368
_refine_ls_R_factor_gt           0.0278
_refine_ls_shift/su_max          0.008
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0332P)²+1.6927P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0740
_refine_ls_wR_factor_ref         0.0817
_reflns_Friedel_coverage         0.000
_reflns_number_gt                17521
_reflns_number_total             19812
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d5dt02437d2.cif
_cod_data_source_block           1(8)
_cod_database_code               7719991
_shelx_shelxl_version_number     2018/3
_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.
;
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C19(H19A,H19B), C20(H20A,H20B), C21(H21A,H21B), C23(H23A,H23B), C24(H24A,
 H24B), C25(H25A,H25B), C27(H27A,H27B), C28(H28A,H28B), C29(H29A,H29B),
 C30(H30A,H30B), C31(H31A,H31B), C32(H32A,H32B), C33(H33A,H33B), C34(H34A,H34B),
  C35(H35A,H35B), C36(H36A,H36B), C1(H1A,H1B), C2(H2A,H2B), C3(H3A,H3B), C4(H4A,
 H4B), C5(H5A,H5B), C6(H6A,H6B), C7(H7A,H7B), C9(H9A,H9B), C10(H10A,H10B),
 C11(H11A,H11B), C12(H12A,H12B), C13(H13A,H13B), C15(H15A,H15B), C16(H16A,H16B),
  C18(H18A,H18B)
;
_olex2_submission_special_instructions 'No special instructions were received'
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
Na2 Na 0.21905(5) 0.39689(5) 0.70398(4) 0.02027(10) Uani 1 1 d . . . . .
O7 O 0.36574(9) 0.41070(9) 0.60233(7) 0.0256(2) Uani 1 1 d . . . . .
O8 O 0.41377(8) 0.56882(9) 0.76479(7) 0.02523(19) Uani 1 1 d . . . . .
O9 O 0.13276(9) 0.52387(9) 0.66931(7) 0.02530(19) Uani 1 1 d . . . . .
O10 O 0.09937(9) 0.45291(9) 0.81427(7) 0.02401(19) Uani 1 1 d . . . . .
O11 O 0.05910(9) 0.18911(8) 0.63118(6) 0.02281(18) Uani 1 1 d . . . . .
O12 O 0.24575(8) 0.23557(9) 0.74534(6) 0.02188(18) Uani 1 1 d . . . . .
N3 N 0.14212(10) 0.34096(10) 0.53412(7) 0.0217(2) Uani 1 1 d . . . . .
N4 N 0.30716(10) 0.45219(10) 0.88772(7) 0.0221(2) Uani 1 1 d . . . . .
C19 C 0.21603(14) 0.29780(15) 0.48384(10) 0.0293(3) Uani 1 1 d . . . . .
H19A H 0.193658 0.283387 0.420980 0.035 Uiso 1 1 calc R U . . .
H19B H 0.206270 0.223668 0.492052 0.035 Uiso 1 1 calc R U . . .
C20 C 0.33723(14) 0.37969(15) 0.51022(10) 0.0304(3) Uani 1 1 d . . . . .
H20A H 0.384388 0.342889 0.480496 0.036 Uiso 1 1 calc R U . . .
H20B H 0.350596 0.449163 0.492915 0.036 Uiso 1 1 calc R U . . .
C21 C 0.47390(12) 0.50147(14) 0.63287(10) 0.0275(3) Uani 1 1 d . . . . .
H21A H 0.477750 0.568913 0.616018 0.033 Uiso 1 1 calc R U . . .
H21B H 0.530832 0.476920 0.606603 0.033 Uiso 1 1 calc R U . . .
C22 C 0.49626(12) 0.53243(14) 0.72994(11) 0.0279(3) Uani 1 1 d . . . . .
H22A H 0.5634(19) 0.5881(19) 0.7480(14) 0.031(5) Uiso 1 1 d . . . . .
H22B H 0.4922(18) 0.4675(19) 0.7451(14) 0.033(5) Uiso 1 1 d . . . . .
C23 C 0.44084(13) 0.62393(13) 0.85675(11) 0.0298(3) Uani 1 1 d . . . . .
H23A H 0.393617 0.666189 0.874914 0.036 Uiso 1 1 calc R U . . .
H23B H 0.520022 0.680491 0.871319 0.036 Uiso 1 1 calc R U . . .
C24 C 0.42319(12) 0.53896(13) 0.90698(10) 0.0279(3) Uani 1 1 d . . . . .
H24A H 0.473977 0.500252 0.891687 0.034 Uiso 1 1 calc R U . . .
H24B H 0.442476 0.580844 0.970376 0.034 Uiso 1 1 calc R U . . .
C25 C 0.14734(14) 0.44735(14) 0.52028(10) 0.0289(3) Uani 1 1 d . . . . .
H25A H 0.113107 0.429776 0.459530 0.035 Uiso 1 1 calc R U . . .
H25B H 0.226724 0.501688 0.527867 0.035 Uiso 1 1 calc R U . . .
C26 C 0.08766(14) 0.50400(14) 0.58259(10) 0.0279(3) Uani 1 1 d . . . . .
H26A H 0.0958(19) 0.577(2) 0.5747(14) 0.036(6) Uiso 1 1 d . . . . .
H26B H 0.0071(17) 0.4560(17) 0.5746(13) 0.026(5) Uiso 1 1 d . . . . .
C27 C 0.06749(14) 0.56079(15) 0.73007(11) 0.0308(3) Uani 1 1 d . . . . .
H27A H -0.012357 0.506440 0.712665 0.037 Uiso 1 1 calc R U . . .
H27B H 0.074138 0.637743 0.730693 0.037 Uiso 1 1 calc R U . . .
C28 C 0.10980(15) 0.56518(14) 0.81867(11) 0.0311(3) Uani 1 1 d . . . . .
H28A H 0.189125 0.620920 0.836806 0.037 Uiso 1 1 calc R U . . .
H28B H 0.065518 0.589733 0.861924 0.037 Uiso 1 1 calc R U . . .
C29 C 0.11472(12) 0.43917(14) 0.89788(9) 0.0265(3) Uani 1 1 d . . . . .
H29A H 0.084996 0.356145 0.891335 0.032 Uiso 1 1 calc R U . . .
H29B H 0.071016 0.472107 0.936596 0.032 Uiso 1 1 calc R U . . .
C30 C 0.23631(13) 0.49638(14) 0.94061(9) 0.0284(3) Uani 1 1 d . . . . .
H30A H 0.264744 0.580163 0.950670 0.034 Uiso 1 1 calc R U . . .
H30B H 0.241263 0.484011 0.998178 0.034 Uiso 1 1 calc R U . . .
C31 C 0.02720(13) 0.25255(13) 0.51250(9) 0.0263(3) Uani 1 1 d . . . . .
H31A H 0.003119 0.226881 0.448586 0.032 Uiso 1 1 calc R U . . .
H31B H -0.022878 0.286036 0.541182 0.032 Uiso 1 1 calc R U . . .
C32 C 0.01555(13) 0.14992(12) 0.54103(9) 0.0252(3) Uani 1 1 d . . . . .
H32A H -0.064241 0.095671 0.530784 0.030 Uiso 1 1 calc R U . . .
H32B H 0.057225 0.109361 0.506918 0.030 Uiso 1 1 calc R U . . .
C33 C 0.07124(12) 0.10194(12) 0.66016(10) 0.0239(2) Uani 1 1 d . . . . .
H33A H 0.111320 0.064787 0.620583 0.029 Uiso 1 1 calc R U . . .
H33B H -0.003261 0.042502 0.660319 0.029 Uiso 1 1 calc R U . . .
C34 C 0.13627(12) 0.15708(12) 0.75049(9) 0.0235(2) Uani 1 1 d . . . . .
H34A H 0.098776 0.198592 0.789232 0.028 Uiso 1 1 calc R U . . .
H34B H 0.141391 0.097960 0.774558 0.028 Uiso 1 1 calc R U . . .
C35 C 0.32446(12) 0.26997(13) 0.82210(10) 0.0244(2) Uani 1 1 d . . . . .
H35A H 0.400716 0.312438 0.810945 0.029 Uiso 1 1 calc R U . . .
H35B H 0.322590 0.200567 0.834759 0.029 Uiso 1 1 calc R U . . .
C36 C 0.30064(12) 0.34499(13) 0.90097(9) 0.0255(3) Uani 1 1 d . . . . .
H36A H 0.224937 0.302250 0.912932 0.031 Uiso 1 1 calc R U . . .
H36B H 0.355377 0.363526 0.952537 0.031 Uiso 1 1 calc R U . . .
Na1 Na 0.54226(5) 1.07427(5) 0.73336(4) 0.02157(10) Uani 1 1 d . . . . .
O1 O 0.59524(8) 1.28240(8) 0.74839(6) 0.02184(18) Uani 1 1 d . . . . .
O2 O 0.47526(9) 1.11244(9) 0.60054(7) 0.02319(18) Uani 1 1 d . . . . .
O3 O 0.68623(9) 1.02287(9) 0.67619(7) 0.02499(19) Uani 1 1 d . . . . .
O4 O 0.50442(11) 0.81933(12) 0.65149(9) 0.0394(3) Uani 1 1 d . . . . .
O5 O 0.39321(9) 1.04246(10) 0.82056(7) 0.02498(19) Uani 1 1 d . . . . .
O6 O 0.59726(10) 1.07185(10) 0.88908(7) 0.0281(2) Uani 1 1 d . . . . .
N1 N 0.77187(10) 1.23245(10) 0.82110(8) 0.0226(2) Uani 1 1 d . . . . .
N2 N 0.34110(10) 0.91075(10) 0.63984(9) 0.0250(2) Uani 1 1 d . . . . .
C1 C 0.78976(12) 1.34563(12) 0.81376(10) 0.0267(3) Uani 1 1 d . . . . .
H1A H 0.816315 1.351727 0.757775 0.032 Uiso 1 1 calc R U . . .
H1B H 0.848539 1.406271 0.861783 0.032 Uiso 1 1 calc R U . . .
C2 C 0.68344(13) 1.36466(12) 0.81784(10) 0.0258(3) Uani 1 1 d . . . . .
H2A H 0.658105 1.360211 0.874457 0.031 Uiso 1 1 calc R U . . .
H2B H 0.699703 1.442788 0.815097 0.031 Uiso 1 1 calc R U . . .
C3 C 0.61016(13) 1.30228(12) 0.66646(10) 0.0249(3) Uani 1 1 d . . . . .
H3A H 0.670452 1.281570 0.642841 0.030 Uiso 1 1 calc R U . . .
H3B H 0.630887 1.384371 0.673072 0.030 Uiso 1 1 calc R U . . .
C4 C 0.50120(13) 1.22879(13) 0.60618(10) 0.0261(3) Uani 1 1 d . . . . .
H4A H 0.441313 1.250710 0.629236 0.031 Uiso 1 1 calc R U . . .
H4B H 0.507777 1.238855 0.547658 0.031 Uiso 1 1 calc R U . . .
C5 C 0.37197(13) 1.03698(15) 0.54503(10) 0.0305(3) Uani 1 1 d . . . . .
H5A H 0.379327 1.036687 0.484028 0.037 Uiso 1 1 calc R U . . .
H5B H 0.312969 1.063401 0.563127 0.037 Uiso 1 1 calc R U . . .
C6 C 0.34012(14) 0.91741(14) 0.55079(10) 0.0322(3) Uani 1 1 d . . . . .
H6A H 0.264190 0.867254 0.517363 0.039 Uiso 1 1 calc R U . . .
H6B H 0.392575 0.887059 0.522652 0.039 Uiso 1 1 calc R U . . .
C7 C 0.84473(12) 1.18563(14) 0.77322(10) 0.0277(3) Uani 1 1 d . . . . .
H7A H 0.860583 1.135273 0.801997 0.033 Uiso 1 1 calc R U . . .
H7B H 0.916724 1.249185 0.773826 0.033 Uiso 1 1 calc R U . . .
C8 C 0.78863(13) 1.11753(15) 0.67983(10) 0.0285(3) Uani 1 1 d . . . . .
H8A H 0.836(2) 1.090(2) 0.6485(15) 0.040(6) Uiso 1 1 d . . . . .
H8B H 0.7699(18) 1.1663(18) 0.6509(14) 0.030(5) Uiso 1 1 d . . . . .
C9 C 0.70000(14) 0.92018(14) 0.67157(11) 0.0316(3) Uani 1 1 d . . . . .
H9A H 0.771611 0.939296 0.707302 0.038 Uiso 1 1 calc R U . . .
H9B H 0.701532 0.879913 0.610380 0.038 Uiso 1 1 calc R U . . .
C10 C 0.60481(16) 0.84493(15) 0.70489(12) 0.0358(4) Uani 1 1 d . . . . .
H10A H 0.612668 0.773189 0.702537 0.043 Uiso 1 1 calc R U . . .
H10B H 0.603607 0.884673 0.766304 0.043 Uiso 1 1 calc R U . . .
C11 C 0.40721(16) 0.78528(15) 0.69230(13) 0.0377(4) Uani 1 1 d . . . . .
H11A H 0.421975 0.837175 0.752818 0.045 Uiso 1 1 calc R U . . .
H11B H 0.385220 0.705874 0.694212 0.045 Uiso 1 1 calc R U . . .
C12 C 0.31611(14) 0.79203(13) 0.63859(13) 0.0356(4) Uani 1 1 d . . . . .
H12A H 0.305950 0.743473 0.577517 0.043 Uiso 1 1 calc R U . . .
H12B H 0.244992 0.761134 0.661315 0.043 Uiso 1 1 calc R U . . .
C13 C 0.78100(13) 1.23451(13) 0.91239(9) 0.0271(3) Uani 1 1 d . . . . .
H13A H 0.753844 1.290280 0.946902 0.033 Uiso 1 1 calc R U . . .
H13B H 0.860681 1.260772 0.936109 0.033 Uiso 1 1 calc R U . . .
C14 C 0.71426(14) 1.11767(14) 0.92232(11) 0.0297(3) Uani 1 1 d . . . . .
H14A H 0.7383(18) 1.0604(19) 0.8869(14) 0.032(5) Uiso 1 1 d . . . . .
H14B H 0.7252(19) 1.123(2) 0.9835(15) 0.039(6) Uiso 1 1 d . . . . .
C15 C 0.53686(15) 1.12537(16) 0.94168(10) 0.0320(3) Uani 1 1 d . . . . .
H15A H 0.556330 1.203137 0.936870 0.038 Uiso 1 1 calc R U . . .
H15B H 0.555655 1.132760 1.003662 0.038 Uiso 1 1 calc R U . . .
C16 C 0.41429(15) 1.05182(17) 0.90997(11) 0.0340(3) Uani 1 1 d . . . . .
H16A H 0.394238 0.974807 0.916499 0.041 Uiso 1 1 calc R U . . .
H16B H 0.369084 1.087427 0.944315 0.041 Uiso 1 1 calc R U . . .
C17 C 0.28051(13) 0.96420(14) 0.78227(11) 0.0286(3) Uani 1 1 d . . . . .
H17A H 0.2665(19) 0.887(2) 0.7906(15) 0.038(6) Uiso 1 1 d . . . . .
H17B H 0.2307(17) 0.9899(17) 0.8117(13) 0.027(5) Uiso 1 1 d . . . . .
C18 C 0.26609(12) 0.95472(14) 0.68711(11) 0.0278(3) Uani 1 1 d . . . . .
H18A H 0.187606 0.902815 0.660185 0.033 Uiso 1 1 calc R U . . .
H18B H 0.281082 1.031378 0.681631 0.033 Uiso 1 1 calc R U . . .
Pd1 Pd 0.07886(2) 1.04696(2) 0.95372(2) 0.01720(3) Uani 1 1 d . . . . .
P1 P 0.06314(3) 0.85428(3) 0.89721(2) 0.01947(6) Uani 1 1 d . . . A 2
P2 P -0.07582(3) 0.95124(3) 0.83833(2) 0.02075(6) Uani 1 1 d . . . . .
P3 P -0.20628(3) 0.87167(3) 0.91255(2) 0.01966(6) Uani 1 1 d . . . B 1
P4 P -0.06445(3) 0.77698(3) 0.97285(2) 0.01955(6) Uani 1 1 d . . . . .
P5 P -0.22075(3) 0.69394(3) 0.87788(2) 0.01968(6) Uani 1 1 d . . . . .
P6 P -0.17952(3) 0.65060(3) 0.74910(2) 0.02372(7) Uani 1 1 d . . . . .
P7 P -0.03517(3) 0.80798(3) 0.76738(2) 0.02226(7) 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'
Na Na 0.0362 0.0249 '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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pd Pd -0.9988 1.0072 '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
O7 Na2 O8 64.24(4) . . ?
O7 Na2 O10 161.48(4) . . ?
O7 Na2 O11 103.94(4) . . ?
O7 Na2 O12 92.10(4) . . ?
O7 Na2 N3 64.48(4) . . ?
O7 Na2 N4 114.16(4) . . ?
O8 Na2 O11 163.05(4) . . ?
O8 Na2 N3 116.90(4) . . ?
O8 Na2 N4 63.09(4) . . ?
O9 Na2 O7 102.38(4) . . ?
O9 Na2 O8 92.46(4) . . ?
O9 Na2 O10 64.99(4) . . ?
O9 Na2 O11 102.32(4) . . ?
O9 Na2 O12 162.70(4) . . ?
O9 Na2 N3 65.74(4) . . ?
O9 Na2 N4 116.34(4) . . ?
O10 Na2 O8 101.46(4) . . ?
O10 Na2 O11 92.39(4) . . ?
O10 Na2 N3 117.33(4) . . ?
O10 Na2 N4 64.51(3) . . ?
O11 Na2 N3 63.47(4) . . ?
O11 Na2 N4 115.86(4) . . ?
O12 Na2 O8 102.44(4) . . ?
O12 Na2 O10 102.92(4) . . ?
O12 Na2 O11 64.51(3) . . ?
O12 Na2 N3 113.65(4) . . ?
O12 Na2 N4 64.52(3) . . ?
N3 Na2 N4 177.88(4) . . ?
C20 O7 Na2 122.14(9) . . ?
C21 O7 Na2 118.08(9) . . ?
C21 O7 C20 111.44(11) . . ?
C22 O8 Na2 107.66(9) . . ?
C22 O8 C23 112.65(12) . . ?
C23 O8 Na2 117.88(9) . . ?
C26 O9 Na2 120.64(9) . . ?
C26 O9 C27 111.00(12) . . ?
C27 O9 Na2 117.54(9) . . ?
C28 O10 Na2 108.43(9) . . ?
C28 O10 C29 113.48(11) . . ?
C29 O10 Na2 116.69(8) . . ?
C32 O11 Na2 120.84(8) . . ?
C32 O11 C33 112.46(11) . . ?
C33 O11 Na2 114.56(8) . . ?
C34 O12 Na2 105.84(8) . . ?
C34 O12 C35 112.60(10) . . ?
C35 O12 Na2 116.24(8) . . ?
C19 N3 Na2 107.46(8) . . ?
C25 N3 Na2 105.93(9) . . ?
C25 N3 C19 111.73(12) . . ?
C31 N3 Na2 110.26(8) . . ?
C31 N3 C19 110.26(12) . . ?
C31 N3 C25 111.05(12) . . ?
C24 N4 Na2 109.32(8) . . ?
C24 N4 C36 111.18(12) . . ?
C30 N4 Na2 107.49(8) . . ?
C30 N4 C24 110.66(12) . . ?
C30 N4 C36 110.93(12) . . ?
C36 N4 Na2 107.12(8) . . ?
N3 C19 H19A 109.0 . . ?
N3 C19 H19B 109.0 . . ?
N3 C19 C20 112.84(13) . . ?
H19A C19 H19B 107.8 . . ?
C20 C19 H19A 109.0 . . ?
C20 C19 H19B 109.0 . . ?
O7 C20 C19 108.89(12) . . ?
O7 C20 H20A 109.9 . . ?
O7 C20 H20B 109.9 . . ?
C19 C20 H20A 109.9 . . ?
C19 C20 H20B 109.9 . . ?
H20A C20 H20B 108.3 . . ?
O7 C21 H21A 110.0 . . ?
O7 C21 H21B 110.0 . . ?
O7 C21 C22 108.48(12) . . ?
H21A C21 H21B 108.4 . . ?
C22 C21 H21A 110.0 . . ?
C22 C21 H21B 110.0 . . ?
O8 C22 C21 108.00(12) . . ?
O8 C22 H22A 111.0(14) . . ?
O8 C22 H22B 110.4(13) . . ?
C21 C22 H22A 107.7(14) . . ?
C21 C22 H22B 109.2(13) . . ?
H22A C22 H22B 110.5(19) . . ?
O8 C23 H23A 109.2 . . ?
O8 C23 H23B 109.2 . . ?
O8 C23 C24 112.04(12) . . ?
H23A C23 H23B 107.9 . . ?
C24 C23 H23A 109.2 . . ?
C24 C23 H23B 109.2 . . ?
N4 C24 C23 111.82(12) . . ?
N4 C24 H24A 109.3 . . ?
N4 C24 H24B 109.3 . . ?
C23 C24 H24A 109.3 . . ?
C23 C24 H24B 109.3 . . ?
H24A C24 H24B 107.9 . . ?
N3 C25 H25A 109.1 . . ?
N3 C25 H25B 109.1 . . ?
N3 C25 C26 112.53(12) . . ?
H25A C25 H25B 107.8 . . ?
C26 C25 H25A 109.1 . . ?
C26 C25 H25B 109.1 . . ?
O9 C26 C25 109.10(12) . . ?
O9 C26 H26A 109.4(13) . . ?
O9 C26 H26B 107.5(12) . . ?
C25 C26 H26A 111.3(13) . . ?
C25 C26 H26B 112.5(12) . . ?
H26A C26 H26B 107.0(17) . . ?
O9 C27 H27A 110.0 . . ?
O9 C27 H27B 110.0 . . ?
O9 C27 C28 108.45(12) . . ?
H27A C27 H27B 108.4 . . ?
C28 C27 H27A 110.0 . . ?
C28 C27 H27B 110.0 . . ?
O10 C28 C27 107.90(13) . . ?
O10 C28 H28A 110.1 . . ?
O10 C28 H28B 110.1 . . ?
C27 C28 H28A 110.1 . . ?
C27 C28 H28B 110.1 . . ?
H28A C28 H28B 108.4 . . ?
O10 C29 H29A 109.0 . . ?
O10 C29 H29B 109.0 . . ?
O10 C29 C30 113.02(12) . . ?
H29A C29 H29B 107.8 . . ?
C30 C29 H29A 109.0 . . ?
C30 C29 H29B 109.0 . . ?
N4 C30 C29 112.63(12) . . ?
N4 C30 H30A 109.1 . . ?
N4 C30 H30B 109.1 . . ?
C29 C30 H30A 109.1 . . ?
C29 C30 H30B 109.1 . . ?
H30A C30 H30B 107.8 . . ?
N3 C31 H31A 109.1 . . ?
N3 C31 H31B 109.1 . . ?
N3 C31 C32 112.32(12) . . ?
H31A C31 H31B 107.9 . . ?
C32 C31 H31A 109.1 . . ?
C32 C31 H31B 109.1 . . ?
O11 C32 C31 108.53(11) . . ?
O11 C32 H32A 110.0 . . ?
O11 C32 H32B 110.0 . . ?
C31 C32 H32A 110.0 . . ?
C31 C32 H32B 110.0 . . ?
H32A C32 H32B 108.4 . . ?
O11 C33 H33A 110.1 . . ?
O11 C33 H33B 110.1 . . ?
O11 C33 C34 107.94(11) . . ?
H33A C33 H33B 108.4 . . ?
C34 C33 H33A 110.1 . . ?
C34 C33 H33B 110.1 . . ?
O12 C34 C33 107.70(11) . . ?
O12 C34 H34A 110.2 . . ?
O12 C34 H34B 110.2 . . ?
C33 C34 H34A 110.2 . . ?
C33 C34 H34B 110.2 . . ?
H34A C34 H34B 108.5 . . ?
O12 C35 H35A 109.1 . . ?
O12 C35 H35B 109.1 . . ?
O12 C35 C36 112.62(11) . . ?
H35A C35 H35B 107.8 . . ?
C36 C35 H35A 109.1 . . ?
C36 C35 H35B 109.1 . . ?
N4 C36 C35 111.73(11) . . ?
N4 C36 H36A 109.3 . . ?
N4 C36 H36B 109.3 . . ?
C35 C36 H36A 109.3 . . ?
C35 C36 H36B 109.3 . . ?
H36A C36 H36B 107.9 . . ?
O1 Na1 O2 64.67(3) . . ?
O1 Na1 O6 105.16(4) . . ?
O1 Na1 N1 64.66(3) . . ?
O1 Na1 N2 120.06(4) . . ?
O2 Na1 O6 166.79(4) . . ?
O2 Na1 N1 115.43(4) . . ?
O2 Na1 N2 64.90(4) . . ?
O3 Na1 O1 108.58(4) . . ?
O3 Na1 O2 97.80(4) . . ?
O3 Na1 O5 148.46(5) . . ?
O3 Na1 O6 93.46(4) . . ?
O3 Na1 N1 64.54(4) . . ?
O3 Na1 N2 108.29(4) . . ?
O5 Na1 O1 99.62(4) . . ?
O5 Na1 O2 107.00(4) . . ?
O5 Na1 O6 65.11(4) . . ?
O5 Na1 N1 118.49(4) . . ?
O5 Na1 N2 67.13(4) . . ?
O6 Na1 N1 63.65(4) . . ?
O6 Na1 N2 117.84(4) . . ?
N2 Na1 N1 172.81(4) . . ?
C2 O1 Na1 116.44(8) . . ?
C3 O1 Na1 110.92(8) . . ?
C3 O1 C2 113.42(11) . . ?
C4 O2 Na1 117.61(8) . . ?
C5 O2 Na1 122.62(9) . . ?
C5 O2 C4 111.04(11) . . ?
C8 O3 Na1 114.80(9) . . ?
C8 O3 C9 113.20(12) . . ?
C9 O3 Na1 127.11(10) . . ?
C10 O4 C11 113.81(15) . . ?
C16 O5 Na1 120.97(9) . . ?
C16 O5 C17 111.37(12) . . ?
C17 O5 Na1 121.18(9) . . ?
C14 O6 Na1 117.69(9) . . ?
C15 O6 Na1 103.84(8) . . ?
C15 O6 C14 114.52(13) . . ?
C1 N1 Na1 106.51(8) . . ?
C7 N1 Na1 105.44(8) . . ?
C7 N1 C1 112.37(12) . . ?
C13 N1 Na1 108.46(9) . . ?
C13 N1 C1 111.65(11) . . ?
C13 N1 C7 111.99(11) . . ?
C6 N2 Na1 106.69(9) . . ?
C6 N2 C12 110.01(13) . . ?
C6 N2 C18 112.65(13) . . ?
C12 N2 Na1 115.65(10) . . ?
C18 N2 Na1 99.53(9) . . ?
C18 N2 C12 111.93(13) . . ?
N1 C1 H1A 109.3 . . ?
N1 C1 H1B 109.3 . . ?
N1 C1 C2 111.58(12) . . ?
H1A C1 H1B 108.0 . . ?
C2 C1 H1A 109.3 . . ?
C2 C1 H1B 109.3 . . ?
O1 C2 C1 112.69(12) . . ?
O1 C2 H2A 109.1 . . ?
O1 C2 H2B 109.1 . . ?
C1 C2 H2A 109.1 . . ?
C1 C2 H2B 109.1 . . ?
H2A C2 H2B 107.8 . . ?
O1 C3 H3A 110.3 . . ?
O1 C3 H3B 110.3 . . ?
O1 C3 C4 107.18(12) . . ?
H3A C3 H3B 108.5 . . ?
C4 C3 H3A 110.3 . . ?
C4 C3 H3B 110.3 . . ?
O2 C4 C3 107.54(11) . . ?
O2 C4 H4A 110.2 . . ?
O2 C4 H4B 110.2 . . ?
C3 C4 H4A 110.2 . . ?
C3 C4 H4B 110.2 . . ?
H4A C4 H4B 108.5 . . ?
O2 C5 H5A 109.9 . . ?
O2 C5 H5B 109.9 . . ?
O2 C5 C6 109.15(12) . . ?
H5A C5 H5B 108.3 . . ?
C6 C5 H5A 109.9 . . ?
C6 C5 H5B 109.9 . . ?
N2 C6 C5 114.31(13) . . ?
N2 C6 H6A 108.7 . . ?
N2 C6 H6B 108.7 . . ?
C5 C6 H6A 108.7 . . ?
C5 C6 H6B 108.7 . . ?
H6A C6 H6B 107.6 . . ?
N1 C7 H7A 109.7 . . ?
N1 C7 H7B 109.7 . . ?
N1 C7 C8 110.00(12) . . ?
H7A C7 H7B 108.2 . . ?
C8 C7 H7A 109.7 . . ?
C8 C7 H7B 109.7 . . ?
O3 C8 C7 111.31(13) . . ?
O3 C8 H8A 108.6(15) . . ?
O3 C8 H8B 106.8(13) . . ?
C7 C8 H8A 110.4(14) . . ?
C7 C8 H8B 110.5(12) . . ?
H8A C8 H8B 109.1(19) . . ?
O3 C9 H9A 110.0 . . ?
O3 C9 H9B 110.0 . . ?
O3 C9 C10 108.63(13) . . ?
H9A C9 H9B 108.3 . . ?
C10 C9 H9A 110.0 . . ?
C10 C9 H9B 110.0 . . ?
O4 C10 C9 107.91(14) . . ?
O4 C10 H10A 110.1 . . ?
O4 C10 H10B 110.1 . . ?
C9 C10 H10A 110.1 . . ?
C9 C10 H10B 110.1 . . ?
H10A C10 H10B 108.4 . . ?
O4 C11 H11A 110.4 . . ?
O4 C11 H11B 110.4 . . ?
O4 C11 C12 106.79(15) . . ?
H11A C11 H11B 108.6 . . ?
C12 C11 H11A 110.4 . . ?
C12 C11 H11B 110.4 . . ?
N2 C12 C11 112.32(14) . . ?
N2 C12 H12A 109.1 . . ?
N2 C12 H12B 109.1 . . ?
C11 C12 H12A 109.1 . . ?
C11 C12 H12B 109.1 . . ?
H12A C12 H12B 107.9 . . ?
N1 C13 H13A 109.2 . . ?
N1 C13 H13B 109.2 . . ?
N1 C13 C14 112.12(12) . . ?
H13A C13 H13B 107.9 . . ?
C14 C13 H13A 109.2 . . ?
C14 C13 H13B 109.2 . . ?
O6 C14 C13 113.33(12) . . ?
O6 C14 H14A 103.4(13) . . ?
O6 C14 H14B 110.6(14) . . ?
C13 C14 H14A 110.4(13) . . ?
C13 C14 H14B 109.1(14) . . ?
H14A C14 H14B 109.9(18) . . ?
O6 C15 H15A 110.2 . . ?
O6 C15 H15B 110.2 . . ?
O6 C15 C16 107.77(14) . . ?
H15A C15 H15B 108.5 . . ?
C16 C15 H15A 110.2 . . ?
C16 C15 H15B 110.2 . . ?
O5 C16 C15 107.43(12) . . ?
O5 C16 H16A 110.2 . . ?
O5 C16 H16B 110.2 . . ?
C15 C16 H16A 110.2 . . ?
C15 C16 H16B 110.2 . . ?
H16A C16 H16B 108.5 . . ?
O5 C17 H17A 108.3(13) . . ?
O5 C17 H17B 109.8(13) . . ?
O5 C17 C18 108.29(11) . . ?
H17A C17 H17B 107.0(18) . . ?
C18 C17 H17A 111.5(13) . . ?
C18 C17 H17B 111.8(12) . . ?
N2 C18 C17 112.19(13) . . ?
N2 C18 H18A 109.2 . . ?
N2 C18 H18B 109.2 . . ?
C17 C18 H18A 109.2 . . ?
C17 C18 H18B 109.2 . . ?
H18A C18 H18B 107.9 . . ?
P1 Pd1 P4 168.002(12) . 2_577 ?
P2 Pd1 Pd1 82.247(10) . 2_577 ?
P2 Pd1 P1 74.227(12) . . ?
P2 Pd1 P3 168.293(13) . 2_577 ?
P2 Pd1 P4 103.829(13) . 2_577 ?
P3 Pd1 Pd1 86.059(10) 2_577 2_577 ?
P3 Pd1 P4 74.460(12) 2_577 2_577 ?
P4 Pd1 Pd1 84.972(10) 2_577 2_577 ?
P4 P1 Pd1 97.320(16) . . ?
P4 P1 P7 103.259(19) . . ?
P7 P1 Pd1 97.962(16) . . ?
P3 P2 Pd1 98.410(16) . . ?
P7 P2 Pd1 98.893(17) . . ?
P7 P2 P3 103.144(19) . . ?
P2 P3 Pd1 93.277(15) . 2_577 ?
P5 P3 Pd1 99.326(16) . 2_577 ?
P5 P3 P2 102.905(19) . . ?
P1 P4 P5 103.109(18) . . ?
P5 P4 Pd1 98.745(16) . 2_577 ?
P3 P5 P4 82.039(17) . . ?
P6 P5 P3 107.78(2) . . ?
P6 P5 P4 108.40(2) . . ?
P5 P6 P7 96.853(19) . . ?
P2 P7 P1 81.210(17) . . ?
P6 P7 P1 107.84(2) . . ?
P6 P7 P2 108.08(2) . . ?
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
Na2 O7 2.5531(12) . ?
Na2 O8 2.6042(12) . ?
Na2 O9 2.5341(11) . ?
Na2 O10 2.5597(12) . ?
Na2 O11 2.6393(12) . ?
Na2 O12 2.5550(11) . ?
Na2 N3 2.6816(13) . ?
Na2 N4 2.9285(13) . ?
O7 C20 1.4222(18) . ?
O7 C21 1.4178(18) . ?
O8 C22 1.4224(18) . ?
O8 C23 1.424(2) . ?
O9 C26 1.4132(18) . ?
O9 C27 1.4330(19) . ?
O10 C28 1.4269(18) . ?
O10 C29 1.4269(18) . ?
O11 C32 1.4177(16) . ?
O11 C33 1.4227(16) . ?
O12 C34 1.4312(16) . ?
O12 C35 1.4315(17) . ?
N3 C19 1.4694(19) . ?
N3 C25 1.4681(18) . ?
N3 C31 1.4630(19) . ?
N4 C24 1.4671(19) . ?
N4 C30 1.4633(19) . ?
N4 C36 1.4693(19) . ?
C19 H19A 0.9900 . ?
C19 H19B 0.9900 . ?
C19 C20 1.501(2) . ?
C20 H20A 0.9900 . ?
C20 H20B 0.9900 . ?
C21 H21A 0.9900 . ?
C21 H21B 0.9900 . ?
C21 C22 1.492(2) . ?
C22 H22A 0.88(2) . ?
C22 H22B 0.94(2) . ?
C23 H23A 0.9900 . ?
C23 H23B 0.9900 . ?
C23 C24 1.515(2) . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C25 C26 1.512(2) . ?
C26 H26A 0.97(2) . ?
C26 H26B 0.98(2) . ?
C27 H27A 0.9900 . ?
C27 H27B 0.9900 . ?
C27 C28 1.493(2) . ?
C28 H28A 0.9900 . ?
C28 H28B 0.9900 . ?
C29 H29A 0.9900 . ?
C29 H29B 0.9900 . ?
C29 C30 1.516(2) . ?
C30 H30A 0.9900 . ?
C30 H30B 0.9900 . ?
C31 H31A 0.9900 . ?
C31 H31B 0.9900 . ?
C31 C32 1.511(2) . ?
C32 H32A 0.9900 . ?
C32 H32B 0.9900 . ?
C33 H33A 0.9900 . ?
C33 H33B 0.9900 . ?
C33 C34 1.495(2) . ?
C34 H34A 0.9900 . ?
C34 H34B 0.9900 . ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C35 C36 1.511(2) . ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
Na1 O1 2.5150(11) . ?
Na1 O2 2.5376(11) . ?
Na1 O3 2.3808(12) . ?
Na1 O5 2.4167(11) . ?
Na1 O6 2.6018(13) . ?
Na1 N1 2.9450(14) . ?
Na1 N2 2.7299(14) . ?
O1 C2 1.4319(17) . ?
O1 C3 1.4209(17) . ?
O2 C4 1.4244(17) . ?
O2 C5 1.4204(18) . ?
O3 C8 1.425(2) . ?
O3 C9 1.4291(18) . ?
O4 C10 1.419(2) . ?
O4 C11 1.426(2) . ?
O5 C16 1.4205(18) . ?
O5 C17 1.4297(19) . ?
O6 C14 1.4348(19) . ?
O6 C15 1.4171(19) . ?
N1 C1 1.4692(18) . ?
N1 C7 1.4656(19) . ?
N1 C13 1.4642(19) . ?
N2 C6 1.462(2) . ?
N2 C12 1.476(2) . ?
N2 C18 1.465(2) . ?
C1 H1A 0.9900 . ?
C1 H1B 0.9900 . ?
C1 C2 1.514(2) . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C3 H3A 0.9900 . ?
C3 H3B 0.9900 . ?
C3 C4 1.499(2) . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C5 C6 1.509(2) . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C7 H7A 0.9900 . ?
C7 H7B 0.9900 . ?
C7 C8 1.514(2) . ?
C8 H8A 0.93(2) . ?
C8 H8B 0.99(2) . ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C9 C10 1.488(3) . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C11 C12 1.500(3) . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
C13 H13A 0.9900 . ?
C13 H13B 0.9900 . ?
C13 C14 1.514(2) . ?
C14 H14A 0.98(2) . ?
C14 H14B 0.97(2) . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C15 C16 1.502(3) . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C17 H17A 1.02(2) . ?
C17 H17B 0.94(2) . ?
C17 C18 1.504(2) . ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
Pd1 Pd1 2.69687(19) 2_577 ?
Pd1 P1 2.3954(4) . ?
Pd1 P2 2.3778(4) . ?
Pd1 P3 2.3873(4) 2_577 ?
Pd1 P4 2.4006(4) 2_577 ?
P1 P4 2.1961(5) . ?
P1 P7 2.2199(5) . ?
P2 P3 2.2123(5) . ?
P2 P7 2.2054(5) . ?
P3 P5 2.2038(5) . ?
P4 P5 2.2100(5) . ?
P5 P6 2.1430(5) . ?
P6 P7 2.1432(5) . ?
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
Na2 O7 C20 C19 -23.19(17) . . . . ?
Na2 O7 C21 C22 28.80(15) . . . . ?
Na2 O8 C22 C21 61.28(13) . . . . ?
Na2 O8 C23 C24 51.71(15) . . . . ?
Na2 O9 C26 C25 -27.54(16) . . . . ?
Na2 O9 C27 C28 27.87(16) . . . . ?
Na2 O10 C28 C27 60.99(14) . . . . ?
Na2 O10 C29 C30 51.97(15) . . . . ?
Na2 O11 C32 C31 -28.45(15) . . . . ?
Na2 O11 C33 C34 26.83(13) . . . . ?
Na2 O12 C34 C33 67.93(11) . . . . ?
Na2 O12 C35 C36 53.49(13) . . . . ?
Na2 N3 C19 C20 -53.46(14) . . . . ?
Na2 N3 C25 C26 -53.54(14) . . . . ?
Na2 N3 C31 C32 -52.68(14) . . . . ?
Na2 N4 C24 C23 35.46(14) . . . . ?
Na2 N4 C30 C29 34.31(15) . . . . ?
Na2 N4 C36 C35 36.10(13) . . . . ?
O7 C21 C22 O8 -60.58(16) . . . . ?
O8 C23 C24 N4 -58.56(17) . . . . ?
O9 C27 C28 O10 -59.18(17) . . . . ?
O10 C29 C30 N4 -58.95(18) . . . . ?
O11 C33 C34 O12 -64.13(14) . . . . ?
O12 C35 C36 N4 -61.30(16) . . . . ?
N3 C19 C20 O7 51.99(17) . . . . ?
N3 C25 C26 O9 55.88(17) . . . . ?
N3 C31 C32 O11 53.95(16) . . . . ?
C19 N3 C25 C26 -170.26(13) . . . . ?
C19 N3 C31 C32 65.82(15) . . . . ?
C20 O7 C21 C22 177.80(13) . . . . ?
C21 O7 C20 C19 -170.74(13) . . . . ?
C22 O8 C23 C24 -74.63(16) . . . . ?
C23 O8 C22 C21 -167.07(12) . . . . ?
C24 N4 C30 C29 153.62(13) . . . . ?
C24 N4 C36 C35 -83.28(14) . . . . ?
C25 N3 C19 C20 62.33(16) . . . . ?
C25 N3 C31 C32 -169.78(12) . . . . ?
C26 O9 C27 C28 172.54(13) . . . . ?
C27 O9 C26 C25 -170.96(13) . . . . ?
C28 O10 C29 C30 -75.20(16) . . . . ?
C29 O10 C28 C27 -167.63(12) . . . . ?
C30 N4 C24 C23 -82.74(15) . . . . ?
C30 N4 C36 C35 153.13(12) . . . . ?
C31 N3 C19 C20 -173.67(12) . . . . ?
C31 N3 C25 C26 66.17(16) . . . . ?
C32 O11 C33 C34 169.84(12) . . . . ?
C33 O11 C32 C31 -168.87(12) . . . . ?
C34 O12 C35 C36 -68.84(15) . . . . ?
C35 O12 C34 C33 -164.06(11) . . . . ?
C36 N4 C24 C23 153.52(12) . . . . ?
C36 N4 C30 C29 -82.49(15) . . . . ?
Na1 O1 C2 C1 55.50(14) . . . . ?
Na1 O1 C3 C4 59.86(12) . . . . ?
Na1 O2 C4 C3 30.82(14) . . . . ?
Na1 O2 C5 C6 -25.53(17) . . . . ?
Na1 O3 C8 C7 66.99(14) . . . . ?
Na1 O3 C9 C10 2.82(17) . . . . ?
Na1 O5 C16 C15 22.07(18) . . . . ?
Na1 O5 C17 C18 -25.50(16) . . . . ?
Na1 O6 C14 C13 48.90(16) . . . . ?
Na1 O6 C15 C16 63.05(13) . . . . ?
Na1 N1 C1 C2 34.28(13) . . . . ?
Na1 N1 C7 C8 27.00(14) . . . . ?
Na1 N1 C13 C14 36.78(14) . . . . ?
Na1 N2 C6 C5 -50.16(15) . . . . ?
Na1 N2 C12 C11 1.57(19) . . . . ?
Na1 N2 C18 C17 -58.66(13) . . . . ?
O1 C3 C4 O2 -59.01(15) . . . . ?
O2 C5 C6 N2 52.02(18) . . . . ?
O3 C9 C10 O4 59.98(17) . . . . ?
O4 C11 C12 N2 -64.75(19) . . . . ?
O5 C17 C18 N2 60.81(16) . . . . ?
O6 C15 C16 O5 -58.53(17) . . . . ?
N1 C1 C2 O1 -61.02(16) . . . . ?
N1 C7 C8 O3 -61.19(17) . . . . ?
N1 C13 C14 O6 -58.48(18) . . . . ?
C1 N1 C7 C8 -88.63(15) . . . . ?
C1 N1 C13 C14 153.84(13) . . . . ?
C2 O1 C3 C4 -166.91(11) . . . . ?
C3 O1 C2 C1 -75.03(15) . . . . ?
C4 O2 C5 C6 -172.24(13) . . . . ?
C5 O2 C4 C3 179.37(12) . . . . ?
C6 N2 C12 C11 122.50(16) . . . . ?
C6 N2 C18 C17 -171.34(13) . . . . ?
C7 N1 C1 C2 149.26(12) . . . . ?
C7 N1 C13 C14 -79.16(16) . . . . ?
C8 O3 C9 C10 156.50(13) . . . . ?
C9 O3 C8 C7 -90.09(15) . . . . ?
C10 O4 C11 C12 165.32(14) . . . . ?
C11 O4 C10 C9 -158.19(14) . . . . ?
C12 N2 C6 C5 -176.32(14) . . . . ?
C12 N2 C18 C17 64.07(17) . . . . ?
C13 N1 C1 C2 -83.95(15) . . . . ?
C13 N1 C7 C8 144.76(13) . . . . ?
C14 O6 C15 C16 -167.29(12) . . . . ?
C15 O6 C14 C13 -73.52(17) . . . . ?
C16 O5 C17 C18 -177.45(13) . . . . ?
C17 O5 C16 C15 174.10(13) . . . . ?
C18 N2 C6 C5 58.04(17) . . . . ?
C18 N2 C12 C11 -111.46(16) . . . . ?
